###################################
# 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 19110
_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' . . . 19110 1
2 '2D 1H-13C HSQC' . . . 19110 1
3 '3D HNCO' . . . 19110 1
4 '3D HNCACB' . . . 19110 1
5 '3D CBCA(CO)NH' . . . 19110 1
6 '2D CON' . . . 19110 1
7 '2D COCA' . . . 19110 1
8 '3D HBHA(CO)NH' . . . 19110 1
9 '3D C(CO)NH' . . . 19110 1
10 '3D H(CCO)NH' . . . 19110 1
11 '3D 1H-15N NOESY' . . . 19110 1
12 '3D 1H-13C NOESY' . . . 19110 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 2 2 SER HA H 1 3.829 0.05 1 1 . . . . 2 S HA . 19110 1
2 . 1 1 2 2 SER HB2 H 1 3.826 0.10 1 1 . . . . 2 S HB2 . 19110 1
3 . 1 1 2 2 SER HB3 H 1 3.826 0.10 1 1 . . . . 2 S HB3 . 19110 1
4 . 1 1 2 2 SER CA C 13 58.17 0.10 1 1 . . . . 2 S CA . 19110 1
5 . 1 1 2 2 SER CB C 13 63.82 0.10 1 1 . . . . 2 S CB . 19110 1
6 . 1 1 3 3 MET H H 1 8.611 0.05 7 1 . . . . 3 M H . 19110 1
7 . 1 1 3 3 MET HA H 1 4.435 0.05 1 1 . . . . 3 M HA . 19110 1
8 . 1 1 3 3 MET HB2 H 1 2.021 0.05 2 2 . . . . 3 M HB2 . 19110 1
9 . 1 1 3 3 MET HG2 H 1 2.555 0.05 1 2 . . . . 3 M HG2 . 19110 1
10 . 1 1 3 3 MET HE1 H 1 2.048 0.05 1 1 . . . . 3 M HE1 . 19110 1
11 . 1 1 3 3 MET HE2 H 1 2.048 0.05 1 1 . . . . 3 M HE2 . 19110 1
12 . 1 1 3 3 MET HE3 H 1 2.048 0.05 1 1 . . . . 3 M HE3 . 19110 1
13 . 1 1 3 3 MET C C 13 176.286 0.10 2 1 . . . . 3 M C . 19110 1
14 . 1 1 3 3 MET CA C 13 55.836 0.10 3 1 . . . . 3 M CA . 19110 1
15 . 1 1 3 3 MET CB C 13 32.719 0.10 1 1 . . . . 3 M CB . 19110 1
16 . 1 1 3 3 MET CE C 13 17.001 0.10 1 1 . . . . 3 M CE . 19110 1
17 . 1 1 3 3 MET N N 15 122.534 0.10 8 1 . . . . 3 M N . 19110 1
18 . 1 1 4 4 SER H H 1 8.286 0.05 8 1 . . . . 4 S H . 19110 1
19 . 1 1 4 4 SER HA H 1 3.977 0.05 4 1 . . . . 4 S HA . 19110 1
20 . 1 1 4 4 SER C C 13 173.939 0.10 2 1 . . . . 4 S C . 19110 1
21 . 1 1 4 4 SER CA C 13 58.626 0.10 3 1 . . . . 4 S CA . 19110 1
22 . 1 1 4 4 SER CB C 13 64.082 0.10 2 1 . . . . 4 S CB . 19110 1
23 . 1 1 4 4 SER N N 15 116.772 0.10 9 1 . . . . 4 S N . 19110 1
24 . 1 1 5 5 ALA H H 1 8.332 0.05 6 1 . . . . 5 A H . 19110 1
25 . 1 1 5 5 ALA HA H 1 4.421 0.05 6 1 . . . . 5 A HA . 19110 1
26 . 1 1 5 5 ALA HB1 H 1 1.355 0.05 4 1 . . . . 5 A HB1 . 19110 1
27 . 1 1 5 5 ALA HB2 H 1 1.355 0.05 4 1 . . . . 5 A HB2 . 19110 1
28 . 1 1 5 5 ALA HB3 H 1 1.355 0.05 4 1 . . . . 5 A HB3 . 19110 1
29 . 1 1 5 5 ALA C C 13 176.933 0.10 2 1 . . . . 5 A C . 19110 1
30 . 1 1 5 5 ALA CA C 13 52.159 0.10 4 1 . . . . 5 A CA . 19110 1
31 . 1 1 5 5 ALA CB C 13 19.839 0.10 3 1 . . . . 5 A CB . 19110 1
32 . 1 1 5 5 ALA N N 15 125.702 0.10 7 1 . . . . 5 A N . 19110 1
33 . 1 1 6 6 GLU H H 1 8.194 0.05 9 1 . . . . 6 E H . 19110 1
34 . 1 1 6 6 GLU HB2 H 1 2.021 0.05 2 2 . . . . 6 E HB2 . 19110 1
35 . 1 1 6 6 GLU HB3 H 1 1.741 0.05 4 2 . . . . 6 E HB3 . 19110 1
36 . 1 1 6 6 GLU HG2 H 1 2.178 0.05 1 2 . . . . 6 E HG2 . 19110 1
37 . 1 1 6 6 GLU C C 13 175.841 0.10 2 1 . . . . 6 E C . 19110 1
38 . 1 1 6 6 GLU CA C 13 56.336 0.10 3 1 . . . . 6 E CA . 19110 1
39 . 1 1 6 6 GLU CB C 13 31.388 0.10 2 1 . . . . 6 E CB . 19110 1
40 . 1 1 6 6 GLU CG C 13 36.451 0.10 1 1 . . . . 6 E CG . 19110 1
41 . 1 1 6 6 GLU N N 15 119.405 0.10 10 1 . . . . 6 E N . 19110 1
42 . 1 1 7 7 GLY H H 1 8.458 0.05 7 1 . . . . 7 G H . 19110 1
43 . 1 1 7 7 GLY HA2 H 1 4.386 0.05 2 2 . . . . 7 G HA2 . 19110 1
44 . 1 1 7 7 GLY HA3 H 1 3.684 0.05 3 2 . . . . 7 G HA3 . 19110 1
45 . 1 1 7 7 GLY C C 13 171.785 0.10 2 1 . . . . 7 G C . 19110 1
46 . 1 1 7 7 GLY CA C 13 44.894 0.10 3 1 . . . . 7 G CA . 19110 1
47 . 1 1 7 7 GLY N N 15 109.426 0.10 7 1 . . . . 7 G N . 19110 1
48 . 1 1 8 8 TYR H H 1 9.311 0.05 5 1 . . . . 8 Y H . 19110 1
49 . 1 1 8 8 TYR HA H 1 5.095 0.05 5 1 . . . . 8 Y HA . 19110 1
50 . 1 1 8 8 TYR HB2 H 1 3.139 0.05 2 2 . . . . 8 Y HB2 . 19110 1
51 . 1 1 8 8 TYR HB3 H 1 2.950 0.05 2 2 . . . . 8 Y HB3 . 19110 1
52 . 1 1 8 8 TYR HD2 H 1 7.082 0.05 2 3 . . . . 8 Y HD2 . 19110 1
53 . 1 1 8 8 TYR HE2 H 1 6.649 0.05 1 3 . . . . 8 Y HE2 . 19110 1
54 . 1 1 8 8 TYR C C 13 174.230 0.10 2 1 . . . . 8 Y C . 19110 1
55 . 1 1 8 8 TYR CA C 13 56.573 0.10 4 1 . . . . 8 Y CA . 19110 1
56 . 1 1 8 8 TYR CB C 13 41.795 0.10 4 1 . . . . 8 Y CB . 19110 1
57 . 1 1 8 8 TYR CD2 C 13 133.068 0.10 1 3 . . . . 8 Y CD2 . 19110 1
58 . 1 1 8 8 TYR N N 15 121.639 0.10 6 1 . . . . 8 Y N . 19110 1
59 . 1 1 9 9 GLN H H 1 9.120 0.05 8 1 . . . . 9 Q H . 19110 1
60 . 1 1 9 9 GLN HA H 1 5.934 0.05 4 1 . . . . 9 Q HA . 19110 1
61 . 1 1 9 9 GLN HB2 H 1 1.788 0.05 1 2 . . . . 9 Q HB2 . 19110 1
62 . 1 1 9 9 GLN HG2 H 1 1.978 0.05 1 2 . . . . 9 Q HG2 . 19110 1
63 . 1 1 9 9 GLN HE21 H 1 7.244 0.05 1 2 . . . . 9 Q HE21 . 19110 1
64 . 1 1 9 9 GLN HE22 H 1 7.028 0.05 1 2 . . . . 9 Q HE22 . 19110 1
65 . 1 1 9 9 GLN C C 13 173.991 0.10 2 1 . . . . 9 Q C . 19110 1
66 . 1 1 9 9 GLN CA C 13 54.717 0.10 4 1 . . . . 9 Q CA . 19110 1
67 . 1 1 9 9 GLN CB C 13 32.605 0.10 2 1 . . . . 9 Q CB . 19110 1
68 . 1 1 9 9 GLN CG C 13 35.729 0.10 1 1 . . . . 9 Q CG . 19110 1
69 . 1 1 9 9 GLN N N 15 119.739 0.10 9 1 . . . . 9 Q N . 19110 1
70 . 1 1 9 9 GLN NE2 N 15 113.286 0.10 2 1 . . . . 9 Q NE2 . 19110 1
71 . 1 1 10 10 TYR H H 1 9.299 0.05 6 1 . . . . 10 Y H . 19110 1
72 . 1 1 10 10 TYR HA H 1 5.306 0.05 3 1 . . . . 10 Y HA . 19110 1
73 . 1 1 10 10 TYR HB2 H 1 2.835 0.05 2 2 . . . . 10 Y HB2 . 19110 1
74 . 1 1 10 10 TYR HB3 H 1 2.466 0.05 2 2 . . . . 10 Y HB3 . 19110 1
75 . 1 1 10 10 TYR HD2 H 1 6.817 0.05 2 3 . . . . 10 Y HD2 . 19110 1
76 . 1 1 10 10 TYR HE2 H 1 6.634 0.05 2 3 . . . . 10 Y HE2 . 19110 1
77 . 1 1 10 10 TYR C C 13 173.313 0.10 2 1 . . . . 10 Y C . 19110 1
78 . 1 1 10 10 TYR CA C 13 56.512 0.10 4 1 . . . . 10 Y CA . 19110 1
79 . 1 1 10 10 TYR CB C 13 43.447 0.10 4 1 . . . . 10 Y CB . 19110 1
80 . 1 1 10 10 TYR CD2 C 13 133.290 0.10 1 3 . . . . 10 Y CD2 . 19110 1
81 . 1 1 10 10 TYR CE2 C 13 117.576 0.10 1 3 . . . . 10 Y CE2 . 19110 1
82 . 1 1 10 10 TYR N N 15 119.797 0.10 7 1 . . . . 10 Y N . 19110 1
83 . 1 1 11 11 ARG H H 1 9.199 0.05 6 1 . . . . 11 R H . 19110 1
84 . 1 1 11 11 ARG HA H 1 5.600 0.05 4 1 . . . . 11 R HA . 19110 1
85 . 1 1 11 11 ARG HB2 H 1 1.773 0.05 2 2 . . . . 11 R HB2 . 19110 1
86 . 1 1 11 11 ARG HB3 H 1 1.402 0.05 2 2 . . . . 11 R HB3 . 19110 1
87 . 1 1 11 11 ARG HG2 H 1 1.361 0.05 2 2 . . . . 11 R HG2 . 19110 1
88 . 1 1 11 11 ARG HG3 H 1 2.155 0.05 2 2 . . . . 11 R HG3 . 19110 1
89 . 1 1 11 11 ARG HD2 H 1 3.132 0.05 2 1 . . . . 11 R HD2 . 19110 1
90 . 1 1 11 11 ARG HE H 1 7.190 0.05 3 1 . . . . 11 R HE . 19110 1
91 . 1 1 11 11 ARG C C 13 176.308 0.10 2 1 . . . . 11 R C . 19110 1
92 . 1 1 11 11 ARG CA C 13 53.168 0.10 4 1 . . . . 11 R CA . 19110 1
93 . 1 1 11 11 ARG CB C 13 34.454 0.10 2 1 . . . . 11 R CB . 19110 1
94 . 1 1 11 11 ARG CG C 13 27.104 0.10 1 1 . . . . 11 R CG . 19110 1
95 . 1 1 11 11 ARG CD C 13 43.415 0.10 1 1 . . . . 11 R CD . 19110 1
96 . 1 1 11 11 ARG N N 15 120.498 0.10 5 1 . . . . 11 R N . 19110 1
97 . 1 1 11 11 ARG NE N 15 89.803 10.10 5 1 . . . . 11 R NE . 19110 1
98 . 1 1 12 12 ALA H H 1 9.171 0.05 7 1 . . . . 12 A H . 19110 1
99 . 1 1 12 12 ALA HA H 1 4.565 0.05 1 1 . . . . 12 A HA . 19110 1
100 . 1 1 12 12 ALA HB1 H 1 1.443 0.05 4 1 . . . . 12 A HB1 . 19110 1
101 . 1 1 12 12 ALA HB2 H 1 1.443 0.05 4 1 . . . . 12 A HB2 . 19110 1
102 . 1 1 12 12 ALA HB3 H 1 1.443 0.05 4 1 . . . . 12 A HB3 . 19110 1
103 . 1 1 12 12 ALA C C 13 177.805 0.10 2 1 . . . . 12 A C . 19110 1
104 . 1 1 12 12 ALA CA C 13 53.065 0.10 4 1 . . . . 12 A CA . 19110 1
105 . 1 1 12 12 ALA CB C 13 19.280 0.10 3 1 . . . . 12 A CB . 19110 1
106 . 1 1 12 12 ALA N N 15 127.824 0.10 8 1 . . . . 12 A N . 19110 1
107 . 1 1 13 13 LEU H H 1 9.238 0.05 7 1 . . . . 13 L H . 19110 1
108 . 1 1 13 13 LEU HA H 1 3.933 0.05 4 1 . . . . 13 L HA . 19110 1
109 . 1 1 13 13 LEU HB2 H 1 0.933 0.05 1 2 . . . . 13 L HB2 . 19110 1
110 . 1 1 13 13 LEU HB3 H 1 0.611 0.05 1 2 . . . . 13 L HB3 . 19110 1
111 . 1 1 13 13 LEU HG H 1 1.362 0.05 1 1 . . . . 13 L HG . 19110 1
112 . 1 1 13 13 LEU HD11 H 1 0.623 0.05 2 2 . . . . 13 L HD11 . 19110 1
113 . 1 1 13 13 LEU HD12 H 1 0.623 0.05 2 2 . . . . 13 L HD12 . 19110 1
114 . 1 1 13 13 LEU HD13 H 1 0.623 0.05 2 2 . . . . 13 L HD13 . 19110 1
115 . 1 1 13 13 LEU HD21 H 1 0.593 0.05 2 2 . . . . 13 L HD21 . 19110 1
116 . 1 1 13 13 LEU HD22 H 1 0.593 0.05 2 2 . . . . 13 L HD22 . 19110 1
117 . 1 1 13 13 LEU HD23 H 1 0.593 0.05 2 2 . . . . 13 L HD23 . 19110 1
118 . 1 1 13 13 LEU C C 13 174.793 0.10 2 1 . . . . 13 L C . 19110 1
119 . 1 1 13 13 LEU CA C 13 55.172 0.10 4 1 . . . . 13 L CA . 19110 1
120 . 1 1 13 13 LEU CB C 13 44.044 0.10 2 1 . . . . 13 L CB . 19110 1
121 . 1 1 13 13 LEU CG C 13 26.676 0.10 1 1 . . . . 13 L CG . 19110 1
122 . 1 1 13 13 LEU CD1 C 13 25.532 0.10 4 2 . . . . 13 L CD1 . 19110 1
123 . 1 1 13 13 LEU CD2 C 13 22.170 0.10 4 2 . . . . 13 L CD2 . 19110 1
124 . 1 1 13 13 LEU N N 15 125.736 0.10 8 1 . . . . 13 L N . 19110 1
125 . 1 1 14 14 TYR H H 1 7.132 0.05 10 1 . . . . 14 Y H . 19110 1
126 . 1 1 14 14 TYR HA H 1 4.682 0.05 3 1 . . . . 14 Y HA . 19110 1
127 . 1 1 14 14 TYR HB2 H 1 3.191 0.05 2 2 . . . . 14 Y HB2 . 19110 1
128 . 1 1 14 14 TYR HB3 H 1 2.463 0.05 3 2 . . . . 14 Y HB3 . 19110 1
129 . 1 1 14 14 TYR HD2 H 1 6.739 0.05 2 3 . . . . 14 Y HD2 . 19110 1
130 . 1 1 14 14 TYR HE2 H 1 6.553 0.05 2 3 . . . . 14 Y HE2 . 19110 1
131 . 1 1 14 14 TYR C C 13 173.340 0.10 2 1 . . . . 14 Y C . 19110 1
132 . 1 1 14 14 TYR CA C 13 54.258 0.10 3 1 . . . . 14 Y CA . 19110 1
133 . 1 1 14 14 TYR CB C 13 42.527 0.10 4 1 . . . . 14 Y CB . 19110 1
134 . 1 1 14 14 TYR CD2 C 13 134.102 0.10 1 3 . . . . 14 Y CD2 . 19110 1
135 . 1 1 14 14 TYR CE2 C 13 117.591 0.10 1 3 . . . . 14 Y CE2 . 19110 1
136 . 1 1 14 14 TYR N N 15 112.278 0.10 11 1 . . . . 14 Y N . 19110 1
137 . 1 1 15 15 ASP H H 1 8.109 0.05 6 1 . . . . 15 D H . 19110 1
138 . 1 1 15 15 ASP HA H 1 4.474 0.05 1 1 . . . . 15 D HA . 19110 1
139 . 1 1 15 15 ASP HB2 H 1 2.707 0.05 3 2 . . . . 15 D HB2 . 19110 1
140 . 1 1 15 15 ASP HB3 H 1 2.400 0.05 3 2 . . . . 15 D HB3 . 19110 1
141 . 1 1 15 15 ASP C C 13 175.582 0.10 2 1 . . . . 15 D C . 19110 1
142 . 1 1 15 15 ASP CA C 13 54.379 0.10 3 1 . . . . 15 D CA . 19110 1
143 . 1 1 15 15 ASP CB C 13 41.680 0.10 2 1 . . . . 15 D CB . 19110 1
144 . 1 1 15 15 ASP N N 15 117.591 0.10 7 1 . . . . 15 D N . 19110 1
145 . 1 1 16 16 TYR H H 1 8.687 0.05 5 1 . . . . 16 Y H . 19110 1
146 . 1 1 16 16 TYR HA H 1 4.666 0.05 2 1 . . . . 16 Y HA . 19110 1
147 . 1 1 16 16 TYR HB2 H 1 2.775 0.05 2 1 . . . . 16 Y HB2 . 19110 1
148 . 1 1 16 16 TYR HB3 H 1 2.531 0.05 2 1 . . . . 16 Y HB3 . 19110 1
149 . 1 1 16 16 TYR HD2 H 1 6.899 0.05 2 3 . . . . 16 Y HD2 . 19110 1
150 . 1 1 16 16 TYR HE2 H 1 6.671 0.05 2 3 . . . . 16 Y HE2 . 19110 1
151 . 1 1 16 16 TYR C C 13 173.714 0.10 2 1 . . . . 16 Y C . 19110 1
152 . 1 1 16 16 TYR CA C 13 57.554 0.10 4 1 . . . . 16 Y CA . 19110 1
153 . 1 1 16 16 TYR CB C 13 42.182 0.10 4 1 . . . . 16 Y CB . 19110 1
154 . 1 1 16 16 TYR CD2 C 13 133.229 0.10 1 3 . . . . 16 Y CD2 . 19110 1
155 . 1 1 16 16 TYR CE2 C 13 118.083 0.10 1 3 . . . . 16 Y CE2 . 19110 1
156 . 1 1 16 16 TYR N N 15 121.941 0.10 6 1 . . . . 16 Y N . 19110 1
157 . 1 1 17 17 LYS H H 1 7.578 0.05 4 1 . . . . 17 K H . 19110 1
158 . 1 1 17 17 LYS HA H 1 4.429 0.05 6 1 . . . . 17 K HA . 19110 1
159 . 1 1 17 17 LYS HB2 H 1 1.443 0.05 1 2 . . . . 17 K HB2 . 19110 1
160 . 1 1 17 17 LYS C C 13 174.093 0.10 1 1 . . . . 17 K C . 19110 1
161 . 1 1 17 17 LYS CA C 13 53.537 0.10 3 1 . . . . 17 K CA . 19110 1
162 . 1 1 17 17 LYS CB C 13 32.646 0.10 2 1 . . . . 17 K CB . 19110 1
163 . 1 1 17 17 LYS CG C 13 24.155 0.10 1 1 . . . . 17 K CG . 19110 1
164 . 1 1 17 17 LYS CD C 13 28.606 0.10 1 1 . . . . 17 K CD . 19110 1
165 . 1 1 17 17 LYS N N 15 129.757 0.10 5 1 . . . . 17 K N . 19110 1
166 . 1 1 18 18 LYS H H 1 8.315 0.05 6 1 . . . . 18 K H . 19110 1
167 . 1 1 18 18 LYS HA H 1 3.734 0.05 3 1 . . . . 18 K HA . 19110 1
168 . 1 1 18 18 LYS HB2 H 1 1.680 0.05 1 2 . . . . 18 K HB2 . 19110 1
169 . 1 1 18 18 LYS HB3 H 1 1.380 0.05 1 2 . . . . 18 K HB3 . 19110 1
170 . 1 1 18 18 LYS C C 13 176.358 0.10 2 1 . . . . 18 K C . 19110 1
171 . 1 1 18 18 LYS CA C 13 57.394 0.10 4 1 . . . . 18 K CA . 19110 1
172 . 1 1 18 18 LYS CB C 13 33.095 0.10 1 1 . . . . 18 K CB . 19110 1
173 . 1 1 18 18 LYS CG C 13 23.232 0.10 1 1 . . . . 18 K CG . 19110 1
174 . 1 1 18 18 LYS N N 15 123.028 0.10 7 1 . . . . 18 K N . 19110 1
175 . 1 1 19 19 GLU H H 1 9.220 0.05 8 1 . . . . 19 E H . 19110 1
176 . 1 1 19 19 GLU HA H 1 4.460 0.05 8 1 . . . . 19 E HA . 19110 1
177 . 1 1 19 19 GLU HB2 H 1 2.108 0.05 3 2 . . . . 19 E HB2 . 19110 1
178 . 1 1 19 19 GLU HG3 H 1 2.141 0.05 1 2 . . . . 19 E HG3 . 19110 1
179 . 1 1 19 19 GLU C C 13 176.095 0.10 2 1 . . . . 19 E C . 19110 1
180 . 1 1 19 19 GLU CA C 13 56.588 0.10 3 1 . . . . 19 E CA . 19110 1
181 . 1 1 19 19 GLU CB C 13 32.547 0.10 2 1 . . . . 19 E CB . 19110 1
182 . 1 1 19 19 GLU CG C 13 36.033 0.10 1 1 . . . . 19 E CG . 19110 1
183 . 1 1 19 19 GLU N N 15 122.842 0.10 9 1 . . . . 19 E N . 19110 1
184 . 1 1 20 20 ARG H H 1 8.758 0.05 8 1 . . . . 20 R H . 19110 1
185 . 1 1 20 20 ARG HA H 1 4.613 0.05 1 1 . . . . 20 R HA . 19110 1
186 . 1 1 20 20 ARG HB2 H 1 1.976 0.05 1 2 . . . . 20 R HB2 . 19110 1
187 . 1 1 20 20 ARG HB3 H 1 1.576 0.05 1 2 . . . . 20 R HB3 . 19110 1
188 . 1 1 20 20 ARG HG2 H 1 1.541 0.05 1 2 . . . . 20 R HG2 . 19110 1
189 . 1 1 20 20 ARG HD2 H 1 2.962 0.05 1 2 . . . . 20 R HD2 . 19110 1
190 . 1 1 20 20 ARG HE H 1 7.159 0.05 3 1 . . . . 20 R HE . 19110 1
191 . 1 1 20 20 ARG C C 13 176.707 0.10 2 1 . . . . 20 R C . 19110 1
192 . 1 1 20 20 ARG CA C 13 54.545 0.10 3 1 . . . . 20 R CA . 19110 1
193 . 1 1 20 20 ARG CB C 13 31.696 0.10 2 1 . . . . 20 R CB . 19110 1
194 . 1 1 20 20 ARG CG C 13 26.976 0.10 1 1 . . . . 20 R CG . 19110 1
195 . 1 1 20 20 ARG CD C 13 43.346 0.10 1 1 . . . . 20 R CD . 19110 1
196 . 1 1 20 20 ARG N N 15 121.883 0.10 9 1 . . . . 20 R N . 19110 1
197 . 1 1 20 20 ARG NE N 15 84.548 0.10 3 1 . . . . 20 R NE . 19110 1
198 . 1 1 21 21 GLU H H 1 8.546 0.05 10 1 . . . . 21 E H . 19110 1
199 . 1 1 21 21 GLU HA H 1 4.029 0.05 4 1 . . . . 21 E HA . 19110 1
200 . 1 1 21 21 GLU HB3 H 1 1.961 0.05 3 2 . . . . 21 E HB3 . 19110 1
201 . 1 1 21 21 GLU HG2 H 1 2.262 0.05 1 2 . . . . 21 E HG2 . 19110 1
202 . 1 1 21 21 GLU C C 13 178.211 0.10 2 1 . . . . 21 E C . 19110 1
203 . 1 1 21 21 GLU CA C 13 59.632 0.10 4 1 . . . . 21 E CA . 19110 1
204 . 1 1 21 21 GLU CB C 13 29.852 0.10 2 1 . . . . 21 E CB . 19110 1
205 . 1 1 21 21 GLU CG C 13 36.410 0.10 1 1 . . . . 21 E CG . 19110 1
206 . 1 1 21 21 GLU N N 15 120.757 0.10 11 1 . . . . 21 E N . 19110 1
207 . 1 1 22 22 GLU H H 1 8.752 0.05 5 1 . . . . 22 E H . 19110 1
208 . 1 1 22 22 GLU HA H 1 4.345 0.05 1 1 . . . . 22 E HA . 19110 1
209 . 1 1 22 22 GLU HB2 H 1 1.848 0.05 1 2 . . . . 22 E HB2 . 19110 1
210 . 1 1 22 22 GLU C C 13 176.715 0.10 2 1 . . . . 22 E C . 19110 1
211 . 1 1 22 22 GLU CA C 13 57.391 0.10 3 1 . . . . 22 E CA . 19110 1
212 . 1 1 22 22 GLU CB C 13 29.840 0.10 1 1 . . . . 22 E CB . 19110 1
213 . 1 1 22 22 GLU CG C 13 36.807 0.10 1 1 . . . . 22 E CG . 19110 1
214 . 1 1 22 22 GLU N N 15 115.228 0.10 6 1 . . . . 22 E N . 19110 1
215 . 1 1 23 23 ASP H H 1 8.019 0.05 6 1 . . . . 23 D H . 19110 1
216 . 1 1 23 23 ASP HA H 1 5.420 0.05 4 1 . . . . 23 D HA . 19110 1
217 . 1 1 23 23 ASP HB2 H 1 3.065 0.05 2 2 . . . . 23 D HB2 . 19110 1
218 . 1 1 23 23 ASP HB3 H 1 2.878 0.05 1 2 . . . . 23 D HB3 . 19110 1
219 . 1 1 23 23 ASP C C 13 175.439 0.10 2 1 . . . . 23 D C . 19110 1
220 . 1 1 23 23 ASP CA C 13 53.637 0.10 3 1 . . . . 23 D CA . 19110 1
221 . 1 1 23 23 ASP CB C 13 42.730 0.10 2 1 . . . . 23 D CB . 19110 1
222 . 1 1 23 23 ASP N N 15 119.780 0.10 7 1 . . . . 23 D N . 19110 1
223 . 1 1 24 24 ILE H H 1 8.137 0.05 6 1 . . . . 24 I H . 19110 1
224 . 1 1 24 24 ILE HA H 1 4.638 0.05 3 1 . . . . 24 I HA . 19110 1
225 . 1 1 24 24 ILE HB H 1 1.887 0.05 1 1 . . . . 24 I HB . 19110 1
226 . 1 1 24 24 ILE HG12 H 1 0.706 0.05 1 1 . . . . 24 I HG12 . 19110 1
227 . 1 1 24 24 ILE HG13 H 1 0.706 0.05 1 1 . . . . 24 I HG13 . 19110 1
228 . 1 1 24 24 ILE HD11 H 1 0.601 0.05 1 1 . . . . 24 I HD11 . 19110 1
229 . 1 1 24 24 ILE HD12 H 1 0.601 0.05 1 1 . . . . 24 I HD12 . 19110 1
230 . 1 1 24 24 ILE HD13 H 1 0.601 0.05 1 1 . . . . 24 I HD13 . 19110 1
231 . 1 1 24 24 ILE C C 13 173.898 0.10 2 1 . . . . 24 I C . 19110 1
232 . 1 1 24 24 ILE CA C 13 59.432 0.10 4 1 . . . . 24 I CA . 19110 1
233 . 1 1 24 24 ILE CB C 13 41.452 0.10 2 1 . . . . 24 I CB . 19110 1
234 . 1 1 24 24 ILE CG1 C 13 24.746 0.10 1 1 . . . . 24 I CG1 . 19110 1
235 . 1 1 24 24 ILE CG2 C 13 19.364 0.10 4 1 . . . . 24 I CG2 . 19110 1
236 . 1 1 24 24 ILE CD1 C 13 15.059 0.10 4 1 . . . . 24 I CD1 . 19110 1
237 . 1 1 24 24 ILE N N 15 111.283 0.10 7 1 . . . . 24 I N . 19110 1
238 . 1 1 25 25 ASP H H 1 7.956 0.05 7 1 . . . . 25 D H . 19110 1
239 . 1 1 25 25 ASP HA H 1 4.748 0.05 2 1 . . . . 25 D HA . 19110 1
240 . 1 1 25 25 ASP HB2 H 1 2.357 0.05 2 2 . . . . 25 D HB2 . 19110 1
241 . 1 1 25 25 ASP HB3 H 1 2.255 0.05 1 2 . . . . 25 D HB3 . 19110 1
242 . 1 1 25 25 ASP C C 13 177.615 0.10 2 1 . . . . 25 D C . 19110 1
243 . 1 1 25 25 ASP CA C 13 54.394 0.10 3 1 . . . . 25 D CA . 19110 1
244 . 1 1 25 25 ASP CB C 13 42.161 0.10 2 1 . . . . 25 D CB . 19110 1
245 . 1 1 25 25 ASP N N 15 115.731 0.10 8 1 . . . . 25 D N . 19110 1
246 . 1 1 26 26 LEU H H 1 9.113 0.05 7 1 . . . . 26 L H . 19110 1
247 . 1 1 26 26 LEU HA H 1 4.569 0.05 5 1 . . . . 26 L HA . 19110 1
248 . 1 1 26 26 LEU HB2 H 1 2.006 0.05 4 2 . . . . 26 L HB2 . 19110 1
249 . 1 1 26 26 LEU HB3 H 1 1.155 0.05 5 2 . . . . 26 L HB3 . 19110 1
250 . 1 1 26 26 LEU HD11 H 1 0.552 0.05 4 2 . . . . 26 L HD11 . 19110 1
251 . 1 1 26 26 LEU HD12 H 1 0.552 0.05 4 2 . . . . 26 L HD12 . 19110 1
252 . 1 1 26 26 LEU HD13 H 1 0.552 0.05 4 2 . . . . 26 L HD13 . 19110 1
253 . 1 1 26 26 LEU HD21 H 1 0.721 0.05 3 2 . . . . 26 L HD21 . 19110 1
254 . 1 1 26 26 LEU HD22 H 1 0.721 0.05 3 2 . . . . 26 L HD22 . 19110 1
255 . 1 1 26 26 LEU HD23 H 1 0.721 0.05 3 2 . . . . 26 L HD23 . 19110 1
256 . 1 1 26 26 LEU C C 13 175.872 0.10 2 1 . . . . 26 L C . 19110 1
257 . 1 1 26 26 LEU CA C 13 53.274 0.10 4 1 . . . . 26 L CA . 19110 1
258 . 1 1 26 26 LEU CB C 13 45.273 0.10 7 1 . . . . 26 L CB . 19110 1
259 . 1 1 26 26 LEU CD1 C 13 24.245 0.10 3 2 . . . . 26 L CD1 . 19110 1
260 . 1 1 26 26 LEU CD2 C 13 25.433 0.10 1 2 . . . . 26 L CD2 . 19110 1
261 . 1 1 26 26 LEU N N 15 116.084 0.10 8 1 . . . . 26 L N . 19110 1
262 . 1 1 27 27 HIS H H 1 8.111 0.05 3 1 . . . . 27 H H . 19110 1
263 . 1 1 27 27 HIS HA H 1 5.204 0.05 1 1 . . . . 27 H HA . 19110 1
264 . 1 1 27 27 HIS HB2 H 1 3.231 0.05 1 2 . . . . 27 H HB2 . 19110 1
265 . 1 1 27 27 HIS HB3 H 1 3.085 0.05 2 2 . . . . 27 H HB3 . 19110 1
266 . 1 1 27 27 HIS HD2 H 1 7.273 0.05 1 1 . . . . 27 H HD2 . 19110 1
267 . 1 1 27 27 HIS C C 13 173.550 0.10 1 1 . . . . 27 H C . 19110 1
268 . 1 1 27 27 HIS CB C 13 29.083 0.10 2 1 . . . . 27 H CB . 19110 1
269 . 1 1 27 27 HIS N N 15 121.500 0.10 3 1 . . . . 27 H N . 19110 1
270 . 1 1 28 28 LEU H H 1 8.493 0.05 6 1 . . . . 28 L H . 19110 1
271 . 1 1 28 28 LEU HA H 1 3.331 0.05 3 1 . . . . 28 L HA . 19110 1
272 . 1 1 28 28 LEU HB2 H 1 1.543 0.05 3 2 . . . . 28 L HB2 . 19110 1
273 . 1 1 28 28 LEU HB3 H 1 1.358 0.05 4 2 . . . . 28 L HB3 . 19110 1
274 . 1 1 28 28 LEU HG H 1 1.679 0.05 1 1 . . . . 28 L HG . 19110 1
275 . 1 1 28 28 LEU HD11 H 1 1.405 0.05 1 2 . . . . 28 L HD11 . 19110 1
276 . 1 1 28 28 LEU HD12 H 1 1.405 0.05 1 2 . . . . 28 L HD12 . 19110 1
277 . 1 1 28 28 LEU HD13 H 1 1.405 0.05 1 2 . . . . 28 L HD13 . 19110 1
278 . 1 1 28 28 LEU HD21 H 1 1.329 0.05 1 2 . . . . 28 L HD21 . 19110 1
279 . 1 1 28 28 LEU HD22 H 1 1.329 0.05 1 2 . . . . 28 L HD22 . 19110 1
280 . 1 1 28 28 LEU HD23 H 1 1.329 0.05 1 2 . . . . 28 L HD23 . 19110 1
281 . 1 1 28 28 LEU C C 13 177.873 0.10 2 1 . . . . 28 L C . 19110 1
282 . 1 1 28 28 LEU CA C 13 57.984 0.10 4 1 . . . . 28 L CA . 19110 1
283 . 1 1 28 28 LEU CB C 13 42.182 0.10 5 1 . . . . 28 L CB . 19110 1
284 . 1 1 28 28 LEU CG C 13 29.028 0.10 2 1 . . . . 28 L CG . 19110 1
285 . 1 1 28 28 LEU CD1 C 13 26.041 0.10 2 2 . . . . 28 L CD1 . 19110 1
286 . 1 1 28 28 LEU CD2 C 13 24.883 0.10 2 2 . . . . 28 L CD2 . 19110 1
287 . 1 1 28 28 LEU N N 15 124.348 0.10 7 1 . . . . 28 L N . 19110 1
288 . 1 1 29 29 GLY H H 1 8.949 0.05 5 1 . . . . 29 G H . 19110 1
289 . 1 1 29 29 GLY HA2 H 1 4.386 0.05 2 2 . . . . 29 G HA2 . 19110 1
290 . 1 1 29 29 GLY HA3 H 1 3.421 0.05 1 2 . . . . 29 G HA3 . 19110 1
291 . 1 1 29 29 GLY C C 13 174.284 0.10 2 1 . . . . 29 G C . 19110 1
292 . 1 1 29 29 GLY CA C 13 45.304 0.10 3 1 . . . . 29 G CA . 19110 1
293 . 1 1 29 29 GLY N N 15 115.851 0.10 6 1 . . . . 29 G N . 19110 1
294 . 1 1 30 30 ASP H H 1 8.756 0.05 5 1 . . . . 30 D H . 19110 1
295 . 1 1 30 30 ASP HA H 1 4.596 0.05 2 1 . . . . 30 D HA . 19110 1
296 . 1 1 30 30 ASP HB2 H 1 2.894 0.05 2 2 . . . . 30 D HB2 . 19110 1
297 . 1 1 30 30 ASP HB3 H 1 2.534 0.05 2 2 . . . . 30 D HB3 . 19110 1
298 . 1 1 30 30 ASP C C 13 174.428 0.10 2 1 . . . . 30 D C . 19110 1
299 . 1 1 30 30 ASP CA C 13 55.313 0.10 3 1 . . . . 30 D CA . 19110 1
300 . 1 1 30 30 ASP CB C 13 41.418 0.10 2 1 . . . . 30 D CB . 19110 1
301 . 1 1 30 30 ASP N N 15 123.446 0.10 6 1 . . . . 30 D N . 19110 1
302 . 1 1 31 31 ILE H H 1 7.982 0.05 10 1 . . . . 31 I H . 19110 1
303 . 1 1 31 31 ILE HA H 1 4.926 0.05 3 1 . . . . 31 I HA . 19110 1
304 . 1 1 31 31 ILE HB H 1 1.740 0.05 3 1 . . . . 31 I HB . 19110 1
305 . 1 1 31 31 ILE HG12 H 1 0.768 0.05 1 2 . . . . 31 I HG12 . 19110 1
306 . 1 1 31 31 ILE HG13 H 1 0.758 0.05 1 1 . . . . 31 I HG13 . 19110 1
307 . 1 1 31 31 ILE HD11 H 1 0.667 0.05 1 1 . . . . 31 I HD11 . 19110 1
308 . 1 1 31 31 ILE HD12 H 1 0.667 0.05 1 1 . . . . 31 I HD12 . 19110 1
309 . 1 1 31 31 ILE HD13 H 1 0.667 0.05 1 1 . . . . 31 I HD13 . 19110 1
310 . 1 1 31 31 ILE C C 13 174.747 0.10 2 1 . . . . 31 I C . 19110 1
311 . 1 1 31 31 ILE CA C 13 58.195 0.10 4 1 . . . . 31 I CA . 19110 1
312 . 1 1 31 31 ILE CB C 13 38.743 0.10 2 1 . . . . 31 I CB . 19110 1
313 . 1 1 31 31 ILE CG1 C 13 26.553 0.10 1 1 . . . . 31 I CG1 . 19110 1
314 . 1 1 31 31 ILE CG2 C 13 17.367 0.10 4 1 . . . . 31 I CG2 . 19110 1
315 . 1 1 31 31 ILE CD1 C 13 10.201 0.10 2 1 . . . . 31 I CD1 . 19110 1
316 . 1 1 31 31 ILE N N 15 120.464 0.10 11 1 . . . . 31 I N . 19110 1
317 . 1 1 32 32 LEU H H 1 9.310 0.05 8 1 . . . . 32 L H . 19110 1
318 . 1 1 32 32 LEU HA H 1 5.543 0.05 6 1 . . . . 32 L HA . 19110 1
319 . 1 1 32 32 LEU HB2 H 1 1.334 0.05 3 2 . . . . 32 L HB2 . 19110 1
320 . 1 1 32 32 LEU HB3 H 1 1.215 0.05 5 2 . . . . 32 L HB3 . 19110 1
321 . 1 1 32 32 LEU HG H 1 0.867 0.05 2 1 . . . . 32 L HG . 19110 1
322 . 1 1 32 32 LEU HD11 H 1 0.290 0.05 4 2 . . . . 32 L HD11 . 19110 1
323 . 1 1 32 32 LEU HD12 H 1 0.290 0.05 4 2 . . . . 32 L HD12 . 19110 1
324 . 1 1 32 32 LEU HD13 H 1 0.290 0.05 4 2 . . . . 32 L HD13 . 19110 1
325 . 1 1 32 32 LEU HD21 H 1 0.024 0.05 3 2 . . . . 32 L HD21 . 19110 1
326 . 1 1 32 32 LEU HD22 H 1 0.024 0.05 3 2 . . . . 32 L HD22 . 19110 1
327 . 1 1 32 32 LEU HD23 H 1 0.024 0.05 3 2 . . . . 32 L HD23 . 19110 1
328 . 1 1 32 32 LEU C C 13 176.466 0.10 2 1 . . . . 32 L C . 19110 1
329 . 1 1 32 32 LEU CA C 13 53.378 0.10 5 1 . . . . 32 L CA . 19110 1
330 . 1 1 32 32 LEU CB C 13 45.157 0.10 2 1 . . . . 32 L CB . 19110 1
331 . 1 1 32 32 LEU CG C 13 26.576 0.10 2 1 . . . . 32 L CG . 19110 1
332 . 1 1 32 32 LEU CD1 C 13 25.149 0.10 3 2 . . . . 32 L CD1 . 19110 1
333 . 1 1 32 32 LEU CD2 C 13 25.721 0.10 2 2 . . . . 32 L CD2 . 19110 1
334 . 1 1 32 32 LEU N N 15 125.811 0.10 9 1 . . . . 32 L N . 19110 1
335 . 1 1 33 33 THR H H 1 9.583 0.05 10 1 . . . . 33 T H . 19110 1
336 . 1 1 33 33 THR HA H 1 5.341 0.05 4 1 . . . . 33 T HA . 19110 1
337 . 1 1 33 33 THR HB H 1 4.124 0.05 2 1 . . . . 33 T HB . 19110 1
338 . 1 1 33 33 THR HG21 H 1 1.144 0.05 2 1 . . . . 33 T HG21 . 19110 1
339 . 1 1 33 33 THR HG22 H 1 1.144 0.05 2 1 . . . . 33 T HG22 . 19110 1
340 . 1 1 33 33 THR HG23 H 1 1.144 0.05 2 1 . . . . 33 T HG23 . 19110 1
341 . 1 1 33 33 THR C C 13 174.983 0.10 2 1 . . . . 33 T C . 19110 1
342 . 1 1 33 33 THR CA C 13 62.083 0.10 4 1 . . . . 33 T CA . 19110 1
343 . 1 1 33 33 THR CB C 13 70.604 0.10 2 1 . . . . 33 T CB . 19110 1
344 . 1 1 33 33 THR CG2 C 13 23.984 0.10 2 1 . . . . 33 T CG2 . 19110 1
345 . 1 1 33 33 THR N N 15 117.710 0.10 11 1 . . . . 33 T N . 19110 1
346 . 1 1 34 34 VAL H H 1 9.985 0.05 7 1 . . . . 34 V H . 19110 1
347 . 1 1 34 34 VAL HA H 1 4.626 0.05 2 1 . . . . 34 V HA . 19110 1
348 . 1 1 34 34 VAL HB H 1 2.431 0.05 2 1 . . . . 34 V HB . 19110 1
349 . 1 1 34 34 VAL HG11 H 1 1.227 0.05 3 2 . . . . 34 V HG11 . 19110 1
350 . 1 1 34 34 VAL HG12 H 1 1.227 0.05 3 2 . . . . 34 V HG12 . 19110 1
351 . 1 1 34 34 VAL HG13 H 1 1.227 0.05 3 2 . . . . 34 V HG13 . 19110 1
352 . 1 1 34 34 VAL HG21 H 1 1.265 0.05 2 2 . . . . 34 V HG21 . 19110 1
353 . 1 1 34 34 VAL HG22 H 1 1.265 0.05 2 2 . . . . 34 V HG22 . 19110 1
354 . 1 1 34 34 VAL HG23 H 1 1.265 0.05 2 2 . . . . 34 V HG23 . 19110 1
355 . 1 1 34 34 VAL C C 13 174.863 0.10 1 1 . . . . 34 V C . 19110 1
356 . 1 1 34 34 VAL CA C 13 60.931 0.10 3 1 . . . . 34 V CA . 19110 1
357 . 1 1 34 34 VAL CB C 13 36.135 0.10 3 1 . . . . 34 V CB . 19110 1
358 . 1 1 34 34 VAL CG1 C 13 22.326 0.10 3 2 . . . . 34 V CG1 . 19110 1
359 . 1 1 34 34 VAL CG2 C 13 20.308 0.10 5 2 . . . . 34 V CG2 . 19110 1
360 . 1 1 34 34 VAL N N 15 131.134 0.10 8 1 . . . . 34 V N . 19110 1
361 . 1 1 35 35 ASN H H 1 9.453 0.05 9 1 . . . . 35 N H . 19110 1
362 . 1 1 35 35 ASN HA H 1 4.795 0.05 3 1 . . . . 35 N HA . 19110 1
363 . 1 1 35 35 ASN HB2 H 1 2.931 0.05 3 2 . . . . 35 N HB2 . 19110 1
364 . 1 1 35 35 ASN HD21 H 1 7.742 0.05 1 2 . . . . 35 N HD21 . 19110 1
365 . 1 1 35 35 ASN HD22 H 1 7.091 0.05 1 2 . . . . 35 N HD22 . 19110 1
366 . 1 1 35 35 ASN C C 13 176.605 0.10 2 1 . . . . 35 N C . 19110 1
367 . 1 1 35 35 ASN CA C 13 54.069 0.10 4 1 . . . . 35 N CA . 19110 1
368 . 1 1 35 35 ASN CB C 13 39.249 0.10 2 1 . . . . 35 N CB . 19110 1
369 . 1 1 35 35 ASN N N 15 126.854 0.10 10 1 . . . . 35 N N . 19110 1
370 . 1 1 35 35 ASN ND2 N 15 113.458 0.10 2 1 . . . . 35 N ND2 . 19110 1
371 . 1 1 36 36 LYS H H 1 8.994 0.05 5 1 . . . . 36 K H . 19110 1
372 . 1 1 36 36 LYS HA H 1 4.011 0.05 2 1 . . . . 36 K HA . 19110 1
373 . 1 1 36 36 LYS HB2 H 1 1.736 0.05 2 2 . . . . 36 K HB2 . 19110 1
374 . 1 1 36 36 LYS HB3 H 1 1.520 0.05 2 2 . . . . 36 K HB3 . 19110 1
375 . 1 1 36 36 LYS C C 13 178.183 0.10 2 1 . . . . 36 K C . 19110 1
376 . 1 1 36 36 LYS CA C 13 60.274 0.10 4 1 . . . . 36 K CA . 19110 1
377 . 1 1 36 36 LYS CB C 13 32.987 0.10 2 1 . . . . 36 K CB . 19110 1
378 . 1 1 36 36 LYS CG C 13 25.213 0.10 1 1 . . . . 36 K CG . 19110 1
379 . 1 1 36 36 LYS N N 15 127.078 0.10 6 1 . . . . 36 K N . 19110 1
380 . 1 1 37 37 GLY H H 1 8.963 0.05 5 1 . . . . 37 G H . 19110 1
381 . 1 1 37 37 GLY HA2 H 1 4.101 0.05 1 2 . . . . 37 G HA2 . 19110 1
382 . 1 1 37 37 GLY HA3 H 1 3.894 0.05 2 2 . . . . 37 G HA3 . 19110 1
383 . 1 1 37 37 GLY C C 13 176.550 0.10 2 1 . . . . 37 G C . 19110 1
384 . 1 1 37 37 GLY CA C 13 46.972 0.10 3 1 . . . . 37 G CA . 19110 1
385 . 1 1 37 37 GLY N N 15 104.943 0.10 6 1 . . . . 37 G N . 19110 1
386 . 1 1 38 38 SER H H 1 7.813 0.05 7 1 . . . . 38 S H . 19110 1
387 . 1 1 38 38 SER HA H 1 4.341 0.05 4 1 . . . . 38 S HA . 19110 1
388 . 1 1 38 38 SER HB2 H 1 4.117 0.05 1 2 . . . . 38 S HB2 . 19110 1
389 . 1 1 38 38 SER CA C 13 61.227 0.10 3 1 . . . . 38 S CA . 19110 1
390 . 1 1 38 38 SER CB C 13 62.996 0.10 2 1 . . . . 38 S CB . 19110 1
391 . 1 1 38 38 SER N N 15 117.029 0.10 7 1 . . . . 38 S N . 19110 1
392 . 1 1 39 39 LEU H H 1 7.361 0.05 8 1 . . . . 39 L H . 19110 1
393 . 1 1 39 39 LEU HA H 1 4.287 0.05 8 1 . . . . 39 L HA . 19110 1
394 . 1 1 39 39 LEU HB2 H 1 1.939 0.05 4 2 . . . . 39 L HB2 . 19110 1
395 . 1 1 39 39 LEU HB3 H 1 1.471 0.05 5 2 . . . . 39 L HB3 . 19110 1
396 . 1 1 39 39 LEU HG H 1 1.197 0.05 2 1 . . . . 39 L HG . 19110 1
397 . 1 1 39 39 LEU HD11 H 1 0.714 0.05 1 2 . . . . 39 L HD11 . 19110 1
398 . 1 1 39 39 LEU HD12 H 1 0.714 0.05 1 2 . . . . 39 L HD12 . 19110 1
399 . 1 1 39 39 LEU HD13 H 1 0.714 0.05 1 2 . . . . 39 L HD13 . 19110 1
400 . 1 1 39 39 LEU HD21 H 1 0.702 0.05 3 2 . . . . 39 L HD21 . 19110 1
401 . 1 1 39 39 LEU HD22 H 1 0.702 0.05 3 2 . . . . 39 L HD22 . 19110 1
402 . 1 1 39 39 LEU HD23 H 1 0.702 0.05 3 2 . . . . 39 L HD23 . 19110 1
403 . 1 1 39 39 LEU C C 13 179.492 0.10 2 1 . . . . 39 L C . 19110 1
404 . 1 1 39 39 LEU CA C 13 57.617 0.10 3 1 . . . . 39 L CA . 19110 1
405 . 1 1 39 39 LEU CB C 13 41.121 0.10 5 1 . . . . 39 L CB . 19110 1
406 . 1 1 39 39 LEU CG C 13 27.411 0.10 2 1 . . . . 39 L CG . 19110 1
407 . 1 1 39 39 LEU CD1 C 13 25.560 0.10 2 2 . . . . 39 L CD1 . 19110 1
408 . 1 1 39 39 LEU CD2 C 13 23.449 0.10 3 2 . . . . 39 L CD2 . 19110 1
409 . 1 1 39 39 LEU N N 15 121.587 0.10 9 1 . . . . 39 L N . 19110 1
410 . 1 1 40 40 VAL H H 1 8.190 0.05 6 1 . . . . 40 V H . 19110 1
411 . 1 1 40 40 VAL HA H 1 3.838 0.05 3 1 . . . . 40 V HA . 19110 1
412 . 1 1 40 40 VAL HB H 1 2.076 0.05 2 1 . . . . 40 V HB . 19110 1
413 . 1 1 40 40 VAL HG11 H 1 1.116 0.05 2 2 . . . . 40 V HG11 . 19110 1
414 . 1 1 40 40 VAL HG12 H 1 1.116 0.05 2 2 . . . . 40 V HG12 . 19110 1
415 . 1 1 40 40 VAL HG13 H 1 1.116 0.05 2 2 . . . . 40 V HG13 . 19110 1
416 . 1 1 40 40 VAL HG21 H 1 0.962 0.05 2 2 . . . . 40 V HG21 . 19110 1
417 . 1 1 40 40 VAL HG22 H 1 0.962 0.05 2 2 . . . . 40 V HG22 . 19110 1
418 . 1 1 40 40 VAL HG23 H 1 0.962 0.05 2 2 . . . . 40 V HG23 . 19110 1
419 . 1 1 40 40 VAL C C 13 180.202 0.10 1 1 . . . . 40 V C . 19110 1
420 . 1 1 40 40 VAL CA C 13 65.974 0.10 5 1 . . . . 40 V CA . 19110 1
421 . 1 1 40 40 VAL CB C 13 32.131 0.10 3 1 . . . . 40 V CB . 19110 1
422 . 1 1 40 40 VAL CG1 C 13 22.624 0.10 5 2 . . . . 40 V CG1 . 19110 1
423 . 1 1 40 40 VAL CG2 C 13 21.070 0.10 5 2 . . . . 40 V CG2 . 19110 1
424 . 1 1 40 40 VAL N N 15 120.614 0.10 7 1 . . . . 40 V N . 19110 1
425 . 1 1 41 41 ALA H H 1 7.861 0.05 9 1 . . . . 41 A H . 19110 1
426 . 1 1 41 41 ALA HA H 1 4.098 0.05 3 1 . . . . 41 A HA . 19110 1
427 . 1 1 41 41 ALA HB1 H 1 1.467 0.05 4 1 . . . . 41 A HB1 . 19110 1
428 . 1 1 41 41 ALA HB2 H 1 1.467 0.05 4 1 . . . . 41 A HB2 . 19110 1
429 . 1 1 41 41 ALA HB3 H 1 1.467 0.05 4 1 . . . . 41 A HB3 . 19110 1
430 . 1 1 41 41 ALA C C 13 178.881 0.10 2 1 . . . . 41 A C . 19110 1
431 . 1 1 41 41 ALA CA C 13 54.561 0.10 4 1 . . . . 41 A CA . 19110 1
432 . 1 1 41 41 ALA CB C 13 18.281 0.10 3 1 . . . . 41 A CB . 19110 1
433 . 1 1 41 41 ALA N N 15 122.367 0.10 9 1 . . . . 41 A N . 19110 1
434 . 1 1 42 42 LEU H H 1 7.229 0.05 10 1 . . . . 42 L H . 19110 1
435 . 1 1 42 42 LEU HA H 1 4.273 0.05 5 1 . . . . 42 L HA . 19110 1
436 . 1 1 42 42 LEU HB2 H 1 1.864 0.05 4 2 . . . . 42 L HB2 . 19110 1
437 . 1 1 42 42 LEU HB3 H 1 1.641 0.05 5 2 . . . . 42 L HB3 . 19110 1
438 . 1 1 42 42 LEU HD11 H 1 0.983 0.05 1 2 . . . . 42 L HD11 . 19110 1
439 . 1 1 42 42 LEU HD12 H 1 0.983 0.05 1 2 . . . . 42 L HD12 . 19110 1
440 . 1 1 42 42 LEU HD13 H 1 0.983 0.05 1 2 . . . . 42 L HD13 . 19110 1
441 . 1 1 42 42 LEU HD21 H 1 0.891 0.05 1 2 . . . . 42 L HD21 . 19110 1
442 . 1 1 42 42 LEU HD22 H 1 0.891 0.05 1 2 . . . . 42 L HD22 . 19110 1
443 . 1 1 42 42 LEU HD23 H 1 0.891 0.05 1 2 . . . . 42 L HD23 . 19110 1
444 . 1 1 42 42 LEU C C 13 177.128 0.10 2 1 . . . . 42 L C . 19110 1
445 . 1 1 42 42 LEU CA C 13 55.018 0.10 5 1 . . . . 42 L CA . 19110 1
446 . 1 1 42 42 LEU CB C 13 42.928 0.10 4 1 . . . . 42 L CB . 19110 1
447 . 1 1 42 42 LEU CG C 13 26.702 0.10 1 1 . . . . 42 L CG . 19110 1
448 . 1 1 42 42 LEU CD1 C 13 25.600 0.10 2 2 . . . . 42 L CD1 . 19110 1
449 . 1 1 42 42 LEU CD2 C 13 22.436 0.10 2 2 . . . . 42 L CD2 . 19110 1
450 . 1 1 42 42 LEU N N 15 116.532 0.10 11 1 . . . . 42 L N . 19110 1
451 . 1 1 43 43 GLY H H 1 7.865 0.05 8 1 . . . . 43 G H . 19110 1
452 . 1 1 43 43 GLY HA2 H 1 3.984 0.05 2 2 . . . . 43 G HA2 . 19110 1
453 . 1 1 43 43 GLY HA3 H 1 3.716 0.05 2 2 . . . . 43 G HA3 . 19110 1
454 . 1 1 43 43 GLY C C 13 174.435 0.10 2 1 . . . . 43 G C . 19110 1
455 . 1 1 43 43 GLY CA C 13 45.429 0.10 3 1 . . . . 43 G CA . 19110 1
456 . 1 1 43 43 GLY N N 15 111.201 0.10 9 1 . . . . 43 G N . 19110 1
457 . 1 1 44 44 PHE H H 1 7.635 0.05 8 1 . . . . 44 F H . 19110 1
458 . 1 1 44 44 PHE HA H 1 4.166 0.05 3 1 . . . . 44 F HA . 19110 1
459 . 1 1 44 44 PHE HB2 H 1 2.170 0.05 1 2 . . . . 44 F HB2 . 19110 1
460 . 1 1 44 44 PHE HB3 H 1 1.879 0.05 2 2 . . . . 44 F HB3 . 19110 1
461 . 1 1 44 44 PHE HD2 H 1 7.072 0.05 2 3 . . . . 44 F HD2 . 19110 1
462 . 1 1 44 44 PHE HE2 H 1 7.201 0.05 2 3 . . . . 44 F HE2 . 19110 1
463 . 1 1 44 44 PHE C C 13 175.275 0.10 2 1 . . . . 44 F C . 19110 1
464 . 1 1 44 44 PHE CA C 13 57.642 0.10 3 1 . . . . 44 F CA . 19110 1
465 . 1 1 44 44 PHE CB C 13 39.444 0.10 4 1 . . . . 44 F CB . 19110 1
466 . 1 1 44 44 PHE CD2 C 13 131.307 0.10 1 3 . . . . 44 F CD2 . 19110 1
467 . 1 1 44 44 PHE CE2 C 13 131.616 0.10 1 3 . . . . 44 F CE2 . 19110 1
468 . 1 1 44 44 PHE N N 15 119.588 0.10 9 1 . . . . 44 F N . 19110 1
469 . 1 1 45 45 SER H H 1 8.586 0.05 5 1 . . . . 45 S H . 19110 1
470 . 1 1 45 45 SER HA H 1 4.588 0.05 2 1 . . . . 45 S HA . 19110 1
471 . 1 1 45 45 SER HB2 H 1 3.805 0.05 3 2 . . . . 45 S HB2 . 19110 1
472 . 1 1 45 45 SER HB3 H 1 3.805 0.05 3 2 . . . . 45 S HB3 . 19110 1
473 . 1 1 45 45 SER C C 13 174.233 0.10 2 1 . . . . 45 S C . 19110 1
474 . 1 1 45 45 SER CA C 13 57.479 0.10 4 1 . . . . 45 S CA . 19110 1
475 . 1 1 45 45 SER CB C 13 65.083 0.10 2 1 . . . . 45 S CB . 19110 1
476 . 1 1 45 45 SER N N 15 117.375 0.10 6 1 . . . . 45 S N . 19110 1
477 . 1 1 46 46 ASP H H 1 8.531 0.05 6 1 . . . . 46 D H . 19110 1
478 . 1 1 46 46 ASP HA H 1 4.396 0.05 2 1 . . . . 46 D HA . 19110 1
479 . 1 1 46 46 ASP HB2 H 1 2.667 0.05 2 2 . . . . 46 D HB2 . 19110 1
480 . 1 1 46 46 ASP HB3 H 1 2.516 0.05 3 2 . . . . 46 D HB3 . 19110 1
481 . 1 1 46 46 ASP C C 13 176.399 0.10 2 1 . . . . 46 D C . 19110 1
482 . 1 1 46 46 ASP CA C 13 56.505 0.10 3 1 . . . . 46 D CA . 19110 1
483 . 1 1 46 46 ASP CB C 13 40.823 0.10 2 1 . . . . 46 D CB . 19110 1
484 . 1 1 46 46 ASP N N 15 122.347 0.10 7 1 . . . . 46 D N . 19110 1
485 . 1 1 47 47 GLY H H 1 9.261 0.05 5 1 . . . . 47 G H . 19110 1
486 . 1 1 47 47 GLY HA2 H 1 4.266 0.05 1 2 . . . . 47 G HA2 . 19110 1
487 . 1 1 47 47 GLY HA3 H 1 3.527 0.05 1 2 . . . . 47 G HA3 . 19110 1
488 . 1 1 47 47 GLY CA C 13 45.481 0.10 2 1 . . . . 47 G CA . 19110 1
489 . 1 1 47 47 GLY N N 15 115.587 0.10 5 1 . . . . 47 G N . 19110 1
490 . 1 1 48 48 GLN H H 1 8.148 0.05 9 1 . . . . 48 Q H . 19110 1
491 . 1 1 48 48 GLN HA H 1 3.747 0.05 4 1 . . . . 48 Q HA . 19110 1
492 . 1 1 48 48 GLN HB2 H 1 2.080 0.05 3 2 . . . . 48 Q HB2 . 19110 1
493 . 1 1 48 48 GLN HB3 H 1 1.842 0.05 3 2 . . . . 48 Q HB3 . 19110 1
494 . 1 1 48 48 GLN HE21 H 1 7.308 0.05 1 2 . . . . 48 Q HE21 . 19110 1
495 . 1 1 48 48 GLN HE22 H 1 7.257 0.05 1 2 . . . . 48 Q HE22 . 19110 1
496 . 1 1 48 48 GLN C C 13 176.715 0.10 2 1 . . . . 48 Q C . 19110 1
497 . 1 1 48 48 GLN CA C 13 58.223 0.10 4 1 . . . . 48 Q CA . 19110 1
498 . 1 1 48 48 GLN CB C 13 29.101 0.10 2 1 . . . . 48 Q CB . 19110 1
499 . 1 1 48 48 GLN CG C 13 35.094 0.10 1 1 . . . . 48 Q CG . 19110 1
500 . 1 1 48 48 GLN N N 15 120.488 0.10 9 1 . . . . 48 Q N . 19110 1
501 . 1 1 48 48 GLN NE2 N 15 113.511 0.10 2 1 . . . . 48 Q NE2 . 19110 1
502 . 1 1 49 49 GLU H H 1 9.622 0.05 6 1 . . . . 49 E H . 19110 1
503 . 1 1 49 49 GLU HA H 1 3.490 0.05 2 1 . . . . 49 E HA . 19110 1
504 . 1 1 49 49 GLU C C 13 175.560 0.10 2 1 . . . . 49 E C . 19110 1
505 . 1 1 49 49 GLU CA C 13 58.022 0.10 2 1 . . . . 49 E CA . 19110 1
506 . 1 1 49 49 GLU CB C 13 26.203 0.10 2 1 . . . . 49 E CB . 19110 1
507 . 1 1 49 49 GLU CG C 13 33.385 0.10 1 1 . . . . 49 E CG . 19110 1
508 . 1 1 49 49 GLU N N 15 118.168 0.10 6 1 . . . . 49 E N . 19110 1
509 . 1 1 50 50 ALA H H 1 6.580 0.05 7 1 . . . . 50 A H . 19110 1
510 . 1 1 50 50 ALA HA H 1 3.714 0.05 4 1 . . . . 50 A HA . 19110 1
511 . 1 1 50 50 ALA HB1 H 1 1.120 0.05 3 1 . . . . 50 A HB1 . 19110 1
512 . 1 1 50 50 ALA HB2 H 1 1.120 0.05 3 1 . . . . 50 A HB2 . 19110 1
513 . 1 1 50 50 ALA HB3 H 1 1.120 0.05 3 1 . . . . 50 A HB3 . 19110 1
514 . 1 1 50 50 ALA C C 13 175.957 0.10 2 1 . . . . 50 A C . 19110 1
515 . 1 1 50 50 ALA CA C 13 51.417 0.10 4 1 . . . . 50 A CA . 19110 1
516 . 1 1 50 50 ALA CB C 13 18.983 0.10 2 1 . . . . 50 A CB . 19110 1
517 . 1 1 50 50 ALA N N 15 120.030 0.10 8 1 . . . . 50 A N . 19110 1
518 . 1 1 51 51 LYS H H 1 7.496 0.05 8 1 . . . . 51 K H . 19110 1
519 . 1 1 51 51 LYS HA H 1 4.928 0.05 3 1 . . . . 51 K HA . 19110 1
520 . 1 1 51 51 LYS HB2 H 1 1.571 0.05 2 2 . . . . 51 K HB2 . 19110 1
521 . 1 1 51 51 LYS HB3 H 1 1.233 0.05 1 2 . . . . 51 K HB3 . 19110 1
522 . 1 1 51 51 LYS C C 13 174.105 0.10 2 1 . . . . 51 K C . 19110 1
523 . 1 1 51 51 LYS CA C 13 53.477 0.10 3 1 . . . . 51 K CA . 19110 1
524 . 1 1 51 51 LYS CB C 13 32.348 0.10 1 1 . . . . 51 K CB . 19110 1
525 . 1 1 51 51 LYS N N 15 118.718 0.10 9 1 . . . . 51 K N . 19110 1
526 . 1 1 52 52 PRO HA H 1 3.981 0.05 3 1 . . . . 52 P HA . 19110 1
527 . 1 1 52 52 PRO HB2 H 1 1.887 0.05 1 2 . . . . 52 P HB2 . 19110 1
528 . 1 1 52 52 PRO HB3 H 1 1.887 0.05 1 2 . . . . 52 P HB3 . 19110 1
529 . 1 1 52 52 PRO HG2 H 1 2.164 0.05 3 2 . . . . 52 P HG2 . 19110 1
530 . 1 1 52 52 PRO HG3 H 1 2.164 0.05 3 2 . . . . 52 P HG3 . 19110 1
531 . 1 1 52 52 PRO HD2 H 1 3.771 0.05 3 2 . . . . 52 P HD2 . 19110 1
532 . 1 1 52 52 PRO HD3 H 1 3.547 0.05 2 2 . . . . 52 P HD3 . 19110 1
533 . 1 1 52 52 PRO CA C 13 64.78 0.10 2 1 . . . . 52 P CA . 19110 1
534 . 1 1 52 52 PRO CB C 13 31.08 0.10 3 1 . . . . 52 P CB . 19110 1
535 . 1 1 52 52 PRO CG C 13 27.81 0.10 4 1 . . . . 52 P CG . 19110 1
536 . 1 1 52 52 PRO CD C 13 50.68 0.10 4 1 . . . . 52 P CD . 19110 1
537 . 1 1 52 52 PRO N N 15 137.854 0.10 1 1 . . . . 52 P N . 19110 1
538 . 1 1 53 53 GLU H H 1 9.993 0.05 7 1 . . . . 53 E H . 19110 1
539 . 1 1 53 53 GLU HA H 1 3.674 0.05 3 1 . . . . 53 E HA . 19110 1
540 . 1 1 53 53 GLU HB2 H 1 2.112 0.05 1 2 . . . . 53 E HB2 . 19110 1
541 . 1 1 53 53 GLU HB3 H 1 1.907 0.05 2 2 . . . . 53 E HB3 . 19110 1
542 . 1 1 53 53 GLU C C 13 177.266 0.10 2 1 . . . . 53 E C . 19110 1
543 . 1 1 53 53 GLU CA C 13 58.609 0.10 4 1 . . . . 53 E CA . 19110 1
544 . 1 1 53 53 GLU CB C 13 27.505 0.10 2 1 . . . . 53 E CB . 19110 1
545 . 1 1 53 53 GLU CG C 13 35.424 0.10 1 1 . . . . 53 E CG . 19110 1
546 . 1 1 53 53 GLU N N 15 119.331 0.10 8 1 . . . . 53 E N . 19110 1
547 . 1 1 54 54 GLU H H 1 7.633 0.05 5 1 . . . . 54 E H . 19110 1
548 . 1 1 54 54 GLU HA H 1 4.173 0.05 3 1 . . . . 54 E HA . 19110 1
549 . 1 1 54 54 GLU HB2 H 1 2.088 0.05 1 2 . . . . 54 E HB2 . 19110 1
550 . 1 1 54 54 GLU HB3 H 1 1.859 0.05 1 2 . . . . 54 E HB3 . 19110 1
551 . 1 1 54 54 GLU C C 13 176.839 0.10 2 1 . . . . 54 E C . 19110 1
552 . 1 1 54 54 GLU CA C 13 56.820 0.10 2 1 . . . . 54 E CA . 19110 1
553 . 1 1 54 54 GLU CB C 13 30.104 0.10 2 1 . . . . 54 E CB . 19110 1
554 . 1 1 54 54 GLU CG C 13 36.959 0.10 1 1 . . . . 54 E CG . 19110 1
555 . 1 1 54 54 GLU N N 15 119.581 0.10 5 1 . . . . 54 E N . 19110 1
556 . 1 1 55 55 ILE H H 1 7.271 0.05 11 1 . . . . 55 I H . 19110 1
557 . 1 1 55 55 ILE HA H 1 3.621 0.05 5 1 . . . . 55 I HA . 19110 1
558 . 1 1 55 55 ILE HB H 1 1.508 0.05 2 1 . . . . 55 I HB . 19110 1
559 . 1 1 55 55 ILE HG12 H 1 1.195 0.05 2 2 . . . . 55 I HG12 . 19110 1
560 . 1 1 55 55 ILE HG13 H 1 0.500 0.05 2 1 . . . . 55 I HG13 . 19110 1
561 . 1 1 55 55 ILE HD11 H 1 0.327 0.05 2 1 . . . . 55 I HD11 . 19110 1
562 . 1 1 55 55 ILE HD12 H 1 0.327 0.05 2 1 . . . . 55 I HD12 . 19110 1
563 . 1 1 55 55 ILE HD13 H 1 0.327 0.05 2 1 . . . . 55 I HD13 . 19110 1
564 . 1 1 55 55 ILE C C 13 176.149 0.10 2 1 . . . . 55 I C . 19110 1
565 . 1 1 55 55 ILE CA C 13 62.808 0.10 6 1 . . . . 55 I CA . 19110 1
566 . 1 1 55 55 ILE CB C 13 38.303 0.10 2 1 . . . . 55 I CB . 19110 1
567 . 1 1 55 55 ILE CG1 C 13 27.024 0.10 4 1 . . . . 55 I CG1 . 19110 1
568 . 1 1 55 55 ILE CG2 C 13 17.058 0.10 2 1 . . . . 55 I CG2 . 19110 1
569 . 1 1 55 55 ILE CD1 C 13 13.214 0.10 3 1 . . . . 55 I CD1 . 19110 1
570 . 1 1 55 55 ILE N N 15 120.571 0.10 12 1 . . . . 55 I N . 19110 1
571 . 1 1 56 56 GLY H H 1 7.653 0.05 7 1 . . . . 56 G H . 19110 1
572 . 1 1 56 56 GLY HA2 H 1 4.197 0.05 2 2 . . . . 56 G HA2 . 19110 1
573 . 1 1 56 56 GLY HA3 H 1 3.243 0.05 3 2 . . . . 56 G HA3 . 19110 1
574 . 1 1 56 56 GLY C C 13 173.684 0.10 2 1 . . . . 56 G C . 19110 1
575 . 1 1 56 56 GLY CA C 13 46.310 0.10 3 1 . . . . 56 G CA . 19110 1
576 . 1 1 56 56 GLY N N 15 108.719 0.10 7 1 . . . . 56 G N . 19110 1
577 . 1 1 57 57 TRP H H 1 8.106 0.05 5 1 . . . . 57 W H . 19110 1
578 . 1 1 57 57 TRP HA H 1 3.341 0.05 3 1 . . . . 57 W HA . 19110 1
579 . 1 1 57 57 TRP HB2 H 1 2.827 0.05 1 2 . . . . 57 W HB2 . 19110 1
580 . 1 1 57 57 TRP HD1 H 1 7.234 0.05 1 1 . . . . 57 W HD1 . 19110 1
581 . 1 1 57 57 TRP HE1 H 1 10.063 0.05 1 1 . . . . 57 W HE1 . 19110 1
582 . 1 1 57 57 TRP HZ2 H 1 7.377 0.05 1 1 . . . . 57 W HZ2 . 19110 1
583 . 1 1 57 57 TRP HZ3 H 1 7.336 0.05 1 1 . . . . 57 W HZ3 . 19110 1
584 . 1 1 57 57 TRP HH2 H 1 7.029 0.05 1 1 . . . . 57 W HH2 . 19110 1
585 . 1 1 57 57 TRP C C 13 174.748 0.10 2 1 . . . . 57 W C . 19110 1
586 . 1 1 57 57 TRP CA C 13 57.972 0.10 3 1 . . . . 57 W CA . 19110 1
587 . 1 1 57 57 TRP CB C 13 30.487 0.10 2 1 . . . . 57 W CB . 19110 1
588 . 1 1 57 57 TRP CD1 C 13 124.724 0.10 1 1 . . . . 57 W CD1 . 19110 1
589 . 1 1 57 57 TRP CZ2 C 13 114.679 0.10 1 1 . . . . 57 W CZ2 . 19110 1
590 . 1 1 57 57 TRP CZ3 C 13 114.576 0.10 1 1 . . . . 57 W CZ3 . 19110 1
591 . 1 1 57 57 TRP CH2 C 13 119.922 0.10 1 1 . . . . 57 W CH2 . 19110 1
592 . 1 1 57 57 TRP N N 15 124.791 0.10 6 1 . . . . 57 W N . 19110 1
593 . 1 1 57 57 TRP NE1 N 15 129.134 0.10 6 1 . . . . 57 W NE1 . 19110 1
594 . 1 1 58 58 LEU H H 1 8.229 0.05 4 1 . . . . 58 L H . 19110 1
595 . 1 1 58 58 LEU HA H 1 4.216 0.05 4 1 . . . . 58 L HA . 19110 1
596 . 1 1 58 58 LEU HB2 H 1 0.622 0.05 2 2 . . . . 58 L HB2 . 19110 1
597 . 1 1 58 58 LEU HG H 1 1.046 0.05 1 1 . . . . 58 L HG . 19110 1
598 . 1 1 58 58 LEU HD11 H 1 0.500 0.05 1 2 . . . . 58 L HD11 . 19110 1
599 . 1 1 58 58 LEU HD12 H 1 0.500 0.05 1 2 . . . . 58 L HD12 . 19110 1
600 . 1 1 58 58 LEU HD13 H 1 0.500 0.05 1 2 . . . . 58 L HD13 . 19110 1
601 . 1 1 58 58 LEU HD21 H 1 0.149 0.05 2 2 . . . . 58 L HD21 . 19110 1
602 . 1 1 58 58 LEU HD22 H 1 0.149 0.05 2 2 . . . . 58 L HD22 . 19110 1
603 . 1 1 58 58 LEU HD23 H 1 0.149 0.05 2 2 . . . . 58 L HD23 . 19110 1
604 . 1 1 58 58 LEU C C 13 173.620 0.10 2 1 . . . . 58 L C . 19110 1
605 . 1 1 58 58 LEU CA C 13 53.625 0.10 4 1 . . . . 58 L CA . 19110 1
606 . 1 1 58 58 LEU CB C 13 45.185 0.10 2 1 . . . . 58 L CB . 19110 1
607 . 1 1 58 58 LEU CG C 13 27.829 0.10 1 1 . . . . 58 L CG . 19110 1
608 . 1 1 58 58 LEU CD1 C 13 25.523 0.10 2 2 . . . . 58 L CD1 . 19110 1
609 . 1 1 58 58 LEU CD2 C 13 25.672 0.10 2 2 . . . . 58 L CD2 . 19110 1
610 . 1 1 59 59 ASN H H 1 7.838 0.05 6 1 . . . . 59 N H . 19110 1
611 . 1 1 59 59 ASN HA H 1 5.321 0.05 3 1 . . . . 59 N HA . 19110 1
612 . 1 1 59 59 ASN HB2 H 1 2.724 0.05 1 2 . . . . 59 N HB2 . 19110 1
613 . 1 1 59 59 ASN HB3 H 1 2.494 0.05 2 2 . . . . 59 N HB3 . 19110 1
614 . 1 1 59 59 ASN HD21 H 1 7.530 0.05 2 2 . . . . 59 N HD21 . 19110 1
615 . 1 1 59 59 ASN HD22 H 1 6.798 0.05 2 2 . . . . 59 N HD22 . 19110 1
616 . 1 1 59 59 ASN C C 13 175.137 0.10 2 1 . . . . 59 N C . 19110 1
617 . 1 1 59 59 ASN CA C 13 53.034 0.10 4 1 . . . . 59 N CA . 19110 1
618 . 1 1 59 59 ASN CB C 13 42.747 0.10 2 1 . . . . 59 N CB . 19110 1
619 . 1 1 59 59 ASN N N 15 117.243 0.10 7 1 . . . . 59 N N . 19110 1
620 . 1 1 59 59 ASN ND2 N 15 112.696 0.10 7 1 . . . . 59 ND2 ND2 . 19110 1
621 . 1 1 60 60 GLY H H 1 8.900 0.05 7 1 . . . . 60 G H . 19110 1
622 . 1 1 60 60 GLY HA2 H 1 4.519 0.05 2 2 . . . . 60 G HA2 . 19110 1
623 . 1 1 60 60 GLY HA3 H 1 4.235 0.05 1 2 . . . . 60 G HA3 . 19110 1
624 . 1 1 60 60 GLY C C 13 169.4 0.10 1 1 . . . . 60 G C . 19110 1
625 . 1 1 60 60 GLY CA C 13 46.775 0.10 2 1 . . . . 60 G CA . 19110 1
626 . 1 1 60 60 GLY N N 15 111.491 0.10 8 1 . . . . 60 G N . 19110 1
627 . 1 1 61 61 TYR H H 1 8.780 0.05 6 1 . . . . 61 Y H . 19110 1
628 . 1 1 61 61 TYR HA H 1 4.772 0.05 4 1 . . . . 61 Y HA . 19110 1
629 . 1 1 61 61 TYR HB2 H 1 2.941 0.05 3 2 . . . . 61 Y HB2 . 19110 1
630 . 1 1 61 61 TYR HD2 H 1 6.800 0.05 2 3 . . . . 61 Y HD2 . 19110 1
631 . 1 1 61 61 TYR HE2 H 1 6.646 0.05 2 3 . . . . 61 Y HE2 . 19110 1
632 . 1 1 61 61 TYR C C 13 173.615 0.10 2 1 . . . . 61 Y C . 19110 1
633 . 1 1 61 61 TYR CA C 13 56.039 0.10 4 1 . . . . 61 Y CA . 19110 1
634 . 1 1 61 61 TYR CB C 13 41.902 0.10 4 1 . . . . 61 Y CB . 19110 1
635 . 1 1 61 61 TYR CD2 C 13 132.887 0.10 1 3 . . . . 61 Y CD2 . 19110 1
636 . 1 1 61 61 TYR CE2 C 13 118.378 0.10 1 3 . . . . 61 Y CE2 . 19110 1
637 . 1 1 61 61 TYR N N 15 120.745 0.10 6 1 . . . . 61 Y N . 19110 1
638 . 1 1 62 62 ASN H H 1 9.046 0.05 5 1 . . . . 62 N H . 19110 1
639 . 1 1 62 62 ASN HA H 1 4.647 0.05 2 1 . . . . 62 N HA . 19110 1
640 . 1 1 62 62 ASN HB2 H 1 3.327 0.05 2 2 . . . . 62 N HB2 . 19110 1
641 . 1 1 62 62 ASN HB3 H 1 1.976 0.05 2 2 . . . . 62 N HB3 . 19110 1
642 . 1 1 62 62 ASN HD21 H 1 7.580 0.05 2 2 . . . . 62 N HD21 . 19110 1
643 . 1 1 62 62 ASN HD22 H 1 6.882 0.05 2 2 . . . . 62 N HD22 . 19110 1
644 . 1 1 62 62 ASN C C 13 174.005 0.10 2 1 . . . . 62 N C . 19110 1
645 . 1 1 62 62 ASN CA C 13 52.555 0.10 4 1 . . . . 62 N CA . 19110 1
646 . 1 1 62 62 ASN CB C 13 39.130 0.10 1 1 . . . . 62 N CB . 19110 1
647 . 1 1 62 62 ASN N N 15 126.440 0.10 6 1 . . . . 62 N N . 19110 1
648 . 1 1 62 62 ASN ND2 N 15 112.979 0.10 6 1 . . . . 62 ND2 ND2 . 19110 1
649 . 1 1 63 63 GLU H H 1 9.318 0.05 5 1 . . . . 63 E H . 19110 1
650 . 1 1 63 63 GLU HA H 1 3.771 0.05 2 1 . . . . 63 E HA . 19110 1
651 . 1 1 63 63 GLU HB2 H 1 2.134 0.05 1 2 . . . . 63 E HB2 . 19110 1
652 . 1 1 63 63 GLU HB3 H 1 1.775 0.05 1 2 . . . . 63 E HB3 . 19110 1
653 . 1 1 63 63 GLU C C 13 178.774 0.10 1 1 . . . . 63 E C . 19110 1
654 . 1 1 63 63 GLU CA C 13 55.417 0.10 2 1 . . . . 63 E CA . 19110 1
655 . 1 1 63 63 GLU CB C 13 29.409 0.10 2 1 . . . . 63 E CB . 19110 1
656 . 1 1 63 63 GLU CG C 13 35.253 0.10 1 1 . . . . 63 E CG . 19110 1
657 . 1 1 63 63 GLU N N 15 125.706 0.10 6 1 . . . . 63 E N . 19110 1
658 . 1 1 64 64 THR H H 1 8.225 0.05 5 1 . . . . 64 T H . 19110 1
659 . 1 1 64 64 THR HA H 1 3.971 0.05 3 1 . . . . 64 T HA . 19110 1
660 . 1 1 64 64 THR HB H 1 4.196 0.05 2 1 . . . . 64 T HB . 19110 1
661 . 1 1 64 64 THR HG21 H 1 1.244 0.05 2 1 . . . . 64 T HG21 . 19110 1
662 . 1 1 64 64 THR HG22 H 1 1.244 0.05 2 1 . . . . 64 T HG22 . 19110 1
663 . 1 1 64 64 THR HG23 H 1 1.244 0.05 2 1 . . . . 64 T HG23 . 19110 1
664 . 1 1 64 64 THR C C 13 176.048 0.10 2 1 . . . . 64 T C . 19110 1
665 . 1 1 64 64 THR CA C 13 66.095 0.10 3 1 . . . . 64 T CA . 19110 1
666 . 1 1 64 64 THR CB C 13 67.871 0.10 3 1 . . . . 64 T CB . 19110 1
667 . 1 1 64 64 THR CG2 C 13 23.056 0.10 1 1 . . . . 64 T CG2 . 19110 1
668 . 1 1 64 64 THR N N 15 116.161 0.10 6 1 . . . . 64 T N . 19110 1
669 . 1 1 65 65 THR H H 1 7.336 0.05 7 1 . . . . 65 T H . 19110 1
670 . 1 1 65 65 THR HA H 1 4.277 0.05 6 1 . . . . 65 T HA . 19110 1
671 . 1 1 65 65 THR HB H 1 4.297 0.05 1 1 . . . . 65 T HB . 19110 1
672 . 1 1 65 65 THR HG21 H 1 1.117 0.05 2 1 . . . . 65 T HG21 . 19110 1
673 . 1 1 65 65 THR HG22 H 1 1.117 0.05 2 1 . . . . 65 T HG22 . 19110 1
674 . 1 1 65 65 THR HG23 H 1 1.117 0.05 2 1 . . . . 65 T HG23 . 19110 1
675 . 1 1 65 65 THR C C 13 176.282 0.10 2 1 . . . . 65 T C . 19110 1
676 . 1 1 65 65 THR CA C 13 61.714 0.10 5 1 . . . . 65 T CA . 19110 1
677 . 1 1 65 65 THR CB C 13 70.461 0.10 3 1 . . . . 65 T CB . 19110 1
678 . 1 1 65 65 THR CG2 C 13 21.750 0.10 3 1 . . . . 65 T CG2 . 19110 1
679 . 1 1 65 65 THR N N 15 109.154 0.10 7 1 . . . . 65 T N . 19110 1
680 . 1 1 66 66 GLY H H 1 8.667 0.05 8 1 . . . . 66 G H . 19110 1
681 . 1 1 66 66 GLY HA2 H 1 4.130 0.05 4 2 . . . . 66 G HA2 . 19110 1
682 . 1 1 66 66 GLY HA3 H 1 3.746 0.05 4 2 . . . . 66 G HA3 . 19110 1
683 . 1 1 66 66 GLY C C 13 173.930 0.10 1 1 . . . . 66 G C . 19110 1
684 . 1 1 66 66 GLY CA C 13 45.686 0.10 2 1 . . . . 66 G CA . 19110 1
685 . 1 1 66 66 GLY N N 15 112.516 0.10 9 1 . . . . 66 G N . 19110 1
686 . 1 1 67 67 GLU H H 1 7.098 0.05 7 1 . . . . 67 E H . 19110 1
687 . 1 1 67 67 GLU HA H 1 4.536 0.05 2 1 . . . . 67 E HA . 19110 1
688 . 1 1 67 67 GLU HB2 H 1 2.056 0.05 2 2 . . . . 67 E HB2 . 19110 1
689 . 1 1 67 67 GLU HB3 H 1 1.869 0.05 2 2 . . . . 67 E HB3 . 19110 1
690 . 1 1 67 67 GLU C C 13 173.658 0.10 2 1 . . . . 67 E C . 19110 1
691 . 1 1 67 67 GLU CA C 13 55.868 0.10 3 1 . . . . 67 E CA . 19110 1
692 . 1 1 67 67 GLU CB C 13 32.023 0.10 2 1 . . . . 67 E CB . 19110 1
693 . 1 1 67 67 GLU CG C 13 36.701 0.10 1 1 . . . . 67 E CG . 19110 1
694 . 1 1 67 67 GLU N N 15 118.572 0.10 8 1 . . . . 67 E N . 19110 1
695 . 1 1 68 68 ARG H H 1 8.617 0.05 4 1 . . . . 68 R H . 19110 1
696 . 1 1 68 68 ARG HA H 1 5.462 0.05 4 1 . . . . 68 R HA . 19110 1
697 . 1 1 68 68 ARG HB2 H 1 1.843 0.05 2 2 . . . . 68 R HB2 . 19110 1
698 . 1 1 68 68 ARG HG2 H 1 1.618 0.05 3 2 . . . . 68 R HG2 . 19110 1
699 . 1 1 68 68 ARG HD2 H 1 3.200 0.05 1 2 . . . . 68 R HD2 . 19110 1
700 . 1 1 68 68 ARG HE H 1 7.333 0.05 4 1 . . . . 68 R HE . 19110 1
701 . 1 1 68 68 ARG C C 13 175.043 0.10 2 1 . . . . 68 R C . 19110 1
702 . 1 1 68 68 ARG CA C 13 54.207 0.10 4 1 . . . . 68 R CA . 19110 1
703 . 1 1 68 68 ARG CB C 13 34.198 0.10 2 1 . . . . 68 R CB . 19110 1
704 . 1 1 68 68 ARG CG C 13 27.632 0.10 1 1 . . . . 68 R CG . 19110 1
705 . 1 1 68 68 ARG CD C 13 43.512 0.10 1 1 . . . . 68 R CD . 19110 1
706 . 1 1 68 68 ARG N N 15 120.339 0.10 5 1 . . . . 68 R N . 19110 1
707 . 1 1 68 68 ARG NE N 15 84.13 10.10 4 1 . . . . 68 R NE . 19110 1
708 . 1 1 69 69 GLY H H 1 8.861 0.05 5 1 . . . . 69 G H . 19110 1
709 . 1 1 69 69 GLY HA2 H 1 4.322 0.05 2 2 . . . . 69 G HA2 . 19110 1
710 . 1 1 69 69 GLY HA3 H 1 4.002 0.05 2 2 . . . . 69 G HA3 . 19110 1
711 . 1 1 69 69 GLY C C 13 170.987 0.10 1 1 . . . . 69 G C . 19110 1
712 . 1 1 69 69 GLY CA C 13 45.901 0.10 2 1 . . . . 69 G CA . 19110 1
713 . 1 1 69 69 GLY N N 15 111.702 0.10 6 1 . . . . 69 G N . 19110 1
714 . 1 1 70 70 ASP H H 1 8.467 0.05 5 1 . . . . 70 D H . 19110 1
715 . 1 1 70 70 ASP HA H 1 5.849 0.05 2 1 . . . . 70 D HA . 19110 1
716 . 1 1 70 70 ASP HB2 H 1 2.510 0.05 2 2 . . . . 70 D HB2 . 19110 1
717 . 1 1 70 70 ASP C C 13 175.786 0.10 2 1 . . . . 70 D C . 19110 1
718 . 1 1 70 70 ASP CA C 13 53.802 0.10 4 1 . . . . 70 D CA . 19110 1
719 . 1 1 70 70 ASP CB C 13 42.076 0.10 2 1 . . . . 70 D CB . 19110 1
720 . 1 1 70 70 ASP N N 15 120.910 0.10 6 1 . . . . 70 D N . 19110 1
721 . 1 1 71 71 PHE H H 1 8.918 0.05 6 1 . . . . 71 F H . 19110 1
722 . 1 1 71 71 PHE HA H 1 4.964 0.05 3 1 . . . . 71 F HA . 19110 1
723 . 1 1 71 71 PHE HB2 H 1 2.974 0.05 2 2 . . . . 71 F HB2 . 19110 1
724 . 1 1 71 71 PHE HB3 H 1 2.505 0.05 1 2 . . . . 71 F HB3 . 19110 1
725 . 1 1 71 71 PHE HE2 H 1 6.684 0.05 2 3 . . . . 71 F HE2 . 19110 1
726 . 1 1 71 71 PHE C C 13 171.100 0.10 2 1 . . . . 71 F C . 19110 1
727 . 1 1 71 71 PHE CA C 13 54.627 0.10 3 1 . . . . 71 F CA . 19110 1
728 . 1 1 71 71 PHE CB C 13 38.924 0.10 2 1 . . . . 71 F CB . 19110 1
729 . 1 1 71 71 PHE N N 15 113.684 0.10 7 1 . . . . 71 F N . 19110 1
730 . 1 1 72 72 PRO HA H 1 3.383 0.05 1 1 . . . . 72 P HA . 19110 1
731 . 1 1 72 72 PRO HB2 H 1 1.242 0.05 2 2 . . . . 72 P HB2 . 19110 1
732 . 1 1 72 72 PRO HB3 H 1 0.766 0.05 2 2 . . . . 72 P HB3 . 19110 1
733 . 1 1 72 72 PRO HG2 H 1 0.229 0.05 2 2 . . . . 72 P HG2 . 19110 1
734 . 1 1 72 72 PRO HG3 H 1 0.229 0.05 2 2 . . . . 72 P HG3 . 19110 1
735 . 1 1 72 72 PRO HD2 H 1 3.537 0.05 2 2 . . . . 72 P HD2 . 19110 1
736 . 1 1 72 72 PRO HD3 H 1 2.595 0.05 2 2 . . . . 72 P HD3 . 19110 1
737 . 1 1 72 72 PRO CA C 13 61.65 0.10 1 1 . . . . 72 P CA . 19110 1
738 . 1 1 72 72 PRO CB C 13 30.70 0.10 1 1 . . . . 72 P CB . 19110 1
739 . 1 1 72 72 PRO CG C 13 26.94 0.10 1 1 . . . . 72 P CG . 19110 1
740 . 1 1 72 72 PRO CD C 13 49.91 0.10 1 1 . . . . 72 P CD . 19110 1
741 . 1 1 72 72 PRO N N 15 135.125 0.10 1 1 . . . . 72 P N . 19110 1
742 . 1 1 73 73 GLY H H 1 7.927 0.05 5 1 . . . . 73 G H . 19110 1
743 . 1 1 73 73 GLY HA2 H 1 3.679 0.05 2 2 . . . . 73 G HA2 . 19110 1
744 . 1 1 73 73 GLY HA3 H 1 3.306 0.05 1 2 . . . . 73 G HA3 . 19110 1
745 . 1 1 73 73 GLY C C 13 174.394 0.10 2 1 . . . . 73 G C . 19110 1
746 . 1 1 73 73 GLY CA C 13 46.622 0.10 3 1 . . . . 73 G CA . 19110 1
747 . 1 1 73 73 GLY N N 15 112.162 0.10 5 1 . . . . 73 G N . 19110 1
748 . 1 1 74 74 THR H H 1 7.272 0.05 4 1 . . . . 74 T H . 19110 1
749 . 1 1 74 74 THR HA H 1 3.964 0.05 4 1 . . . . 74 T HA . 19110 1
750 . 1 1 74 74 THR HB H 1 4.269 0.05 1 1 . . . . 74 T HB . 19110 1
751 . 1 1 74 74 THR C C 13 175.582 0.10 2 1 . . . . 74 T C . 19110 1
752 . 1 1 74 74 THR CA C 13 62.873 0.10 4 1 . . . . 74 T CA . 19110 1
753 . 1 1 74 74 THR CB C 13 69.038 0.10 2 1 . . . . 74 T CB . 19110 1
754 . 1 1 74 74 THR CG2 C 13 22.987 0.10 1 1 . . . . 74 T CG2 . 19110 1
755 . 1 1 74 74 THR N N 15 104.114 0.10 4 1 . . . . 74 T N . 19110 1
756 . 1 1 75 75 TYR H H 1 7.474 0.05 7 1 . . . . 75 Y H . 19110 1
757 . 1 1 75 75 TYR HA H 1 4.674 0.05 3 1 . . . . 75 Y HA . 19110 1
758 . 1 1 75 75 TYR HB2 H 1 3.348 0.05 2 2 . . . . 75 Y HB2 . 19110 1
759 . 1 1 75 75 TYR HB3 H 1 2.852 0.05 2 2 . . . . 75 Y HB3 . 19110 1
760 . 1 1 75 75 TYR C C 13 174.888 0.10 2 1 . . . . 75 Y C . 19110 1
761 . 1 1 75 75 TYR CA C 13 58.172 0.10 4 1 . . . . 75 Y CA . 19110 1
762 . 1 1 75 75 TYR CB C 13 39.056 0.10 2 1 . . . . 75 Y CB . 19110 1
763 . 1 1 75 75 TYR N N 15 119.446 0.10 8 1 . . . . 75 Y N . 19110 1
764 . 1 1 76 76 VAL H H 1 7.279 0.05 4 1 . . . . 76 V H . 19110 1
765 . 1 1 76 76 VAL HA H 1 5.458 0.05 5 1 . . . . 76 V HA . 19110 1
766 . 1 1 76 76 VAL HB H 1 2.136 0.05 2 1 . . . . 76 V HB . 19110 1
767 . 1 1 76 76 VAL HG11 H 1 0.687 0.05 3 2 . . . . 76 V HG11 . 19110 1
768 . 1 1 76 76 VAL HG12 H 1 0.687 0.05 3 2 . . . . 76 V HG12 . 19110 1
769 . 1 1 76 76 VAL HG13 H 1 0.687 0.05 3 2 . . . . 76 V HG13 . 19110 1
770 . 1 1 76 76 VAL HG21 H 1 0.768 0.05 2 2 . . . . 76 V HG21 . 19110 1
771 . 1 1 76 76 VAL HG22 H 1 0.768 0.05 2 2 . . . . 76 V HG22 . 19110 1
772 . 1 1 76 76 VAL HG23 H 1 0.768 0.05 2 2 . . . . 76 V HG23 . 19110 1
773 . 1 1 76 76 VAL C C 13 172.972 0.10 2 1 . . . . 76 V C . 19110 1
774 . 1 1 76 76 VAL CA C 13 58.747 0.10 4 1 . . . . 76 V CA . 19110 1
775 . 1 1 76 76 VAL CB C 13 36.509 0.10 2 1 . . . . 76 V CB . 19110 1
776 . 1 1 76 76 VAL CG1 C 13 21.001 0.10 5 2 . . . . 76 V CG1 . 19110 1
777 . 1 1 76 76 VAL CG2 C 13 19.218 0.10 4 2 . . . . 76 V CG2 . 19110 1
778 . 1 1 76 76 VAL N N 15 108.946 0.10 5 1 . . . . 76 V N . 19110 1
779 . 1 1 77 77 GLU H H 1 8.759 0.05 7 1 . . . . 77 E H . 19110 1
780 . 1 1 77 77 GLU HA H 1 5.041 0.05 3 1 . . . . 77 E HA . 19110 1
781 . 1 1 77 77 GLU HB2 H 1 2.120 0.05 3 2 . . . . 77 E HB2 . 19110 1
782 . 1 1 77 77 GLU HB3 H 1 1.940 0.05 1 2 . . . . 77 E HB3 . 19110 1
783 . 1 1 77 77 GLU C C 13 175.577 0.10 2 1 . . . . 77 E C . 19110 1
784 . 1 1 77 77 GLU CA C 13 53.169 0.10 4 1 . . . . 77 E CA . 19110 1
785 . 1 1 77 77 GLU CB C 13 33.054 0.10 2 1 . . . . 77 E CB . 19110 1
786 . 1 1 77 77 GLU CG C 13 35.210 0.10 1 1 . . . . 77 E CG . 19110 1
787 . 1 1 77 77 GLU N N 15 115.511 0.10 8 1 . . . . 77 E N . 19110 1
788 . 1 1 78 78 TYR H H 1 9.421 0.05 7 1 . . . . 78 Y H . 19110 1
789 . 1 1 78 78 TYR HA H 1 4.395 0.05 2 1 . . . . 78 Y HA . 19110 1
790 . 1 1 78 78 TYR HB2 H 1 3.083 0.05 2 2 . . . . 78 Y HB2 . 19110 1
791 . 1 1 78 78 TYR HB3 H 1 2.903 0.05 1 2 . . . . 78 Y HB3 . 19110 1
792 . 1 1 78 78 TYR HD2 H 1 6.622 0.05 1 3 . . . . 78 Y HD2 . 19110 1
793 . 1 1 78 78 TYR HE2 H 1 6.537 0.05 2 3 . . . . 78 Y HE2 . 19110 1
794 . 1 1 78 78 TYR C C 13 175.916 0.10 2 1 . . . . 78 Y C . 19110 1
795 . 1 1 78 78 TYR CA C 13 58.748 0.10 3 1 . . . . 78 Y CA . 19110 1
796 . 1 1 78 78 TYR CB C 13 39.159 0.10 4 1 . . . . 78 Y CB . 19110 1
797 . 1 1 78 78 TYR CE2 C 13 118.393 0.10 1 3 . . . . 78 Y CE2 . 19110 1
798 . 1 1 78 78 TYR N N 15 125.584 0.10 8 1 . . . . 78 Y N . 19110 1
799 . 1 1 79 79 ILE H H 1 8.333 0.05 5 1 . . . . 79 I H . 19110 1
800 . 1 1 79 79 ILE HA H 1 4.260 0.05 2 1 . . . . 79 I HA . 19110 1
801 . 1 1 79 79 ILE HB H 1 1.682 0.05 1 1 . . . . 79 I HB . 19110 1
802 . 1 1 79 79 ILE HG12 H 1 0.676 0.05 1 1 . . . . 79 I HG12 . 19110 1
803 . 1 1 79 79 ILE HG13 H 1 0.676 0.05 1 1 . . . . 79 I HG13 . 19110 1
804 . 1 1 79 79 ILE HD11 H 1 0.601 0.05 1 1 . . . . 79 I HD11 . 19110 1
805 . 1 1 79 79 ILE HD12 H 1 0.601 0.05 1 1 . . . . 79 I HD12 . 19110 1
806 . 1 1 79 79 ILE HD13 H 1 0.601 0.05 1 1 . . . . 79 I HD13 . 19110 1
807 . 1 1 79 79 ILE C C 13 175.297 0.10 2 1 . . . . 79 I C . 19110 1
808 . 1 1 79 79 ILE CA C 13 61.096 0.10 3 1 . . . . 79 I CA . 19110 1
809 . 1 1 79 79 ILE CB C 13 39.190 0.10 1 1 . . . . 79 I CB . 19110 1
810 . 1 1 79 79 ILE CG2 C 13 17.848 0.10 3 1 . . . . 79 I CG2 . 19110 1
811 . 1 1 79 79 ILE CD1 C 13 13.794 0.10 3 1 . . . . 79 I CD1 . 19110 1
812 . 1 1 79 79 ILE N N 15 122.158 0.10 6 1 . . . . 79 I N . 19110 1
813 . 1 1 80 80 GLY H H 1 8.861 0.05 1 1 . . . . 80 G H . 19110 1
814 . 1 1 80 80 GLY HA2 H 1 3.385 0.05 2 2 . . . . 80 G HA2 . 19110 1
815 . 1 1 80 80 GLY HA3 H 1 4.252 0.05 2 2 . . . . 80 G HA3 . 19110 1
816 . 1 1 80 80 GLY C C 13 171.094 0.10 2 1 . . . . 80 G C . 19110 1
817 . 1 1 80 80 GLY CA C 13 45.412 0.10 3 1 . . . . 80 G CA . 19110 1
818 . 1 1 80 80 GLY N N 15 111.700 0.10 1 1 . . . . 80 G N . 19110 1
819 . 1 1 81 81 ARG H H 1 8.335 0.05 5 1 . . . . 81 R H . 19110 1
820 . 1 1 81 81 ARG HA H 1 4.883 0.05 2 1 . . . . 81 R HA . 19110 1
821 . 1 1 81 81 ARG HB2 H 1 1.860 0.05 1 2 . . . . 81 R HB2 . 19110 1
822 . 1 1 81 81 ARG HB3 H 1 1.702 0.05 2 2 . . . . 81 R HB3 . 19110 1
823 . 1 1 81 81 ARG HD2 H 1 3.194 0.05 2 2 . . . . 81 R HD2 . 19110 1
824 . 1 1 81 81 ARG C C 13 176.750 0.10 2 1 . . . . 81 R C . 19110 1
825 . 1 1 81 81 ARG CA C 13 54.990 0.10 4 1 . . . . 81 R CA . 19110 1
826 . 1 1 81 81 ARG CB C 13 32.034 0.10 2 1 . . . . 81 R CB . 19110 1
827 . 1 1 81 81 ARG CG C 13 24.419 0.10 2 1 . . . . 81 R CG . 19110 1
828 . 1 1 81 81 ARG N N 15 117.249 0.10 6 1 . . . . 81 R N . 19110 1
829 . 1 1 82 82 LYS H H 1 8.323 0.05 5 1 . . . . 82 K H . 19110 1
830 . 1 1 82 82 LYS HA H 1 4.207 0.05 2 1 . . . . 82 K HA . 19110 1
831 . 1 1 82 82 LYS HB2 H 1 1.543 0.05 1 2 . . . . 82 K HB2 . 19110 1
832 . 1 1 82 82 LYS HB3 H 1 1.299 0.05 1 2 . . . . 82 K HB3 . 19110 1
833 . 1 1 82 82 LYS C C 13 174.977 0.10 2 1 . . . . 82 K C . 19110 1
834 . 1 1 82 82 LYS CA C 13 55.810 0.10 4 1 . . . . 82 K CA . 19110 1
835 . 1 1 82 82 LYS CB C 13 34.670 0.10 2 1 . . . . 82 K CB . 19110 1
836 . 1 1 82 82 LYS N N 15 122.643 0.10 6 1 . . . . 82 K N . 19110 1
837 . 1 1 83 83 LYS H H 1 8.543 0.05 8 1 . . . . 83 K H . 19110 1
838 . 1 1 83 83 LYS HA H 1 4.395 0.05 1 1 . . . . 83 K HA . 19110 1
839 . 1 1 83 83 LYS HB2 H 1 1.697 0.05 3 2 . . . . 83 K HB2 . 19110 1
840 . 1 1 83 83 LYS HB3 H 1 1.373 0.05 1 2 . . . . 83 K HB3 . 19110 1
841 . 1 1 83 83 LYS C C 13 176.133 0.10 2 1 . . . . 83 K C . 19110 1
842 . 1 1 83 83 LYS CA C 13 56.300 0.10 3 1 . . . . 83 K CA . 19110 1
843 . 1 1 83 83 LYS CB C 13 32.966 0.10 2 1 . . . . 83 K CB . 19110 1
844 . 1 1 83 83 LYS CG C 13 24.628 0.10 1 1 . . . . 83 K CG . 19110 1
845 . 1 1 83 83 LYS CD C 13 27.289 0.10 1 1 . . . . 83 K CD . 19110 1
846 . 1 1 83 83 LYS N N 15 127.110 0.10 9 1 . . . . 83 K N . 19110 1
847 . 1 1 84 84 ILE H H 1 8.352 0.05 4 1 . . . . 84 I H . 19110 1
848 . 1 1 84 84 ILE HA H 1 4.143 0.05 4 1 . . . . 84 I HA . 19110 1
849 . 1 1 84 84 ILE HB H 1 1.772 0.05 1 1 . . . . 84 I HB . 19110 1
850 . 1 1 84 84 ILE HG12 H 1 0.816 0.05 1 1 . . . . 84 I HG12 . 19110 1
851 . 1 1 84 84 ILE HG13 H 1 0.816 0.05 1 1 . . . . 84 I HG13 . 19110 1
852 . 1 1 84 84 ILE HD11 H 1 0.733 0.05 1 1 . . . . 84 I HD11 . 19110 1
853 . 1 1 84 84 ILE HD12 H 1 0.733 0.05 1 1 . . . . 84 I HD12 . 19110 1
854 . 1 1 84 84 ILE HD13 H 1 0.733 0.05 1 1 . . . . 84 I HD13 . 19110 1
855 . 1 1 84 84 ILE C C 13 174.883 0.10 2 1 . . . . 84 I C . 19110 1
856 . 1 1 84 84 ILE CA C 13 61.050 0.10 4 1 . . . . 84 I CA . 19110 1
857 . 1 1 84 84 ILE CB C 13 38.674 0.10 2 1 . . . . 84 I CB . 19110 1
858 . 1 1 84 84 ILE CG2 C 13 17.527 0.10 4 1 . . . . 84 I CG2 . 19110 1
859 . 1 1 84 84 ILE CD1 C 13 13.021 0.10 3 1 . . . . 84 I CD1 . 19110 1
860 . 1 1 84 84 ILE N N 15 124.086 0.10 5 1 . . . . 84 I N . 19110 1
861 . 1 1 85 85 SER H H 1 7.922 0.05 6 1 . . . . 85 S H . 19110 1
862 . 1 1 85 85 SER HA H 1 4.587 0.05 1 1 . . . . 85 S HA . 19110 1
863 . 1 1 85 85 SER HB2 H 1 3.640 0.05 2 2 . . . . 85 S HB2 . 19110 1
864 . 1 1 85 85 SER C C 13 171.868 0.10 2 1 . . . . 85 S C . 19110 1
865 . 1 1 85 85 SER CA C 13 56.130 0.10 2 1 . . . . 85 S CA . 19110 1
866 . 1 1 85 85 SER CB C 13 64.629 0.10 1 1 . . . . 85 S CB . 19110 1
867 . 1 1 85 85 SER N N 15 119.945 0.10 6 1 . . . . 85 S N . 19110 1
868 . 1 1 86 86 PRO HA H 1 3.884 0.05 1 1 . . . . 86 P HA . 19110 1
869 . 1 1 86 86 PRO HB2 H 1 1.941 0.05 2 2 . . . . 86 P HB2 . 19110 1
870 . 1 1 86 86 PRO HB3 H 1 1.850 0.05 2 2 . . . . 86 P HB3 . 19110 1
871 . 1 1 86 86 PRO HG2 H 1 2.152 0.05 2 2 . . . . 86 P HG2 . 19110 1
872 . 1 1 86 86 PRO HG3 H 1 2.152 0.05 2 2 . . . . 86 P HG3 . 19110 1
873 . 1 1 86 86 PRO HD2 H 1 3.857 0.05 2 2 . . . . 86 P HD2 . 19110 1
874 . 1 1 86 86 PRO HD3 H 1 3.541 0.05 2 2 . . . . 86 P HD3 . 19110 1
875 . 1 1 86 86 PRO CA C 13 64.78 0.10 1 1 . . . . 86 P CA . 19110 1
876 . 1 1 86 86 PRO CB C 13 30.70 0.10 1 1 . . . . 86 P CB . 19110 1
877 . 1 1 86 86 PRO CG C 13 27.26 0.10 1 1 . . . . 86 P CG . 19110 1
878 . 1 1 86 86 PRO CD C 13 50.70 0.10 1 1 . . . . 86 P CD . 19110 1
879 . 1 1 86 86 PRO N N 15 142.079 0.10 1 1 . . . . 86 P N . 19110 1
stop_
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