###################################
# 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 27689
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $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' . . . 27689 1
2 '3D 1H-15N NOESY' . . . 27689 1
3 '3D 1H-15N TOCSY' . . . 27689 1
4 '3D HBHA(CO)NH' . . . 27689 1
5 '3D HNCO' . . . 27689 1
6 '3D HNCA' . . . 27689 1
7 '3D HN(CO)CA' . . . 27689 1
8 '3D CBCA(CO)NH' . . . 27689 1
9 '3D HN(CA)CO' . . . 27689 1
10 '2D 1H-15N SOFAST HMQC' . . . 27689 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 7 7 HIS C C 13 174.762 0.06 . 1 . . . . . 7 H CO . 27689 1
2 . 1 . 1 7 7 HIS CA C 13 56.134 0.13 . 1 . . . . . 7 H CA . 27689 1
3 . 1 . 1 7 7 HIS CB C 13 29.758 0.22 . 1 . . . . . 7 H CB . 27689 1
4 . 1 . 1 8 8 ARG H H 1 8.571 0.01 . 1 . . . . . 8 R HN . 27689 1
5 . 1 . 1 8 8 ARG HA H 1 4.312 0.04 . 1 . . . . . 8 R HA . 27689 1
6 . 1 . 1 8 8 ARG HB2 H 1 1.768 0.04 . 2 . . . . . 8 R HB . 27689 1
7 . 1 . 1 8 8 ARG HB3 H 1 1.768 0.04 . 2 . . . . . 8 R HB . 27689 1
8 . 1 . 1 8 8 ARG C C 13 175.769 0.06 . 1 . . . . . 8 R CO . 27689 1
9 . 1 . 1 8 8 ARG CA C 13 56.322 0.13 . 1 . . . . . 8 R CA . 27689 1
10 . 1 . 1 8 8 ARG CB C 13 30.953 0.22 . 1 . . . . . 8 R CB . 27689 1
11 . 1 . 1 8 8 ARG N N 15 123.119 0.04 . 1 . . . . . 8 R N . 27689 1
12 . 1 . 1 9 9 ASP H H 1 8.481 0.01 . 1 . . . . . 9 D HN . 27689 1
13 . 1 . 1 9 9 ASP HA H 1 4.556 0.04 . 1 . . . . . 9 D HA . 27689 1
14 . 1 . 1 9 9 ASP HB2 H 1 2.649 0.04 . 2 . . . . . 9 D HB . 27689 1
15 . 1 . 1 9 9 ASP HB3 H 1 2.649 0.04 . 2 . . . . . 9 D HB . 27689 1
16 . 1 . 1 9 9 ASP C C 13 175.851 0.06 . 1 . . . . . 9 D CO . 27689 1
17 . 1 . 1 9 9 ASP CA C 13 54.380 0.13 . 1 . . . . . 9 D CA . 27689 1
18 . 1 . 1 9 9 ASP CB C 13 41.255 0.22 . 1 . . . . . 9 D CB . 27689 1
19 . 1 . 1 9 9 ASP N N 15 121.591 0.04 . 1 . . . . . 9 D N . 27689 1
20 . 1 . 1 10 10 HIS H H 1 8.431 0.01 . 1 . . . . . 10 H HN . 27689 1
21 . 1 . 1 10 10 HIS HA H 1 4.660 0.04 . 1 . . . . . 10 H HA . 27689 1
22 . 1 . 1 10 10 HIS HB2 H 1 3.197 0.04 . 2 . . . . . 10 H HB . 27689 1
23 . 1 . 1 10 10 HIS HB3 H 1 3.197 0.04 . 2 . . . . . 10 H HB . 27689 1
24 . 1 . 1 10 10 HIS C C 13 174.363 0.06 . 1 . . . . . 10 H CO . 27689 1
25 . 1 . 1 10 10 HIS CA C 13 55.398 0.13 . 1 . . . . . 10 H CA . 27689 1
26 . 1 . 1 10 10 HIS CB C 13 29.546 0.22 . 1 . . . . . 10 H CB . 27689 1
27 . 1 . 1 10 10 HIS N N 15 119.094 0.04 . 1 . . . . . 10 H N . 27689 1
28 . 1 . 1 11 11 ARG H H 1 8.420 0.01 . 1 . . . . . 11 R HN . 27689 1
29 . 1 . 1 11 11 ARG HA H 1 4.607 0.04 . 1 . . . . . 11 R HA . 27689 1
30 . 1 . 1 11 11 ARG HB2 H 1 1.738 0.04 . 2 . . . . . 11 R HB . 27689 1
31 . 1 . 1 11 11 ARG HB3 H 1 1.738 0.04 . 2 . . . . . 11 R HB . 27689 1
32 . 1 . 1 11 11 ARG C C 13 174.265 0.06 . 1 . . . . . 11 R CO . 27689 1
33 . 1 . 1 11 11 ARG CA C 13 54.231 0.13 . 1 . . . . . 11 R CA . 27689 1
34 . 1 . 1 11 11 ARG N N 15 124.272 0.04 . 1 . . . . . 11 R N . 27689 1
35 . 1 . 1 12 12 PRO HA H 1 4.526 0.04 . 1 . . . . . 12 P HA . 27689 1
36 . 1 . 1 12 12 PRO HB2 H 1 2.330 0.04 . 2 . . . . . 12 P HB . 27689 1
37 . 1 . 1 12 12 PRO HB3 H 1 2.330 0.04 . 2 . . . . . 12 P HB . 27689 1
38 . 1 . 1 12 12 PRO C C 13 177.154 0.06 . 1 . . . . . 12 P CO . 27689 1
39 . 1 . 1 12 12 PRO CA C 13 63.109 0.13 . 1 . . . . . 12 P CA . 27689 1
40 . 1 . 1 12 12 PRO CB C 13 32.233 0.22 . 1 . . . . . 12 P CB . 27689 1
41 . 1 . 1 13 13 THR H H 1 8.413 0.01 . 1 . . . . . 13 T HN . 27689 1
42 . 1 . 1 13 13 THR HA H 1 4.338 0.04 . 1 . . . . . 13 T HA . 27689 1
43 . 1 . 1 13 13 THR HB H 1 4.338 0.04 . 1 . . . . . 13 T HB . 27689 1
44 . 1 . 1 13 13 THR C C 13 174.684 0.06 . 1 . . . . . 13 T CO . 27689 1
45 . 1 . 1 13 13 THR CA C 13 61.764 0.13 . 1 . . . . . 13 T CA . 27689 1
46 . 1 . 1 13 13 THR CB C 13 70.136 0.22 . 1 . . . . . 13 T CB . 27689 1
47 . 1 . 1 13 13 THR N N 15 114.676 0.04 . 1 . . . . . 13 T N . 27689 1
48 . 1 . 1 14 14 ALA H H 1 8.515 0.01 . 1 . . . . . 14 A HN . 27689 1
49 . 1 . 1 14 14 ALA HA H 1 4.389 0.04 . 1 . . . . . 14 A HA . 27689 1
50 . 1 . 1 14 14 ALA HB1 H 1 1.466 0.04 . 1 . . . . . 14 A HB . 27689 1
51 . 1 . 1 14 14 ALA HB2 H 1 1.466 0.04 . 1 . . . . . 14 A HB . 27689 1
52 . 1 . 1 14 14 ALA HB3 H 1 1.466 0.04 . 1 . . . . . 14 A HB . 27689 1
53 . 1 . 1 14 14 ALA C C 13 178.564 0.06 . 1 . . . . . 14 A CO . 27689 1
54 . 1 . 1 14 14 ALA CA C 13 53.272 0.13 . 1 . . . . . 14 A CA . 27689 1
55 . 1 . 1 14 14 ALA CB C 13 19.353 0.22 . 1 . . . . . 14 A CB . 27689 1
56 . 1 . 1 14 14 ALA N N 15 126.127 0.04 . 1 . . . . . 14 A N . 27689 1
57 . 1 . 1 15 15 THR H H 1 8.103 0.01 . 1 . . . . . 15 T HN . 27689 1
58 . 1 . 1 15 15 THR HA H 1 4.251 0.04 . 1 . . . . . 15 T HA . 27689 1
59 . 1 . 1 15 15 THR HB H 1 4.251 0.04 . 1 . . . . . 15 T HB . 27689 1
60 . 1 . 1 15 15 THR C C 13 175.043 0.06 . 1 . . . . . 15 T CO . 27689 1
61 . 1 . 1 15 15 THR CA C 13 63.128 0.13 . 1 . . . . . 15 T CA . 27689 1
62 . 1 . 1 15 15 THR CB C 13 69.275 0.22 . 1 . . . . . 15 T CB . 27689 1
63 . 1 . 1 15 15 THR N N 15 113.127 0.04 . 1 . . . . . 15 T N . 27689 1
64 . 1 . 1 16 16 ASP H H 1 8.285 0.01 . 1 . . . . . 16 D HN . 27689 1
65 . 1 . 1 16 16 ASP HA H 1 4.518 0.04 . 1 . . . . . 16 D HA . 27689 1
66 . 1 . 1 16 16 ASP HB2 H 1 2.737 0.04 . 2 . . . . . 16 D HB . 27689 1
67 . 1 . 1 16 16 ASP HB3 H 1 2.737 0.04 . 2 . . . . . 16 D HB . 27689 1
68 . 1 . 1 16 16 ASP C C 13 177.476 0.06 . 1 . . . . . 16 D CO . 27689 1
69 . 1 . 1 16 16 ASP CA C 13 55.812 0.13 . 1 . . . . . 16 D CA . 27689 1
70 . 1 . 1 16 16 ASP CB C 13 40.860 0.22 . 1 . . . . . 16 D CB . 27689 1
71 . 1 . 1 16 16 ASP N N 15 122.197 0.04 . 1 . . . . . 16 D N . 27689 1
72 . 1 . 1 17 17 GLU H H 1 8.354 0.01 . 1 . . . . . 17 E HN . 27689 1
73 . 1 . 1 17 17 GLU HA H 1 4.191 0.04 . 1 . . . . . 17 E HA . 27689 1
74 . 1 . 1 17 17 GLU HB2 H 1 2.063 0.04 . 2 . . . . . 17 E HB . 27689 1
75 . 1 . 1 17 17 GLU HB3 H 1 2.063 0.04 . 2 . . . . . 17 E HB . 27689 1
76 . 1 . 1 17 17 GLU C C 13 177.940 0.06 . 1 . . . . . 17 E CO . 27689 1
77 . 1 . 1 17 17 GLU CA C 13 58.290 0.13 . 1 . . . . . 17 E CA . 27689 1
78 . 1 . 1 17 17 GLU CB C 13 29.844 0.22 . 1 . . . . . 17 E CB . 27689 1
79 . 1 . 1 17 17 GLU N N 15 120.717 0.04 . 1 . . . . . 17 E N . 27689 1
80 . 1 . 1 18 18 LEU H H 1 8.101 0.01 . 1 . . . . . 18 L HN . 27689 1
81 . 1 . 1 18 18 LEU HA H 1 4.261 0.04 . 1 . . . . . 18 L HA . 27689 1
82 . 1 . 1 18 18 LEU HB2 H 1 1.695 0.04 . 2 . . . . . 18 L HB . 27689 1
83 . 1 . 1 18 18 LEU HB3 H 1 1.695 0.04 . 2 . . . . . 18 L HB . 27689 1
84 . 1 . 1 18 18 LEU C C 13 179.055 0.06 . 1 . . . . . 18 L CO . 27689 1
85 . 1 . 1 18 18 LEU CA C 13 56.814 0.13 . 1 . . . . . 18 L CA . 27689 1
86 . 1 . 1 18 18 LEU CB C 13 41.877 0.22 . 1 . . . . . 18 L CB . 27689 1
87 . 1 . 1 18 18 LEU N N 15 122.087 0.04 . 1 . . . . . 18 L N . 27689 1
88 . 1 . 1 19 19 ILE H H 1 8.081 0.01 . 1 . . . . . 19 I HN . 27689 1
89 . 1 . 1 19 19 ILE HA H 1 3.968 0.04 . 1 . . . . . 19 I HA . 27689 1
90 . 1 . 1 19 19 ILE HB H 1 1.985 0.04 . 1 . . . . . 19 I HB . 27689 1
91 . 1 . 1 19 19 ILE C C 13 177.935 0.06 . 1 . . . . . 19 I CO . 27689 1
92 . 1 . 1 19 19 ILE CA C 13 63.019 0.13 . 1 . . . . . 19 I CA . 27689 1
93 . 1 . 1 19 19 ILE CB C 13 38.028 0.22 . 1 . . . . . 19 I CB . 27689 1
94 . 1 . 1 19 19 ILE N N 15 121.756 0.04 . 1 . . . . . 19 I N . 27689 1
95 . 1 . 1 20 20 GLN H H 1 8.323 0.01 . 1 . . . . . 20 Q HN . 27689 1
96 . 1 . 1 20 20 GLN HA H 1 4.206 0.04 . 1 . . . . . 20 Q HA . 27689 1
97 . 1 . 1 20 20 GLN HB2 H 1 2.134 0.04 . 2 . . . . . 20 Q HB . 27689 1
98 . 1 . 1 20 20 GLN HB3 H 1 2.134 0.04 . 2 . . . . . 20 Q HB . 27689 1
99 . 1 . 1 20 20 GLN C C 13 177.559 0.06 . 1 . . . . . 20 Q CO . 27689 1
100 . 1 . 1 20 20 GLN CA C 13 57.550 0.13 . 1 . . . . . 20 Q CA . 27689 1
101 . 1 . 1 20 20 GLN CB C 13 28.625 0.22 . 1 . . . . . 20 Q CB . 27689 1
102 . 1 . 1 20 20 GLN N N 15 121.914 0.04 . 1 . . . . . 20 Q N . 27689 1
103 . 1 . 1 21 21 ALA H H 1 8.295 0.01 . 1 . . . . . 21 A HN . 27689 1
104 . 1 . 1 21 21 ALA HA H 1 4.209 0.04 . 1 . . . . . 21 A HA . 27689 1
105 . 1 . 1 21 21 ALA HB1 H 1 1.474 0.04 . 1 . . . . . 21 A HB . 27689 1
106 . 1 . 1 21 21 ALA HB2 H 1 1.474 0.04 . 1 . . . . . 21 A HB . 27689 1
107 . 1 . 1 21 21 ALA HB3 H 1 1.474 0.04 . 1 . . . . . 21 A HB . 27689 1
108 . 1 . 1 21 21 ALA C C 13 179.938 0.06 . 1 . . . . . 21 A CO . 27689 1
109 . 1 . 1 21 21 ALA CA C 13 54.596 0.13 . 1 . . . . . 21 A CA . 27689 1
110 . 1 . 1 21 21 ALA CB C 13 18.690 0.22 . 1 . . . . . 21 A CB . 27689 1
111 . 1 . 1 21 21 ALA N N 15 123.197 0.04 . 1 . . . . . 21 A N . 27689 1
112 . 1 . 1 22 22 SER H H 1 8.239 0.01 . 1 . . . . . 22 S HN . 27689 1
113 . 1 . 1 22 22 SER HA H 1 4.323 0.04 . 1 . . . . . 22 S HA . 27689 1
114 . 1 . 1 22 22 SER HB2 H 1 4.015 0.04 . 2 . . . . . 22 S HB . 27689 1
115 . 1 . 1 22 22 SER HB3 H 1 4.015 0.04 . 2 . . . . . 22 S HB . 27689 1
116 . 1 . 1 22 22 SER C C 13 176.338 0.06 . 1 . . . . . 22 S CO . 27689 1
117 . 1 . 1 22 22 SER CA C 13 60.562 0.13 . 1 . . . . . 22 S CA . 27689 1
118 . 1 . 1 22 22 SER CB C 13 62.960 0.22 . 1 . . . . . 22 S CB . 27689 1
119 . 1 . 1 22 22 SER N N 15 114.633 0.04 . 1 . . . . . 22 S N . 27689 1
120 . 1 . 1 23 23 LYS H H 1 8.097 0.01 . 1 . . . . . 23 K HN . 27689 1
121 . 1 . 1 23 23 LYS HA H 1 4.208 0.04 . 1 . . . . . 23 K HA . 27689 1
122 . 1 . 1 23 23 LYS HB2 H 1 1.942 0.04 . 2 . . . . . 23 K HB . 27689 1
123 . 1 . 1 23 23 LYS HB3 H 1 1.942 0.04 . 2 . . . . . 23 K HB . 27689 1
124 . 1 . 1 23 23 LYS C C 13 178.391 0.06 . 1 . . . . . 23 K CO . 27689 1
125 . 1 . 1 23 23 LYS CA C 13 58.588 0.13 . 1 . . . . . 23 K CA . 27689 1
126 . 1 . 1 23 23 LYS CB C 13 32.404 0.22 . 1 . . . . . 23 K CB . 27689 1
127 . 1 . 1 23 23 LYS N N 15 123.424 0.04 . 1 . . . . . 23 K N . 27689 1
128 . 1 . 1 24 24 LEU H H 1 8.008 0.01 . 1 . . . . . 24 L HN . 27689 1
129 . 1 . 1 24 24 LEU HA H 1 4.184 0.04 . 1 . . . . . 24 L HA . 27689 1
130 . 1 . 1 24 24 LEU HB2 H 1 1.722 0.04 . 2 . . . . . 24 L HB . 27689 1
131 . 1 . 1 24 24 LEU HB3 H 1 1.722 0.04 . 2 . . . . . 24 L HB . 27689 1
132 . 1 . 1 24 24 LEU C C 13 178.892 0.06 . 1 . . . . . 24 L CO . 27689 1
133 . 1 . 1 24 24 LEU CA C 13 57.435 0.13 . 1 . . . . . 24 L CA . 27689 1
134 . 1 . 1 24 24 LEU CB C 13 41.685 0.22 . 1 . . . . . 24 L CB . 27689 1
135 . 1 . 1 24 24 LEU N N 15 120.149 0.04 . 1 . . . . . 24 L N . 27689 1
136 . 1 . 1 25 25 LYS H H 1 7.997 0.01 . 1 . . . . . 25 K HN . 27689 1
137 . 1 . 1 25 25 LYS HA H 1 4.175 0.04 . 1 . . . . . 25 K HA . 27689 1
138 . 1 . 1 25 25 LYS HB2 H 1 1.952 0.04 . 2 . . . . . 25 K HB . 27689 1
139 . 1 . 1 25 25 LYS HB3 H 1 1.952 0.04 . 2 . . . . . 25 K HB . 27689 1
140 . 1 . 1 25 25 LYS C C 13 178.344 0.06 . 1 . . . . . 25 K CO . 27689 1
141 . 1 . 1 25 25 LYS CA C 13 58.730 0.13 . 1 . . . . . 25 K CA . 27689 1
142 . 1 . 1 25 25 LYS CB C 13 32.479 0.22 . 1 . . . . . 25 K CB . 27689 1
143 . 1 . 1 25 25 LYS N N 15 119.935 0.04 . 1 . . . . . 25 K N . 27689 1
144 . 1 . 1 26 26 GLN H H 1 7.973 0.01 . 1 . . . . . 26 Q HN . 27689 1
145 . 1 . 1 26 26 GLN HA H 1 4.204 0.04 . 1 . . . . . 26 Q HA . 27689 1
146 . 1 . 1 26 26 GLN HB2 H 1 2.231 0.04 . 2 . . . . . 26 Q HB . 27689 1
147 . 1 . 1 26 26 GLN HB3 H 1 2.231 0.04 . 2 . . . . . 26 Q HB . 27689 1
148 . 1 . 1 26 26 GLN C C 13 178.663 0.06 . 1 . . . . . 26 Q CO . 27689 1
149 . 1 . 1 26 26 GLN CA C 13 58.576 0.13 . 1 . . . . . 26 Q CA . 27689 1
150 . 1 . 1 26 26 GLN CB C 13 28.653 0.22 . 1 . . . . . 26 Q CB . 27689 1
151 . 1 . 1 26 26 GLN N N 15 118.907 0.04 . 1 . . . . . 26 Q N . 27689 1
152 . 1 . 1 27 27 ILE H H 1 8.099 0.01 . 1 . . . . . 27 I HN . 27689 1
153 . 1 . 1 27 27 ILE HA H 1 3.927 0.04 . 1 . . . . . 27 I HA . 27689 1
154 . 1 . 1 27 27 ILE HB H 1 1.985 0.04 . 1 . . . . . 27 I HB . 27689 1
155 . 1 . 1 27 27 ILE C C 13 178.859 0.06 . 1 . . . . . 27 I CO . 27689 1
156 . 1 . 1 27 27 ILE CA C 13 64.529 0.13 . 1 . . . . . 27 I CA . 27689 1
157 . 1 . 1 27 27 ILE CB C 13 38.377 0.22 . 1 . . . . . 27 I CB . 27689 1
158 . 1 . 1 27 27 ILE N N 15 121.600 0.04 . 1 . . . . . 27 I N . 27689 1
159 . 1 . 1 28 28 GLN H H 1 8.332 0.01 . 1 . . . . . 28 Q HN . 27689 1
160 . 1 . 1 28 28 GLN HA H 1 4.233 0.04 . 1 . . . . . 28 Q HA . 27689 1
161 . 1 . 1 28 28 GLN HB2 H 1 2.182 0.04 . 2 . . . . . 28 Q HB . 27689 1
162 . 1 . 1 28 28 GLN HB3 H 1 2.182 0.04 . 2 . . . . . 28 Q HB . 27689 1
163 . 1 . 1 28 28 GLN C C 13 178.921 0.06 . 1 . . . . . 28 Q CO . 27689 1
164 . 1 . 1 28 28 GLN CA C 13 58.459 0.13 . 1 . . . . . 28 Q CA . 27689 1
165 . 1 . 1 28 28 GLN CB C 13 28.552 0.22 . 1 . . . . . 28 Q CB . 27689 1
166 . 1 . 1 28 28 GLN N N 15 121.321 0.04 . 1 . . . . . 28 Q N . 27689 1
167 . 1 . 1 29 29 GLU H H 1 8.635 0.01 . 1 . . . . . 29 E HN . 27689 1
168 . 1 . 1 29 29 GLU HA H 1 4.123 0.04 . 1 . . . . . 29 E HA . 27689 1
169 . 1 . 1 29 29 GLU HB2 H 1 2.149 0.04 . 2 . . . . . 29 E HB . 27689 1
170 . 1 . 1 29 29 GLU HB3 H 1 2.149 0.04 . 2 . . . . . 29 E HB . 27689 1
171 . 1 . 1 29 29 GLU C C 13 179.197 0.06 . 1 . . . . . 29 E CO . 27689 1
172 . 1 . 1 29 29 GLU CA C 13 59.014 0.13 . 1 . . . . . 29 E CA . 27689 1
173 . 1 . 1 29 29 GLU CB C 13 29.529 0.22 . 1 . . . . . 29 E CB . 27689 1
174 . 1 . 1 29 29 GLU N N 15 120.825 0.04 . 1 . . . . . 29 E N . 27689 1
175 . 1 . 1 30 30 HIS H H 1 8.414 0.01 . 1 . . . . . 30 H HN . 27689 1
176 . 1 . 1 30 30 HIS HA H 1 4.463 0.04 . 1 . . . . . 30 H HA . 27689 1
177 . 1 . 1 30 30 HIS C C 13 176.281 0.06 . 1 . . . . . 30 H CO . 27689 1
178 . 1 . 1 30 30 HIS CA C 13 59.296 0.13 . 1 . . . . . 30 H CA . 27689 1
179 . 1 . 1 30 30 HIS CB C 13 28.935 0.22 . 1 . . . . . 30 H CB . 27689 1
180 . 1 . 1 30 30 HIS N N 15 120.551 0.04 . 1 . . . . . 30 H N . 27689 1
181 . 1 . 1 31 31 ALA H H 1 8.174 0.01 . 1 . . . . . 31 A HN . 27689 1
182 . 1 . 1 31 31 ALA HA H 1 4.112 0.04 . 1 . . . . . 31 A HA . 27689 1
183 . 1 . 1 31 31 ALA HB1 H 1 1.587 0.04 . 1 . . . . . 31 A HB . 27689 1
184 . 1 . 1 31 31 ALA HB2 H 1 1.587 0.04 . 1 . . . . . 31 A HB . 27689 1
185 . 1 . 1 31 31 ALA HB3 H 1 1.587 0.04 . 1 . . . . . 31 A HB . 27689 1
186 . 1 . 1 31 31 ALA C C 13 180.656 0.06 . 1 . . . . . 31 A CO . 27689 1
187 . 1 . 1 31 31 ALA CA C 13 55.044 0.13 . 1 . . . . . 31 A CA . 27689 1
188 . 1 . 1 31 31 ALA CB C 13 18.333 0.22 . 1 . . . . . 31 A CB . 27689 1
189 . 1 . 1 31 31 ALA N N 15 121.255 0.04 . 1 . . . . . 31 A N . 27689 1
190 . 1 . 1 32 32 LYS H H 1 8.056 0.01 . 1 . . . . . 32 K HN . 27689 1
191 . 1 . 1 32 32 LYS HA H 1 4.109 0.04 . 1 . . . . . 32 K HA . 27689 1
192 . 1 . 1 32 32 LYS HB2 H 1 1.979 0.04 . 2 . . . . . 32 K HB . 27689 1
193 . 1 . 1 32 32 LYS HB3 H 1 1.979 0.04 . 2 . . . . . 32 K HB . 27689 1
194 . 1 . 1 32 32 LYS C C 13 178.029 0.06 . 1 . . . . . 32 K CO . 27689 1
195 . 1 . 1 32 32 LYS CA C 13 59.160 0.13 . 1 . . . . . 32 K CA . 27689 1
196 . 1 . 1 32 32 LYS CB C 13 32.464 0.22 . 1 . . . . . 32 K CB . 27689 1
197 . 1 . 1 32 32 LYS N N 15 119.138 0.04 . 1 . . . . . 32 K N . 27689 1
198 . 1 . 1 33 33 ALA H H 1 7.925 0.01 . 1 . . . . . 33 A HN . 27689 1
199 . 1 . 1 33 33 ALA HA H 1 4.263 0.04 . 1 . . . . . 33 A HA . 27689 1
200 . 1 . 1 33 33 ALA HB1 H 1 1.621 0.04 . 1 . . . . . 33 A HB . 27689 1
201 . 1 . 1 33 33 ALA HB2 H 1 1.621 0.04 . 1 . . . . . 33 A HB . 27689 1
202 . 1 . 1 33 33 ALA HB3 H 1 1.621 0.04 . 1 . . . . . 33 A HB . 27689 1
203 . 1 . 1 33 33 ALA C C 13 179.733 0.06 . 1 . . . . . 33 A CO . 27689 1
204 . 1 . 1 33 33 ALA CA C 13 55.609 0.13 . 1 . . . . . 33 A CA . 27689 1
205 . 1 . 1 33 33 ALA CB C 13 18.270 0.22 . 1 . . . . . 33 A CB . 27689 1
206 . 1 . 1 33 33 ALA N N 15 122.051 0.04 . 1 . . . . . 33 A N . 27689 1
207 . 1 . 1 34 34 ILE H H 1 7.826 0.01 . 1 . . . . . 34 I HN . 27689 1
208 . 1 . 1 34 34 ILE HA H 1 3.516 0.04 . 1 . . . . . 34 I HA . 27689 1
209 . 1 . 1 34 34 ILE HB H 1 1.915 0.04 . 1 . . . . . 34 I HB . 27689 1
210 . 1 . 1 34 34 ILE C C 13 177.941 0.06 . 1 . . . . . 34 I CO . 27689 1
211 . 1 . 1 34 34 ILE CA C 13 62.578 0.13 . 1 . . . . . 34 I CA . 27689 1
212 . 1 . 1 34 34 ILE CB C 13 36.436 0.22 . 1 . . . . . 34 I CB . 27689 1
213 . 1 . 1 34 34 ILE N N 15 116.276 0.04 . 1 . . . . . 34 I N . 27689 1
214 . 1 . 1 35 35 LEU H H 1 7.732 0.01 . 1 . . . . . 35 L HN . 27689 1
215 . 1 . 1 35 35 LEU HA H 1 4.251 0.04 . 1 . . . . . 35 L HA . 27689 1
216 . 1 . 1 35 35 LEU C C 13 180.243 0.06 . 1 . . . . . 35 L CO . 27689 1
217 . 1 . 1 35 35 LEU CA C 13 58.654 0.13 . 1 . . . . . 35 L CA . 27689 1
218 . 1 . 1 35 35 LEU CB C 13 42.091 0.22 . 1 . . . . . 35 L CB . 27689 1
219 . 1 . 1 35 35 LEU N N 15 122.157 0.04 . 1 . . . . . 35 L N . 27689 1
220 . 1 . 1 36 36 LEU H H 1 8.158 0.01 . 1 . . . . . 36 L HN . 27689 1
221 . 1 . 1 36 36 LEU HB2 H 1 1.817 0.04 . 2 . . . . . 36 L HB . 27689 1
222 . 1 . 1 36 36 LEU HB3 H 1 1.817 0.04 . 2 . . . . . 36 L HB . 27689 1
223 . 1 . 1 36 36 LEU C C 13 180.632 0.06 . 1 . . . . . 36 L CO . 27689 1
224 . 1 . 1 36 36 LEU CA C 13 58.209 0.13 . 1 . . . . . 36 L CA . 27689 1
225 . 1 . 1 36 36 LEU CB C 13 41.820 0.22 . 1 . . . . . 36 L CB . 27689 1
226 . 1 . 1 36 36 LEU N N 15 120.120 0.04 . 1 . . . . . 36 L N . 27689 1
227 . 1 . 1 37 37 ILE H H 1 8.583 0.01 . 1 . . . . . 37 I HN . 27689 1
228 . 1 . 1 37 37 ILE C C 13 178.043 0.06 . 1 . . . . . 37 I CO . 27689 1
229 . 1 . 1 37 37 ILE CA C 13 65.826 0.13 . 1 . . . . . 37 I CA . 27689 1
230 . 1 . 1 37 37 ILE CB C 13 37.677 0.22 . 1 . . . . . 37 I CB . 27689 1
231 . 1 . 1 37 37 ILE N N 15 121.300 0.04 . 1 . . . . . 37 I N . 27689 1
232 . 1 . 1 38 38 ASN H H 1 8.630 0.01 . 1 . . . . . 38 N HN . 27689 1
233 . 1 . 1 38 38 ASN HA H 1 4.575 0.04 . 1 . . . . . 38 N HA . 27689 1
234 . 1 . 1 38 38 ASN C C 13 177.876 0.06 . 1 . . . . . 38 N CO . 27689 1
235 . 1 . 1 38 38 ASN CA C 13 57.416 0.13 . 1 . . . . . 38 N CA . 27689 1
236 . 1 . 1 38 38 ASN CB C 13 38.449 0.22 . 1 . . . . . 38 N CB . 27689 1
237 . 1 . 1 38 38 ASN N N 15 118.327 0.04 . 1 . . . . . 38 N N . 27689 1
238 . 1 . 1 39 39 ARG H H 1 8.109 0.01 . 1 . . . . . 39 R HN . 27689 1
239 . 1 . 1 39 39 ARG C C 13 179.346 0.06 . 1 . . . . . 39 R CO . 27689 1
240 . 1 . 1 39 39 ARG CA C 13 59.647 0.13 . 1 . . . . . 39 R CA . 27689 1
241 . 1 . 1 39 39 ARG CB C 13 29.810 0.22 . 1 . . . . . 39 R CB . 27689 1
242 . 1 . 1 39 39 ARG N N 15 119.928 0.04 . 1 . . . . . 39 R N . 27689 1
243 . 1 . 1 40 40 GLN H H 1 7.749 0.01 . 1 . . . . . 40 Q HN . 27689 1
244 . 1 . 1 40 40 GLN HA H 1 4.212 0.04 . 1 . . . . . 40 Q HA . 27689 1
245 . 1 . 1 40 40 GLN HB2 H 1 2.175 0.04 . 2 . . . . . 40 Q HB . 27689 1
246 . 1 . 1 40 40 GLN HB3 H 1 2.175 0.04 . 2 . . . . . 40 Q HB . 27689 1
247 . 1 . 1 40 40 GLN C C 13 179.609 0.06 . 1 . . . . . 40 Q CO . 27689 1
248 . 1 . 1 40 40 GLN CA C 13 58.600 0.13 . 1 . . . . . 40 Q CA . 27689 1
249 . 1 . 1 40 40 GLN CB C 13 28.374 0.22 . 1 . . . . . 40 Q CB . 27689 1
250 . 1 . 1 40 40 GLN N N 15 118.738 0.04 . 1 . . . . . 40 Q N . 27689 1
251 . 1 . 1 41 41 LEU H H 1 8.943 0.01 . 1 . . . . . 41 L HN . 27689 1
252 . 1 . 1 41 41 LEU HA H 1 3.894 0.04 . 1 . . . . . 41 L HA . 27689 1
253 . 1 . 1 41 41 LEU C C 13 178.215 0.06 . 1 . . . . . 41 L CO . 27689 1
254 . 1 . 1 41 41 LEU CA C 13 58.047 0.13 . 1 . . . . . 41 L CA . 27689 1
255 . 1 . 1 41 41 LEU CB C 13 41.529 0.22 . 1 . . . . . 41 L CB . 27689 1
256 . 1 . 1 41 41 LEU N N 15 119.705 0.04 . 1 . . . . . 41 L N . 27689 1
257 . 1 . 1 42 42 GLN H H 1 7.771 0.01 . 1 . . . . . 42 Q HN . 27689 1
258 . 1 . 1 42 42 GLN HA H 1 3.964 0.04 . 1 . . . . . 42 Q HA . 27689 1
259 . 1 . 1 42 42 GLN HB2 H 1 2.213 0.04 . 2 . . . . . 42 Q HB . 27689 1
260 . 1 . 1 42 42 GLN HB3 H 1 2.213 0.04 . 2 . . . . . 42 Q HB . 27689 1
261 . 1 . 1 42 42 GLN C C 13 176.627 0.06 . 1 . . . . . 42 Q CO . 27689 1
262 . 1 . 1 42 42 GLN CA C 13 58.649 0.13 . 1 . . . . . 42 Q CA . 27689 1
263 . 1 . 1 42 42 GLN CB C 13 28.265 0.22 . 1 . . . . . 42 Q CB . 27689 1
264 . 1 . 1 42 42 GLN N N 15 115.059 0.04 . 1 . . . . . 42 Q N . 27689 1
265 . 1 . 1 43 43 ASP H H 1 7.240 0.01 . 1 . . . . . 43 D HN . 27689 1
266 . 1 . 1 43 43 ASP HB2 H 1 2.785 0.04 . 2 . . . . . 43 D HB . 27689 1
267 . 1 . 1 43 43 ASP HB3 H 1 2.785 0.04 . 2 . . . . . 43 D HB . 27689 1
268 . 1 . 1 43 43 ASP C C 13 177.346 0.06 . 1 . . . . . 43 D CO . 27689 1
269 . 1 . 1 43 43 ASP CA C 13 55.825 0.13 . 1 . . . . . 43 D CA . 27689 1
270 . 1 . 1 43 43 ASP CB C 13 41.823 0.22 . 1 . . . . . 43 D CB . 27689 1
271 . 1 . 1 43 43 ASP N N 15 115.483 0.04 . 1 . . . . . 43 D N . 27689 1
272 . 1 . 1 44 44 ILE H H 1 7.711 0.01 . 1 . . . . . 44 I HN . 27689 1
273 . 1 . 1 44 44 ILE HA H 1 4.048 0.04 . 1 . . . . . 44 I HA . 27689 1
274 . 1 . 1 44 44 ILE HB H 1 1.764 0.04 . 1 . . . . . 44 I HB . 27689 1
275 . 1 . 1 44 44 ILE C C 13 176.945 0.06 . 1 . . . . . 44 I CO . 27689 1
276 . 1 . 1 44 44 ILE CA C 13 62.931 0.13 . 1 . . . . . 44 I CA . 27689 1
277 . 1 . 1 44 44 ILE CB C 13 40.461 0.22 . 1 . . . . . 44 I CB . 27689 1
278 . 1 . 1 44 44 ILE N N 15 116.732 0.04 . 1 . . . . . 44 I N . 27689 1
279 . 1 . 1 45 45 LEU H H 1 8.011 0.01 . 1 . . . . . 45 L HN . 27689 1
280 . 1 . 1 45 45 LEU HA H 1 4.266 0.04 . 1 . . . . . 45 L HA . 27689 1
281 . 1 . 1 45 45 LEU HB2 H 1 2.086 0.04 . 2 . . . . . 45 L HB . 27689 1
282 . 1 . 1 45 45 LEU HB3 H 1 2.086 0.04 . 2 . . . . . 45 L HB . 27689 1
283 . 1 . 1 45 45 LEU CA C 13 53.267 0.13 . 1 . . . . . 45 L CA . 27689 1
284 . 1 . 1 45 45 LEU N N 15 120.593 0.04 . 1 . . . . . 45 L N . 27689 1
285 . 1 . 1 46 46 PRO C C 13 177.333 0.06 . 1 . . . . . 46 P CO . 27689 1
286 . 1 . 1 46 46 PRO CA C 13 62.282 0.13 . 1 . . . . . 46 P CA . 27689 1
287 . 1 . 1 46 46 PRO CB C 13 32.665 0.22 . 1 . . . . . 46 P CB . 27689 1
288 . 1 . 1 47 47 LYS H H 1 8.785 0.01 . 1 . . . . . 47 K HN . 27689 1
289 . 1 . 1 47 47 LYS C C 13 177.798 0.06 . 1 . . . . . 47 K CO . 27689 1
290 . 1 . 1 47 47 LYS CA C 13 59.945 0.13 . 1 . . . . . 47 K CA . 27689 1
291 . 1 . 1 47 47 LYS CB C 13 32.668 0.22 . 1 . . . . . 47 K CB . 27689 1
292 . 1 . 1 47 47 LYS N N 15 121.734 0.04 . 1 . . . . . 47 K N . 27689 1
293 . 1 . 1 48 48 GLY H H 1 9.001 0.01 . 1 . . . . . 48 G HN . 27689 1
294 . 1 . 1 48 48 GLY HA2 H 1 3.789 0.04 . 2 . . . . . 48 G HA1 . 27689 1
295 . 1 . 1 48 48 GLY HA3 H 1 3.977 0.04 . 2 . . . . . 48 G HA2 . 27689 1
296 . 1 . 1 48 48 GLY C C 13 174.484 0.06 . 1 . . . . . 48 G CO . 27689 1
297 . 1 . 1 48 48 GLY CA C 13 45.771 0.13 . 1 . . . . . 48 G CA . 27689 1
298 . 1 . 1 48 48 GLY N N 15 109.607 0.04 . 1 . . . . . 48 G N . 27689 1
299 . 1 . 1 49 49 LEU H H 1 7.915 0.01 . 1 . . . . . 49 L HN . 27689 1
300 . 1 . 1 49 49 LEU HA H 1 4.550 0.04 . 1 . . . . . 49 L HA . 27689 1
301 . 1 . 1 49 49 LEU HB2 H 1 1.633 0.04 . 2 . . . . . 49 L HB . 27689 1
302 . 1 . 1 49 49 LEU HB3 H 1 1.633 0.04 . 2 . . . . . 49 L HB . 27689 1
303 . 1 . 1 49 49 LEU C C 13 177.372 0.06 . 1 . . . . . 49 L CO . 27689 1
304 . 1 . 1 49 49 LEU CA C 13 55.239 0.13 . 1 . . . . . 49 L CA . 27689 1
305 . 1 . 1 49 49 LEU CB C 13 44.402 0.22 . 1 . . . . . 49 L CB . 27689 1
306 . 1 . 1 49 49 LEU N N 15 117.885 0.04 . 1 . . . . . 49 L N . 27689 1
307 . 1 . 1 50 50 LYS H H 1 7.448 0.01 . 1 . . . . . 50 K HN . 27689 1
308 . 1 . 1 50 50 LYS C C 13 176.825 0.06 . 1 . . . . . 50 K CO . 27689 1
309 . 1 . 1 50 50 LYS CA C 13 60.049 0.13 . 1 . . . . . 50 K CA . 27689 1
310 . 1 . 1 50 50 LYS CB C 13 32.040 0.22 . 1 . . . . . 50 K CB . 27689 1
311 . 1 . 1 50 50 LYS N N 15 116.964 0.04 . 1 . . . . . 50 K N . 27689 1
312 . 1 . 1 51 51 THR H H 1 7.731 0.01 . 1 . . . . . 51 T HN . 27689 1
313 . 1 . 1 51 51 THR C C 13 175.395 0.06 . 1 . . . . . 51 T CO . 27689 1
314 . 1 . 1 51 51 THR CA C 13 63.233 0.13 . 1 . . . . . 51 T CA . 27689 1
315 . 1 . 1 51 51 THR N N 15 116.747 0.04 . 1 . . . . . 51 T N . 27689 1
316 . 1 . 1 52 52 GLN H H 1 7.727 0.01 . 1 . . . . . 52 Q HN . 27689 1
317 . 1 . 1 52 52 GLN HB2 H 1 1.708 0.04 . 2 . . . . . 52 Q HB . 27689 1
318 . 1 . 1 52 52 GLN HB3 H 1 1.708 0.04 . 2 . . . . . 52 Q HB . 27689 1
319 . 1 . 1 52 52 GLN C C 13 172.820 0.06 . 1 . . . . . 52 Q CO . 27689 1
320 . 1 . 1 52 52 GLN CA C 13 55.911 0.13 . 1 . . . . . 52 Q CA . 27689 1
321 . 1 . 1 52 52 GLN CB C 13 31.652 0.22 . 1 . . . . . 52 Q CB . 27689 1
322 . 1 . 1 52 52 GLN N N 15 118.859 0.04 . 1 . . . . . 52 Q N . 27689 1
323 . 1 . 1 53 53 VAL H H 1 7.062 0.01 . 1 . . . . . 53 V HN . 27689 1
324 . 1 . 1 53 53 VAL HA H 1 5.200 0.04 . 1 . . . . . 53 V HA . 27689 1
325 . 1 . 1 53 53 VAL HB H 1 1.917 0.04 . 1 . . . . . 53 V HB . 27689 1
326 . 1 . 1 53 53 VAL C C 13 174.351 0.06 . 1 . . . . . 53 V CO . 27689 1
327 . 1 . 1 53 53 VAL CA C 13 60.051 0.13 . 1 . . . . . 53 V CA . 27689 1
328 . 1 . 1 53 53 VAL CB C 13 35.266 0.22 . 1 . . . . . 53 V CB . 27689 1
329 . 1 . 1 53 53 VAL N N 15 116.814 0.04 . 1 . . . . . 53 V N . 27689 1
330 . 1 . 1 54 54 ARG H H 1 8.844 0.01 . 1 . . . . . 54 R HN . 27689 1
331 . 1 . 1 54 54 ARG HA H 1 4.751 0.04 . 1 . . . . . 54 R HA . 27689 1
332 . 1 . 1 54 54 ARG C C 13 174.497 0.06 . 1 . . . . . 54 R CO . 27689 1
333 . 1 . 1 54 54 ARG CA C 13 53.972 0.13 . 1 . . . . . 54 R CA . 27689 1
334 . 1 . 1 54 54 ARG CB C 13 34.395 0.22 . 1 . . . . . 54 R CB . 27689 1
335 . 1 . 1 54 54 ARG N N 15 122.044 0.04 . 1 . . . . . 54 R N . 27689 1
336 . 1 . 1 55 55 ALA H H 1 9.766 0.01 . 1 . . . . . 55 A HN . 27689 1
337 . 1 . 1 55 55 ALA HB1 H 1 1.127 0.04 . 1 . . . . . 55 A HB . 27689 1
338 . 1 . 1 55 55 ALA HB2 H 1 1.127 0.04 . 1 . . . . . 55 A HB . 27689 1
339 . 1 . 1 55 55 ALA HB3 H 1 1.127 0.04 . 1 . . . . . 55 A HB . 27689 1
340 . 1 . 1 55 55 ALA C C 13 175.371 0.06 . 1 . . . . . 55 A CO . 27689 1
341 . 1 . 1 55 55 ALA CA C 13 52.388 0.13 . 1 . . . . . 55 A CA . 27689 1
342 . 1 . 1 55 55 ALA CB C 13 18.986 0.22 . 1 . . . . . 55 A CB . 27689 1
343 . 1 . 1 55 55 ALA N N 15 125.237 0.04 . 1 . . . . . 55 A N . 27689 1
344 . 1 . 1 56 56 ALA H H 1 9.075 0.01 . 1 . . . . . 56 A HN . 27689 1
345 . 1 . 1 56 56 ALA HA H 1 4.567 0.04 . 1 . . . . . 56 A HA . 27689 1
346 . 1 . 1 56 56 ALA HB1 H 1 1.222 0.04 . 1 . . . . . 56 A HB . 27689 1
347 . 1 . 1 56 56 ALA HB2 H 1 1.222 0.04 . 1 . . . . . 56 A HB . 27689 1
348 . 1 . 1 56 56 ALA HB3 H 1 1.222 0.04 . 1 . . . . . 56 A HB . 27689 1
349 . 1 . 1 56 56 ALA C C 13 176.659 0.06 . 1 . . . . . 56 A CO . 27689 1
350 . 1 . 1 56 56 ALA CA C 13 52.675 0.13 . 1 . . . . . 56 A CA . 27689 1
351 . 1 . 1 56 56 ALA CB C 13 21.748 0.22 . 1 . . . . . 56 A CB . 27689 1
352 . 1 . 1 56 56 ALA N N 15 124.826 0.04 . 1 . . . . . 56 A N . 27689 1
353 . 1 . 1 57 57 ASN H H 1 7.726 0.01 . 1 . . . . . 57 N HN . 27689 1
354 . 1 . 1 57 57 ASN HA H 1 4.946 0.04 . 1 . . . . . 57 N HA . 27689 1
355 . 1 . 1 57 57 ASN HB2 H 1 2.698 0.04 . 2 . . . . . 57 N HB . 27689 1
356 . 1 . 1 57 57 ASN HB3 H 1 2.698 0.04 . 2 . . . . . 57 N HB . 27689 1
357 . 1 . 1 57 57 ASN C C 13 172.602 0.06 . 1 . . . . . 57 N CO . 27689 1
358 . 1 . 1 57 57 ASN CA C 13 52.801 0.13 . 1 . . . . . 57 N CA . 27689 1
359 . 1 . 1 57 57 ASN CB C 13 41.859 0.22 . 1 . . . . . 57 N CB . 27689 1
360 . 1 . 1 57 57 ASN N N 15 111.839 0.04 . 1 . . . . . 57 N N . 27689 1
361 . 1 . 1 58 58 VAL H H 1 9.173 0.01 . 1 . . . . . 58 V HN . 27689 1
362 . 1 . 1 58 58 VAL HB H 1 1.875 0.04 . 1 . . . . . 58 V HB . 27689 1
363 . 1 . 1 58 58 VAL C C 13 174.366 0.06 . 1 . . . . . 58 V CO . 27689 1
364 . 1 . 1 58 58 VAL CA C 13 61.031 0.13 . 1 . . . . . 58 V CA . 27689 1
365 . 1 . 1 58 58 VAL CB C 13 34.437 0.22 . 1 . . . . . 58 V CB . 27689 1
366 . 1 . 1 58 58 VAL N N 15 121.851 0.04 . 1 . . . . . 58 V N . 27689 1
367 . 1 . 1 59 59 ARG H H 1 8.519 0.01 . 1 . . . . . 59 R HN . 27689 1
368 . 1 . 1 59 59 ARG HA H 1 4.593 0.04 . 1 . . . . . 59 R HA . 27689 1
369 . 1 . 1 59 59 ARG HB2 H 1 1.815 0.04 . 2 . . . . . 59 R HB . 27689 1
370 . 1 . 1 59 59 ARG HB3 H 1 1.815 0.04 . 2 . . . . . 59 R HB . 27689 1
371 . 1 . 1 59 59 ARG C C 13 177.067 0.06 . 1 . . . . . 59 R CO . 27689 1
372 . 1 . 1 59 59 ARG CA C 13 55.459 0.13 . 1 . . . . . 59 R CA . 27689 1
373 . 1 . 1 59 59 ARG CB C 13 31.588 0.22 . 1 . . . . . 59 R CB . 27689 1
374 . 1 . 1 59 59 ARG N N 15 127.510 0.04 . 1 . . . . . 59 R N . 27689 1
375 . 1 . 1 60 60 GLY H H 1 9.319 0.01 . 1 . . . . . 60 G HN . 27689 1
376 . 1 . 1 60 60 GLY HA2 H 1 3.922 0.04 . 2 . . . . . 60 G HA . 27689 1
377 . 1 . 1 60 60 GLY HA3 H 1 3.922 0.04 . 2 . . . . . 60 G HA . 27689 1
378 . 1 . 1 60 60 GLY C C 13 174.605 0.06 . 1 . . . . . 60 G CO . 27689 1
379 . 1 . 1 60 60 GLY CA C 13 47.322 0.13 . 1 . . . . . 60 G CA . 27689 1
380 . 1 . 1 60 60 GLY N N 15 118.399 0.04 . 1 . . . . . 60 G N . 27689 1
381 . 1 . 1 61 61 GLY H H 1 8.660 0.01 . 1 . . . . . 61 G HN . 27689 1
382 . 1 . 1 61 61 GLY HA2 H 1 4.224 0.04 . 2 . . . . . 61 G HA . 27689 1
383 . 1 . 1 61 61 GLY HA3 H 1 4.224 0.04 . 2 . . . . . 61 G HA . 27689 1
384 . 1 . 1 61 61 GLY C C 13 172.703 0.06 . 1 . . . . . 61 G CO . 27689 1
385 . 1 . 1 61 61 GLY CA C 13 45.713 0.13 . 1 . . . . . 61 G CA . 27689 1
386 . 1 . 1 61 61 GLY N N 15 110.457 0.04 . 1 . . . . . 61 G N . 27689 1
387 . 1 . 1 62 62 ASN H H 1 8.144 0.01 . 1 . . . . . 62 N HN . 27689 1
388 . 1 . 1 62 62 ASN HA H 1 5.137 0.04 . 1 . . . . . 62 N HA . 27689 1
389 . 1 . 1 62 62 ASN HB2 H 1 2.695 0.04 . 2 . . . . . 62 N HB . 27689 1
390 . 1 . 1 62 62 ASN HB3 H 1 2.695 0.04 . 2 . . . . . 62 N HB . 27689 1
391 . 1 . 1 62 62 ASN C C 13 172.806 0.06 . 1 . . . . . 62 N CO . 27689 1
392 . 1 . 1 62 62 ASN CA C 13 52.409 0.13 . 1 . . . . . 62 N CA . 27689 1
393 . 1 . 1 62 62 ASN CB C 13 40.277 0.22 . 1 . . . . . 62 N CB . 27689 1
394 . 1 . 1 62 62 ASN N N 15 120.204 0.04 . 1 . . . . . 62 N N . 27689 1
395 . 1 . 1 63 63 LEU H H 1 8.595 0.01 . 1 . . . . . 63 L HN . 27689 1
396 . 1 . 1 63 63 LEU HB2 H 1 2.055 0.04 . 2 . . . . . 63 L HB . 27689 1
397 . 1 . 1 63 63 LEU HB3 H 1 2.055 0.04 . 2 . . . . . 63 L HB . 27689 1
398 . 1 . 1 63 63 LEU C C 13 173.781 0.06 . 1 . . . . . 63 L CO . 27689 1
399 . 1 . 1 63 63 LEU CA C 13 53.995 0.13 . 1 . . . . . 63 L CA . 27689 1
400 . 1 . 1 63 63 LEU CB C 13 43.769 0.22 . 1 . . . . . 63 L CB . 27689 1
401 . 1 . 1 63 63 LEU N N 15 128.416 0.04 . 1 . . . . . 63 L N . 27689 1
402 . 1 . 1 64 64 VAL H H 1 8.962 0.01 . 1 . . . . . 64 V HN . 27689 1
403 . 1 . 1 64 64 VAL HA H 1 4.763 0.04 . 1 . . . . . 64 V HA . 27689 1
404 . 1 . 1 64 64 VAL HB H 1 1.922 0.04 . 1 . . . . . 64 V HB . 27689 1
405 . 1 . 1 64 64 VAL C C 13 176.074 0.06 . 1 . . . . . 64 V CO . 27689 1
406 . 1 . 1 64 64 VAL CA C 13 61.546 0.13 . 1 . . . . . 64 V CA . 27689 1
407 . 1 . 1 64 64 VAL CB C 13 32.852 0.22 . 1 . . . . . 64 V CB . 27689 1
408 . 1 . 1 64 64 VAL N N 15 127.600 0.04 . 1 . . . . . 64 V N . 27689 1
409 . 1 . 1 65 65 LEU H H 1 9.417 0.01 . 1 . . . . . 65 L HN . 27689 1
410 . 1 . 1 65 65 LEU HA H 1 5.141 0.04 . 1 . . . . . 65 L HA . 27689 1
411 . 1 . 1 65 65 LEU HB2 H 1 1.259 0.04 . 2 . . . . . 65 L HB . 27689 1
412 . 1 . 1 65 65 LEU HB3 H 1 1.259 0.04 . 2 . . . . . 65 L HB . 27689 1
413 . 1 . 1 65 65 LEU C C 13 175.436 0.06 . 1 . . . . . 65 L CO . 27689 1
414 . 1 . 1 65 65 LEU CA C 13 52.431 0.13 . 1 . . . . . 65 L CA . 27689 1
415 . 1 . 1 65 65 LEU CB C 13 44.067 0.22 . 1 . . . . . 65 L CB . 27689 1
416 . 1 . 1 65 65 LEU N N 15 126.452 0.04 . 1 . . . . . 65 L N . 27689 1
417 . 1 . 1 66 66 GLU H H 1 9.272 0.01 . 1 . . . . . 66 E HN . 27689 1
418 . 1 . 1 66 66 GLU HA H 1 5.343 0.04 . 1 . . . . . 66 E HA . 27689 1
419 . 1 . 1 66 66 GLU C C 13 174.293 0.06 . 1 . . . . . 66 E CO . 27689 1
420 . 1 . 1 66 66 GLU CA C 13 53.477 0.13 . 1 . . . . . 66 E CA . 27689 1
421 . 1 . 1 66 66 GLU CB C 13 33.920 0.22 . 1 . . . . . 66 E CB . 27689 1
422 . 1 . 1 66 66 GLU N N 15 118.412 0.04 . 1 . . . . . 66 E N . 27689 1
423 . 1 . 1 67 67 ALA H H 1 8.777 0.01 . 1 . . . . . 67 A HN . 27689 1
424 . 1 . 1 67 67 ALA HA H 1 5.424 0.04 . 1 . . . . . 67 A HA . 27689 1
425 . 1 . 1 67 67 ALA HB1 H 1 1.220 0.04 . 1 . . . . . 67 A HB . 27689 1
426 . 1 . 1 67 67 ALA HB2 H 1 1.220 0.04 . 1 . . . . . 67 A HB . 27689 1
427 . 1 . 1 67 67 ALA HB3 H 1 1.220 0.04 . 1 . . . . . 67 A HB . 27689 1
428 . 1 . 1 67 67 ALA C C 13 178.628 0.06 . 1 . . . . . 67 A CO . 27689 1
429 . 1 . 1 67 67 ALA CA C 13 49.067 0.13 . 1 . . . . . 67 A CA . 27689 1
430 . 1 . 1 67 67 ALA CB C 13 23.087 0.22 . 1 . . . . . 67 A CB . 27689 1
431 . 1 . 1 67 67 ALA N N 15 121.300 0.04 . 1 . . . . . 67 A N . 27689 1
432 . 1 . 1 68 68 ALA H H 1 7.966 0.01 . 1 . . . . . 68 A HN . 27689 1
433 . 1 . 1 68 68 ALA HA H 1 4.287 0.04 . 1 . . . . . 68 A HA . 27689 1
434 . 1 . 1 68 68 ALA HB1 H 1 1.320 0.04 . 1 . . . . . 68 A HB . 27689 1
435 . 1 . 1 68 68 ALA HB2 H 1 1.320 0.04 . 1 . . . . . 68 A HB . 27689 1
436 . 1 . 1 68 68 ALA HB3 H 1 1.320 0.04 . 1 . . . . . 68 A HB . 27689 1
437 . 1 . 1 68 68 ALA C C 13 175.049 0.06 . 1 . . . . . 68 A CO . 27689 1
438 . 1 . 1 68 68 ALA CA C 13 54.121 0.13 . 1 . . . . . 68 A CA . 27689 1
439 . 1 . 1 68 68 ALA CB C 13 20.118 0.22 . 1 . . . . . 68 A CB . 27689 1
440 . 1 . 1 68 68 ALA N N 15 119.560 0.04 . 1 . . . . . 68 A N . 27689 1
441 . 1 . 1 69 69 SER H H 1 7.074 0.01 . 1 . . . . . 69 S HN . 27689 1
442 . 1 . 1 69 69 SER HA H 1 4.715 0.04 . 1 . . . . . 69 S HA . 27689 1
443 . 1 . 1 69 69 SER C C 13 174.135 0.06 . 1 . . . . . 69 S CO . 27689 1
444 . 1 . 1 69 69 SER CA C 13 55.907 0.13 . 1 . . . . . 69 S CA . 27689 1
445 . 1 . 1 69 69 SER CB C 13 67.332 0.22 . 1 . . . . . 69 S CB . 27689 1
446 . 1 . 1 69 69 SER N N 15 105.213 0.04 . 1 . . . . . 69 S N . 27689 1
447 . 1 . 1 70 70 ALA H H 1 9.402 0.01 . 1 . . . . . 70 A HN . 27689 1
448 . 1 . 1 70 70 ALA HA H 1 3.948 0.04 . 1 . . . . . 70 A HA . 27689 1
449 . 1 . 1 70 70 ALA HB1 H 1 1.518 0.04 . 1 . . . . . 70 A HB . 27689 1
450 . 1 . 1 70 70 ALA HB2 H 1 1.518 0.04 . 1 . . . . . 70 A HB . 27689 1
451 . 1 . 1 70 70 ALA HB3 H 1 1.518 0.04 . 1 . . . . . 70 A HB . 27689 1
452 . 1 . 1 70 70 ALA C C 13 179.821 0.06 . 1 . . . . . 70 A CO . 27689 1
453 . 1 . 1 70 70 ALA CA C 13 55.386 0.13 . 1 . . . . . 70 A CA . 27689 1
454 . 1 . 1 70 70 ALA CB C 13 17.994 0.22 . 1 . . . . . 70 A CB . 27689 1
455 . 1 . 1 70 70 ALA N N 15 125.391 0.04 . 1 . . . . . 70 A N . 27689 1
456 . 1 . 1 71 71 ALA H H 1 8.566 0.01 . 1 . . . . . 71 A HN . 27689 1
457 . 1 . 1 71 71 ALA HA H 1 4.160 0.04 . 1 . . . . . 71 A HA . 27689 1
458 . 1 . 1 71 71 ALA HB1 H 1 1.419 0.04 . 1 . . . . . 71 A HB . 27689 1
459 . 1 . 1 71 71 ALA HB2 H 1 1.419 0.04 . 1 . . . . . 71 A HB . 27689 1
460 . 1 . 1 71 71 ALA HB3 H 1 1.419 0.04 . 1 . . . . . 71 A HB . 27689 1
461 . 1 . 1 71 71 ALA C C 13 181.034 0.06 . 1 . . . . . 71 A CO . 27689 1
462 . 1 . 1 71 71 ALA CA C 13 55.171 0.13 . 1 . . . . . 71 A CA . 27689 1
463 . 1 . 1 71 71 ALA CB C 13 18.398 0.22 . 1 . . . . . 71 A CB . 27689 1
464 . 1 . 1 71 71 ALA N N 15 122.098 0.04 . 1 . . . . . 71 A N . 27689 1
465 . 1 . 1 72 72 LEU H H 1 7.779 0.01 . 1 . . . . . 72 L HN . 27689 1
466 . 1 . 1 72 72 LEU HA H 1 4.085 0.04 . 1 . . . . . 72 L HA . 27689 1
467 . 1 . 1 72 72 LEU HB2 H 1 1.228 0.04 . 2 . . . . . 72 L HB . 27689 1
468 . 1 . 1 72 72 LEU HB3 H 1 1.228 0.04 . 2 . . . . . 72 L HB . 27689 1
469 . 1 . 1 72 72 LEU C C 13 178.794 0.06 . 1 . . . . . 72 L CO . 27689 1
470 . 1 . 1 72 72 LEU CA C 13 57.306 0.13 . 1 . . . . . 72 L CA . 27689 1
471 . 1 . 1 72 72 LEU CB C 13 42.432 0.22 . 1 . . . . . 72 L CB . 27689 1
472 . 1 . 1 72 72 LEU N N 15 118.947 0.04 . 1 . . . . . 72 L N . 27689 1
473 . 1 . 1 73 73 LYS H H 1 8.272 0.01 . 1 . . . . . 73 K HN . 27689 1
474 . 1 . 1 73 73 LYS C C 13 176.861 0.06 . 1 . . . . . 73 K CO . 27689 1
475 . 1 . 1 73 73 LYS CA C 13 59.825 0.13 . 1 . . . . . 73 K CA . 27689 1
476 . 1 . 1 73 73 LYS CB C 13 32.041 0.22 . 1 . . . . . 73 K CB . 27689 1
477 . 1 . 1 73 73 LYS N N 15 120.946 0.04 . 1 . . . . . 73 K N . 27689 1
478 . 1 . 1 74 74 MET H H 1 7.732 0.01 . 1 . . . . . 74 M HN . 27689 1
479 . 1 . 1 74 74 MET HA H 1 4.180 0.04 . 1 . . . . . 74 M HA . 27689 1
480 . 1 . 1 74 74 MET HB2 H 1 2.194 0.04 . 2 . . . . . 74 M HB . 27689 1
481 . 1 . 1 74 74 MET HB3 H 1 2.194 0.04 . 2 . . . . . 74 M HB . 27689 1
482 . 1 . 1 74 74 MET C C 13 178.503 0.06 . 1 . . . . . 74 M CO . 27689 1
483 . 1 . 1 74 74 MET CA C 13 59.091 0.13 . 1 . . . . . 74 M CA . 27689 1
484 . 1 . 1 74 74 MET CB C 13 32.526 0.22 . 1 . . . . . 74 M CB . 27689 1
485 . 1 . 1 74 74 MET N N 15 116.730 0.04 . 1 . . . . . 74 M N . 27689 1
486 . 1 . 1 75 75 LYS H H 1 7.198 0.01 . 1 . . . . . 75 K HN . 27689 1
487 . 1 . 1 75 75 LYS HA H 1 4.187 0.04 . 1 . . . . . 75 K HA . 27689 1
488 . 1 . 1 75 75 LYS HB2 H 1 2.010 0.04 . 2 . . . . . 75 K HB . 27689 1
489 . 1 . 1 75 75 LYS HB3 H 1 2.010 0.04 . 2 . . . . . 75 K HB . 27689 1
490 . 1 . 1 75 75 LYS C C 13 179.322 0.06 . 1 . . . . . 75 K CO . 27689 1
491 . 1 . 1 75 75 LYS CA C 13 59.358 0.13 . 1 . . . . . 75 K CA . 27689 1
492 . 1 . 1 75 75 LYS CB C 13 32.953 0.22 . 1 . . . . . 75 K CB . 27689 1
493 . 1 . 1 75 75 LYS N N 15 117.404 0.04 . 1 . . . . . 75 K N . 27689 1
494 . 1 . 1 76 76 VAL H H 1 8.326 0.01 . 1 . . . . . 76 V HN . 27689 1
495 . 1 . 1 76 76 VAL HA H 1 3.458 0.04 . 1 . . . . . 76 V HA . 27689 1
496 . 1 . 1 76 76 VAL HB H 1 2.011 0.04 . 1 . . . . . 76 V HB . 27689 1
497 . 1 . 1 76 76 VAL C C 13 178.087 0.06 . 1 . . . . . 76 V CO . 27689 1
498 . 1 . 1 76 76 VAL CA C 13 66.154 0.13 . 1 . . . . . 76 V CA . 27689 1
499 . 1 . 1 76 76 VAL CB C 13 31.140 0.22 . 1 . . . . . 76 V CB . 27689 1
500 . 1 . 1 76 76 VAL N N 15 119.637 0.04 . 1 . . . . . 76 V N . 27689 1
501 . 1 . 1 77 77 ASP H H 1 9.017 0.01 . 1 . . . . . 77 D HN . 27689 1
502 . 1 . 1 77 77 ASP HA H 1 4.534 0.04 . 1 . . . . . 77 D HA . 27689 1
503 . 1 . 1 77 77 ASP HB2 H 1 2.495 0.04 . 2 . . . . . 77 D HB1 . 27689 1
504 . 1 . 1 77 77 ASP HB3 H 1 2.776 0.04 . 2 . . . . . 77 D HB2 . 27689 1
505 . 1 . 1 77 77 ASP C C 13 180.570 0.06 . 1 . . . . . 77 D CO . 27689 1
506 . 1 . 1 77 77 ASP CA C 13 57.752 0.13 . 1 . . . . . 77 D CA . 27689 1
507 . 1 . 1 77 77 ASP CB C 13 39.683 0.22 . 1 . . . . . 77 D CB . 27689 1
508 . 1 . 1 77 77 ASP N N 15 120.843 0.04 . 1 . . . . . 77 D N . 27689 1
509 . 1 . 1 78 78 TYR H H 1 7.530 0.01 . 1 . . . . . 78 Y HN . 27689 1
510 . 1 . 1 78 78 TYR HA H 1 4.421 0.04 . 1 . . . . . 78 Y HA . 27689 1
511 . 1 . 1 78 78 TYR HB2 H 1 3.270 0.04 . 2 . . . . . 78 Y HB . 27689 1
512 . 1 . 1 78 78 TYR HB3 H 1 3.270 0.04 . 2 . . . . . 78 Y HB . 27689 1
513 . 1 . 1 78 78 TYR C C 13 177.591 0.06 . 1 . . . . . 78 Y CO . 27689 1
514 . 1 . 1 78 78 TYR CA C 13 60.850 0.13 . 1 . . . . . 78 Y CA . 27689 1
515 . 1 . 1 78 78 TYR CB C 13 38.483 0.22 . 1 . . . . . 78 Y CB . 27689 1
516 . 1 . 1 78 78 TYR N N 15 118.702 0.04 . 1 . . . . . 78 Y N . 27689 1
517 . 1 . 1 79 79 GLU H H 1 7.564 0.01 . 1 . . . . . 79 E HN . 27689 1
518 . 1 . 1 79 79 GLU HA H 1 4.635 0.04 . 1 . . . . . 79 E HA . 27689 1
519 . 1 . 1 79 79 GLU HB2 H 1 2.620 0.04 . 2 . . . . . 79 E HB . 27689 1
520 . 1 . 1 79 79 GLU HB3 H 1 2.620 0.04 . 2 . . . . . 79 E HB . 27689 1
521 . 1 . 1 79 79 GLU C C 13 177.399 0.06 . 1 . . . . . 79 E CO . 27689 1
522 . 1 . 1 79 79 GLU CA C 13 55.421 0.13 . 1 . . . . . 79 E CA . 27689 1
523 . 1 . 1 79 79 GLU CB C 13 30.719 0.22 . 1 . . . . . 79 E CB . 27689 1
524 . 1 . 1 79 79 GLU N N 15 116.501 0.04 . 1 . . . . . 79 E N . 27689 1
525 . 1 . 1 80 80 ARG H H 1 7.439 0.01 . 1 . . . . . 80 R HN . 27689 1
526 . 1 . 1 80 80 ARG C C 13 176.755 0.06 . 1 . . . . . 80 R CO . 27689 1
527 . 1 . 1 80 80 ARG CA C 13 61.543 0.13 . 1 . . . . . 80 R CA . 27689 1
528 . 1 . 1 80 80 ARG CB C 13 30.410 0.22 . 1 . . . . . 80 R CB . 27689 1
529 . 1 . 1 80 80 ARG N N 15 120.332 0.04 . 1 . . . . . 80 R N . 27689 1
530 . 1 . 1 81 81 LEU H H 1 8.420 0.01 . 1 . . . . . 81 L HN . 27689 1
531 . 1 . 1 81 81 LEU HA H 1 4.207 0.04 . 1 . . . . . 81 L HA . 27689 1
532 . 1 . 1 81 81 LEU HB2 H 1 1.677 0.04 . 2 . . . . . 81 L HB . 27689 1
533 . 1 . 1 81 81 LEU HB3 H 1 1.677 0.04 . 2 . . . . . 81 L HB . 27689 1
534 . 1 . 1 81 81 LEU C C 13 179.949 0.06 . 1 . . . . . 81 L CO . 27689 1
535 . 1 . 1 81 81 LEU CA C 13 58.227 0.13 . 1 . . . . . 81 L CA . 27689 1
536 . 1 . 1 81 81 LEU CB C 13 40.396 0.22 . 1 . . . . . 81 L CB . 27689 1
537 . 1 . 1 81 81 LEU N N 15 119.102 0.04 . 1 . . . . . 81 L N . 27689 1
538 . 1 . 1 82 82 HIS H H 1 8.070 0.01 . 1 . . . . . 82 H HN . 27689 1
539 . 1 . 1 82 82 HIS HB2 H 1 3.445 0.04 . 2 . . . . . 82 H HB . 27689 1
540 . 1 . 1 82 82 HIS HB3 H 1 3.445 0.04 . 2 . . . . . 82 H HB . 27689 1
541 . 1 . 1 82 82 HIS C C 13 177.402 0.06 . 1 . . . . . 82 H CO . 27689 1
542 . 1 . 1 82 82 HIS CA C 13 58.047 0.13 . 1 . . . . . 82 H CA . 27689 1
543 . 1 . 1 82 82 HIS CB C 13 28.894 0.22 . 1 . . . . . 82 H CB . 27689 1
544 . 1 . 1 82 82 HIS N N 15 121.868 0.04 . 1 . . . . . 82 H N . 27689 1
545 . 1 . 1 83 83 ILE H H 1 8.532 0.01 . 1 . . . . . 83 I HN . 27689 1
546 . 1 . 1 83 83 ILE HA H 1 4.276 0.04 . 1 . . . . . 83 I HA . 27689 1
547 . 1 . 1 83 83 ILE HB H 1 1.862 0.04 . 1 . . . . . 83 I HB . 27689 1
548 . 1 . 1 83 83 ILE C C 13 177.317 0.06 . 1 . . . . . 83 I CO . 27689 1
549 . 1 . 1 83 83 ILE CA C 13 65.838 0.13 . 1 . . . . . 83 I CA . 27689 1
550 . 1 . 1 83 83 ILE CB C 13 38.224 0.22 . 1 . . . . . 83 I CB . 27689 1
551 . 1 . 1 83 83 ILE N N 15 119.514 0.04 . 1 . . . . . 83 I N . 27689 1
552 . 1 . 1 84 84 LEU H H 1 8.482 0.01 . 1 . . . . . 84 L HN . 27689 1
553 . 1 . 1 84 84 LEU HA H 1 3.837 0.04 . 1 . . . . . 84 L HA . 27689 1
554 . 1 . 1 84 84 LEU HB2 H 1 1.568 0.04 . 2 . . . . . 84 L HB . 27689 1
555 . 1 . 1 84 84 LEU HB3 H 1 1.568 0.04 . 2 . . . . . 84 L HB . 27689 1
556 . 1 . 1 84 84 LEU C C 13 178.368 0.06 . 1 . . . . . 84 L CO . 27689 1
557 . 1 . 1 84 84 LEU CA C 13 58.655 0.13 . 1 . . . . . 84 L CA . 27689 1
558 . 1 . 1 84 84 LEU CB C 13 42.096 0.22 . 1 . . . . . 84 L CB . 27689 1
559 . 1 . 1 84 84 LEU N N 15 119.214 0.04 . 1 . . . . . 84 L N . 27689 1
560 . 1 . 1 85 85 THR H H 1 8.353 0.01 . 1 . . . . . 85 T HN . 27689 1
561 . 1 . 1 85 85 THR C C 13 176.542 0.06 . 1 . . . . . 85 T CO . 27689 1
562 . 1 . 1 85 85 THR CA C 13 67.124 0.13 . 1 . . . . . 85 T CA . 27689 1
563 . 1 . 1 85 85 THR CB C 13 68.833 0.22 . 1 . . . . . 85 T CB . 27689 1
564 . 1 . 1 85 85 THR N N 15 114.414 0.04 . 1 . . . . . 85 T N . 27689 1
565 . 1 . 1 86 86 GLN H H 1 7.902 0.01 . 1 . . . . . 86 Q HN . 27689 1
566 . 1 . 1 86 86 GLN HA H 1 4.011 0.04 . 1 . . . . . 86 Q HA . 27689 1
567 . 1 . 1 86 86 GLN HB2 H 1 2.026 0.04 . 2 . . . . . 86 Q HB . 27689 1
568 . 1 . 1 86 86 GLN HB3 H 1 2.026 0.04 . 2 . . . . . 86 Q HB . 27689 1
569 . 1 . 1 86 86 GLN C C 13 179.243 0.06 . 1 . . . . . 86 Q CO . 27689 1
570 . 1 . 1 86 86 GLN CA C 13 59.045 0.13 . 1 . . . . . 86 Q CA . 27689 1
571 . 1 . 1 86 86 GLN CB C 13 29.313 0.22 . 1 . . . . . 86 Q CB . 27689 1
572 . 1 . 1 86 86 GLN N N 15 119.479 0.04 . 1 . . . . . 86 Q N . 27689 1
573 . 1 . 1 87 87 LEU H H 1 8.560 0.01 . 1 . . . . . 87 L HN . 27689 1
574 . 1 . 1 87 87 LEU HA H 1 4.161 0.04 . 1 . . . . . 87 L HA . 27689 1
575 . 1 . 1 87 87 LEU C C 13 179.968 0.06 . 1 . . . . . 87 L CO . 27689 1
576 . 1 . 1 87 87 LEU CA C 13 58.502 0.13 . 1 . . . . . 87 L CA . 27689 1
577 . 1 . 1 87 87 LEU CB C 13 41.457 0.22 . 1 . . . . . 87 L CB . 27689 1
578 . 1 . 1 87 87 LEU N N 15 119.568 0.04 . 1 . . . . . 87 L N . 27689 1
579 . 1 . 1 88 88 ARG H H 1 8.618 0.01 . 1 . . . . . 88 R HN . 27689 1
580 . 1 . 1 88 88 ARG C C 13 179.266 0.06 . 1 . . . . . 88 R CO . 27689 1
581 . 1 . 1 88 88 ARG CA C 13 59.828 0.13 . 1 . . . . . 88 R CA . 27689 1
582 . 1 . 1 88 88 ARG CB C 13 30.675 0.22 . 1 . . . . . 88 R CB . 27689 1
583 . 1 . 1 88 88 ARG N N 15 119.302 0.04 . 1 . . . . . 88 R N . 27689 1
584 . 1 . 1 89 89 GLN H H 1 7.756 0.01 . 1 . . . . . 89 Q HN . 27689 1
585 . 1 . 1 89 89 GLN HA H 1 4.233 0.04 . 1 . . . . . 89 Q HA . 27689 1
586 . 1 . 1 89 89 GLN HB2 H 1 2.173 0.04 . 2 . . . . . 89 Q HB . 27689 1
587 . 1 . 1 89 89 GLN HB3 H 1 2.173 0.04 . 2 . . . . . 89 Q HB . 27689 1
588 . 1 . 1 89 89 GLN C C 13 176.371 0.06 . 1 . . . . . 89 Q CO . 27689 1
589 . 1 . 1 89 89 GLN CA C 13 57.078 0.13 . 1 . . . . . 89 Q CA . 27689 1
590 . 1 . 1 89 89 GLN CB C 13 29.015 0.22 . 1 . . . . . 89 Q CB . 27689 1
591 . 1 . 1 89 89 GLN N N 15 116.889 0.04 . 1 . . . . . 89 Q N . 27689 1
592 . 1 . 1 90 90 ASN H H 1 7.630 0.01 . 1 . . . . . 90 N HN . 27689 1
593 . 1 . 1 90 90 ASN HA H 1 4.966 0.04 . 1 . . . . . 90 N HA . 27689 1
594 . 1 . 1 90 90 ASN HB2 H 1 3.139 0.04 . 2 . . . . . 90 N HB2 . 27689 1
595 . 1 . 1 90 90 ASN HB3 H 1 2.769 0.04 . 2 . . . . . 90 N HB3 . 27689 1
596 . 1 . 1 90 90 ASN C C 13 174.626 0.06 . 1 . . . . . 90 N CO . 27689 1
597 . 1 . 1 90 90 ASN CA C 13 53.097 0.13 . 1 . . . . . 90 N CA . 27689 1
598 . 1 . 1 90 90 ASN CB C 13 39.213 0.22 . 1 . . . . . 90 N CB . 27689 1
599 . 1 . 1 90 90 ASN N N 15 118.413 0.04 . 1 . . . . . 90 N N . 27689 1
600 . 1 . 1 91 91 GLY H H 1 7.792 0.01 . 1 . . . . . 91 G HN . 27689 1
601 . 1 . 1 91 91 GLY HA2 H 1 3.574 0.04 . 2 . . . . . 91 G HA . 27689 1
602 . 1 . 1 91 91 GLY HA3 H 1 3.574 0.04 . 2 . . . . . 91 G HA . 27689 1
603 . 1 . 1 91 91 GLY C C 13 174.711 0.06 . 1 . . . . . 91 G CO . 27689 1
604 . 1 . 1 91 91 GLY CA C 13 45.428 0.13 . 1 . . . . . 91 G CA . 27689 1
605 . 1 . 1 91 91 GLY N N 15 104.388 0.04 . 1 . . . . . 91 G N . 27689 1
606 . 1 . 1 92 92 PHE H H 1 7.926 0.01 . 1 . . . . . 92 F HN . 27689 1
607 . 1 . 1 92 92 PHE HA H 1 4.953 0.04 . 1 . . . . . 92 F HA . 27689 1
608 . 1 . 1 92 92 PHE HB2 H 1 2.526 0.04 . 2 . . . . . 92 F HB2 . 27689 1
609 . 1 . 1 92 92 PHE HB3 H 1 2.921 0.04 . 2 . . . . . 92 F HB3 . 27689 1
610 . 1 . 1 92 92 PHE C C 13 176.566 0.06 . 1 . . . . . 92 F CO . 27689 1
611 . 1 . 1 92 92 PHE CA C 13 56.514 0.13 . 1 . . . . . 92 F CA . 27689 1
612 . 1 . 1 92 92 PHE CB C 13 37.270 0.22 . 1 . . . . . 92 F CB . 27689 1
613 . 1 . 1 92 92 PHE N N 15 120.145 0.04 . 1 . . . . . 92 F N . 27689 1
614 . 1 . 1 93 93 GLY H H 1 8.318 0.01 . 1 . . . . . 93 G HN . 27689 1
615 . 1 . 1 93 93 GLY HA2 H 1 3.897 0.04 . 2 . . . . . 93 G HA . 27689 1
616 . 1 . 1 93 93 GLY HA3 H 1 3.897 0.04 . 2 . . . . . 93 G HA . 27689 1
617 . 1 . 1 93 93 GLY C C 13 173.713 0.06 . 1 . . . . . 93 G CO . 27689 1
618 . 1 . 1 93 93 GLY CA C 13 47.204 0.13 . 1 . . . . . 93 G CA . 27689 1
619 . 1 . 1 93 93 GLY N N 15 106.879 0.04 . 1 . . . . . 93 G N . 27689 1
620 . 1 . 1 94 94 HIS H H 1 8.533 0.01 . 1 . . . . . 94 H HN . 27689 1
621 . 1 . 1 94 94 HIS HA H 1 4.644 0.04 . 1 . . . . . 94 H HA . 27689 1
622 . 1 . 1 94 94 HIS HB2 H 1 3.180 0.04 . 2 . . . . . 94 H HB . 27689 1
623 . 1 . 1 94 94 HIS HB3 H 1 3.180 0.04 . 2 . . . . . 94 H HB . 27689 1
624 . 1 . 1 94 94 HIS C C 13 175.298 0.06 . 1 . . . . . 94 H CO . 27689 1
625 . 1 . 1 94 94 HIS CA C 13 55.733 0.13 . 1 . . . . . 94 H CA . 27689 1
626 . 1 . 1 94 94 HIS CB C 13 29.650 0.22 . 1 . . . . . 94 H CB . 27689 1
627 . 1 . 1 94 94 HIS N N 15 115.448 0.04 . 1 . . . . . 94 H N . 27689 1
628 . 1 . 1 95 95 LEU H H 1 7.249 0.01 . 1 . . . . . 95 L HN . 27689 1
629 . 1 . 1 95 95 LEU HA H 1 4.317 0.04 . 1 . . . . . 95 L HA . 27689 1
630 . 1 . 1 95 95 LEU HB2 H 1 1.815 0.04 . 2 . . . . . 95 L HB . 27689 1
631 . 1 . 1 95 95 LEU HB3 H 1 1.815 0.04 . 2 . . . . . 95 L HB . 27689 1
632 . 1 . 1 95 95 LEU C C 13 176.707 0.06 . 1 . . . . . 95 L CO . 27689 1
633 . 1 . 1 95 95 LEU CA C 13 55.231 0.13 . 1 . . . . . 95 L CA . 27689 1
634 . 1 . 1 95 95 LEU CB C 13 42.262 0.22 . 1 . . . . . 95 L CB . 27689 1
635 . 1 . 1 95 95 LEU N N 15 119.953 0.04 . 1 . . . . . 95 L N . 27689 1
636 . 1 . 1 96 96 ILE H H 1 9.604 0.01 . 1 . . . . . 96 I HN . 27689 1
637 . 1 . 1 96 96 ILE HA H 1 4.389 0.04 . 1 . . . . . 96 I HA . 27689 1
638 . 1 . 1 96 96 ILE HB H 1 1.939 0.04 . 1 . . . . . 96 I HB . 27689 1
639 . 1 . 1 96 96 ILE C C 13 175.712 0.06 . 1 . . . . . 96 I CO . 27689 1
640 . 1 . 1 96 96 ILE CA C 13 61.121 0.13 . 1 . . . . . 96 I CA . 27689 1
641 . 1 . 1 96 96 ILE CB C 13 41.035 0.22 . 1 . . . . . 96 I CB . 27689 1
642 . 1 . 1 96 96 ILE N N 15 118.044 0.04 . 1 . . . . . 96 I N . 27689 1
643 . 1 . 1 97 97 SER H H 1 8.083 0.01 . 1 . . . . . 97 S HN . 27689 1
644 . 1 . 1 97 97 SER HA H 1 4.709 0.04 . 1 . . . . . 97 S HA . 27689 1
645 . 1 . 1 97 97 SER HB2 H 1 3.927 0.04 . 2 . . . . . 97 S HB . 27689 1
646 . 1 . 1 97 97 SER HB3 H 1 3.927 0.04 . 2 . . . . . 97 S HB . 27689 1
647 . 1 . 1 97 97 SER C C 13 171.714 0.06 . 1 . . . . . 97 S CO . 27689 1
648 . 1 . 1 97 97 SER CA C 13 57.764 0.13 . 1 . . . . . 97 S CA . 27689 1
649 . 1 . 1 97 97 SER CB C 13 65.669 0.22 . 1 . . . . . 97 S CB . 27689 1
650 . 1 . 1 97 97 SER N N 15 114.730 0.04 . 1 . . . . . 97 S N . 27689 1
651 . 1 . 1 98 98 ILE H H 1 8.551 0.01 . 1 . . . . . 98 I HN . 27689 1
652 . 1 . 1 98 98 ILE HB H 1 1.515 0.04 . 1 . . . . . 98 I HB . 27689 1
653 . 1 . 1 98 98 ILE C C 13 173.848 0.06 . 1 . . . . . 98 I CO . 27689 1
654 . 1 . 1 98 98 ILE CA C 13 59.648 0.13 . 1 . . . . . 98 I CA . 27689 1
655 . 1 . 1 98 98 ILE CB C 13 42.030 0.22 . 1 . . . . . 98 I CB . 27689 1
656 . 1 . 1 98 98 ILE N N 15 119.534 0.04 . 1 . . . . . 98 I N . 27689 1
657 . 1 . 1 99 99 GLU H H 1 8.909 0.01 . 1 . . . . . 99 E HN . 27689 1
658 . 1 . 1 99 99 GLU HA H 1 4.749 0.04 . 1 . . . . . 99 E HA . 27689 1
659 . 1 . 1 99 99 GLU HB2 H 1 2.042 0.04 . 2 . . . . . 99 E HB . 27689 1
660 . 1 . 1 99 99 GLU HB3 H 1 2.042 0.04 . 2 . . . . . 99 E HB . 27689 1
661 . 1 . 1 99 99 GLU C C 13 173.767 0.06 . 1 . . . . . 99 E CO . 27689 1
662 . 1 . 1 99 99 GLU CA C 13 54.382 0.13 . 1 . . . . . 99 E CA . 27689 1
663 . 1 . 1 99 99 GLU CB C 13 33.798 0.22 . 1 . . . . . 99 E CB . 27689 1
664 . 1 . 1 99 99 GLU N N 15 127.976 0.04 . 1 . . . . . 99 E N . 27689 1
665 . 1 . 1 100 100 VAL H H 1 9.544 0.01 . 1 . . . . . 100 V HN . 27689 1
666 . 1 . 1 100 100 VAL HA H 1 4.991 0.04 . 1 . . . . . 100 V HA . 27689 1
667 . 1 . 1 100 100 VAL HB H 1 2.018 0.04 . 1 . . . . . 100 V HB . 27689 1
668 . 1 . 1 100 100 VAL C C 13 175.710 0.06 . 1 . . . . . 100 V CO . 27689 1
669 . 1 . 1 100 100 VAL CA C 13 60.558 0.13 . 1 . . . . . 100 V CA . 27689 1
670 . 1 . 1 100 100 VAL CB C 13 33.050 0.22 . 1 . . . . . 100 V CB . 27689 1
671 . 1 . 1 100 100 VAL N N 15 124.480 0.04 . 1 . . . . . 100 V N . 27689 1
672 . 1 . 1 101 101 ARG H H 1 9.257 0.01 . 1 . . . . . 101 R HN . 27689 1
673 . 1 . 1 101 101 ARG HA H 1 4.943 0.04 . 1 . . . . . 101 R HA . 27689 1
674 . 1 . 1 101 101 ARG C C 13 174.776 0.06 . 1 . . . . . 101 R CO . 27689 1
675 . 1 . 1 101 101 ARG CA C 13 53.793 0.13 . 1 . . . . . 101 R CA . 27689 1
676 . 1 . 1 101 101 ARG CB C 13 33.592 0.22 . 1 . . . . . 101 R CB . 27689 1
677 . 1 . 1 101 101 ARG N N 15 128.184 0.04 . 1 . . . . . 101 R N . 27689 1
678 . 1 . 1 102 102 VAL H H 1 8.877 0.01 . 1 . . . . . 102 V HN . 27689 1
679 . 1 . 1 102 102 VAL HA H 1 4.517 0.04 . 1 . . . . . 102 V HA . 27689 1
680 . 1 . 1 102 102 VAL HB H 1 2.008 0.04 . 1 . . . . . 102 V HB . 27689 1
681 . 1 . 1 102 102 VAL C C 13 176.334 0.06 . 1 . . . . . 102 V CO . 27689 1
682 . 1 . 1 102 102 VAL CA C 13 62.285 0.13 . 1 . . . . . 102 V CA . 27689 1
683 . 1 . 1 102 102 VAL CB C 13 32.087 0.22 . 1 . . . . . 102 V CB . 27689 1
684 . 1 . 1 102 102 VAL N N 15 122.009 0.04 . 1 . . . . . 102 V N . 27689 1
685 . 1 . 1 103 103 ASN H H 1 8.665 0.01 . 1 . . . . . 103 N HN . 27689 1
686 . 1 . 1 103 103 ASN HA H 1 5.154 0.04 . 1 . . . . . 103 N HA . 27689 1
687 . 1 . 1 103 103 ASN HB2 H 1 2.760 0.04 . 2 . . . . . 103 N HB . 27689 1
688 . 1 . 1 103 103 ASN HB3 H 1 2.760 0.04 . 2 . . . . . 103 N HB . 27689 1
689 . 1 . 1 103 103 ASN CA C 13 49.391 0.13 . 1 . . . . . 103 N CA . 27689 1
690 . 1 . 1 103 103 ASN N N 15 123.114 0.04 . 1 . . . . . 103 N N . 27689 1
691 . 1 . 1 104 104 PRO HB2 H 1 2.121 0.04 . 2 . . . . . 104 P HB2 . 27689 1
692 . 1 . 1 104 104 PRO HB3 H 1 2.478 0.04 . 2 . . . . . 104 P HB3 . 27689 1
693 . 1 . 1 104 104 PRO C C 13 178.248 0.06 . 1 . . . . . 104 P CO . 27689 1
694 . 1 . 1 104 104 PRO CA C 13 63.656 0.13 . 1 . . . . . 104 P CA . 27689 1
695 . 1 . 1 104 104 PRO CB C 13 32.361 0.22 . 1 . . . . . 104 P CB . 27689 1
696 . 1 . 1 105 105 GLU H H 1 7.769 0.01 . 1 . . . . . 105 E HN . 27689 1
697 . 1 . 1 105 105 GLU HA H 1 4.294 0.04 . 1 . . . . . 105 E HA . 27689 1
698 . 1 . 1 105 105 GLU HB2 H 1 1.935 0.04 . 2 . . . . . 105 E HB . 27689 1
699 . 1 . 1 105 105 GLU HB3 H 1 1.935 0.04 . 2 . . . . . 105 E HB . 27689 1
700 . 1 . 1 105 105 GLU C C 13 177.572 0.06 . 1 . . . . . 105 E CO . 27689 1
701 . 1 . 1 105 105 GLU CA C 13 57.058 0.13 . 1 . . . . . 105 E CA . 27689 1
702 . 1 . 1 105 105 GLU CB C 13 29.196 0.22 . 1 . . . . . 105 E CB . 27689 1
703 . 1 . 1 105 105 GLU N N 15 117.475 0.04 . 1 . . . . . 105 E N . 27689 1
704 . 1 . 1 106 106 LEU H H 1 7.458 0.01 . 1 . . . . . 106 L HN . 27689 1
705 . 1 . 1 106 106 LEU HA H 1 3.984 0.04 . 1 . . . . . 106 L HA . 27689 1
706 . 1 . 1 106 106 LEU HB2 H 1 1.508 0.04 . 2 . . . . . 106 L HB . 27689 1
707 . 1 . 1 106 106 LEU HB3 H 1 1.508 0.04 . 2 . . . . . 106 L HB . 27689 1
708 . 1 . 1 106 106 LEU C C 13 177.455 0.06 . 1 . . . . . 106 L CO . 27689 1
709 . 1 . 1 106 106 LEU CA C 13 56.758 0.13 . 1 . . . . . 106 L CA . 27689 1
710 . 1 . 1 106 106 LEU CB C 13 42.070 0.22 . 1 . . . . . 106 L CB . 27689 1
711 . 1 . 1 106 106 LEU N N 15 118.867 0.04 . 1 . . . . . 106 L N . 27689 1
712 . 1 . 1 107 107 TYR H H 1 7.797 0.01 . 1 . . . . . 107 Y HN . 27689 1
713 . 1 . 1 107 107 TYR HA H 1 4.434 0.04 . 1 . . . . . 107 Y HA . 27689 1
714 . 1 . 1 107 107 TYR HB2 H 1 3.104 0.04 . 2 . . . . . 107 Y HB . 27689 1
715 . 1 . 1 107 107 TYR HB3 H 1 3.104 0.04 . 2 . . . . . 107 Y HB . 27689 1
716 . 1 . 1 107 107 TYR C C 13 176.109 0.06 . 1 . . . . . 107 Y CO . 27689 1
717 . 1 . 1 107 107 TYR CA C 13 59.108 0.13 . 1 . . . . . 107 Y CA . 27689 1
718 . 1 . 1 107 107 TYR CB C 13 38.209 0.22 . 1 . . . . . 107 Y CB . 27689 1
719 . 1 . 1 107 107 TYR N N 15 118.130 0.04 . 1 . . . . . 107 Y N . 27689 1
720 . 1 . 1 108 108 ARG H H 1 7.723 0.01 . 1 . . . . . 108 R HN . 27689 1
721 . 1 . 1 108 108 ARG HA H 1 4.234 0.04 . 1 . . . . . 108 R HA . 27689 1
722 . 1 . 1 108 108 ARG HB2 H 1 1.764 0.04 . 2 . . . . . 108 R HB . 27689 1
723 . 1 . 1 108 108 ARG HB3 H 1 1.764 0.04 . 2 . . . . . 108 R HB . 27689 1
724 . 1 . 1 108 108 ARG C C 13 176.212 0.06 . 1 . . . . . 108 R CO . 27689 1
725 . 1 . 1 108 108 ARG CA C 13 56.347 0.13 . 1 . . . . . 108 R CA . 27689 1
726 . 1 . 1 108 108 ARG CB C 13 30.963 0.22 . 1 . . . . . 108 R CB . 27689 1
727 . 1 . 1 108 108 ARG N N 15 122.195 0.04 . 1 . . . . . 108 R N . 27689 1
728 . 1 . 1 109 109 GLN H H 1 8.199 0.01 . 1 . . . . . 109 Q HN . 27689 1
729 . 1 . 1 109 109 GLN HA H 1 4.257 0.04 . 1 . . . . . 109 Q HA . 27689 1
730 . 1 . 1 109 109 GLN HB2 H 1 2.043 0.04 . 2 . . . . . 109 Q HB . 27689 1
731 . 1 . 1 109 109 GLN HB3 H 1 2.043 0.04 . 2 . . . . . 109 Q HB . 27689 1
732 . 1 . 1 109 109 GLN C C 13 176.166 0.06 . 1 . . . . . 109 Q CO . 27689 1
733 . 1 . 1 109 109 GLN CA C 13 56.254 0.13 . 1 . . . . . 109 Q CA . 27689 1
734 . 1 . 1 109 109 GLN CB C 13 29.395 0.22 . 1 . . . . . 109 Q CB . 27689 1
735 . 1 . 1 109 109 GLN N N 15 120.702 0.04 . 1 . . . . . 109 Q N . 27689 1
736 . 1 . 1 110 110 SER H H 1 8.265 0.01 . 1 . . . . . 110 S HN . 27689 1
737 . 1 . 1 110 110 SER HA H 1 4.397 0.04 . 1 . . . . . 110 S HA . 27689 1
738 . 1 . 1 110 110 SER HB2 H 1 3.873 0.04 . 2 . . . . . 110 S HB . 27689 1
739 . 1 . 1 110 110 SER HB3 H 1 3.873 0.04 . 2 . . . . . 110 S HB . 27689 1
740 . 1 . 1 110 110 SER C C 13 174.372 0.06 . 1 . . . . . 110 S CO . 27689 1
741 . 1 . 1 110 110 SER CA C 13 58.619 0.13 . 1 . . . . . 110 S CA . 27689 1
742 . 1 . 1 110 110 SER CB C 13 63.814 0.22 . 1 . . . . . 110 S CB . 27689 1
743 . 1 . 1 110 110 SER N N 15 117.136 0.04 . 1 . . . . . 110 S N . 27689 1
744 . 1 . 1 111 111 LYS H H 1 8.290 0.01 . 1 . . . . . 111 K HN . 27689 1
745 . 1 . 1 111 111 LYS HA H 1 4.357 0.04 . 1 . . . . . 111 K HA . 27689 1
746 . 1 . 1 111 111 LYS HB2 H 1 1.793 0.04 . 2 . . . . . 111 K HB . 27689 1
747 . 1 . 1 111 111 LYS HB3 H 1 1.793 0.04 . 2 . . . . . 111 K HB . 27689 1
748 . 1 . 1 111 111 LYS C C 13 176.503 0.06 . 1 . . . . . 111 K CO . 27689 1
749 . 1 . 1 111 111 LYS CA C 13 56.362 0.13 . 1 . . . . . 111 K CA . 27689 1
750 . 1 . 1 111 111 LYS CB C 13 32.985 0.22 . 1 . . . . . 111 K CB . 27689 1
751 . 1 . 1 111 111 LYS N N 15 123.153 0.04 . 1 . . . . . 111 K N . 27689 1
752 . 1 . 1 112 112 ILE H H 1 8.229 0.01 . 1 . . . . . 112 I HN . 27689 1
753 . 1 . 1 112 112 ILE HA H 1 4.240 0.04 . 1 . . . . . 112 I HA . 27689 1
754 . 1 . 1 112 112 ILE HB H 1 1.901 0.04 . 1 . . . . . 112 I HB . 27689 1
755 . 1 . 1 112 112 ILE C C 13 176.596 0.06 . 1 . . . . . 112 I CO . 27689 1
756 . 1 . 1 112 112 ILE CA C 13 61.309 0.13 . 1 . . . . . 112 I CA . 27689 1
757 . 1 . 1 112 112 ILE CB C 13 38.576 0.22 . 1 . . . . . 112 I CB . 27689 1
758 . 1 . 1 112 112 ILE N N 15 122.221 0.04 . 1 . . . . . 112 I N . 27689 1
759 . 1 . 1 113 113 THR H H 1 8.286 0.01 . 1 . . . . . 113 T HN . 27689 1
760 . 1 . 1 113 113 THR HB H 1 4.377 0.04 . 1 . . . . . 113 T HB . 27689 1
761 . 1 . 1 113 113 THR C C 13 174.523 0.06 . 1 . . . . . 113 T CO . 27689 1
762 . 1 . 1 113 113 THR CA C 13 61.617 0.13 . 1 . . . . . 113 T CA . 27689 1
763 . 1 . 1 113 113 THR CB C 13 69.796 0.22 . 1 . . . . . 113 T CB . 27689 1
764 . 1 . 1 113 113 THR N N 15 118.198 0.04 . 1 . . . . . 113 T N . 27689 1
765 . 1 . 1 114 114 SER H H 1 8.370 0.01 . 1 . . . . . 114 S HN . 27689 1
766 . 1 . 1 114 114 SER HA H 1 4.481 0.04 . 1 . . . . . 114 S HA . 27689 1
767 . 1 . 1 114 114 SER HB2 H 1 3.892 0.04 . 2 . . . . . 114 S HB . 27689 1
768 . 1 . 1 114 114 SER HB3 H 1 3.892 0.04 . 2 . . . . . 114 S HB . 27689 1
769 . 1 . 1 114 114 SER C C 13 174.593 0.06 . 1 . . . . . 114 S CO . 27689 1
770 . 1 . 1 114 114 SER CA C 13 58.510 0.13 . 1 . . . . . 114 S CA . 27689 1
771 . 1 . 1 114 114 SER CB C 13 63.852 0.22 . 1 . . . . . 114 S CB . 27689 1
772 . 1 . 1 114 114 SER N N 15 117.971 0.04 . 1 . . . . . 114 S N . 27689 1
773 . 1 . 1 115 115 GLU H H 1 8.519 0.01 . 1 . . . . . 115 E HN . 27689 1
774 . 1 . 1 115 115 GLU HA H 1 4.326 0.04 . 1 . . . . . 115 E HA . 27689 1
775 . 1 . 1 115 115 GLU HB2 H 1 1.976 0.04 . 2 . . . . . 115 E HB . 27689 1
776 . 1 . 1 115 115 GLU HB3 H 1 1.976 0.04 . 2 . . . . . 115 E HB . 27689 1
777 . 1 . 1 115 115 GLU C C 13 176.108 0.06 . 1 . . . . . 115 E CO . 27689 1
778 . 1 . 1 115 115 GLU CA C 13 56.727 0.13 . 1 . . . . . 115 E CA . 27689 1
779 . 1 . 1 115 115 GLU CB C 13 30.269 0.22 . 1 . . . . . 115 E CB . 27689 1
780 . 1 . 1 115 115 GLU N N 15 122.642 0.04 . 1 . . . . . 115 E N . 27689 1
781 . 1 . 1 116 116 ASP H H 1 8.304 0.01 . 1 . . . . . 116 D HN . 27689 1
782 . 1 . 1 116 116 ASP HA H 1 4.610 0.04 . 1 . . . . . 116 D HA . 27689 1
783 . 1 . 1 116 116 ASP HB2 H 1 2.642 0.04 . 2 . . . . . 116 D HB . 27689 1
784 . 1 . 1 116 116 ASP HB3 H 1 2.642 0.04 . 2 . . . . . 116 D HB . 27689 1
785 . 1 . 1 116 116 ASP C C 13 174.872 0.06 . 1 . . . . . 116 D CO . 27689 1
786 . 1 . 1 116 116 ASP CA C 13 54.437 0.13 . 1 . . . . . 116 D CA . 27689 1
787 . 1 . 1 116 116 ASP CB C 13 41.197 0.22 . 1 . . . . . 116 D CB . 27689 1
788 . 1 . 1 116 116 ASP N N 15 121.308 0.04 . 1 . . . . . 116 D N . 27689 1
789 . 1 . 1 117 117 ALA H H 1 7.815 0.01 . 1 . . . . . 117 A HN . 27689 1
790 . 1 . 1 117 117 ALA HA H 1 4.121 0.04 . 1 . . . . . 117 A HA . 27689 1
791 . 1 . 1 117 117 ALA HB1 H 1 1.347 0.04 . 1 . . . . . 117 A HB . 27689 1
792 . 1 . 1 117 117 ALA HB2 H 1 1.347 0.04 . 1 . . . . . 117 A HB . 27689 1
793 . 1 . 1 117 117 ALA HB3 H 1 1.347 0.04 . 1 . . . . . 117 A HB . 27689 1
794 . 1 . 1 117 117 ALA C C 13 176.672 0.06 . 1 . . . . . 117 A CO . 27689 1
795 . 1 . 1 117 117 ALA CA C 13 53.964 0.13 . 1 . . . . . 117 A CA . 27689 1
796 . 1 . 1 117 117 ALA N N 15 129.514 0.04 . 1 . . . . . 117 A N . 27689 1
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