###################################
# 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 19050
_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
1 '2D 1H-15N HSQC' . . . 19050 1
2 '2D 1H-13C HMQC' . . . 19050 1
3 '3D HNCA' . . . 19050 1
4 '3D HN(CO)CA' . . . 19050 1
5 '3D HNCACB' . . . 19050 1
6 '3D HN(CO)CACB' . . . 19050 1
7 '3D HNCO' . . . 19050 1
8 '3D HN(CA)CO' . . . 19050 1
9 '3D C(CO)NH' . . . 19050 1
10 '3D H(CCO)NH' . . . 19050 1
12 '3D 1H-13C NOESY' . . . 19050 1
13 '3D H(C)CH-TOCSY' . . . 19050 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 MET HE1 H 1 2.103 0.015 . 1 . . . A 76 MET HE1 . 19050 1
2 . 1 1 1 1 MET HE2 H 1 2.103 0.015 . 1 . . . A 76 MET HE2 . 19050 1
3 . 1 1 1 1 MET HE3 H 1 2.103 0.015 . 1 . . . A 76 MET HE3 . 19050 1
4 . 1 1 1 1 MET CE C 13 16.856 0.051 . 1 . . . A 76 MET CE . 19050 1
5 . 1 1 2 2 LYS HA H 1 4.355 0.012 . 1 . . . A 77 LYS HA . 19050 1
6 . 1 1 2 2 LYS HB2 H 1 1.824 0.015 . 1 . . . A 77 LYS HB2 . 19050 1
7 . 1 1 2 2 LYS HG3 H 1 1.444 0.013 . 1 . . . A 77 LYS HG3 . 19050 1
8 . 1 1 2 2 LYS HD3 H 1 1.706 0.013 . 1 . . . A 77 LYS HD3 . 19050 1
9 . 1 1 2 2 LYS HE3 H 1 3.001 0.009 . 1 . . . A 77 LYS HE3 . 19050 1
10 . 1 1 2 2 LYS C C 13 176.202 0.011 . 1 . . . A 77 LYS C . 19050 1
11 . 1 1 2 2 LYS CA C 13 56.379 0.155 . 1 . . . A 77 LYS CA . 19050 1
12 . 1 1 2 2 LYS CB C 13 32.944 0.126 . 1 . . . A 77 LYS CB . 19050 1
13 . 1 1 2 2 LYS CG C 13 24.490 0.141 . 1 . . . A 77 LYS CG . 19050 1
14 . 1 1 2 2 LYS CD C 13 28.942 0.081 . 1 . . . A 77 LYS CD . 19050 1
15 . 1 1 2 2 LYS CE C 13 41.874 0.093 . 1 . . . A 77 LYS CE . 19050 1
16 . 1 1 3 3 GLU H H 1 8.747 0.004 . 1 . . . A 78 GLU H . 19050 1
17 . 1 1 3 3 GLU HA H 1 4.234 0.011 . 1 . . . A 78 GLU HA . 19050 1
18 . 1 1 3 3 GLU HB2 H 1 1.964 0.015 . 1 . . . A 78 GLU HB2 . 19050 1
19 . 1 1 3 3 GLU HG3 H 1 2.294 0.015 . 1 . . . A 78 GLU HG3 . 19050 1
20 . 1 1 3 3 GLU C C 13 176.521 0.004 . 1 . . . A 78 GLU C . 19050 1
21 . 1 1 3 3 GLU CA C 13 57.084 0.134 . 1 . . . A 78 GLU CA . 19050 1
22 . 1 1 3 3 GLU CB C 13 29.974 0.101 . 1 . . . A 78 GLU CB . 19050 1
23 . 1 1 3 3 GLU CG C 13 36.341 0.065 . 1 . . . A 78 GLU CG . 19050 1
24 . 1 1 3 3 GLU N N 15 123.146 0.012 . 1 . . . A 78 GLU N . 19050 1
25 . 1 1 4 4 GLN H H 1 8.432 0.005 . 1 . . . A 79 GLN H . 19050 1
26 . 1 1 4 4 GLN HA H 1 4.336 0.010 . 1 . . . A 79 GLN HA . 19050 1
27 . 1 1 4 4 GLN HB2 H 1 2.110 0.014 . 2 . . . A 79 GLN HB2 . 19050 1
28 . 1 1 4 4 GLN HB3 H 1 2.034 0.019 . 2 . . . A 79 GLN HB3 . 19050 1
29 . 1 1 4 4 GLN HG3 H 1 2.368 0.012 . 1 . . . A 79 GLN HG3 . 19050 1
30 . 1 1 4 4 GLN HE21 H 1 6.833 0.007 . 1 . . . A 79 GLN HE21 . 19050 1
31 . 1 1 4 4 GLN HE22 H 1 7.610 0.004 . 1 . . . A 79 GLN HE22 . 19050 1
32 . 1 1 4 4 GLN C C 13 175.676 0.014 . 1 . . . A 79 GLN C . 19050 1
33 . 1 1 4 4 GLN CA C 13 56.033 0.145 . 1 . . . A 79 GLN CA . 19050 1
34 . 1 1 4 4 GLN CB C 13 29.556 0.097 . 1 . . . A 79 GLN CB . 19050 1
35 . 1 1 4 4 GLN CG C 13 33.759 0.062 . 1 . . . A 79 GLN CG . 19050 1
36 . 1 1 4 4 GLN N N 15 120.488 0.021 . 1 . . . A 79 GLN N . 19050 1
37 . 1 1 4 4 GLN NE2 N 15 112.232 0.231 . 1 . . . A 79 GLN NE2 . 19050 1
38 . 1 1 5 5 ASP H H 1 8.406 0.004 . 1 . . . A 80 ASP H . 19050 1
39 . 1 1 5 5 ASP HA H 1 4.654 0.009 . 1 . . . A 80 ASP HA . 19050 1
40 . 1 1 5 5 ASP HB2 H 1 2.662 0.013 . 2 . . . A 80 ASP HB2 . 19050 1
41 . 1 1 5 5 ASP HB3 H 1 2.713 0.017 . 2 . . . A 80 ASP HB3 . 19050 1
42 . 1 1 5 5 ASP C C 13 176.282 0.001 . 1 . . . A 80 ASP C . 19050 1
43 . 1 1 5 5 ASP CA C 13 54.536 0.128 . 1 . . . A 80 ASP CA . 19050 1
44 . 1 1 5 5 ASP CB C 13 41.280 0.086 . 1 . . . A 80 ASP CB . 19050 1
45 . 1 1 5 5 ASP N N 15 121.743 0.023 . 1 . . . A 80 ASP N . 19050 1
46 . 1 1 6 6 SER H H 1 8.381 0.007 . 1 . . . A 81 SER H . 19050 1
47 . 1 1 6 6 SER HA H 1 4.501 0.012 . 1 . . . A 81 SER HA . 19050 1
48 . 1 1 6 6 SER HB2 H 1 3.963 0.013 . 2 . . . A 81 SER HB2 . 19050 1
49 . 1 1 6 6 SER HB3 H 1 4.070 0.010 . 2 . . . A 81 SER HB3 . 19050 1
50 . 1 1 6 6 SER C C 13 175.181 0.030 . 1 . . . A 81 SER C . 19050 1
51 . 1 1 6 6 SER CA C 13 58.553 0.140 . 1 . . . A 81 SER CA . 19050 1
52 . 1 1 6 6 SER CB C 13 64.017 0.104 . 1 . . . A 81 SER CB . 19050 1
53 . 1 1 6 6 SER N N 15 116.240 0.035 . 1 . . . A 81 SER N . 19050 1
54 . 1 1 7 7 GLU H H 1 8.635 0.005 . 1 . . . A 82 GLU H . 19050 1
55 . 1 1 7 7 GLU HA H 1 4.224 0.015 . 1 . . . A 82 GLU HA . 19050 1
56 . 1 1 7 7 GLU HB2 H 1 2.084 0.017 . 1 . . . A 82 GLU HB2 . 19050 1
57 . 1 1 7 7 GLU HG3 H 1 2.346 0.018 . 1 . . . A 82 GLU HG3 . 19050 1
58 . 1 1 7 7 GLU C C 13 177.429 0.021 . 1 . . . A 82 GLU C . 19050 1
59 . 1 1 7 7 GLU CA C 13 58.624 0.066 . 1 . . . A 82 GLU CA . 19050 1
60 . 1 1 7 7 GLU CB C 13 29.652 0.084 . 1 . . . A 82 GLU CB . 19050 1
61 . 1 1 7 7 GLU CG C 13 36.444 0.067 . 1 . . . A 82 GLU CG . 19050 1
62 . 1 1 7 7 GLU N N 15 123.005 0.019 . 1 . . . A 82 GLU N . 19050 1
63 . 1 1 8 8 GLU H H 1 8.436 0.004 . 1 . . . A 83 GLU H . 19050 1
64 . 1 1 8 8 GLU HA H 1 4.065 0.011 . 1 . . . A 83 GLU HA . 19050 1
65 . 1 1 8 8 GLU HB2 H 1 2.097 0.020 . 1 . . . A 83 GLU HB2 . 19050 1
66 . 1 1 8 8 GLU HG3 H 1 2.361 0.014 . 1 . . . A 83 GLU HG3 . 19050 1
67 . 1 1 8 8 GLU C C 13 178.511 0.020 . 1 . . . A 83 GLU C . 19050 1
68 . 1 1 8 8 GLU CA C 13 59.436 0.111 . 1 . . . A 83 GLU CA . 19050 1
69 . 1 1 8 8 GLU CB C 13 29.487 0.065 . 1 . . . A 83 GLU CB . 19050 1
70 . 1 1 8 8 GLU CG C 13 36.496 0.086 . 1 . . . A 83 GLU CG . 19050 1
71 . 1 1 8 8 GLU N N 15 118.813 0.052 . 1 . . . A 83 GLU N . 19050 1
72 . 1 1 9 9 GLU H H 1 8.132 0.004 . 1 . . . A 84 GLU H . 19050 1
73 . 1 1 9 9 GLU HA H 1 4.228 0.008 . 1 . . . A 84 GLU HA . 19050 1
74 . 1 1 9 9 GLU HB2 H 1 2.207 0.019 . 2 . . . A 84 GLU HB2 . 19050 1
75 . 1 1 9 9 GLU HB3 H 1 2.327 0.027 . 2 . . . A 84 GLU HB3 . 19050 1
76 . 1 1 9 9 GLU HG2 H 1 2.433 0.015 . 2 . . . A 84 GLU HG2 . 19050 1
77 . 1 1 9 9 GLU HG3 H 1 2.324 0.029 . 2 . . . A 84 GLU HG3 . 19050 1
78 . 1 1 9 9 GLU C C 13 178.869 0.019 . 1 . . . A 84 GLU C . 19050 1
79 . 1 1 9 9 GLU CA C 13 59.003 0.164 . 1 . . . A 84 GLU CA . 19050 1
80 . 1 1 9 9 GLU CB C 13 29.997 0.170 . 1 . . . A 84 GLU CB . 19050 1
81 . 1 1 9 9 GLU CG C 13 36.846 0.075 . 1 . . . A 84 GLU CG . 19050 1
82 . 1 1 9 9 GLU N N 15 118.916 0.036 . 1 . . . A 84 GLU N . 19050 1
83 . 1 1 10 10 LEU H H 1 8.027 0.007 . 1 . . . A 85 LEU H . 19050 1
84 . 1 1 10 10 LEU HA H 1 4.325 0.025 . 1 . . . A 85 LEU HA . 19050 1
85 . 1 1 10 10 LEU HB2 H 1 1.661 0.027 . 2 . . . A 85 LEU HB2 . 19050 1
86 . 1 1 10 10 LEU HB3 H 1 2.335 0.017 . 2 . . . A 85 LEU HB3 . 19050 1
87 . 1 1 10 10 LEU HG H 1 1.829 0.023 . 1 . . . A 85 LEU HG . 19050 1
88 . 1 1 10 10 LEU HD11 H 1 0.888 0.010 . 2 . . . A 85 LEU HD11 . 19050 1
89 . 1 1 10 10 LEU HD12 H 1 0.888 0.010 . 2 . . . A 85 LEU HD12 . 19050 1
90 . 1 1 10 10 LEU HD13 H 1 0.888 0.010 . 2 . . . A 85 LEU HD13 . 19050 1
91 . 1 1 10 10 LEU HD21 H 1 0.816 0.021 . 2 . . . A 85 LEU HD21 . 19050 1
92 . 1 1 10 10 LEU HD22 H 1 0.816 0.021 . 2 . . . A 85 LEU HD22 . 19050 1
93 . 1 1 10 10 LEU HD23 H 1 0.816 0.021 . 2 . . . A 85 LEU HD23 . 19050 1
94 . 1 1 10 10 LEU C C 13 178.906 0.031 . 1 . . . A 85 LEU C . 19050 1
95 . 1 1 10 10 LEU CA C 13 57.921 0.113 . 1 . . . A 85 LEU CA . 19050 1
96 . 1 1 10 10 LEU CB C 13 41.983 0.094 . 1 . . . A 85 LEU CB . 19050 1
97 . 1 1 10 10 LEU CG C 13 27.254 0.110 . 1 . . . A 85 LEU CG . 19050 1
98 . 1 1 10 10 LEU CD1 C 13 26.303 0.146 . 2 . . . A 85 LEU CD1 . 19050 1
99 . 1 1 10 10 LEU CD2 C 13 23.394 0.087 . 2 . . . A 85 LEU CD2 . 19050 1
100 . 1 1 10 10 LEU N N 15 121.056 0.128 . 1 . . . A 85 LEU N . 19050 1
101 . 1 1 11 11 ILE H H 1 8.230 0.006 . 1 . . . A 86 ILE H . 19050 1
102 . 1 1 11 11 ILE HA H 1 3.825 0.009 . 1 . . . A 86 ILE HA . 19050 1
103 . 1 1 11 11 ILE HB H 1 1.882 0.016 . 1 . . . A 86 ILE HB . 19050 1
104 . 1 1 11 11 ILE HG12 H 1 0.859 0.018 . 2 . . . A 86 ILE HG12 . 19050 1
105 . 1 1 11 11 ILE HG13 H 1 1.814 0.015 . 2 . . . A 86 ILE HG13 . 19050 1
106 . 1 1 11 11 ILE HG21 H 1 0.879 0.012 . 1 . . . A 86 ILE HG21 . 19050 1
107 . 1 1 11 11 ILE HG22 H 1 0.879 0.012 . 1 . . . A 86 ILE HG22 . 19050 1
108 . 1 1 11 11 ILE HG23 H 1 0.879 0.012 . 1 . . . A 86 ILE HG23 . 19050 1
109 . 1 1 11 11 ILE HD11 H 1 0.642 0.019 . 1 . . . A 86 ILE HD11 . 19050 1
110 . 1 1 11 11 ILE HD12 H 1 0.642 0.019 . 1 . . . A 86 ILE HD12 . 19050 1
111 . 1 1 11 11 ILE HD13 H 1 0.642 0.019 . 1 . . . A 86 ILE HD13 . 19050 1
112 . 1 1 11 11 ILE C C 13 178.159 0.007 . 1 . . . A 86 ILE C . 19050 1
113 . 1 1 11 11 ILE CA C 13 64.848 0.099 . 1 . . . A 86 ILE CA . 19050 1
114 . 1 1 11 11 ILE CB C 13 38.148 0.104 . 1 . . . A 86 ILE CB . 19050 1
115 . 1 1 11 11 ILE CG1 C 13 28.936 0.099 . 1 . . . A 86 ILE CG1 . 19050 1
116 . 1 1 11 11 ILE CG2 C 13 17.297 0.119 . 1 . . . A 86 ILE CG2 . 19050 1
117 . 1 1 11 11 ILE CD1 C 13 13.343 0.065 . 1 . . . A 86 ILE CD1 . 19050 1
118 . 1 1 11 11 ILE N N 15 121.050 0.049 . 1 . . . A 86 ILE N . 19050 1
119 . 1 1 12 12 GLU H H 1 7.718 0.006 . 1 . . . A 87 GLU H . 19050 1
120 . 1 1 12 12 GLU HA H 1 4.012 0.013 . 1 . . . A 87 GLU HA . 19050 1
121 . 1 1 12 12 GLU HB2 H 1 2.157 0.017 . 1 . . . A 87 GLU HB2 . 19050 1
122 . 1 1 12 12 GLU HG3 H 1 2.368 0.014 . 1 . . . A 87 GLU HG3 . 19050 1
123 . 1 1 12 12 GLU C C 13 179.183 0.005 . 1 . . . A 87 GLU C . 19050 1
124 . 1 1 12 12 GLU CA C 13 59.078 0.088 . 1 . . . A 87 GLU CA . 19050 1
125 . 1 1 12 12 GLU CB C 13 29.369 0.160 . 1 . . . A 87 GLU CB . 19050 1
126 . 1 1 12 12 GLU CG C 13 36.483 0.064 . 1 . . . A 87 GLU CG . 19050 1
127 . 1 1 12 12 GLU N N 15 118.341 0.018 . 1 . . . A 87 GLU N . 19050 1
128 . 1 1 13 13 ALA H H 1 8.038 0.003 . 1 . . . A 88 ALA H . 19050 1
129 . 1 1 13 13 ALA HA H 1 3.880 0.013 . 1 . . . A 88 ALA HA . 19050 1
130 . 1 1 13 13 ALA HB1 H 1 1.133 0.014 . 1 . . . A 88 ALA HB1 . 19050 1
131 . 1 1 13 13 ALA HB2 H 1 1.133 0.014 . 1 . . . A 88 ALA HB2 . 19050 1
132 . 1 1 13 13 ALA HB3 H 1 1.133 0.014 . 1 . . . A 88 ALA HB3 . 19050 1
133 . 1 1 13 13 ALA C C 13 178.594 0.003 . 1 . . . A 88 ALA C . 19050 1
134 . 1 1 13 13 ALA CA C 13 55.200 0.086 . 1 . . . A 88 ALA CA . 19050 1
135 . 1 1 13 13 ALA CB C 13 17.291 0.108 . 1 . . . A 88 ALA CB . 19050 1
136 . 1 1 13 13 ALA N N 15 121.292 0.065 . 1 . . . A 88 ALA N . 19050 1
137 . 1 1 14 14 PHE H H 1 8.442 0.007 . 1 . . . A 89 PHE H . 19050 1
138 . 1 1 14 14 PHE HA H 1 2.974 0.012 . 1 . . . A 89 PHE HA . 19050 1
139 . 1 1 14 14 PHE HB2 H 1 2.945 0.022 . 2 . . . A 89 PHE HB2 . 19050 1
140 . 1 1 14 14 PHE HB3 H 1 3.180 0.021 . 2 . . . A 89 PHE HB3 . 19050 1
141 . 1 1 14 14 PHE HD1 H 1 6.634 0.011 . 3 . . . A 89 PHE HD1 . 19050 1
142 . 1 1 14 14 PHE HD2 H 1 6.634 0.011 . 3 . . . A 89 PHE HD2 . 19050 1
143 . 1 1 14 14 PHE HE1 H 1 7.045 0.016 . 3 . . . A 89 PHE HE1 . 19050 1
144 . 1 1 14 14 PHE HE2 H 1 7.045 0.016 . 3 . . . A 89 PHE HE2 . 19050 1
145 . 1 1 14 14 PHE HZ H 1 6.918 0.004 . 1 . . . A 89 PHE HZ . 19050 1
146 . 1 1 14 14 PHE C C 13 176.920 0.037 . 1 . . . A 89 PHE C . 19050 1
147 . 1 1 14 14 PHE CA C 13 62.274 0.085 . 1 . . . A 89 PHE CA . 19050 1
148 . 1 1 14 14 PHE CB C 13 39.238 0.089 . 1 . . . A 89 PHE CB . 19050 1
149 . 1 1 14 14 PHE CD1 C 13 131.656 0.066 . 3 . . . A 89 PHE CD1 . 19050 1
150 . 1 1 14 14 PHE CD2 C 13 131.656 0.066 . 3 . . . A 89 PHE CD2 . 19050 1
151 . 1 1 14 14 PHE CE1 C 13 131.267 0.100 . 3 . . . A 89 PHE CE1 . 19050 1
152 . 1 1 14 14 PHE CE2 C 13 131.267 0.100 . 3 . . . A 89 PHE CE2 . 19050 1
153 . 1 1 14 14 PHE CZ C 13 131.764 0.050 . 1 . . . A 89 PHE CZ . 19050 1
154 . 1 1 14 14 PHE N N 15 118.869 0.058 . 1 . . . A 89 PHE N . 19050 1
155 . 1 1 15 15 LYS H H 1 7.651 0.006 . 1 . . . A 90 LYS H . 19050 1
156 . 1 1 15 15 LYS HA H 1 3.826 0.008 . 1 . . . A 90 LYS HA . 19050 1
157 . 1 1 15 15 LYS HB2 H 1 1.876 0.016 . 1 . . . A 90 LYS HB2 . 19050 1
158 . 1 1 15 15 LYS HG2 H 1 1.882 0.013 . 2 . . . A 90 LYS HG2 . 19050 1
159 . 1 1 15 15 LYS HG3 H 1 1.568 0.014 . 2 . . . A 90 LYS HG3 . 19050 1
160 . 1 1 15 15 LYS HD3 H 1 1.690 0.009 . 1 . . . A 90 LYS HD3 . 19050 1
161 . 1 1 15 15 LYS HE3 H 1 2.908 0.009 . 1 . . . A 90 LYS HE3 . 19050 1
162 . 1 1 15 15 LYS C C 13 178.143 0.023 . 1 . . . A 90 LYS C . 19050 1
163 . 1 1 15 15 LYS CA C 13 58.993 0.129 . 1 . . . A 90 LYS CA . 19050 1
164 . 1 1 15 15 LYS CB C 13 32.835 0.131 . 1 . . . A 90 LYS CB . 19050 1
165 . 1 1 15 15 LYS CG C 13 25.877 0.093 . 1 . . . A 90 LYS CG . 19050 1
166 . 1 1 15 15 LYS CD C 13 29.715 0.110 . 1 . . . A 90 LYS CD . 19050 1
167 . 1 1 15 15 LYS CE C 13 41.817 0.064 . 1 . . . A 90 LYS CE . 19050 1
168 . 1 1 15 15 LYS N N 15 114.673 0.063 . 1 . . . A 90 LYS N . 19050 1
169 . 1 1 16 16 VAL H H 1 7.289 0.008 . 1 . . . A 91 VAL H . 19050 1
170 . 1 1 16 16 VAL HA H 1 3.289 0.009 . 1 . . . A 91 VAL HA . 19050 1
171 . 1 1 16 16 VAL HB H 1 2.030 0.010 . 1 . . . A 91 VAL HB . 19050 1
172 . 1 1 16 16 VAL HG11 H 1 0.782 0.017 . 2 . . . A 91 VAL HG11 . 19050 1
173 . 1 1 16 16 VAL HG12 H 1 0.782 0.017 . 2 . . . A 91 VAL HG12 . 19050 1
174 . 1 1 16 16 VAL HG13 H 1 0.782 0.017 . 2 . . . A 91 VAL HG13 . 19050 1
175 . 1 1 16 16 VAL HG21 H 1 0.114 0.007 . 2 . . . A 91 VAL HG21 . 19050 1
176 . 1 1 16 16 VAL HG22 H 1 0.114 0.007 . 2 . . . A 91 VAL HG22 . 19050 1
177 . 1 1 16 16 VAL HG23 H 1 0.114 0.007 . 2 . . . A 91 VAL HG23 . 19050 1
178 . 1 1 16 16 VAL C C 13 176.506 0.005 . 1 . . . A 91 VAL C . 19050 1
179 . 1 1 16 16 VAL CA C 13 65.581 0.083 . 1 . . . A 91 VAL CA . 19050 1
180 . 1 1 16 16 VAL CB C 13 30.954 0.108 . 1 . . . A 91 VAL CB . 19050 1
181 . 1 1 16 16 VAL CG1 C 13 23.072 0.109 . 2 . . . A 91 VAL CG1 . 19050 1
182 . 1 1 16 16 VAL CG2 C 13 20.205 0.070 . 2 . . . A 91 VAL CG2 . 19050 1
183 . 1 1 16 16 VAL N N 15 118.655 0.068 . 1 . . . A 91 VAL N . 19050 1
184 . 1 1 17 17 PHE H H 1 6.788 0.013 . 1 . . . A 92 PHE H . 19050 1
185 . 1 1 17 17 PHE HA H 1 4.131 0.012 . 1 . . . A 92 PHE HA . 19050 1
186 . 1 1 17 17 PHE HB2 H 1 2.428 0.014 . 2 . . . A 92 PHE HB2 . 19050 1
187 . 1 1 17 17 PHE HB3 H 1 2.647 0.012 . 2 . . . A 92 PHE HB3 . 19050 1
188 . 1 1 17 17 PHE HD1 H 1 7.251 0.014 . 3 . . . A 92 PHE HD1 . 19050 1
189 . 1 1 17 17 PHE HD2 H 1 7.251 0.014 . 3 . . . A 92 PHE HD2 . 19050 1
190 . 1 1 17 17 PHE HE1 H 1 7.088 0.029 . 3 . . . A 92 PHE HE1 . 19050 1
191 . 1 1 17 17 PHE HE2 H 1 7.088 0.029 . 3 . . . A 92 PHE HE2 . 19050 1
192 . 1 1 17 17 PHE HZ H 1 7.217 0.023 . 1 . . . A 92 PHE HZ . 19050 1
193 . 1 1 17 17 PHE C C 13 175.735 0.014 . 1 . . . A 92 PHE C . 19050 1
194 . 1 1 17 17 PHE CA C 13 60.560 0.130 . 1 . . . A 92 PHE CA . 19050 1
195 . 1 1 17 17 PHE CB C 13 40.660 0.066 . 1 . . . A 92 PHE CB . 19050 1
196 . 1 1 17 17 PHE CD1 C 13 131.834 0.032 . 3 . . . A 92 PHE CD1 . 19050 1
197 . 1 1 17 17 PHE CD2 C 13 131.834 0.032 . 3 . . . A 92 PHE CD2 . 19050 1
198 . 1 1 17 17 PHE CE1 C 13 130.489 0.093 . 3 . . . A 92 PHE CE1 . 19050 1
199 . 1 1 17 17 PHE CE2 C 13 130.489 0.093 . 3 . . . A 92 PHE CE2 . 19050 1
200 . 1 1 17 17 PHE CZ C 13 129.212 0.049 . 1 . . . A 92 PHE CZ . 19050 1
201 . 1 1 17 17 PHE N N 15 115.100 0.049 . 1 . . . A 92 PHE N . 19050 1
202 . 1 1 18 18 ASP H H 1 7.720 0.008 . 1 . . . A 93 ASP H . 19050 1
203 . 1 1 18 18 ASP HA H 1 4.508 0.015 . 1 . . . A 93 ASP HA . 19050 1
204 . 1 1 18 18 ASP HB2 H 1 1.343 0.013 . 2 . . . A 93 ASP HB2 . 19050 1
205 . 1 1 18 18 ASP HB3 H 1 2.219 0.019 . 2 . . . A 93 ASP HB3 . 19050 1
206 . 1 1 18 18 ASP C C 13 177.583 0.011 . 1 . . . A 93 ASP C . 19050 1
207 . 1 1 18 18 ASP CA C 13 51.872 0.129 . 1 . . . A 93 ASP CA . 19050 1
208 . 1 1 18 18 ASP CB C 13 38.448 0.106 . 1 . . . A 93 ASP CB . 19050 1
209 . 1 1 18 18 ASP N N 15 115.789 0.052 . 1 . . . A 93 ASP N . 19050 1
210 . 1 1 19 19 ARG H H 1 7.511 0.010 . 1 . . . A 94 ARG H . 19050 1
211 . 1 1 19 19 ARG HA H 1 3.817 0.016 . 1 . . . A 94 ARG HA . 19050 1
212 . 1 1 19 19 ARG HB2 H 1 1.738 0.018 . 2 . . . A 94 ARG HB2 . 19050 1
213 . 1 1 19 19 ARG HB3 H 1 1.901 0.011 . 2 . . . A 94 ARG HB3 . 19050 1
214 . 1 1 19 19 ARG HG2 H 1 1.735 0.013 . 2 . . . A 94 ARG HG2 . 19050 1
215 . 1 1 19 19 ARG HG3 H 1 1.586 0.018 . 2 . . . A 94 ARG HG3 . 19050 1
216 . 1 1 19 19 ARG HD2 H 1 3.085 0.014 . 1 . . . A 94 ARG HD2 . 19050 1
217 . 1 1 19 19 ARG C C 13 178.022 0.025 . 1 . . . A 94 ARG C . 19050 1
218 . 1 1 19 19 ARG CA C 13 59.454 0.122 . 1 . . . A 94 ARG CA . 19050 1
219 . 1 1 19 19 ARG CB C 13 30.867 0.110 . 1 . . . A 94 ARG CB . 19050 1
220 . 1 1 19 19 ARG CG C 13 26.954 0.191 . 1 . . . A 94 ARG CG . 19050 1
221 . 1 1 19 19 ARG CD C 13 43.146 0.146 . 1 . . . A 94 ARG CD . 19050 1
222 . 1 1 19 19 ARG N N 15 124.129 0.041 . 1 . . . A 94 ARG N . 19050 1
223 . 1 1 20 20 ASP H H 1 8.278 0.008 . 1 . . . A 95 ASP H . 19050 1
224 . 1 1 20 20 ASP HA H 1 4.531 0.012 . 1 . . . A 95 ASP HA . 19050 1
225 . 1 1 20 20 ASP HB2 H 1 2.626 0.012 . 2 . . . A 95 ASP HB2 . 19050 1
226 . 1 1 20 20 ASP HB3 H 1 3.066 0.012 . 2 . . . A 95 ASP HB3 . 19050 1
227 . 1 1 20 20 ASP C C 13 177.952 0.009 . 1 . . . A 95 ASP C . 19050 1
228 . 1 1 20 20 ASP CA C 13 53.019 0.103 . 1 . . . A 95 ASP CA . 19050 1
229 . 1 1 20 20 ASP CB C 13 39.675 0.156 . 1 . . . A 95 ASP CB . 19050 1
230 . 1 1 20 20 ASP N N 15 113.762 0.031 . 1 . . . A 95 ASP N . 19050 1
231 . 1 1 21 21 GLY H H 1 7.745 0.004 . 1 . . . A 96 GLY H . 19050 1
232 . 1 1 21 21 GLY HA2 H 1 3.857 0.023 . 1 . . . A 96 GLY HA2 . 19050 1
233 . 1 1 21 21 GLY HA3 H 1 3.856 0.018 . 1 . . . A 96 GLY HA3 . 19050 1
234 . 1 1 21 21 GLY C C 13 175.040 0.005 . 1 . . . A 96 GLY C . 19050 1
235 . 1 1 21 21 GLY CA C 13 47.097 0.087 . 1 . . . A 96 GLY CA . 19050 1
236 . 1 1 21 21 GLY N N 15 108.646 0.026 . 1 . . . A 96 GLY N . 19050 1
237 . 1 1 22 22 ASN H H 1 8.202 0.006 . 1 . . . A 97 ASN H . 19050 1
238 . 1 1 22 22 ASN HA H 1 4.611 0.014 . 1 . . . A 97 ASN HA . 19050 1
239 . 1 1 22 22 ASN HB2 H 1 2.598 0.018 . 2 . . . A 97 ASN HB2 . 19050 1
240 . 1 1 22 22 ASN HB3 H 1 3.269 0.011 . 2 . . . A 97 ASN HB3 . 19050 1
241 . 1 1 22 22 ASN HD21 H 1 6.825 0.030 . 1 . . . A 97 ASN HD21 . 19050 1
242 . 1 1 22 22 ASN HD22 H 1 7.959 0.006 . 1 . . . A 97 ASN HD22 . 19050 1
243 . 1 1 22 22 ASN C C 13 176.101 0.010 . 1 . . . A 97 ASN C . 19050 1
244 . 1 1 22 22 ASN CA C 13 52.563 0.096 . 1 . . . A 97 ASN CA . 19050 1
245 . 1 1 22 22 ASN CB C 13 37.775 0.104 . 1 . . . A 97 ASN CB . 19050 1
246 . 1 1 22 22 ASN N N 15 119.389 0.026 . 1 . . . A 97 ASN N . 19050 1
247 . 1 1 22 22 ASN ND2 N 15 115.323 0.184 . 1 . . . A 97 ASN ND2 . 19050 1
248 . 1 1 23 23 GLY H H 1 10.849 0.003 . 1 . . . A 98 GLY H . 19050 1
249 . 1 1 23 23 GLY HA2 H 1 4.272 0.008 . 2 . . . A 98 GLY HA2 . 19050 1
250 . 1 1 23 23 GLY HA3 H 1 3.641 0.011 . 2 . . . A 98 GLY HA3 . 19050 1
251 . 1 1 23 23 GLY C C 13 172.995 0.010 . 1 . . . A 98 GLY C . 19050 1
252 . 1 1 23 23 GLY CA C 13 45.281 0.069 . 1 . . . A 98 GLY CA . 19050 1
253 . 1 1 23 23 GLY N N 15 113.536 0.058 . 1 . . . A 98 GLY N . 19050 1
254 . 1 1 24 24 LEU H H 1 7.491 0.011 . 1 . . . A 99 LEU H . 19050 1
255 . 1 1 24 24 LEU HA H 1 4.885 0.009 . 1 . . . A 99 LEU HA . 19050 1
256 . 1 1 24 24 LEU HB2 H 1 0.960 0.014 . 2 . . . A 99 LEU HB2 . 19050 1
257 . 1 1 24 24 LEU HB3 H 1 1.567 0.009 . 2 . . . A 99 LEU HB3 . 19050 1
258 . 1 1 24 24 LEU HG H 1 1.333 0.017 . 1 . . . A 99 LEU HG . 19050 1
259 . 1 1 24 24 LEU HD11 H 1 0.882 0.009 . 2 . . . A 99 LEU HD11 . 19050 1
260 . 1 1 24 24 LEU HD12 H 1 0.882 0.009 . 2 . . . A 99 LEU HD12 . 19050 1
261 . 1 1 24 24 LEU HD13 H 1 0.882 0.009 . 2 . . . A 99 LEU HD13 . 19050 1
262 . 1 1 24 24 LEU HD21 H 1 0.438 0.011 . 2 . . . A 99 LEU HD21 . 19050 1
263 . 1 1 24 24 LEU HD22 H 1 0.438 0.011 . 2 . . . A 99 LEU HD22 . 19050 1
264 . 1 1 24 24 LEU HD23 H 1 0.438 0.011 . 2 . . . A 99 LEU HD23 . 19050 1
265 . 1 1 24 24 LEU C C 13 175.779 0.032 . 1 . . . A 99 LEU C . 19050 1
266 . 1 1 24 24 LEU CA C 13 52.679 0.094 . 1 . . . A 99 LEU CA . 19050 1
267 . 1 1 24 24 LEU CB C 13 46.301 0.073 . 1 . . . A 99 LEU CB . 19050 1
268 . 1 1 24 24 LEU CG C 13 25.799 0.097 . 1 . . . A 99 LEU CG . 19050 1
269 . 1 1 24 24 LEU CD1 C 13 23.517 0.110 . 2 . . . A 99 LEU CD1 . 19050 1
270 . 1 1 24 24 LEU CD2 C 13 25.160 0.103 . 2 . . . A 99 LEU CD2 . 19050 1
271 . 1 1 24 24 LEU N N 15 119.091 0.033 . 1 . . . A 99 LEU N . 19050 1
272 . 1 1 25 25 ILE H H 1 9.961 0.006 . 1 . . . A 100 ILE H . 19050 1
273 . 1 1 25 25 ILE HA H 1 4.708 0.018 . 1 . . . A 100 ILE HA . 19050 1
274 . 1 1 25 25 ILE HB H 1 1.961 0.012 . 1 . . . A 100 ILE HB . 19050 1
275 . 1 1 25 25 ILE HG12 H 1 0.118 0.012 . 2 . . . A 100 ILE HG12 . 19050 1
276 . 1 1 25 25 ILE HG13 H 1 1.344 0.013 . 2 . . . A 100 ILE HG13 . 19050 1
277 . 1 1 25 25 ILE HG21 H 1 0.954 0.013 . 1 . . . A 100 ILE HG21 . 19050 1
278 . 1 1 25 25 ILE HG22 H 1 0.954 0.013 . 1 . . . A 100 ILE HG22 . 19050 1
279 . 1 1 25 25 ILE HG23 H 1 0.954 0.013 . 1 . . . A 100 ILE HG23 . 19050 1
280 . 1 1 25 25 ILE HD11 H 1 0.403 0.010 . 1 . . . A 100 ILE HD11 . 19050 1
281 . 1 1 25 25 ILE HD12 H 1 0.403 0.010 . 1 . . . A 100 ILE HD12 . 19050 1
282 . 1 1 25 25 ILE HD13 H 1 0.403 0.010 . 1 . . . A 100 ILE HD13 . 19050 1
283 . 1 1 25 25 ILE C C 13 175.828 0.011 . 1 . . . A 100 ILE C . 19050 1
284 . 1 1 25 25 ILE CA C 13 61.451 0.099 . 1 . . . A 100 ILE CA . 19050 1
285 . 1 1 25 25 ILE CB C 13 38.773 0.071 . 1 . . . A 100 ILE CB . 19050 1
286 . 1 1 25 25 ILE CG1 C 13 26.768 0.071 . 1 . . . A 100 ILE CG1 . 19050 1
287 . 1 1 25 25 ILE CG2 C 13 17.724 0.066 . 1 . . . A 100 ILE CG2 . 19050 1
288 . 1 1 25 25 ILE CD1 C 13 15.651 0.063 . 1 . . . A 100 ILE CD1 . 19050 1
289 . 1 1 25 25 ILE N N 15 128.255 0.021 . 1 . . . A 100 ILE N . 19050 1
290 . 1 1 26 26 SER H H 1 9.270 0.006 . 1 . . . A 101 SER H . 19050 1
291 . 1 1 26 26 SER HA H 1 4.783 0.016 . 1 . . . A 101 SER HA . 19050 1
292 . 1 1 26 26 SER HB2 H 1 3.996 0.010 . 2 . . . A 101 SER HB2 . 19050 1
293 . 1 1 26 26 SER HB3 H 1 4.377 0.010 . 2 . . . A 101 SER HB3 . 19050 1
294 . 1 1 26 26 SER C C 13 174.834 0.050 . 1 . . . A 101 SER C . 19050 1
295 . 1 1 26 26 SER CA C 13 55.506 0.086 . 1 . . . A 101 SER CA . 19050 1
296 . 1 1 26 26 SER CB C 13 67.093 0.160 . 1 . . . A 101 SER CB . 19050 1
297 . 1 1 26 26 SER N N 15 124.506 0.052 . 1 . . . A 101 SER N . 19050 1
298 . 1 1 27 27 ALA H H 1 9.219 0.007 . 1 . . . A 102 ALA H . 19050 1
299 . 1 1 27 27 ALA HA H 1 3.872 0.013 . 1 . . . A 102 ALA HA . 19050 1
300 . 1 1 27 27 ALA HB1 H 1 1.417 0.011 . 1 . . . A 102 ALA HB1 . 19050 1
301 . 1 1 27 27 ALA HB2 H 1 1.417 0.011 . 1 . . . A 102 ALA HB2 . 19050 1
302 . 1 1 27 27 ALA HB3 H 1 1.417 0.011 . 1 . . . A 102 ALA HB3 . 19050 1
303 . 1 1 27 27 ALA C C 13 179.294 0.003 . 1 . . . A 102 ALA C . 19050 1
304 . 1 1 27 27 ALA CA C 13 55.722 0.121 . 1 . . . A 102 ALA CA . 19050 1
305 . 1 1 27 27 ALA CB C 13 17.942 0.089 . 1 . . . A 102 ALA CB . 19050 1
306 . 1 1 27 27 ALA N N 15 123.242 0.031 . 1 . . . A 102 ALA N . 19050 1
307 . 1 1 28 28 ALA H H 1 8.206 0.004 . 1 . . . A 103 ALA H . 19050 1
308 . 1 1 28 28 ALA HA H 1 4.065 0.010 . 1 . . . A 103 ALA HA . 19050 1
309 . 1 1 28 28 ALA HB1 H 1 1.429 0.013 . 1 . . . A 103 ALA HB1 . 19050 1
310 . 1 1 28 28 ALA HB2 H 1 1.429 0.013 . 1 . . . A 103 ALA HB2 . 19050 1
311 . 1 1 28 28 ALA HB3 H 1 1.429 0.013 . 1 . . . A 103 ALA HB3 . 19050 1
312 . 1 1 28 28 ALA C C 13 181.791 0.016 . 1 . . . A 103 ALA C . 19050 1
313 . 1 1 28 28 ALA CA C 13 55.100 0.081 . 1 . . . A 103 ALA CA . 19050 1
314 . 1 1 28 28 ALA CB C 13 18.303 0.102 . 1 . . . A 103 ALA CB . 19050 1
315 . 1 1 28 28 ALA N N 15 118.440 0.039 . 1 . . . A 103 ALA N . 19050 1
316 . 1 1 29 29 GLU H H 1 7.905 0.006 . 1 . . . A 104 GLU H . 19050 1
317 . 1 1 29 29 GLU HA H 1 4.022 0.018 . 1 . . . A 104 GLU HA . 19050 1
318 . 1 1 29 29 GLU HB2 H 1 2.589 0.017 . 2 . . . A 104 GLU HB2 . 19050 1
319 . 1 1 29 29 GLU HB3 H 1 2.794 0.017 . 2 . . . A 104 GLU HB3 . 19050 1
320 . 1 1 29 29 GLU HG2 H 1 2.206 0.020 . 2 . . . A 104 GLU HG2 . 19050 1
321 . 1 1 29 29 GLU HG3 H 1 2.609 0.018 . 2 . . . A 104 GLU HG3 . 19050 1
322 . 1 1 29 29 GLU C C 13 178.034 0.004 . 1 . . . A 104 GLU C . 19050 1
323 . 1 1 29 29 GLU CA C 13 59.680 0.100 . 1 . . . A 104 GLU CA . 19050 1
324 . 1 1 29 29 GLU CB C 13 28.956 0.096 . 1 . . . A 104 GLU CB . 19050 1
325 . 1 1 29 29 GLU CG C 13 38.055 0.050 . 1 . . . A 104 GLU CG . 19050 1
326 . 1 1 29 29 GLU N N 15 120.314 0.021 . 1 . . . A 104 GLU N . 19050 1
327 . 1 1 30 30 LEU H H 1 8.586 0.012 . 1 . . . A 105 LEU H . 19050 1
328 . 1 1 30 30 LEU HA H 1 4.109 0.010 . 1 . . . A 105 LEU HA . 19050 1
329 . 1 1 30 30 LEU HB2 H 1 1.869 0.013 . 2 . . . A 105 LEU HB2 . 19050 1
330 . 1 1 30 30 LEU HB3 H 1 1.573 0.016 . 2 . . . A 105 LEU HB3 . 19050 1
331 . 1 1 30 30 LEU HG H 1 1.574 0.015 . 1 . . . A 105 LEU HG . 19050 1
332 . 1 1 30 30 LEU HD11 H 1 0.857 0.015 . 2 . . . A 105 LEU HD11 . 19050 1
333 . 1 1 30 30 LEU HD12 H 1 0.857 0.015 . 2 . . . A 105 LEU HD12 . 19050 1
334 . 1 1 30 30 LEU HD13 H 1 0.857 0.015 . 2 . . . A 105 LEU HD13 . 19050 1
335 . 1 1 30 30 LEU HD21 H 1 0.843 0.022 . 2 . . . A 105 LEU HD21 . 19050 1
336 . 1 1 30 30 LEU HD22 H 1 0.843 0.022 . 2 . . . A 105 LEU HD22 . 19050 1
337 . 1 1 30 30 LEU HD23 H 1 0.843 0.022 . 2 . . . A 105 LEU HD23 . 19050 1
338 . 1 1 30 30 LEU C C 13 178.607 0.009 . 1 . . . A 105 LEU C . 19050 1
339 . 1 1 30 30 LEU CA C 13 58.633 0.103 . 1 . . . A 105 LEU CA . 19050 1
340 . 1 1 30 30 LEU CB C 13 42.242 0.091 . 1 . . . A 105 LEU CB . 19050 1
341 . 1 1 30 30 LEU CG C 13 27.029 0.076 . 1 . . . A 105 LEU CG . 19050 1
342 . 1 1 30 30 LEU CD1 C 13 24.374 0.150 . 2 . . . A 105 LEU CD1 . 19050 1
343 . 1 1 30 30 LEU CD2 C 13 25.868 0.084 . 2 . . . A 105 LEU CD2 . 19050 1
344 . 1 1 30 30 LEU N N 15 119.500 0.024 . 1 . . . A 105 LEU N . 19050 1
345 . 1 1 31 31 ARG H H 1 8.690 0.006 . 1 . . . A 106 ARG H . 19050 1
346 . 1 1 31 31 ARG HA H 1 3.831 0.007 . 1 . . . A 106 ARG HA . 19050 1
347 . 1 1 31 31 ARG HB3 H 1 1.972 0.014 . 1 . . . A 106 ARG HB3 . 19050 1
348 . 1 1 31 31 ARG HG3 H 1 1.651 0.018 . 1 . . . A 106 ARG HG3 . 19050 1
349 . 1 1 31 31 ARG HD2 H 1 3.178 0.013 . 2 . . . A 106 ARG HD2 . 19050 1
350 . 1 1 31 31 ARG HD3 H 1 3.231 0.020 . 2 . . . A 106 ARG HD3 . 19050 1
351 . 1 1 31 31 ARG HE H 1 7.256 0.003 . 1 . . . A 106 ARG HE . 19050 1
352 . 1 1 31 31 ARG C C 13 178.932 0.070 . 1 . . . A 106 ARG C . 19050 1
353 . 1 1 31 31 ARG CA C 13 60.018 0.105 . 1 . . . A 106 ARG CA . 19050 1
354 . 1 1 31 31 ARG CB C 13 30.671 0.140 . 1 . . . A 106 ARG CB . 19050 1
355 . 1 1 31 31 ARG CG C 13 27.671 0.137 . 1 . . . A 106 ARG CG . 19050 1
356 . 1 1 31 31 ARG CD C 13 43.428 0.194 . 1 . . . A 106 ARG CD . 19050 1
357 . 1 1 31 31 ARG N N 15 116.602 0.056 . 1 . . . A 106 ARG N . 19050 1
358 . 1 1 31 31 ARG NE N 15 84.659 0.020 . 1 . . . A 106 ARG NE . 19050 1
359 . 1 1 32 32 HIS H H 1 7.992 0.022 . 1 . . . A 107 HIS H . 19050 1
360 . 1 1 32 32 HIS HA H 1 4.199 0.010 . 1 . . . A 107 HIS HA . 19050 1
361 . 1 1 32 32 HIS HB2 H 1 3.271 0.019 . 2 . . . A 107 HIS HB2 . 19050 1
362 . 1 1 32 32 HIS HB3 H 1 3.302 0.022 . 2 . . . A 107 HIS HB3 . 19050 1
363 . 1 1 32 32 HIS HD2 H 1 6.763 0.011 . 1 . . . A 107 HIS HD2 . 19050 1
364 . 1 1 32 32 HIS C C 13 177.974 0.029 . 1 . . . A 107 HIS C . 19050 1
365 . 1 1 32 32 HIS CA C 13 60.144 0.144 . 1 . . . A 107 HIS CA . 19050 1
366 . 1 1 32 32 HIS CB C 13 31.385 0.166 . 1 . . . A 107 HIS CB . 19050 1
367 . 1 1 32 32 HIS CD2 C 13 119.403 0.038 . 1 . . . A 107 HIS CD2 . 19050 1
368 . 1 1 32 32 HIS N N 15 119.516 0.074 . 1 . . . A 107 HIS N . 19050 1
369 . 1 1 33 33 VAL H H 1 8.770 0.011 . 1 . . . A 108 VAL H . 19050 1
370 . 1 1 33 33 VAL HA H 1 3.565 0.014 . 1 . . . A 108 VAL HA . 19050 1
371 . 1 1 33 33 VAL HB H 1 2.047 0.011 . 1 . . . A 108 VAL HB . 19050 1
372 . 1 1 33 33 VAL HG11 H 1 0.363 0.014 . 2 . . . A 108 VAL HG11 . 19050 1
373 . 1 1 33 33 VAL HG12 H 1 0.363 0.014 . 2 . . . A 108 VAL HG12 . 19050 1
374 . 1 1 33 33 VAL HG13 H 1 0.363 0.014 . 2 . . . A 108 VAL HG13 . 19050 1
375 . 1 1 33 33 VAL HG21 H 1 1.189 0.011 . 2 . . . A 108 VAL HG21 . 19050 1
376 . 1 1 33 33 VAL HG22 H 1 1.189 0.011 . 2 . . . A 108 VAL HG22 . 19050 1
377 . 1 1 33 33 VAL HG23 H 1 1.189 0.011 . 2 . . . A 108 VAL HG23 . 19050 1
378 . 1 1 33 33 VAL C C 13 178.357 0.005 . 1 . . . A 108 VAL C . 19050 1
379 . 1 1 33 33 VAL CA C 13 66.815 0.172 . 1 . . . A 108 VAL CA . 19050 1
380 . 1 1 33 33 VAL CB C 13 31.998 0.104 . 1 . . . A 108 VAL CB . 19050 1
381 . 1 1 33 33 VAL CG1 C 13 21.804 0.068 . 2 . . . A 108 VAL CG1 . 19050 1
382 . 1 1 33 33 VAL CG2 C 13 23.358 0.069 . 2 . . . A 108 VAL CG2 . 19050 1
383 . 1 1 33 33 VAL N N 15 119.415 0.041 . 1 . . . A 108 VAL N . 19050 1
384 . 1 1 34 34 MET H H 1 8.498 0.004 . 1 . . . A 109 MET H . 19050 1
385 . 1 1 34 34 MET HA H 1 4.244 0.026 . 1 . . . A 109 MET HA . 19050 1
386 . 1 1 34 34 MET HB2 H 1 2.390 0.019 . 2 . . . A 109 MET HB2 . 19050 1
387 . 1 1 34 34 MET HB3 H 1 2.079 0.024 . 2 . . . A 109 MET HB3 . 19050 1
388 . 1 1 34 34 MET HG2 H 1 2.462 0.030 . 2 . . . A 109 MET HG2 . 19050 1
389 . 1 1 34 34 MET HG3 H 1 2.938 0.020 . 2 . . . A 109 MET HG3 . 19050 1
390 . 1 1 34 34 MET HE1 H 1 1.925 0.013 . 1 . . . A 109 MET HE1 . 19050 1
391 . 1 1 34 34 MET HE2 H 1 1.925 0.013 . 1 . . . A 109 MET HE2 . 19050 1
392 . 1 1 34 34 MET HE3 H 1 1.925 0.013 . 1 . . . A 109 MET HE3 . 19050 1
393 . 1 1 34 34 MET C C 13 178.815 0.022 . 1 . . . A 109 MET C . 19050 1
394 . 1 1 34 34 MET CA C 13 58.435 0.098 . 1 . . . A 109 MET CA . 19050 1
395 . 1 1 34 34 MET CB C 13 30.722 0.121 . 1 . . . A 109 MET CB . 19050 1
396 . 1 1 34 34 MET CG C 13 34.205 0.086 . 1 . . . A 109 MET CG . 19050 1
397 . 1 1 34 34 MET CE C 13 18.440 0.045 . 1 . . . A 109 MET CE . 19050 1
398 . 1 1 34 34 MET N N 15 115.732 0.034 . 1 . . . A 109 MET N . 19050 1
399 . 1 1 35 35 THR H H 1 7.869 0.007 . 1 . . . A 110 THR H . 19050 1
400 . 1 1 35 35 THR HA H 1 3.995 0.010 . 1 . . . A 110 THR HA . 19050 1
401 . 1 1 35 35 THR HB H 1 4.285 0.010 . 1 . . . A 110 THR HB . 19050 1
402 . 1 1 35 35 THR HG21 H 1 1.218 0.012 . 1 . . . A 110 THR HG21 . 19050 1
403 . 1 1 35 35 THR HG22 H 1 1.218 0.012 . 1 . . . A 110 THR HG22 . 19050 1
404 . 1 1 35 35 THR HG23 H 1 1.218 0.012 . 1 . . . A 110 THR HG23 . 19050 1
405 . 1 1 35 35 THR C C 13 178.024 0.000 . 1 . . . A 110 THR C . 19050 1
406 . 1 1 35 35 THR CA C 13 66.750 0.109 . 1 . . . A 110 THR CA . 19050 1
407 . 1 1 35 35 THR CB C 13 68.435 0.156 . 1 . . . A 110 THR CB . 19050 1
408 . 1 1 35 35 THR CG2 C 13 21.300 0.078 . 1 . . . A 110 THR CG2 . 19050 1
409 . 1 1 35 35 THR N N 15 114.958 0.040 . 1 . . . A 110 THR N . 19050 1
410 . 1 1 36 36 ASN H H 1 7.798 0.005 . 1 . . . A 111 ASN H . 19050 1
411 . 1 1 36 36 ASN HA H 1 4.443 0.021 . 1 . . . A 111 ASN HA . 19050 1
412 . 1 1 36 36 ASN HB2 H 1 2.784 0.018 . 2 . . . A 111 ASN HB2 . 19050 1
413 . 1 1 36 36 ASN HB3 H 1 2.811 0.018 . 2 . . . A 111 ASN HB3 . 19050 1
414 . 1 1 36 36 ASN HD21 H 1 6.542 0.007 . 1 . . . A 111 ASN HD21 . 19050 1
415 . 1 1 36 36 ASN HD22 H 1 7.408 0.004 . 1 . . . A 111 ASN HD22 . 19050 1
416 . 1 1 36 36 ASN C C 13 176.395 0.009 . 1 . . . A 111 ASN C . 19050 1
417 . 1 1 36 36 ASN CA C 13 55.992 0.125 . 1 . . . A 111 ASN CA . 19050 1
418 . 1 1 36 36 ASN CB C 13 38.394 0.141 . 1 . . . A 111 ASN CB . 19050 1
419 . 1 1 36 36 ASN N N 15 122.242 0.017 . 1 . . . A 111 ASN N . 19050 1
420 . 1 1 36 36 ASN ND2 N 15 111.425 0.241 . 1 . . . A 111 ASN ND2 . 19050 1
421 . 1 1 37 37 LEU H H 1 7.906 0.006 . 1 . . . A 112 LEU H . 19050 1
422 . 1 1 37 37 LEU HA H 1 4.410 0.020 . 1 . . . A 112 LEU HA . 19050 1
423 . 1 1 37 37 LEU HB2 H 1 1.854 0.018 . 2 . . . A 112 LEU HB2 . 19050 1
424 . 1 1 37 37 LEU HB3 H 1 1.955 0.018 . 2 . . . A 112 LEU HB3 . 19050 1
425 . 1 1 37 37 LEU HG H 1 1.864 0.019 . 1 . . . A 112 LEU HG . 19050 1
426 . 1 1 37 37 LEU HD11 H 1 0.797 0.016 . 2 . . . A 112 LEU HD11 . 19050 1
427 . 1 1 37 37 LEU HD12 H 1 0.797 0.016 . 2 . . . A 112 LEU HD12 . 19050 1
428 . 1 1 37 37 LEU HD13 H 1 0.797 0.016 . 2 . . . A 112 LEU HD13 . 19050 1
429 . 1 1 37 37 LEU HD21 H 1 0.814 0.017 . 2 . . . A 112 LEU HD21 . 19050 1
430 . 1 1 37 37 LEU HD22 H 1 0.814 0.017 . 2 . . . A 112 LEU HD22 . 19050 1
431 . 1 1 37 37 LEU HD23 H 1 0.814 0.017 . 2 . . . A 112 LEU HD23 . 19050 1
432 . 1 1 37 37 LEU C C 13 176.732 0.015 . 1 . . . A 112 LEU C . 19050 1
433 . 1 1 37 37 LEU CA C 13 54.760 0.126 . 1 . . . A 112 LEU CA . 19050 1
434 . 1 1 37 37 LEU CB C 13 41.340 0.105 . 1 . . . A 112 LEU CB . 19050 1
435 . 1 1 37 37 LEU CG C 13 26.805 0.191 . 1 . . . A 112 LEU CG . 19050 1
436 . 1 1 37 37 LEU CD1 C 13 25.629 0.071 . 2 . . . A 112 LEU CD1 . 19050 1
437 . 1 1 37 37 LEU CD2 C 13 22.438 0.062 . 2 . . . A 112 LEU CD2 . 19050 1
438 . 1 1 37 37 LEU N N 15 118.707 0.035 . 1 . . . A 112 LEU N . 19050 1
439 . 1 1 38 38 GLY H H 1 7.646 0.008 . 1 . . . A 113 GLY H . 19050 1
440 . 1 1 38 38 GLY HA2 H 1 4.181 0.016 . 2 . . . A 113 GLY HA2 . 19050 1
441 . 1 1 38 38 GLY HA3 H 1 3.748 0.014 . 2 . . . A 113 GLY HA3 . 19050 1
442 . 1 1 38 38 GLY C C 13 174.243 0.018 . 1 . . . A 113 GLY C . 19050 1
443 . 1 1 38 38 GLY CA C 13 45.913 0.123 . 1 . . . A 113 GLY CA . 19050 1
444 . 1 1 38 38 GLY N N 15 105.912 0.040 . 1 . . . A 113 GLY N . 19050 1
445 . 1 1 39 39 GLU H H 1 8.092 0.008 . 1 . . . A 114 GLU H . 19050 1
446 . 1 1 39 39 GLU HA H 1 4.449 0.010 . 1 . . . A 114 GLU HA . 19050 1
447 . 1 1 39 39 GLU HB2 H 1 1.659 0.014 . 2 . . . A 114 GLU HB2 . 19050 1
448 . 1 1 39 39 GLU HB3 H 1 1.945 0.016 . 2 . . . A 114 GLU HB3 . 19050 1
449 . 1 1 39 39 GLU HG2 H 1 2.220 0.014 . 2 . . . A 114 GLU HG2 . 19050 1
450 . 1 1 39 39 GLU HG3 H 1 2.021 0.022 . 2 . . . A 114 GLU HG3 . 19050 1
451 . 1 1 39 39 GLU C C 13 174.862 0.008 . 1 . . . A 114 GLU C . 19050 1
452 . 1 1 39 39 GLU CA C 13 54.226 0.099 . 1 . . . A 114 GLU CA . 19050 1
453 . 1 1 39 39 GLU CB C 13 30.091 0.128 . 1 . . . A 114 GLU CB . 19050 1
454 . 1 1 39 39 GLU CG C 13 35.295 0.087 . 1 . . . A 114 GLU CG . 19050 1
455 . 1 1 39 39 GLU N N 15 120.382 0.040 . 1 . . . A 114 GLU N . 19050 1
456 . 1 1 40 40 LYS H H 1 8.540 0.004 . 1 . . . A 115 LYS H . 19050 1
457 . 1 1 40 40 LYS HA H 1 4.340 0.016 . 1 . . . A 115 LYS HA . 19050 1
458 . 1 1 40 40 LYS HB3 H 1 1.747 0.024 . 1 . . . A 115 LYS HB3 . 19050 1
459 . 1 1 40 40 LYS HG3 H 1 1.310 0.012 . 1 . . . A 115 LYS HG3 . 19050 1
460 . 1 1 40 40 LYS HD3 H 1 1.663 0.012 . 1 . . . A 115 LYS HD3 . 19050 1
461 . 1 1 40 40 LYS HE3 H 1 2.971 0.014 . 1 . . . A 115 LYS HE3 . 19050 1
462 . 1 1 40 40 LYS C C 13 175.509 0.008 . 1 . . . A 115 LYS C . 19050 1
463 . 1 1 40 40 LYS CA C 13 55.801 0.121 . 1 . . . A 115 LYS CA . 19050 1
464 . 1 1 40 40 LYS CB C 13 31.785 0.100 . 1 . . . A 115 LYS CB . 19050 1
465 . 1 1 40 40 LYS CG C 13 24.377 0.197 . 1 . . . A 115 LYS CG . 19050 1
466 . 1 1 40 40 LYS CD C 13 28.958 0.085 . 1 . . . A 115 LYS CD . 19050 1
467 . 1 1 40 40 LYS CE C 13 41.856 0.055 . 1 . . . A 115 LYS CE . 19050 1
468 . 1 1 40 40 LYS N N 15 124.202 0.032 . 1 . . . A 115 LYS N . 19050 1
469 . 1 1 41 41 LEU H H 1 8.127 0.005 . 1 . . . A 116 LEU H . 19050 1
470 . 1 1 41 41 LEU HA H 1 4.819 0.012 . 1 . . . A 116 LEU HA . 19050 1
471 . 1 1 41 41 LEU HB2 H 1 1.516 0.023 . 2 . . . A 116 LEU HB2 . 19050 1
472 . 1 1 41 41 LEU HB3 H 1 1.580 0.023 . 2 . . . A 116 LEU HB3 . 19050 1
473 . 1 1 41 41 LEU HG H 1 1.599 0.018 . 1 . . . A 116 LEU HG . 19050 1
474 . 1 1 41 41 LEU HD11 H 1 0.800 0.014 . 2 . . . A 116 LEU HD11 . 19050 1
475 . 1 1 41 41 LEU HD12 H 1 0.800 0.014 . 2 . . . A 116 LEU HD12 . 19050 1
476 . 1 1 41 41 LEU HD13 H 1 0.800 0.014 . 2 . . . A 116 LEU HD13 . 19050 1
477 . 1 1 41 41 LEU HD21 H 1 0.813 0.016 . 2 . . . A 116 LEU HD21 . 19050 1
478 . 1 1 41 41 LEU HD22 H 1 0.813 0.016 . 2 . . . A 116 LEU HD22 . 19050 1
479 . 1 1 41 41 LEU HD23 H 1 0.813 0.016 . 2 . . . A 116 LEU HD23 . 19050 1
480 . 1 1 41 41 LEU C C 13 177.972 0.009 . 1 . . . A 116 LEU C . 19050 1
481 . 1 1 41 41 LEU CA C 13 53.787 0.097 . 1 . . . A 116 LEU CA . 19050 1
482 . 1 1 41 41 LEU CB C 13 44.938 0.118 . 1 . . . A 116 LEU CB . 19050 1
483 . 1 1 41 41 LEU CG C 13 27.385 0.181 . 1 . . . A 116 LEU CG . 19050 1
484 . 1 1 41 41 LEU CD1 C 13 26.855 0.075 . 2 . . . A 116 LEU CD1 . 19050 1
485 . 1 1 41 41 LEU CD2 C 13 23.925 0.077 . 2 . . . A 116 LEU CD2 . 19050 1
486 . 1 1 41 41 LEU N N 15 125.733 0.034 . 1 . . . A 116 LEU N . 19050 1
487 . 1 1 42 42 THR H H 1 9.298 0.006 . 1 . . . A 117 THR H . 19050 1
488 . 1 1 42 42 THR HA H 1 4.460 0.011 . 1 . . . A 117 THR HA . 19050 1
489 . 1 1 42 42 THR HB H 1 4.714 0.012 . 1 . . . A 117 THR HB . 19050 1
490 . 1 1 42 42 THR HG21 H 1 1.318 0.012 . 1 . . . A 117 THR HG21 . 19050 1
491 . 1 1 42 42 THR HG22 H 1 1.318 0.012 . 1 . . . A 117 THR HG22 . 19050 1
492 . 1 1 42 42 THR HG23 H 1 1.318 0.012 . 1 . . . A 117 THR HG23 . 19050 1
493 . 1 1 42 42 THR C C 13 175.475 0.013 . 1 . . . A 117 THR C . 19050 1
494 . 1 1 42 42 THR CA C 13 60.638 0.128 . 1 . . . A 117 THR CA . 19050 1
495 . 1 1 42 42 THR CB C 13 70.812 0.045 . 1 . . . A 117 THR CB . 19050 1
496 . 1 1 42 42 THR CG2 C 13 21.747 0.171 . 1 . . . A 117 THR CG2 . 19050 1
497 . 1 1 42 42 THR N N 15 114.717 0.033 . 1 . . . A 117 THR N . 19050 1
498 . 1 1 43 43 ASP H H 1 8.872 0.004 . 1 . . . A 118 ASP H . 19050 1
499 . 1 1 43 43 ASP HA H 1 4.238 0.012 . 1 . . . A 118 ASP HA . 19050 1
500 . 1 1 43 43 ASP HB2 H 1 2.779 0.020 . 2 . . . A 118 ASP HB2 . 19050 1
501 . 1 1 43 43 ASP HB3 H 1 2.620 0.011 . 2 . . . A 118 ASP HB3 . 19050 1
502 . 1 1 43 43 ASP C C 13 178.667 0.008 . 1 . . . A 118 ASP C . 19050 1
503 . 1 1 43 43 ASP CA C 13 58.058 0.080 . 1 . . . A 118 ASP CA . 19050 1
504 . 1 1 43 43 ASP CB C 13 39.564 0.119 . 1 . . . A 118 ASP CB . 19050 1
505 . 1 1 43 43 ASP N N 15 120.800 0.026 . 1 . . . A 118 ASP N . 19050 1
506 . 1 1 44 44 ASP H H 1 8.311 0.005 . 1 . . . A 119 ASP H . 19050 1
507 . 1 1 44 44 ASP HA H 1 4.418 0.008 . 1 . . . A 119 ASP HA . 19050 1
508 . 1 1 44 44 ASP HB2 H 1 2.546 0.008 . 2 . . . A 119 ASP HB2 . 19050 1
509 . 1 1 44 44 ASP HB3 H 1 2.660 0.010 . 2 . . . A 119 ASP HB3 . 19050 1
510 . 1 1 44 44 ASP C C 13 178.662 0.025 . 1 . . . A 119 ASP C . 19050 1
511 . 1 1 44 44 ASP CA C 13 57.108 0.089 . 1 . . . A 119 ASP CA . 19050 1
512 . 1 1 44 44 ASP CB C 13 40.316 0.057 . 1 . . . A 119 ASP CB . 19050 1
513 . 1 1 44 44 ASP N N 15 118.011 0.022 . 1 . . . A 119 ASP N . 19050 1
514 . 1 1 45 45 GLU H H 1 7.711 0.004 . 1 . . . A 120 GLU H . 19050 1
515 . 1 1 45 45 GLU HA H 1 3.996 0.011 . 1 . . . A 120 GLU HA . 19050 1
516 . 1 1 45 45 GLU HB2 H 1 1.909 0.016 . 2 . . . A 120 GLU HB2 . 19050 1
517 . 1 1 45 45 GLU HB3 H 1 2.423 0.021 . 2 . . . A 120 GLU HB3 . 19050 1
518 . 1 1 45 45 GLU HG2 H 1 2.248 0.017 . 2 . . . A 120 GLU HG2 . 19050 1
519 . 1 1 45 45 GLU HG3 H 1 2.391 0.013 . 2 . . . A 120 GLU HG3 . 19050 1
520 . 1 1 45 45 GLU C C 13 179.894 0.016 . 1 . . . A 120 GLU C . 19050 1
521 . 1 1 45 45 GLU CA C 13 59.272 0.104 . 1 . . . A 120 GLU CA . 19050 1
522 . 1 1 45 45 GLU CB C 13 30.355 0.069 . 1 . . . A 120 GLU CB . 19050 1
523 . 1 1 45 45 GLU CG C 13 37.867 0.039 . 1 . . . A 120 GLU CG . 19050 1
524 . 1 1 45 45 GLU N N 15 120.926 0.033 . 1 . . . A 120 GLU N . 19050 1
525 . 1 1 46 46 VAL H H 1 8.093 0.005 . 1 . . . A 121 VAL H . 19050 1
526 . 1 1 46 46 VAL HA H 1 3.597 0.009 . 1 . . . A 121 VAL HA . 19050 1
527 . 1 1 46 46 VAL HB H 1 2.240 0.013 . 1 . . . A 121 VAL HB . 19050 1
528 . 1 1 46 46 VAL HG11 H 1 1.042 0.010 . 2 . . . A 121 VAL HG11 . 19050 1
529 . 1 1 46 46 VAL HG12 H 1 1.042 0.010 . 2 . . . A 121 VAL HG12 . 19050 1
530 . 1 1 46 46 VAL HG13 H 1 1.042 0.010 . 2 . . . A 121 VAL HG13 . 19050 1
531 . 1 1 46 46 VAL HG21 H 1 0.972 0.011 . 2 . . . A 121 VAL HG21 . 19050 1
532 . 1 1 46 46 VAL HG22 H 1 0.972 0.011 . 2 . . . A 121 VAL HG22 . 19050 1
533 . 1 1 46 46 VAL HG23 H 1 0.972 0.011 . 2 . . . A 121 VAL HG23 . 19050 1
534 . 1 1 46 46 VAL C C 13 177.225 0.012 . 1 . . . A 121 VAL C . 19050 1
535 . 1 1 46 46 VAL CA C 13 66.936 0.090 . 1 . . . A 121 VAL CA . 19050 1
536 . 1 1 46 46 VAL CB C 13 31.327 0.110 . 1 . . . A 121 VAL CB . 19050 1
537 . 1 1 46 46 VAL CG1 C 13 22.242 0.069 . 2 . . . A 121 VAL CG1 . 19050 1
538 . 1 1 46 46 VAL CG2 C 13 23.901 0.045 . 2 . . . A 121 VAL CG2 . 19050 1
539 . 1 1 46 46 VAL N N 15 120.807 0.042 . 1 . . . A 121 VAL N . 19050 1
540 . 1 1 47 47 ASP H H 1 7.992 0.005 . 1 . . . A 122 ASP H . 19050 1
541 . 1 1 47 47 ASP HA H 1 4.326 0.010 . 1 . . . A 122 ASP HA . 19050 1
542 . 1 1 47 47 ASP HB2 H 1 2.640 0.018 . 2 . . . A 122 ASP HB2 . 19050 1
543 . 1 1 47 47 ASP HB3 H 1 2.811 0.024 . 2 . . . A 122 ASP HB3 . 19050 1
544 . 1 1 47 47 ASP C C 13 179.112 0.001 . 1 . . . A 122 ASP C . 19050 1
545 . 1 1 47 47 ASP CA C 13 57.613 0.122 . 1 . . . A 122 ASP CA . 19050 1
546 . 1 1 47 47 ASP CB C 13 40.525 0.082 . 1 . . . A 122 ASP CB . 19050 1
547 . 1 1 47 47 ASP N N 15 119.435 0.052 . 1 . . . A 122 ASP N . 19050 1
548 . 1 1 48 48 GLU H H 1 7.959 0.006 . 1 . . . A 123 GLU H . 19050 1
549 . 1 1 48 48 GLU HA H 1 4.000 0.011 . 1 . . . A 123 GLU HA . 19050 1
550 . 1 1 48 48 GLU HB2 H 1 1.995 0.027 . 1 . . . A 123 GLU HB2 . 19050 1
551 . 1 1 48 48 GLU HG3 H 1 2.296 0.011 . 1 . . . A 123 GLU HG3 . 19050 1
552 . 1 1 48 48 GLU C C 13 177.979 0.010 . 1 . . . A 123 GLU C . 19050 1
553 . 1 1 48 48 GLU CA C 13 59.242 0.118 . 1 . . . A 123 GLU CA . 19050 1
554 . 1 1 48 48 GLU CB C 13 29.471 0.023 . 1 . . . A 123 GLU CB . 19050 1
555 . 1 1 48 48 GLU CG C 13 36.019 0.131 . 1 . . . A 123 GLU CG . 19050 1
556 . 1 1 48 48 GLU N N 15 119.496 0.056 . 1 . . . A 123 GLU N . 19050 1
557 . 1 1 49 49 MET H H 1 7.801 0.005 . 1 . . . A 124 MET H . 19050 1
558 . 1 1 49 49 MET HA H 1 4.012 0.016 . 1 . . . A 124 MET HA . 19050 1
559 . 1 1 49 49 MET HB2 H 1 1.970 0.017 . 2 . . . A 124 MET HB2 . 19050 1
560 . 1 1 49 49 MET HB3 H 1 2.287 0.013 . 2 . . . A 124 MET HB3 . 19050 1
561 . 1 1 49 49 MET HG2 H 1 2.365 0.016 . 2 . . . A 124 MET HG2 . 19050 1
562 . 1 1 49 49 MET HG3 H 1 2.747 0.017 . 2 . . . A 124 MET HG3 . 19050 1
563 . 1 1 49 49 MET HE1 H 1 1.979 0.010 . 1 . . . A 124 MET HE1 . 19050 1
564 . 1 1 49 49 MET HE2 H 1 1.979 0.010 . 1 . . . A 124 MET HE2 . 19050 1
565 . 1 1 49 49 MET HE3 H 1 1.979 0.010 . 1 . . . A 124 MET HE3 . 19050 1
566 . 1 1 49 49 MET C C 13 178.784 0.004 . 1 . . . A 124 MET C . 19050 1
567 . 1 1 49 49 MET CA C 13 59.374 0.156 . 1 . . . A 124 MET CA . 19050 1
568 . 1 1 49 49 MET CB C 13 33.196 0.089 . 1 . . . A 124 MET CB . 19050 1
569 . 1 1 49 49 MET CG C 13 32.194 0.077 . 1 . . . A 124 MET CG . 19050 1
570 . 1 1 49 49 MET CE C 13 17.070 0.052 . 1 . . . A 124 MET CE . 19050 1
571 . 1 1 49 49 MET N N 15 119.608 0.023 . 1 . . . A 124 MET N . 19050 1
572 . 1 1 50 50 ILE H H 1 7.928 0.004 . 1 . . . A 125 ILE H . 19050 1
573 . 1 1 50 50 ILE HA H 1 3.492 0.014 . 1 . . . A 125 ILE HA . 19050 1
574 . 1 1 50 50 ILE HB H 1 2.059 0.012 . 1 . . . A 125 ILE HB . 19050 1
575 . 1 1 50 50 ILE HG12 H 1 1.137 0.010 . 2 . . . A 125 ILE HG12 . 19050 1
576 . 1 1 50 50 ILE HG13 H 1 1.587 0.010 . 2 . . . A 125 ILE HG13 . 19050 1
577 . 1 1 50 50 ILE HG21 H 1 0.661 0.012 . 1 . . . A 125 ILE HG21 . 19050 1
578 . 1 1 50 50 ILE HG22 H 1 0.661 0.012 . 1 . . . A 125 ILE HG22 . 19050 1
579 . 1 1 50 50 ILE HG23 H 1 0.661 0.012 . 1 . . . A 125 ILE HG23 . 19050 1
580 . 1 1 50 50 ILE HD11 H 1 0.686 0.019 . 1 . . . A 125 ILE HD11 . 19050 1
581 . 1 1 50 50 ILE HD12 H 1 0.686 0.019 . 1 . . . A 125 ILE HD12 . 19050 1
582 . 1 1 50 50 ILE HD13 H 1 0.686 0.019 . 1 . . . A 125 ILE HD13 . 19050 1
583 . 1 1 50 50 ILE C C 13 177.146 0.002 . 1 . . . A 125 ILE C . 19050 1
584 . 1 1 50 50 ILE CA C 13 64.399 0.099 . 1 . . . A 125 ILE CA . 19050 1
585 . 1 1 50 50 ILE CB C 13 36.555 0.092 . 1 . . . A 125 ILE CB . 19050 1
586 . 1 1 50 50 ILE CG1 C 13 28.410 0.087 . 1 . . . A 125 ILE CG1 . 19050 1
587 . 1 1 50 50 ILE CG2 C 13 16.225 0.076 . 1 . . . A 125 ILE CG2 . 19050 1
588 . 1 1 50 50 ILE CD1 C 13 11.084 0.128 . 1 . . . A 125 ILE CD1 . 19050 1
589 . 1 1 50 50 ILE N N 15 117.471 0.037 . 1 . . . A 125 ILE N . 19050 1
590 . 1 1 51 51 ARG H H 1 8.244 0.005 . 1 . . . A 126 ARG H . 19050 1
591 . 1 1 51 51 ARG HA H 1 3.998 0.010 . 1 . . . A 126 ARG HA . 19050 1
592 . 1 1 51 51 ARG HB2 H 1 1.909 0.017 . 1 . . . A 126 ARG HB2 . 19050 1
593 . 1 1 51 51 ARG HG2 H 1 1.648 0.026 . 2 . . . A 126 ARG HG2 . 19050 1
594 . 1 1 51 51 ARG HG3 H 1 1.772 0.020 . 2 . . . A 126 ARG HG3 . 19050 1
595 . 1 1 51 51 ARG HD3 H 1 3.213 0.011 . 1 . . . A 126 ARG HD3 . 19050 1
596 . 1 1 51 51 ARG HE H 1 7.517 0.001 . 1 . . . A 126 ARG HE . 19050 1
597 . 1 1 51 51 ARG C C 13 179.310 0.022 . 1 . . . A 126 ARG C . 19050 1
598 . 1 1 51 51 ARG CA C 13 59.669 0.160 . 1 . . . A 126 ARG CA . 19050 1
599 . 1 1 51 51 ARG CB C 13 30.240 0.106 . 1 . . . A 126 ARG CB . 19050 1
600 . 1 1 51 51 ARG CG C 13 27.851 0.168 . 1 . . . A 126 ARG CG . 19050 1
601 . 1 1 51 51 ARG CD C 13 43.253 0.115 . 1 . . . A 126 ARG CD . 19050 1
602 . 1 1 51 51 ARG N N 15 118.017 0.068 . 1 . . . A 126 ARG N . 19050 1
603 . 1 1 51 51 ARG NE N 15 84.360 0.013 . 1 . . . A 126 ARG NE . 19050 1
604 . 1 1 52 52 GLU H H 1 7.891 0.006 . 1 . . . A 127 GLU H . 19050 1
605 . 1 1 52 52 GLU HA H 1 3.995 0.011 . 1 . . . A 127 GLU HA . 19050 1
606 . 1 1 52 52 GLU HB2 H 1 2.063 0.017 . 1 . . . A 127 GLU HB2 . 19050 1
607 . 1 1 52 52 GLU HG2 H 1 2.438 0.011 . 2 . . . A 127 GLU HG2 . 19050 1
608 . 1 1 52 52 GLU HG3 H 1 2.272 0.024 . 2 . . . A 127 GLU HG3 . 19050 1
609 . 1 1 52 52 GLU C C 13 177.219 0.001 . 1 . . . A 127 GLU C . 19050 1
610 . 1 1 52 52 GLU CA C 13 58.582 0.177 . 1 . . . A 127 GLU CA . 19050 1
611 . 1 1 52 52 GLU CB C 13 29.841 0.104 . 1 . . . A 127 GLU CB . 19050 1
612 . 1 1 52 52 GLU CG C 13 36.562 0.107 . 1 . . . A 127 GLU CG . 19050 1
613 . 1 1 52 52 GLU N N 15 115.902 0.041 . 1 . . . A 127 GLU N . 19050 1
614 . 1 1 53 53 ALA H H 1 7.298 0.006 . 1 . . . A 128 ALA H . 19050 1
615 . 1 1 53 53 ALA HA H 1 4.450 0.006 . 1 . . . A 128 ALA HA . 19050 1
616 . 1 1 53 53 ALA HB1 H 1 1.423 0.015 . 1 . . . A 128 ALA HB1 . 19050 1
617 . 1 1 53 53 ALA HB2 H 1 1.423 0.015 . 1 . . . A 128 ALA HB2 . 19050 1
618 . 1 1 53 53 ALA HB3 H 1 1.423 0.015 . 1 . . . A 128 ALA HB3 . 19050 1
619 . 1 1 53 53 ALA C C 13 177.888 0.014 . 1 . . . A 128 ALA C . 19050 1
620 . 1 1 53 53 ALA CA C 13 51.921 0.102 . 1 . . . A 128 ALA CA . 19050 1
621 . 1 1 53 53 ALA CB C 13 21.491 0.080 . 1 . . . A 128 ALA CB . 19050 1
622 . 1 1 53 53 ALA N N 15 118.763 0.050 . 1 . . . A 128 ALA N . 19050 1
623 . 1 1 54 54 ASP H H 1 7.997 0.005 . 1 . . . A 129 ASP H . 19050 1
624 . 1 1 54 54 ASP HA H 1 4.455 0.012 . 1 . . . A 129 ASP HA . 19050 1
625 . 1 1 54 54 ASP HB2 H 1 2.539 0.017 . 2 . . . A 129 ASP HB2 . 19050 1
626 . 1 1 54 54 ASP HB3 H 1 2.830 0.019 . 2 . . . A 129 ASP HB3 . 19050 1
627 . 1 1 54 54 ASP C C 13 175.969 0.017 . 1 . . . A 129 ASP C . 19050 1
628 . 1 1 54 54 ASP CA C 13 54.259 0.142 . 1 . . . A 129 ASP CA . 19050 1
629 . 1 1 54 54 ASP CB C 13 40.432 0.081 . 1 . . . A 129 ASP CB . 19050 1
630 . 1 1 54 54 ASP N N 15 117.823 0.015 . 1 . . . A 129 ASP N . 19050 1
631 . 1 1 55 55 ILE H H 1 8.408 0.007 . 1 . . . A 130 ILE H . 19050 1
632 . 1 1 55 55 ILE HA H 1 3.976 0.010 . 1 . . . A 130 ILE HA . 19050 1
633 . 1 1 55 55 ILE HB H 1 2.034 0.012 . 1 . . . A 130 ILE HB . 19050 1
634 . 1 1 55 55 ILE HG12 H 1 1.382 0.016 . 2 . . . A 130 ILE HG12 . 19050 1
635 . 1 1 55 55 ILE HG13 H 1 1.628 0.013 . 2 . . . A 130 ILE HG13 . 19050 1
636 . 1 1 55 55 ILE HG21 H 1 0.918 0.012 . 1 . . . A 130 ILE HG21 . 19050 1
637 . 1 1 55 55 ILE HG22 H 1 0.918 0.012 . 1 . . . A 130 ILE HG22 . 19050 1
638 . 1 1 55 55 ILE HG23 H 1 0.918 0.012 . 1 . . . A 130 ILE HG23 . 19050 1
639 . 1 1 55 55 ILE HD11 H 1 0.854 0.014 . 1 . . . A 130 ILE HD11 . 19050 1
640 . 1 1 55 55 ILE HD12 H 1 0.854 0.014 . 1 . . . A 130 ILE HD12 . 19050 1
641 . 1 1 55 55 ILE HD13 H 1 0.854 0.014 . 1 . . . A 130 ILE HD13 . 19050 1
642 . 1 1 55 55 ILE C C 13 177.720 0.008 . 1 . . . A 130 ILE C . 19050 1
643 . 1 1 55 55 ILE CA C 13 62.755 0.087 . 1 . . . A 130 ILE CA . 19050 1
644 . 1 1 55 55 ILE CB C 13 38.248 0.116 . 1 . . . A 130 ILE CB . 19050 1
645 . 1 1 55 55 ILE CG1 C 13 27.627 0.130 . 1 . . . A 130 ILE CG1 . 19050 1
646 . 1 1 55 55 ILE CG2 C 13 17.164 0.058 . 1 . . . A 130 ILE CG2 . 19050 1
647 . 1 1 55 55 ILE CD1 C 13 11.666 0.085 . 1 . . . A 130 ILE CD1 . 19050 1
648 . 1 1 55 55 ILE N N 15 127.724 0.029 . 1 . . . A 130 ILE N . 19050 1
649 . 1 1 56 56 ASP H H 1 8.224 0.005 . 1 . . . A 131 ASP H . 19050 1
650 . 1 1 56 56 ASP HA H 1 4.542 0.007 . 1 . . . A 131 ASP HA . 19050 1
651 . 1 1 56 56 ASP HB2 H 1 2.619 0.014 . 2 . . . A 131 ASP HB2 . 19050 1
652 . 1 1 56 56 ASP HB3 H 1 3.061 0.013 . 2 . . . A 131 ASP HB3 . 19050 1
653 . 1 1 56 56 ASP C C 13 178.247 0.006 . 1 . . . A 131 ASP C . 19050 1
654 . 1 1 56 56 ASP CA C 13 53.739 0.114 . 1 . . . A 131 ASP CA . 19050 1
655 . 1 1 56 56 ASP CB C 13 39.838 0.108 . 1 . . . A 131 ASP CB . 19050 1
656 . 1 1 56 56 ASP N N 15 116.998 0.045 . 1 . . . A 131 ASP N . 19050 1
657 . 1 1 57 57 GLY H H 1 7.585 0.005 . 1 . . . A 132 GLY H . 19050 1
658 . 1 1 57 57 GLY HA2 H 1 3.996 0.017 . 2 . . . A 132 GLY HA2 . 19050 1
659 . 1 1 57 57 GLY HA3 H 1 3.834 0.015 . 2 . . . A 132 GLY HA3 . 19050 1
660 . 1 1 57 57 GLY C C 13 175.298 0.019 . 1 . . . A 132 GLY C . 19050 1
661 . 1 1 57 57 GLY CA C 13 47.360 0.122 . 1 . . . A 132 GLY CA . 19050 1
662 . 1 1 57 57 GLY N N 15 108.645 0.029 . 1 . . . A 132 GLY N . 19050 1
663 . 1 1 58 58 ASP H H 1 8.371 0.009 . 1 . . . A 133 ASP H . 19050 1
664 . 1 1 58 58 ASP HA H 1 4.613 0.012 . 1 . . . A 133 ASP HA . 19050 1
665 . 1 1 58 58 ASP HB2 H 1 2.522 0.013 . 2 . . . A 133 ASP HB2 . 19050 1
666 . 1 1 58 58 ASP HB3 H 1 3.114 0.011 . 2 . . . A 133 ASP HB3 . 19050 1
667 . 1 1 58 58 ASP C C 13 179.110 0.010 . 1 . . . A 133 ASP C . 19050 1
668 . 1 1 58 58 ASP CA C 13 53.569 0.111 . 1 . . . A 133 ASP CA . 19050 1
669 . 1 1 58 58 ASP CB C 13 40.360 0.173 . 1 . . . A 133 ASP CB . 19050 1
670 . 1 1 58 58 ASP N N 15 120.990 0.035 . 1 . . . A 133 ASP N . 19050 1
671 . 1 1 59 59 GLY H H 1 10.474 0.007 . 1 . . . A 134 GLY H . 19050 1
672 . 1 1 59 59 GLY HA2 H 1 3.995 0.009 . 2 . . . A 134 GLY HA2 . 19050 1
673 . 1 1 59 59 GLY HA3 H 1 3.404 0.009 . 2 . . . A 134 GLY HA3 . 19050 1
674 . 1 1 59 59 GLY C C 13 172.177 0.016 . 1 . . . A 134 GLY C . 19050 1
675 . 1 1 59 59 GLY CA C 13 46.050 0.116 . 1 . . . A 134 GLY CA . 19050 1
676 . 1 1 59 59 GLY N N 15 115.313 0.022 . 1 . . . A 134 GLY N . 19050 1
677 . 1 1 60 60 HIS H H 1 8.299 0.007 . 1 . . . A 135 HIS H . 19050 1
678 . 1 1 60 60 HIS HA H 1 5.049 0.007 . 1 . . . A 135 HIS HA . 19050 1
679 . 1 1 60 60 HIS HB2 H 1 2.689 0.018 . 2 . . . A 135 HIS HB2 . 19050 1
680 . 1 1 60 60 HIS HB3 H 1 2.873 0.019 . 2 . . . A 135 HIS HB3 . 19050 1
681 . 1 1 60 60 HIS HD2 H 1 6.331 0.013 . 1 . . . A 135 HIS HD2 . 19050 1
682 . 1 1 60 60 HIS C C 13 174.742 0.023 . 1 . . . A 135 HIS C . 19050 1
683 . 1 1 60 60 HIS CA C 13 54.109 0.093 . 1 . . . A 135 HIS CA . 19050 1
684 . 1 1 60 60 HIS CB C 13 34.766 0.077 . 1 . . . A 135 HIS CB . 19050 1
685 . 1 1 60 60 HIS N N 15 116.095 0.028 . 1 . . . A 135 HIS N . 19050 1
686 . 1 1 61 61 ILE H H 1 9.286 0.009 . 1 . . . A 136 ILE H . 19050 1
687 . 1 1 61 61 ILE HA H 1 5.168 0.008 . 1 . . . A 136 ILE HA . 19050 1
688 . 1 1 61 61 ILE HB H 1 2.078 0.012 . 1 . . . A 136 ILE HB . 19050 1
689 . 1 1 61 61 ILE HG12 H 1 0.938 0.017 . 2 . . . A 136 ILE HG12 . 19050 1
690 . 1 1 61 61 ILE HG13 H 1 1.546 0.016 . 2 . . . A 136 ILE HG13 . 19050 1
691 . 1 1 61 61 ILE HG21 H 1 1.258 0.012 . 1 . . . A 136 ILE HG21 . 19050 1
692 . 1 1 61 61 ILE HG22 H 1 1.258 0.012 . 1 . . . A 136 ILE HG22 . 19050 1
693 . 1 1 61 61 ILE HG23 H 1 1.258 0.012 . 1 . . . A 136 ILE HG23 . 19050 1
694 . 1 1 61 61 ILE HD11 H 1 0.749 0.013 . 1 . . . A 136 ILE HD11 . 19050 1
695 . 1 1 61 61 ILE HD12 H 1 0.749 0.013 . 1 . . . A 136 ILE HD12 . 19050 1
696 . 1 1 61 61 ILE HD13 H 1 0.749 0.013 . 1 . . . A 136 ILE HD13 . 19050 1
697 . 1 1 61 61 ILE C C 13 175.993 0.024 . 1 . . . A 136 ILE C . 19050 1
698 . 1 1 61 61 ILE CA C 13 59.892 0.128 . 1 . . . A 136 ILE CA . 19050 1
699 . 1 1 61 61 ILE CB C 13 39.390 0.096 . 1 . . . A 136 ILE CB . 19050 1
700 . 1 1 61 61 ILE CG1 C 13 26.935 0.069 . 1 . . . A 136 ILE CG1 . 19050 1
701 . 1 1 61 61 ILE CG2 C 13 18.145 0.064 . 1 . . . A 136 ILE CG2 . 19050 1
702 . 1 1 61 61 ILE CD1 C 13 12.863 0.065 . 1 . . . A 136 ILE CD1 . 19050 1
703 . 1 1 61 61 ILE N N 15 124.511 0.044 . 1 . . . A 136 ILE N . 19050 1
704 . 1 1 62 62 ASN H H 1 9.478 0.006 . 1 . . . A 137 ASN H . 19050 1
705 . 1 1 62 62 ASN HA H 1 5.436 0.012 . 1 . . . A 137 ASN HA . 19050 1
706 . 1 1 62 62 ASN HB2 H 1 3.212 0.014 . 2 . . . A 137 ASN HB2 . 19050 1
707 . 1 1 62 62 ASN HB3 H 1 3.404 0.010 . 2 . . . A 137 ASN HB3 . 19050 1
708 . 1 1 62 62 ASN HD21 H 1 6.693 0.003 . 1 . . . A 137 ASN HD21 . 19050 1
709 . 1 1 62 62 ASN HD22 H 1 7.241 0.020 . 1 . . . A 137 ASN HD22 . 19050 1
710 . 1 1 62 62 ASN C C 13 175.376 0.004 . 1 . . . A 137 ASN C . 19050 1
711 . 1 1 62 62 ASN CA C 13 51.057 0.151 . 1 . . . A 137 ASN CA . 19050 1
712 . 1 1 62 62 ASN CB C 13 37.942 0.083 . 1 . . . A 137 ASN CB . 19050 1
713 . 1 1 62 62 ASN N N 15 129.252 0.029 . 1 . . . A 137 ASN N . 19050 1
714 . 1 1 62 62 ASN ND2 N 15 107.618 0.207 . 1 . . . A 137 ASN ND2 . 19050 1
715 . 1 1 63 63 TYR H H 1 8.673 0.004 . 1 . . . A 138 TYR H . 19050 1
716 . 1 1 63 63 TYR HA H 1 3.507 0.008 . 1 . . . A 138 TYR HA . 19050 1
717 . 1 1 63 63 TYR HB2 H 1 2.006 0.015 . 2 . . . A 138 TYR HB2 . 19050 1
718 . 1 1 63 63 TYR HB3 H 1 2.402 0.017 . 2 . . . A 138 TYR HB3 . 19050 1
719 . 1 1 63 63 TYR HD1 H 1 6.448 0.006 . 3 . . . A 138 TYR HD1 . 19050 1
720 . 1 1 63 63 TYR HD2 H 1 6.448 0.006 . 3 . . . A 138 TYR HD2 . 19050 1
721 . 1 1 63 63 TYR HE1 H 1 6.527 0.005 . 3 . . . A 138 TYR HE1 . 19050 1
722 . 1 1 63 63 TYR HE2 H 1 6.527 0.005 . 3 . . . A 138 TYR HE2 . 19050 1
723 . 1 1 63 63 TYR C C 13 176.123 0.011 . 1 . . . A 138 TYR C . 19050 1
724 . 1 1 63 63 TYR CA C 13 62.760 0.090 . 1 . . . A 138 TYR CA . 19050 1
725 . 1 1 63 63 TYR CB C 13 37.477 0.090 . 1 . . . A 138 TYR CB . 19050 1
726 . 1 1 63 63 TYR CD1 C 13 132.261 0.015 . 3 . . . A 138 TYR CD1 . 19050 1
727 . 1 1 63 63 TYR CD2 C 13 132.261 0.015 . 3 . . . A 138 TYR CD2 . 19050 1
728 . 1 1 63 63 TYR CE1 C 13 118.095 0.018 . 3 . . . A 138 TYR CE1 . 19050 1
729 . 1 1 63 63 TYR CE2 C 13 118.095 0.018 . 3 . . . A 138 TYR CE2 . 19050 1
730 . 1 1 63 63 TYR N N 15 119.148 0.030 . 1 . . . A 138 TYR N . 19050 1
731 . 1 1 64 64 GLU H H 1 8.079 0.005 . 1 . . . A 139 GLU H . 19050 1
732 . 1 1 64 64 GLU HA H 1 3.662 0.011 . 1 . . . A 139 GLU HA . 19050 1
733 . 1 1 64 64 GLU HB2 H 1 1.990 0.017 . 2 . . . A 139 GLU HB2 . 19050 1
734 . 1 1 64 64 GLU HB3 H 1 2.085 0.019 . 2 . . . A 139 GLU HB3 . 19050 1
735 . 1 1 64 64 GLU HG2 H 1 2.312 0.010 . 2 . . . A 139 GLU HG2 . 19050 1
736 . 1 1 64 64 GLU HG3 H 1 2.302 0.012 . 2 . . . A 139 GLU HG3 . 19050 1
737 . 1 1 64 64 GLU C C 13 180.434 0.012 . 1 . . . A 139 GLU C . 19050 1
738 . 1 1 64 64 GLU CA C 13 60.112 0.129 . 1 . . . A 139 GLU CA . 19050 1
739 . 1 1 64 64 GLU CB C 13 29.048 0.085 . 1 . . . A 139 GLU CB . 19050 1
740 . 1 1 64 64 GLU CG C 13 36.730 0.125 . 1 . . . A 139 GLU CG . 19050 1
741 . 1 1 64 64 GLU N N 15 118.718 0.024 . 1 . . . A 139 GLU N . 19050 1
742 . 1 1 65 65 GLU H H 1 8.814 0.005 . 1 . . . A 140 GLU H . 19050 1
743 . 1 1 65 65 GLU HA H 1 3.994 0.014 . 1 . . . A 140 GLU HA . 19050 1
744 . 1 1 65 65 GLU HB2 H 1 2.107 0.029 . 2 . . . A 140 GLU HB2 . 19050 1
745 . 1 1 65 65 GLU HB3 H 1 2.590 0.019 . 2 . . . A 140 GLU HB3 . 19050 1
746 . 1 1 65 65 GLU HG2 H 1 2.448 0.013 . 2 . . . A 140 GLU HG2 . 19050 1
747 . 1 1 65 65 GLU HG3 H 1 2.839 0.014 . 2 . . . A 140 GLU HG3 . 19050 1
748 . 1 1 65 65 GLU C C 13 179.295 0.010 . 1 . . . A 140 GLU C . 19050 1
749 . 1 1 65 65 GLU CA C 13 58.304 0.108 . 1 . . . A 140 GLU CA . 19050 1
750 . 1 1 65 65 GLU CB C 13 29.903 0.173 . 1 . . . A 140 GLU CB . 19050 1
751 . 1 1 65 65 GLU CG C 13 36.861 0.073 . 1 . . . A 140 GLU CG . 19050 1
752 . 1 1 65 65 GLU N N 15 119.561 0.054 . 1 . . . A 140 GLU N . 19050 1
753 . 1 1 66 66 PHE H H 1 8.944 0.011 . 1 . . . A 141 PHE H . 19050 1
754 . 1 1 66 66 PHE HA H 1 3.968 0.015 . 1 . . . A 141 PHE HA . 19050 1
755 . 1 1 66 66 PHE HB2 H 1 3.233 0.015 . 2 . . . A 141 PHE HB2 . 19050 1
756 . 1 1 66 66 PHE HB3 H 1 3.499 0.011 . 2 . . . A 141 PHE HB3 . 19050 1
757 . 1 1 66 66 PHE HD1 H 1 6.914 0.016 . 3 . . . A 141 PHE HD1 . 19050 1
758 . 1 1 66 66 PHE HD2 H 1 6.914 0.016 . 3 . . . A 141 PHE HD2 . 19050 1
759 . 1 1 66 66 PHE HE1 H 1 7.043 0.013 . 3 . . . A 141 PHE HE1 . 19050 1
760 . 1 1 66 66 PHE HE2 H 1 7.043 0.013 . 3 . . . A 141 PHE HE2 . 19050 1
761 . 1 1 66 66 PHE HZ H 1 6.636 0.006 . 1 . . . A 141 PHE HZ . 19050 1
762 . 1 1 66 66 PHE C C 13 176.525 0.008 . 1 . . . A 141 PHE C . 19050 1
763 . 1 1 66 66 PHE CA C 13 61.505 0.082 . 1 . . . A 141 PHE CA . 19050 1
764 . 1 1 66 66 PHE CB C 13 39.916 0.082 . 1 . . . A 141 PHE CB . 19050 1
765 . 1 1 66 66 PHE CD1 C 13 131.744 0.044 . 3 . . . A 141 PHE CD1 . 19050 1
766 . 1 1 66 66 PHE CD2 C 13 131.744 0.044 . 3 . . . A 141 PHE CD2 . 19050 1
767 . 1 1 66 66 PHE CE1 C 13 131.256 0.076 . 3 . . . A 141 PHE CE1 . 19050 1
768 . 1 1 66 66 PHE CE2 C 13 131.256 0.076 . 3 . . . A 141 PHE CE2 . 19050 1
769 . 1 1 66 66 PHE CZ C 13 131.570 0.036 . 1 . . . A 141 PHE CZ . 19050 1
770 . 1 1 66 66 PHE N N 15 124.341 0.044 . 1 . . . A 141 PHE N . 19050 1
771 . 1 1 67 67 VAL H H 1 8.525 0.009 . 1 . . . A 142 VAL H . 19050 1
772 . 1 1 67 67 VAL HA H 1 3.096 0.011 . 1 . . . A 142 VAL HA . 19050 1
773 . 1 1 67 67 VAL HB H 1 1.817 0.018 . 1 . . . A 142 VAL HB . 19050 1
774 . 1 1 67 67 VAL HG11 H 1 0.521 0.012 . 2 . . . A 142 VAL HG11 . 19050 1
775 . 1 1 67 67 VAL HG12 H 1 0.521 0.012 . 2 . . . A 142 VAL HG12 . 19050 1
776 . 1 1 67 67 VAL HG13 H 1 0.521 0.012 . 2 . . . A 142 VAL HG13 . 19050 1
777 . 1 1 67 67 VAL HG21 H 1 0.744 0.012 . 2 . . . A 142 VAL HG21 . 19050 1
778 . 1 1 67 67 VAL HG22 H 1 0.744 0.012 . 2 . . . A 142 VAL HG22 . 19050 1
779 . 1 1 67 67 VAL HG23 H 1 0.744 0.012 . 2 . . . A 142 VAL HG23 . 19050 1
780 . 1 1 67 67 VAL C C 13 177.697 0.016 . 1 . . . A 142 VAL C . 19050 1
781 . 1 1 67 67 VAL CA C 13 67.281 0.079 . 1 . . . A 142 VAL CA . 19050 1
782 . 1 1 67 67 VAL CB C 13 31.595 0.102 . 1 . . . A 142 VAL CB . 19050 1
783 . 1 1 67 67 VAL CG1 C 13 22.873 0.052 . 2 . . . A 142 VAL CG1 . 19050 1
784 . 1 1 67 67 VAL CG2 C 13 21.230 0.052 . 2 . . . A 142 VAL CG2 . 19050 1
785 . 1 1 67 67 VAL N N 15 119.442 0.036 . 1 . . . A 142 VAL N . 19050 1
786 . 1 1 68 68 ARG H H 1 7.318 0.009 . 1 . . . A 143 ARG H . 19050 1
787 . 1 1 68 68 ARG HA H 1 3.910 0.013 . 1 . . . A 143 ARG HA . 19050 1
788 . 1 1 68 68 ARG HB2 H 1 1.851 0.023 . 1 . . . A 143 ARG HB2 . 19050 1
789 . 1 1 68 68 ARG HG2 H 1 1.567 0.018 . 1 . . . A 143 ARG HG2 . 19050 1
790 . 1 1 68 68 ARG HD3 H 1 3.210 0.012 . 1 . . . A 143 ARG HD3 . 19050 1
791 . 1 1 68 68 ARG HE H 1 7.393 0.009 . 1 . . . A 143 ARG HE . 19050 1
792 . 1 1 68 68 ARG C C 13 178.643 0.016 . 1 . . . A 143 ARG C . 19050 1
793 . 1 1 68 68 ARG CA C 13 58.981 0.092 . 1 . . . A 143 ARG CA . 19050 1
794 . 1 1 68 68 ARG CB C 13 29.859 0.124 . 1 . . . A 143 ARG CB . 19050 1
795 . 1 1 68 68 ARG CG C 13 27.398 0.122 . 1 . . . A 143 ARG CG . 19050 1
796 . 1 1 68 68 ARG CD C 13 43.185 0.082 . 1 . . . A 143 ARG CD . 19050 1
797 . 1 1 68 68 ARG N N 15 116.201 0.036 . 1 . . . A 143 ARG N . 19050 1
798 . 1 1 68 68 ARG NE N 15 84.543 0.021 . 1 . . . A 143 ARG NE . 19050 1
799 . 1 1 69 69 MET H H 1 7.563 0.006 . 1 . . . A 144 MET H . 19050 1
800 . 1 1 69 69 MET HA H 1 4.108 0.016 . 1 . . . A 144 MET HA . 19050 1
801 . 1 1 69 69 MET HB2 H 1 2.036 0.024 . 2 . . . A 144 MET HB2 . 19050 1
802 . 1 1 69 69 MET HB3 H 1 2.086 0.018 . 2 . . . A 144 MET HB3 . 19050 1
803 . 1 1 69 69 MET HG2 H 1 2.416 0.014 . 2 . . . A 144 MET HG2 . 19050 1
804 . 1 1 69 69 MET HG3 H 1 2.428 0.011 . 2 . . . A 144 MET HG3 . 19050 1
805 . 1 1 69 69 MET HE1 H 1 1.792 0.017 . 1 . . . A 144 MET HE1 . 19050 1
806 . 1 1 69 69 MET HE2 H 1 1.792 0.017 . 1 . . . A 144 MET HE2 . 19050 1
807 . 1 1 69 69 MET HE3 H 1 1.792 0.017 . 1 . . . A 144 MET HE3 . 19050 1
808 . 1 1 69 69 MET C C 13 177.259 0.010 . 1 . . . A 144 MET C . 19050 1
809 . 1 1 69 69 MET CA C 13 57.831 0.117 . 1 . . . A 144 MET CA . 19050 1
810 . 1 1 69 69 MET CB C 13 33.121 0.088 . 1 . . . A 144 MET CB . 19050 1
811 . 1 1 69 69 MET CG C 13 31.312 0.078 . 1 . . . A 144 MET CG . 19050 1
812 . 1 1 69 69 MET CE C 13 17.085 0.062 . 1 . . . A 144 MET CE . 19050 1
813 . 1 1 69 69 MET N N 15 117.446 0.052 . 1 . . . A 144 MET N . 19050 1
814 . 1 1 70 70 MET H H 1 7.684 0.006 . 1 . . . A 145 MET H . 19050 1
815 . 1 1 70 70 MET HA H 1 4.265 0.012 . 1 . . . A 145 MET HA . 19050 1
816 . 1 1 70 70 MET HB2 H 1 1.471 0.012 . 2 . . . A 145 MET HB2 . 19050 1
817 . 1 1 70 70 MET HB3 H 1 1.713 0.017 . 2 . . . A 145 MET HB3 . 19050 1
818 . 1 1 70 70 MET HE1 H 1 1.709 0.012 . 1 . . . A 145 MET HE1 . 19050 1
819 . 1 1 70 70 MET HE2 H 1 1.709 0.012 . 1 . . . A 145 MET HE2 . 19050 1
820 . 1 1 70 70 MET HE3 H 1 1.709 0.012 . 1 . . . A 145 MET HE3 . 19050 1
821 . 1 1 70 70 MET C C 13 177.751 0.006 . 1 . . . A 145 MET C . 19050 1
822 . 1 1 70 70 MET CA C 13 55.510 0.099 . 1 . . . A 145 MET CA . 19050 1
823 . 1 1 70 70 MET CB C 13 31.898 0.119 . 1 . . . A 145 MET CB . 19050 1
824 . 1 1 70 70 MET CE C 13 16.364 0.061 . 1 . . . A 145 MET CE . 19050 1
825 . 1 1 70 70 MET N N 15 116.143 0.035 . 1 . . . A 145 MET N . 19050 1
826 . 1 1 71 71 VAL H H 1 7.771 0.008 . 1 . . . A 146 VAL H . 19050 1
827 . 1 1 71 71 VAL HA H 1 4.257 0.014 . 1 . . . A 146 VAL HA . 19050 1
828 . 1 1 71 71 VAL HB H 1 2.211 0.013 . 1 . . . A 146 VAL HB . 19050 1
829 . 1 1 71 71 VAL HG11 H 1 0.895 0.015 . 2 . . . A 146 VAL HG11 . 19050 1
830 . 1 1 71 71 VAL HG12 H 1 0.895 0.015 . 2 . . . A 146 VAL HG12 . 19050 1
831 . 1 1 71 71 VAL HG13 H 1 0.895 0.015 . 2 . . . A 146 VAL HG13 . 19050 1
832 . 1 1 71 71 VAL HG21 H 1 0.894 0.012 . 2 . . . A 146 VAL HG21 . 19050 1
833 . 1 1 71 71 VAL HG22 H 1 0.894 0.012 . 2 . . . A 146 VAL HG22 . 19050 1
834 . 1 1 71 71 VAL HG23 H 1 0.894 0.012 . 2 . . . A 146 VAL HG23 . 19050 1
835 . 1 1 71 71 VAL C C 13 176.320 0.008 . 1 . . . A 146 VAL C . 19050 1
836 . 1 1 71 71 VAL CA C 13 61.800 0.110 . 1 . . . A 146 VAL CA . 19050 1
837 . 1 1 71 71 VAL CB C 13 32.293 0.085 . 1 . . . A 146 VAL CB . 19050 1
838 . 1 1 71 71 VAL CG1 C 13 19.933 0.153 . 2 . . . A 146 VAL CG1 . 19050 1
839 . 1 1 71 71 VAL CG2 C 13 20.862 0.057 . 2 . . . A 146 VAL CG2 . 19050 1
840 . 1 1 71 71 VAL N N 15 114.592 0.043 . 1 . . . A 146 VAL N . 19050 1
841 . 1 1 72 72 SER H H 1 7.725 0.007 . 1 . . . A 147 SER H . 19050 1
842 . 1 1 72 72 SER HA H 1 4.386 0.010 . 1 . . . A 147 SER HA . 19050 1
843 . 1 1 72 72 SER HB2 H 1 3.887 0.014 . 2 . . . A 147 SER HB2 . 19050 1
844 . 1 1 72 72 SER HB3 H 1 3.894 0.007 . 2 . . . A 147 SER HB3 . 19050 1
845 . 1 1 72 72 SER C C 13 173.437 0.006 . 1 . . . A 147 SER C . 19050 1
846 . 1 1 72 72 SER CA C 13 58.924 0.132 . 1 . . . A 147 SER CA . 19050 1
847 . 1 1 72 72 SER CB C 13 63.615 0.113 . 1 . . . A 147 SER CB . 19050 1
848 . 1 1 72 72 SER N N 15 118.964 0.044 . 1 . . . A 147 SER N . 19050 1
849 . 1 1 73 73 LYS H H 1 7.922 0.005 . 1 . . . A 148 LYS H . 19050 1
850 . 1 1 73 73 LYS HA H 1 4.186 0.007 . 1 . . . A 148 LYS HA . 19050 1
851 . 1 1 73 73 LYS HB2 H 1 1.697 0.012 . 2 . . . A 148 LYS HB2 . 19050 1
852 . 1 1 73 73 LYS HB3 H 1 1.828 0.008 . 2 . . . A 148 LYS HB3 . 19050 1
853 . 1 1 73 73 LYS HG3 H 1 1.388 0.010 . 1 . . . A 148 LYS HG3 . 19050 1
854 . 1 1 73 73 LYS HD2 H 1 1.659 0.011 . 1 . . . A 148 LYS HD2 . 19050 1
855 . 1 1 73 73 LYS HE3 H 1 2.969 0.009 . 1 . . . A 148 LYS HE3 . 19050 1
856 . 1 1 73 73 LYS C C 13 181.058 0.000 . 1 . . . A 148 LYS C . 19050 1
857 . 1 1 73 73 LYS CA C 13 57.365 0.130 . 1 . . . A 148 LYS CA . 19050 1
858 . 1 1 73 73 LYS CB C 13 33.795 0.127 . 1 . . . A 148 LYS CB . 19050 1
859 . 1 1 73 73 LYS CG C 13 24.524 0.162 . 1 . . . A 148 LYS CG . 19050 1
860 . 1 1 73 73 LYS CD C 13 28.932 0.142 . 1 . . . A 148 LYS CD . 19050 1
861 . 1 1 73 73 LYS CE C 13 41.977 0.083 . 1 . . . A 148 LYS CE . 19050 1
862 . 1 1 73 73 LYS N N 15 128.236 0.029 . 1 . . . A 148 LYS N . 19050 1
stop_
save_
###################################
# 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_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2
_Assigned_chem_shift_list.Entry_ID 19050
_Assigned_chem_shift_list.ID 2
_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
17 '2D 1H-1H doubly 12C,14N filtered NOESY' . . . 19050 2
18 '2D 1H-1H 12C,14N filtered TOCSY' . . . 19050 2
20 '2D 1H-1H 12C,14N filtered TOCSY' . . . 19050 2
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 4 4 GLN H H 1 8.683 0.003 . 1 . . . B 1904 GLN H . 19050 2
2 . 2 2 4 4 GLN HA H 1 4.234 0.013 . 1 . . . B 1904 GLN HA . 19050 2
3 . 2 2 4 4 GLN HB2 H 1 1.835 0.010 . 2 . . . B 1904 GLN HB2 . 19050 2
4 . 2 2 4 4 GLN HB3 H 1 1.741 0.010 . 2 . . . B 1904 GLN HB3 . 19050 2
5 . 2 2 5 5 GLU H H 1 8.567 0.005 . 1 . . . B 1905 GLU H . 19050 2
6 . 2 2 5 5 GLU HA H 1 4.183 0.007 . 1 . . . B 1905 GLU HA . 19050 2
7 . 2 2 5 5 GLU HB2 H 1 2.059 0.010 . 2 . . . B 1905 GLU HB2 . 19050 2
8 . 2 2 5 5 GLU HB3 H 1 2.007 0.011 . 2 . . . B 1905 GLU HB3 . 19050 2
9 . 2 2 5 5 GLU HG3 H 1 2.354 0.007 . 1 . . . B 1905 GLU HG3 . 19050 2
10 . 2 2 6 6 GLU H H 1 8.623 0.003 . 1 . . . B 1906 GLU H . 19050 2
11 . 2 2 6 6 GLU HA H 1 4.213 0.009 . 1 . . . B 1906 GLU HA . 19050 2
12 . 2 2 6 6 GLU HB2 H 1 2.049 0.009 . 2 . . . B 1906 GLU HB2 . 19050 2
13 . 2 2 6 6 GLU HB3 H 1 1.932 0.012 . 2 . . . B 1906 GLU HB3 . 19050 2
14 . 2 2 6 6 GLU HG3 H 1 2.242 0.006 . 1 . . . B 1906 GLU HG3 . 19050 2
15 . 2 2 7 7 VAL H H 1 8.112 0.004 . 1 . . . B 1907 VAL H . 19050 2
16 . 2 2 7 7 VAL HA H 1 4.153 0.006 . 1 . . . B 1907 VAL HA . 19050 2
17 . 2 2 7 7 VAL HB H 1 2.305 0.005 . 1 . . . B 1907 VAL HB . 19050 2
18 . 2 2 7 7 VAL HG21 H 1 0.996 0.009 . 1 . . . B 1907 VAL HG21 . 19050 2
19 . 2 2 7 7 VAL HG22 H 1 0.996 0.009 . 1 . . . B 1907 VAL HG22 . 19050 2
20 . 2 2 7 7 VAL HG23 H 1 0.996 0.009 . 1 . . . B 1907 VAL HG23 . 19050 2
21 . 2 2 8 8 SER H H 1 8.775 0.005 . 1 . . . B 1908 SER H . 19050 2
22 . 2 2 8 8 SER HA H 1 4.082 0.010 . 1 . . . B 1908 SER HA . 19050 2
23 . 2 2 8 8 SER HB2 H 1 3.884 0.010 . 2 . . . B 1908 SER HB2 . 19050 2
24 . 2 2 8 8 SER HB3 H 1 3.789 0.011 . 2 . . . B 1908 SER HB3 . 19050 2
25 . 2 2 9 9 ALA H H 1 8.467 0.006 . 1 . . . B 1909 ALA H . 19050 2
26 . 2 2 9 9 ALA HA H 1 3.982 0.009 . 1 . . . B 1909 ALA HA . 19050 2
27 . 2 2 9 9 ALA HB1 H 1 1.446 0.011 . 1 . . . B 1909 ALA HB1 . 19050 2
28 . 2 2 9 9 ALA HB2 H 1 1.446 0.011 . 1 . . . B 1909 ALA HB2 . 19050 2
29 . 2 2 9 9 ALA HB3 H 1 1.446 0.011 . 1 . . . B 1909 ALA HB3 . 19050 2
30 . 2 2 10 10 ILE H H 1 7.288 0.005 . 1 . . . B 1910 ILE H . 19050 2
31 . 2 2 10 10 ILE HA H 1 3.749 0.005 . 1 . . . B 1910 ILE HA . 19050 2
32 . 2 2 10 10 ILE HB H 1 2.032 0.008 . 1 . . . B 1910 ILE HB . 19050 2
33 . 2 2 10 10 ILE HG12 H 1 2.162 0.005 . 2 . . . B 1910 ILE HG12 . 19050 2
34 . 2 2 10 10 ILE HG13 H 1 1.300 0.009 . 2 . . . B 1910 ILE HG13 . 19050 2
35 . 2 2 10 10 ILE HG21 H 1 0.894 0.017 . 1 . . . B 1910 ILE HG21 . 19050 2
36 . 2 2 10 10 ILE HG22 H 1 0.894 0.017 . 1 . . . B 1910 ILE HG22 . 19050 2
37 . 2 2 10 10 ILE HG23 H 1 0.894 0.017 . 1 . . . B 1910 ILE HG23 . 19050 2
38 . 2 2 10 10 ILE HD11 H 1 0.992 0.013 . 1 . . . B 1910 ILE HD11 . 19050 2
39 . 2 2 10 10 ILE HD12 H 1 0.992 0.013 . 1 . . . B 1910 ILE HD12 . 19050 2
40 . 2 2 10 10 ILE HD13 H 1 0.992 0.013 . 1 . . . B 1910 ILE HD13 . 19050 2
41 . 2 2 11 11 VAL H H 1 7.465 0.007 . 1 . . . B 1911 VAL H . 19050 2
42 . 2 2 11 11 VAL HA H 1 3.495 0.005 . 1 . . . B 1911 VAL HA . 19050 2
43 . 2 2 11 11 VAL HB H 1 2.116 0.013 . 1 . . . B 1911 VAL HB . 19050 2
44 . 2 2 11 11 VAL HG11 H 1 0.892 0.015 . 2 . . . B 1911 VAL HG11 . 19050 2
45 . 2 2 11 11 VAL HG12 H 1 0.892 0.015 . 2 . . . B 1911 VAL HG12 . 19050 2
46 . 2 2 11 11 VAL HG13 H 1 0.892 0.015 . 2 . . . B 1911 VAL HG13 . 19050 2
47 . 2 2 11 11 VAL HG21 H 1 0.980 0.015 . 2 . . . B 1911 VAL HG21 . 19050 2
48 . 2 2 11 11 VAL HG22 H 1 0.980 0.015 . 2 . . . B 1911 VAL HG22 . 19050 2
49 . 2 2 11 11 VAL HG23 H 1 0.980 0.015 . 2 . . . B 1911 VAL HG23 . 19050 2
50 . 2 2 12 12 ILE H H 1 7.912 0.004 . 1 . . . B 1912 ILE H . 19050 2
51 . 2 2 12 12 ILE HA H 1 3.696 0.010 . 1 . . . B 1912 ILE HA . 19050 2
52 . 2 2 12 12 ILE HB H 1 1.746 0.012 . 1 . . . B 1912 ILE HB . 19050 2
53 . 2 2 12 12 ILE HG12 H 1 0.994 0.014 . 2 . . . B 1912 ILE HG12 . 19050 2
54 . 2 2 12 12 ILE HG13 H 1 1.556 0.010 . 2 . . . B 1912 ILE HG13 . 19050 2
55 . 2 2 12 12 ILE HG21 H 1 0.850 0.012 . 1 . . . B 1912 ILE HG21 . 19050 2
56 . 2 2 12 12 ILE HG22 H 1 0.850 0.012 . 1 . . . B 1912 ILE HG22 . 19050 2
57 . 2 2 12 12 ILE HG23 H 1 0.850 0.012 . 1 . . . B 1912 ILE HG23 . 19050 2
58 . 2 2 12 12 ILE HD11 H 1 0.550 0.014 . 1 . . . B 1912 ILE HD11 . 19050 2
59 . 2 2 12 12 ILE HD12 H 1 0.550 0.014 . 1 . . . B 1912 ILE HD12 . 19050 2
60 . 2 2 12 12 ILE HD13 H 1 0.550 0.014 . 1 . . . B 1912 ILE HD13 . 19050 2
61 . 2 2 13 13 GLN H H 1 8.017 0.006 . 1 . . . B 1913 GLN H . 19050 2
62 . 2 2 13 13 GLN HA H 1 3.991 0.011 . 1 . . . B 1913 GLN HA . 19050 2
63 . 2 2 13 13 GLN HB2 H 1 2.156 0.012 . 2 . . . B 1913 GLN HB2 . 19050 2
64 . 2 2 13 13 GLN HB3 H 1 2.126 0.015 . 2 . . . B 1913 GLN HB3 . 19050 2
65 . 2 2 13 13 GLN HG2 H 1 2.412 0.010 . 2 . . . B 1913 GLN HG2 . 19050 2
66 . 2 2 13 13 GLN HG3 H 1 2.575 0.012 . 2 . . . B 1913 GLN HG3 . 19050 2
67 . 2 2 13 13 GLN HE21 H 1 6.879 0.009 . 1 . . . B 1913 GLN HE21 . 19050 2
68 . 2 2 13 13 GLN HE22 H 1 7.353 0.007 . 1 . . . B 1913 GLN HE22 . 19050 2
69 . 2 2 14 14 ARG H H 1 8.249 0.005 . 1 . . . B 1914 ARG H . 19050 2
70 . 2 2 14 14 ARG HA H 1 4.058 0.010 . 1 . . . B 1914 ARG HA . 19050 2
71 . 2 2 14 14 ARG HB2 H 1 2.008 0.012 . 2 . . . B 1914 ARG HB2 . 19050 2
72 . 2 2 14 14 ARG HB3 H 1 1.913 0.008 . 2 . . . B 1914 ARG HB3 . 19050 2
73 . 2 2 14 14 ARG HD3 H 1 3.196 0.017 . 1 . . . B 1914 ARG HD3 . 19050 2
74 . 2 2 15 15 ALA H H 1 8.140 0.010 . 1 . . . B 1915 ALA H . 19050 2
75 . 2 2 15 15 ALA HA H 1 3.704 0.013 . 1 . . . B 1915 ALA HA . 19050 2
76 . 2 2 15 15 ALA HB1 H 1 1.713 0.017 . 1 . . . B 1915 ALA HB1 . 19050 2
77 . 2 2 15 15 ALA HB2 H 1 1.713 0.017 . 1 . . . B 1915 ALA HB2 . 19050 2
78 . 2 2 15 15 ALA HB3 H 1 1.713 0.017 . 1 . . . B 1915 ALA HB3 . 19050 2
79 . 2 2 16 16 TYR H H 1 8.017 0.006 . 1 . . . B 1916 TYR H . 19050 2
80 . 2 2 16 16 TYR HA H 1 3.997 0.009 . 1 . . . B 1916 TYR HA . 19050 2
81 . 2 2 16 16 TYR HB2 H 1 3.131 0.011 . 2 . . . B 1916 TYR HB2 . 19050 2
82 . 2 2 16 16 TYR HB3 H 1 3.380 0.011 . 2 . . . B 1916 TYR HB3 . 19050 2
83 . 2 2 16 16 TYR HD1 H 1 6.898 0.011 . 3 . . . B 1916 TYR HD1 . 19050 2
84 . 2 2 16 16 TYR HD2 H 1 6.898 0.011 . 3 . . . B 1916 TYR HD2 . 19050 2
85 . 2 2 16 16 TYR HE1 H 1 6.765 0.017 . 3 . . . B 1916 TYR HE1 . 19050 2
86 . 2 2 16 16 TYR HE2 H 1 6.765 0.017 . 3 . . . B 1916 TYR HE2 . 19050 2
87 . 2 2 17 17 ARG H H 1 7.866 0.004 . 1 . . . B 1917 ARG H . 19050 2
88 . 2 2 17 17 ARG HA H 1 4.051 0.009 . 1 . . . B 1917 ARG HA . 19050 2
89 . 2 2 17 17 ARG HB2 H 1 2.155 0.009 . 2 . . . B 1917 ARG HB2 . 19050 2
90 . 2 2 17 17 ARG HB3 H 1 1.958 0.008 . 2 . . . B 1917 ARG HB3 . 19050 2
91 . 2 2 17 17 ARG HG2 H 1 1.923 0.009 . 2 . . . B 1917 ARG HG2 . 19050 2
92 . 2 2 17 17 ARG HG3 H 1 1.604 0.007 . 2 . . . B 1917 ARG HG3 . 19050 2
93 . 2 2 17 17 ARG HD2 H 1 3.317 0.009 . 2 . . . B 1917 ARG HD2 . 19050 2
94 . 2 2 17 17 ARG HD3 H 1 3.265 0.010 . 2 . . . B 1917 ARG HD3 . 19050 2
95 . 2 2 18 18 ARG H H 1 8.387 0.005 . 1 . . . B 1918 ARG H . 19050 2
96 . 2 2 18 18 ARG HA H 1 3.858 0.008 . 1 . . . B 1918 ARG HA . 19050 2
97 . 2 2 18 18 ARG HB2 H 1 2.018 0.014 . 2 . . . B 1918 ARG HB2 . 19050 2
98 . 2 2 18 18 ARG HB3 H 1 1.913 0.008 . 2 . . . B 1918 ARG HB3 . 19050 2
99 . 2 2 18 18 ARG HG3 H 1 1.696 0.010 . 1 . . . B 1918 ARG HG3 . 19050 2
100 . 2 2 18 18 ARG HD2 H 1 3.215 0.011 . 2 . . . B 1918 ARG HD2 . 19050 2
101 . 2 2 18 18 ARG HD3 H 1 3.167 0.014 . 2 . . . B 1918 ARG HD3 . 19050 2
102 . 2 2 19 19 TYR H H 1 8.878 0.007 . 1 . . . B 1919 TYR H . 19050 2
103 . 2 2 19 19 TYR HA H 1 4.379 0.011 . 1 . . . B 1919 TYR HA . 19050 2
104 . 2 2 19 19 TYR HB2 H 1 3.268 0.012 . 2 . . . B 1919 TYR HB2 . 19050 2
105 . 2 2 19 19 TYR HB3 H 1 3.182 0.014 . 2 . . . B 1919 TYR HB3 . 19050 2
106 . 2 2 19 19 TYR HD1 H 1 7.035 0.008 . 3 . . . B 1919 TYR HD1 . 19050 2
107 . 2 2 19 19 TYR HD2 H 1 7.035 0.008 . 3 . . . B 1919 TYR HD2 . 19050 2
108 . 2 2 19 19 TYR HE1 H 1 6.793 0.009 . 3 . . . B 1919 TYR HE1 . 19050 2
109 . 2 2 19 19 TYR HE2 H 1 6.793 0.009 . 3 . . . B 1919 TYR HE2 . 19050 2
110 . 2 2 20 20 LEU H H 1 8.137 0.010 . 1 . . . B 1920 LEU H . 19050 2
111 . 2 2 20 20 LEU HA H 1 3.699 0.007 . 1 . . . B 1920 LEU HA . 19050 2
112 . 2 2 20 20 LEU HB2 H 1 1.355 0.012 . 2 . . . B 1920 LEU HB2 . 19050 2
113 . 2 2 20 20 LEU HB3 H 1 1.430 0.014 . 2 . . . B 1920 LEU HB3 . 19050 2
114 . 2 2 20 20 LEU HD11 H 1 0.839 0.015 . 2 . . . B 1920 LEU HD11 . 19050 2
115 . 2 2 20 20 LEU HD12 H 1 0.839 0.015 . 2 . . . B 1920 LEU HD12 . 19050 2
116 . 2 2 20 20 LEU HD13 H 1 0.839 0.015 . 2 . . . B 1920 LEU HD13 . 19050 2
117 . 2 2 20 20 LEU HD21 H 1 0.806 0.010 . 2 . . . B 1920 LEU HD21 . 19050 2
118 . 2 2 20 20 LEU HD22 H 1 0.806 0.010 . 2 . . . B 1920 LEU HD22 . 19050 2
119 . 2 2 20 20 LEU HD23 H 1 0.806 0.010 . 2 . . . B 1920 LEU HD23 . 19050 2
120 . 2 2 21 21 LEU H H 1 7.677 0.005 . 1 . . . B 1921 LEU H . 19050 2
121 . 2 2 21 21 LEU HA H 1 4.055 0.011 . 1 . . . B 1921 LEU HA . 19050 2
122 . 2 2 21 21 LEU HB3 H 1 1.776 0.013 . 1 . . . B 1921 LEU HB3 . 19050 2
123 . 2 2 22 22 LYS H H 1 7.760 0.006 . 1 . . . B 1922 LYS H . 19050 2
124 . 2 2 22 22 LYS HA H 1 4.041 0.005 . 1 . . . B 1922 LYS HA . 19050 2
125 . 2 2 22 22 LYS HB3 H 1 2.069 0.005 . 1 . . . B 1922 LYS HB3 . 19050 2
126 . 2 2 22 22 LYS HG3 H 1 0.923 0.012 . 1 . . . B 1922 LYS HG3 . 19050 2
127 . 2 2 23 23 GLN H H 1 8.181 0.005 . 1 . . . B 1923 GLN H . 19050 2
128 . 2 2 23 23 GLN HA H 1 4.304 0.007 . 1 . . . B 1923 GLN HA . 19050 2
129 . 2 2 23 23 GLN HB2 H 1 1.729 0.009 . 2 . . . B 1923 GLN HB2 . 19050 2
130 . 2 2 23 23 GLN HB3 H 1 1.826 0.010 . 2 . . . B 1923 GLN HB3 . 19050 2
131 . 2 2 23 23 GLN HG3 H 1 1.426 0.012 . 1 . . . B 1923 GLN HG3 . 19050 2
132 . 2 2 24 24 LYS H H 1 7.945 0.004 . 1 . . . B 1924 LYS H . 19050 2
133 . 2 2 24 24 LYS HA H 1 4.123 0.006 . 1 . . . B 1924 LYS HA . 19050 2
134 . 2 2 24 24 LYS HB2 H 1 1.677 0.008 . 2 . . . B 1924 LYS HB2 . 19050 2
135 . 2 2 24 24 LYS HB3 H 1 1.789 0.008 . 2 . . . B 1924 LYS HB3 . 19050 2
136 . 2 2 24 24 LYS HG3 H 1 1.377 0.006 . 1 . . . B 1924 LYS HG3 . 19050 2
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