###################################
# 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 16666
_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 '3D HNCACB' . . . 16666 1
2 '2D 1H-15N HSQC' . . . 16666 1
3 '3D CBCA(CO)NH' . . . 16666 1
5 '3D HNCO' . . . 16666 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 HIS H H 1 8.126 0.02 . 1 . . . . 1 HIS H . 16666 1
2 . 1 1 1 1 HIS HA H 1 4.775 0.02 . 1 . . . . 1 HIS HA . 16666 1
3 . 1 1 1 1 HIS HB2 H 1 3.23 0.02 . 2 . . . . 1 HIS HB2 . 16666 1
4 . 1 1 1 1 HIS HB3 H 1 3.146 0.02 . 2 . . . . 1 HIS HB3 . 16666 1
5 . 1 1 1 1 HIS HD2 H 1 7.28 0.02 . 1 . . . . 1 HIS HD2 . 16666 1
6 . 1 1 1 1 HIS HE1 H 1 8.578 0.02 . 1 . . . . 1 HIS HE1 . 16666 1
7 . 1 1 1 1 HIS C C 13 174.1 0.3 . 1 . . . . 1 HIS C . 16666 1
8 . 1 1 1 1 HIS CA C 13 52.721 0.3 . 1 . . . . 1 HIS CA . 16666 1
9 . 1 1 1 1 HIS CB C 13 28.853 0.3 . 1 . . . . 1 HIS CB . 16666 1
10 . 1 1 1 1 HIS CD2 C 13 119.735 0.3 . 1 . . . . 1 HIS CD2 . 16666 1
11 . 1 1 1 1 HIS CE1 C 13 136.19 0.3 . 1 . . . . 1 HIS CE1 . 16666 1
12 . 1 1 1 1 HIS N N 15 123.4 0.3 . 1 . . . . 1 HIS N . 16666 1
13 . 1 1 2 2 THR H H 1 8.272 0.02 . 1 . . . . 2 THR H . 16666 1
14 . 1 1 2 2 THR HA H 1 4.328 0.02 . 1 . . . . 2 THR HA . 16666 1
15 . 1 1 2 2 THR HB H 1 4.18 0.02 . 1 . . . . 2 THR HB . 16666 1
16 . 1 1 2 2 THR HG21 H 1 1.251 0.02 . 1 . . . . 2 THR HG2 . 16666 1
17 . 1 1 2 2 THR HG22 H 1 1.251 0.02 . 1 . . . . 2 THR HG2 . 16666 1
18 . 1 1 2 2 THR HG23 H 1 1.251 0.02 . 1 . . . . 2 THR HG2 . 16666 1
19 . 1 1 2 2 THR CA C 13 59.744 0.3 . 1 . . . . 2 THR CA . 16666 1
20 . 1 1 2 2 THR CB C 13 69.542 0.3 . 1 . . . . 2 THR CB . 16666 1
21 . 1 1 2 2 THR CG2 C 13 22.327 0.3 . 1 . . . . 2 THR CG2 . 16666 1
22 . 1 1 2 2 THR N N 15 119.224 0.3 . 1 . . . . 2 THR N . 16666 1
23 . 1 1 3 3 PRO HA H 1 4.464 0.02 . 1 . . . . 3 PRO HA . 16666 1
24 . 1 1 3 3 PRO HB2 H 1 2.274 0.02 . 2 . . . . 3 PRO HB2 . 16666 1
25 . 1 1 3 3 PRO HB3 H 1 1.879 0.02 . 2 . . . . 3 PRO HB3 . 16666 1
26 . 1 1 3 3 PRO HD2 H 1 3.72 0.02 . 2 . . . . 3 PRO HD2 . 16666 1
27 . 1 1 3 3 PRO HD3 H 1 3.876 0.02 . 2 . . . . 3 PRO HD3 . 16666 1
28 . 1 1 3 3 PRO HG2 H 1 2.171 0.02 . 2 . . . . 3 PRO HG2 . 16666 1
29 . 1 1 3 3 PRO HG3 H 1 2.004 0.02 . 2 . . . . 3 PRO HG3 . 16666 1
30 . 1 1 3 3 PRO C C 13 176.53 0.3 . 1 . . . . 3 PRO C . 16666 1
31 . 1 1 3 3 PRO CA C 13 62.741 0.3 . 1 . . . . 3 PRO CA . 16666 1
32 . 1 1 3 3 PRO CB C 13 31.889 0.3 . 1 . . . . 3 PRO CB . 16666 1
33 . 1 1 3 3 PRO CD C 13 50.774 0.3 . 1 . . . . 3 PRO CD . 16666 1
34 . 1 1 3 3 PRO CG C 13 27.1 0.3 . 1 . . . . 3 PRO CG . 16666 1
35 . 1 1 4 4 THR H H 1 8.371 0.02 . 1 . . . . 4 THR H . 16666 1
36 . 1 1 4 4 THR HA H 1 4.54 0.02 . 1 . . . . 4 THR HA . 16666 1
37 . 1 1 4 4 THR HB H 1 4.107 0.02 . 1 . . . . 4 THR HB . 16666 1
38 . 1 1 4 4 THR HG21 H 1 1.267 0.02 . 1 . . . . 4 THR HG2 . 16666 1
39 . 1 1 4 4 THR HG22 H 1 1.267 0.02 . 1 . . . . 4 THR HG2 . 16666 1
40 . 1 1 4 4 THR HG23 H 1 1.267 0.02 . 1 . . . . 4 THR HG2 . 16666 1
41 . 1 1 4 4 THR CA C 13 59.841 0.3 . 1 . . . . 4 THR CA . 16666 1
42 . 1 1 4 4 THR CB C 13 69.736 0.3 . 1 . . . . 4 THR CB . 16666 1
43 . 1 1 4 4 THR CG2 C 13 21.149 0.3 . 1 . . . . 4 THR CG2 . 16666 1
44 . 1 1 4 4 THR N N 15 118.217 0.3 . 1 . . . . 4 THR N . 16666 1
45 . 1 1 5 5 PRO HA H 1 4.463 0.02 . 1 . . . . 5 PRO HA . 16666 1
46 . 1 1 5 5 PRO HB2 H 1 2.301 0.02 . 2 . . . . 5 PRO HB2 . 16666 1
47 . 1 1 5 5 PRO HB3 H 1 1.877 0.02 . 2 . . . . 5 PRO HB3 . 16666 1
48 . 1 1 5 5 PRO HD2 H 1 3.7 0.02 . 2 . . . . 5 PRO HD2 . 16666 1
49 . 1 1 5 5 PRO HD3 H 1 3.855 0.02 . 2 . . . . 5 PRO HD3 . 16666 1
50 . 1 1 5 5 PRO HG2 H 1 2.171 0.02 . 2 . . . . 5 PRO HG2 . 16666 1
51 . 1 1 5 5 PRO HG3 H 1 2.004 0.02 . 2 . . . . 5 PRO HG3 . 16666 1
52 . 1 1 5 5 PRO C C 13 176.44 0.3 . 1 . . . . 5 PRO C . 16666 1
53 . 1 1 5 5 PRO CA C 13 62.643 0.3 . 1 . . . . 5 PRO CA . 16666 1
54 . 1 1 5 5 PRO CB C 13 31.731 0.3 . 1 . . . . 5 PRO CB . 16666 1
55 . 1 1 5 5 PRO CD C 13 50.774 0.3 . 1 . . . . 5 PRO CD . 16666 1
56 . 1 1 5 5 PRO CG C 13 27.1 0.3 . 1 . . . . 5 PRO CG . 16666 1
57 . 1 1 6 6 THR H H 1 8.336 0.02 . 1 . . . . 6 THR H . 16666 1
58 . 1 1 6 6 THR HA H 1 4.502 0.02 . 1 . . . . 6 THR HA . 16666 1
59 . 1 1 6 6 THR HB H 1 4.108 0.02 . 1 . . . . 6 THR HB . 16666 1
60 . 1 1 6 6 THR HG21 H 1 1.258 0.02 . 1 . . . . 6 THR HG2 . 16666 1
61 . 1 1 6 6 THR HG22 H 1 1.258 0.02 . 1 . . . . 6 THR HG2 . 16666 1
62 . 1 1 6 6 THR HG23 H 1 1.258 0.02 . 1 . . . . 6 THR HG2 . 16666 1
63 . 1 1 6 6 THR CA C 13 59.841 0.3 . 1 . . . . 6 THR CA . 16666 1
64 . 1 1 6 6 THR CB C 13 69.562 0.3 . 1 . . . . 6 THR CB . 16666 1
65 . 1 1 6 6 THR CG2 C 13 22.222 0.3 . 1 . . . . 6 THR CG2 . 16666 1
66 . 1 1 6 6 THR N N 15 118.61 0.3 . 1 . . . . 6 THR N . 16666 1
67 . 1 1 7 7 PRO HA H 1 4.459 0.02 . 1 . . . . 7 PRO HA . 16666 1
68 . 1 1 7 7 PRO HB2 H 1 2.279 0.02 . 2 . . . . 7 PRO HB2 . 16666 1
69 . 1 1 7 7 PRO HB3 H 1 1.888 0.02 . 2 . . . . 7 PRO HB3 . 16666 1
70 . 1 1 7 7 PRO HD2 H 1 3.719 0.02 . 2 . . . . 7 PRO HD2 . 16666 1
71 . 1 1 7 7 PRO HD3 H 1 3.876 0.02 . 2 . . . . 7 PRO HD3 . 16666 1
72 . 1 1 7 7 PRO HG2 H 1 2.173 0.02 . 2 . . . . 7 PRO HG2 . 16666 1
73 . 1 1 7 7 PRO HG3 H 1 1.993 0.02 . 2 . . . . 7 PRO HG3 . 16666 1
74 . 1 1 7 7 PRO C C 13 175.74 0.3 . 1 . . . . 7 PRO C . 16666 1
75 . 1 1 7 7 PRO CA C 13 62.823 0.3 . 1 . . . . 7 PRO CA . 16666 1
76 . 1 1 7 7 PRO CB C 13 32.009 0.3 . 1 . . . . 7 PRO CB . 16666 1
77 . 1 1 7 7 PRO CD C 13 50.779 0.3 . 1 . . . . 7 PRO CD . 16666 1
78 . 1 1 7 7 PRO CG C 13 27.1 0.3 . 1 . . . . 7 PRO CG . 16666 1
79 . 1 1 8 8 ILE H H 1 8.33 0.02 . 1 . . . . 8 ILE H . 16666 1
80 . 1 1 8 8 ILE HA H 1 4.431 0.02 . 1 . . . . 8 ILE HA . 16666 1
81 . 1 1 8 8 ILE HB H 1 1.809 0.02 . 1 . . . . 8 ILE HB . 16666 1
82 . 1 1 8 8 ILE HD11 H 1 0.733 0.02 . 1 . . . . 8 ILE HD1 . 16666 1
83 . 1 1 8 8 ILE HD12 H 1 0.733 0.02 . 1 . . . . 8 ILE HD1 . 16666 1
84 . 1 1 8 8 ILE HD13 H 1 0.733 0.02 . 1 . . . . 8 ILE HD1 . 16666 1
85 . 1 1 8 8 ILE HG12 H 1 1.453 0.02 . 2 . . . . 8 ILE HG12 . 16666 1
86 . 1 1 8 8 ILE HG13 H 1 1.303 0.02 . 2 . . . . 8 ILE HG13 . 16666 1
87 . 1 1 8 8 ILE HG21 H 1 0.835 0.02 . 1 . . . . 8 ILE HG2 . 16666 1
88 . 1 1 8 8 ILE HG22 H 1 0.835 0.02 . 1 . . . . 8 ILE HG2 . 16666 1
89 . 1 1 8 8 ILE HG23 H 1 0.835 0.02 . 1 . . . . 8 ILE HG2 . 16666 1
90 . 1 1 8 8 ILE C C 13 175.74 0.3 . 1 . . . . 8 ILE C . 16666 1
91 . 1 1 8 8 ILE CA C 13 59.377 0.3 . 1 . . . . 8 ILE CA . 16666 1
92 . 1 1 8 8 ILE CB C 13 38.832 0.3 . 1 . . . . 8 ILE CB . 16666 1
93 . 1 1 8 8 ILE CD1 C 13 11.266 0.3 . 1 . . . . 8 ILE CD1 . 16666 1
94 . 1 1 8 8 ILE CG1 C 13 26.549 0.3 . 1 . . . . 8 ILE CG1 . 16666 1
95 . 1 1 8 8 ILE CG2 C 13 17.64 0.3 . 1 . . . . 8 ILE CG2 . 16666 1
96 . 1 1 8 8 ILE N N 15 121.651 0.3 . 1 . . . . 8 ILE N . 16666 1
97 . 1 1 9 9 CYS H H 1 9.155 0.02 . 1 . . . . 9 CYS H . 16666 1
98 . 1 1 9 9 CYS HA H 1 5.022 0.02 . 1 . . . . 9 CYS HA . 16666 1
99 . 1 1 9 9 CYS HB2 H 1 3.073 0.02 . 2 . . . . 9 CYS HB2 . 16666 1
100 . 1 1 9 9 CYS HB3 H 1 2.933 0.02 . 2 . . . . 9 CYS HB3 . 16666 1
101 . 1 1 9 9 CYS C C 13 172.69 0.3 . 1 . . . . 9 CYS C . 16666 1
102 . 1 1 9 9 CYS CA C 13 59.416 0.3 . 1 . . . . 9 CYS CA . 16666 1
103 . 1 1 9 9 CYS CB C 13 40.903 0.3 . 1 . . . . 9 CYS CB . 16666 1
104 . 1 1 9 9 CYS N N 15 127.957 0.3 . 1 . . . . 9 CYS N . 16666 1
105 . 1 1 10 10 LYS H H 1 8.684 0.3 . 1 . . . . 10 LYS H . 16666 1
106 . 1 1 10 10 LYS HA H 1 5.66 0.02 . 1 . . . . 10 LYS HA . 16666 1
107 . 1 1 10 10 LYS HB2 H 1 1.708 0.02 . 2 . . . . 10 LYS HB2 . 16666 1
108 . 1 1 10 10 LYS HB3 H 1 1.708 0.02 . 2 . . . . 10 LYS HB3 . 16666 1
109 . 1 1 10 10 LYS HD2 H 1 1.493 0.02 . 2 . . . . 10 LYS HD2 . 16666 1
110 . 1 1 10 10 LYS HD3 H 1 1.493 0.02 . 2 . . . . 10 LYS HD3 . 16666 1
111 . 1 1 10 10 LYS HE2 H 1 2.607 0.02 . 2 . . . . 10 LYS HE2 . 16666 1
112 . 1 1 10 10 LYS HE3 H 1 2.697 0.02 . 2 . . . . 10 LYS HE3 . 16666 1
113 . 1 1 10 10 LYS HG2 H 1 1.222 0.02 . 2 . . . . 10 LYS HG2 . 16666 1
114 . 1 1 10 10 LYS HG3 H 1 1.222 0.02 . 2 . . . . 10 LYS HG3 . 16666 1
115 . 1 1 10 10 LYS C C 13 175.27 0.3 . 1 . . . . 10 LYS C . 16666 1
116 . 1 1 10 10 LYS CA C 13 54.067 0.3 . 1 . . . . 10 LYS CA . 16666 1
117 . 1 1 10 10 LYS CB C 13 36.005 0.3 . 1 . . . . 10 LYS CB . 16666 1
118 . 1 1 10 10 LYS CD C 13 29.446 0.3 . 1 . . . . 10 LYS CD . 16666 1
119 . 1 1 10 10 LYS CE C 13 41.437 0.3 . 1 . . . . 10 LYS CE . 16666 1
120 . 1 1 10 10 LYS CG C 13 23.582 0.3 . 1 . . . . 10 LYS CG . 16666 1
121 . 1 1 10 10 LYS N N 15 119.148 0.3 . 1 . . . . 10 LYS N . 16666 1
122 . 1 1 11 11 SER H H 1 8.843 0.02 . 1 . . . . 11 SER H . 16666 1
123 . 1 1 11 11 SER HA H 1 4.691 0.02 . 1 . . . . 11 SER HA . 16666 1
124 . 1 1 11 11 SER HB2 H 1 3.776 0.02 . 2 . . . . 11 SER HB2 . 16666 1
125 . 1 1 11 11 SER HB3 H 1 3.591 0.02 . 2 . . . . 11 SER HB3 . 16666 1
126 . 1 1 11 11 SER C C 13 172.46 0.3 . 1 . . . . 11 SER C . 16666 1
127 . 1 1 11 11 SER CA C 13 56.794 0.3 . 1 . . . . 11 SER CA . 16666 1
128 . 1 1 11 11 SER CB C 13 65.604 0.3 . 1 . . . . 11 SER CB . 16666 1
129 . 1 1 11 11 SER N N 15 115.616 0.3 . 1 . . . . 11 SER N . 16666 1
130 . 1 1 12 12 ARG H H 1 8.782 0.02 . 1 . . . . 12 ARG H . 16666 1
131 . 1 1 12 12 ARG HA H 1 5.373 0.02 . 1 . . . . 12 ARG HA . 16666 1
132 . 1 1 12 12 ARG HB2 H 1 2.32 0.02 . 2 . . . . 12 ARG HB2 . 16666 1
133 . 1 1 12 12 ARG HB3 H 1 1.882 0.02 . 2 . . . . 12 ARG HB3 . 16666 1
134 . 1 1 12 12 ARG HD2 H 1 3.248 0.02 . 2 . . . . 12 ARG HD2 . 16666 1
135 . 1 1 12 12 ARG HD3 H 1 3.248 0.02 . 2 . . . . 12 ARG HD3 . 16666 1
136 . 1 1 12 12 ARG HG2 H 1 1.333 0.02 . 2 . . . . 12 ARG HG2 . 16666 1
137 . 1 1 12 12 ARG HG3 H 1 1.333 0.02 . 2 . . . . 12 ARG HG3 . 16666 1
138 . 1 1 12 12 ARG C C 13 176.46 0.3 . 1 . . . . 12 ARG C . 16666 1
139 . 1 1 12 12 ARG CA C 13 56.533 0.3 . 1 . . . . 12 ARG CA . 16666 1
140 . 1 1 12 12 ARG CB C 13 29.707 0.3 . 1 . . . . 12 ARG CB . 16666 1
141 . 1 1 12 12 ARG N N 15 126.61 0.3 . 1 . . . . 12 ARG N . 16666 1
142 . 1 1 13 13 SER H H 1 8.025 0.02 . 1 . . . . 13 SER H . 16666 1
143 . 1 1 13 13 SER HA H 1 4.425 0.02 . 1 . . . . 13 SER HA . 16666 1
144 . 1 1 13 13 SER HB2 H 1 3.812 0.02 . 2 . . . . 13 SER HB2 . 16666 1
145 . 1 1 13 13 SER HB3 H 1 3.812 0.02 . 2 . . . . 13 SER HB3 . 16666 1
146 . 1 1 13 13 SER C C 13 175.74 0.3 . 1 . . . . 13 SER C . 16666 1
147 . 1 1 13 13 SER CA C 13 58.091 0.3 . 1 . . . . 13 SER CA . 16666 1
148 . 1 1 13 13 SER CB C 13 63.644 0.3 . 1 . . . . 13 SER CB . 16666 1
149 . 1 1 13 13 SER N N 15 119.212 0.3 . 1 . . . . 13 SER N . 16666 1
150 . 1 1 14 14 HIS H H 1 8.681 0.02 . 1 . . . . 14 HIS H . 16666 1
151 . 1 1 14 14 HIS HA H 1 4.74 0.02 . 1 . . . . 14 HIS HA . 16666 1
152 . 1 1 14 14 HIS HB2 H 1 3.187 0.02 . 2 . . . . 14 HIS HB2 . 16666 1
153 . 1 1 14 14 HIS HB3 H 1 3.187 0.02 . 2 . . . . 14 HIS HB3 . 16666 1
154 . 1 1 14 14 HIS HD2 H 1 7.28 0.02 . 1 . . . . 14 HIS HD2 . 16666 1
155 . 1 1 14 14 HIS HE1 H 1 8.578 0.02 . 1 . . . . 14 HIS HE1 . 16666 1
156 . 1 1 14 14 HIS C C 13 174.09 0.3 . 1 . . . . 14 HIS C . 16666 1
157 . 1 1 14 14 HIS CA C 13 54.966 0.3 . 1 . . . . 14 HIS CA . 16666 1
158 . 1 1 14 14 HIS CB C 13 28.817 0.3 . 1 . . . . 14 HIS CB . 16666 1
159 . 1 1 14 14 HIS CD2 C 13 119.742 0.3 . 1 . . . . 14 HIS CD2 . 16666 1
160 . 1 1 14 14 HIS CE1 C 13 136.19 0.3 . 1 . . . . 14 HIS CE1 . 16666 1
161 . 1 1 14 14 HIS N N 15 120.434 0.3 . 1 . . . . 14 HIS N . 16666 1
162 . 1 1 15 15 GLU H H 1 8.369 0.02 . 1 . . . . 15 GLU H . 16666 1
163 . 1 1 15 15 GLU HA H 1 4.175 0.02 . 1 . . . . 15 GLU HA . 16666 1
164 . 1 1 15 15 GLU HB2 H 1 2.132 0.02 . 2 . . . . 15 GLU HB2 . 16666 1
165 . 1 1 15 15 GLU HB3 H 1 2.132 0.02 . 2 . . . . 15 GLU HB3 . 16666 1
166 . 1 1 15 15 GLU HG2 H 1 2.683 0.02 . 2 . . . . 15 GLU HG2 . 16666 1
167 . 1 1 15 15 GLU HG3 H 1 2.683 0.02 . 2 . . . . 15 GLU HG3 . 16666 1
168 . 1 1 15 15 GLU C C 13 174.118 0.3 . 1 . . . . 15 GLU C . 16666 1
169 . 1 1 15 15 GLU CA C 13 55.467 0.3 . 1 . . . . 15 GLU CA . 16666 1
170 . 1 1 15 15 GLU CB C 13 31.489 0.3 . 1 . . . . 15 GLU CB . 16666 1
171 . 1 1 15 15 GLU CG C 13 31.54 0.3 . 1 . . . . 15 GLU CG . 16666 1
172 . 1 1 15 15 GLU N N 15 121.375 0.3 . 1 . . . . 15 GLU N . 16666 1
173 . 1 1 16 16 TYR H H 1 8.15 0.02 . 1 . . . . 16 TYR H . 16666 1
174 . 1 1 16 16 TYR HA H 1 4.119 0.02 . 1 . . . . 16 TYR HA . 16666 1
175 . 1 1 16 16 TYR HB2 H 1 2.838 0.02 . 2 . . . . 16 TYR HB2 . 16666 1
176 . 1 1 16 16 TYR HB3 H 1 2.73 0.02 . 2 . . . . 16 TYR HB3 . 16666 1
177 . 1 1 16 16 TYR HD1 H 1 6.957 0.02 . 3 . . . . 16 TYR HD1 . 16666 1
178 . 1 1 16 16 TYR HD2 H 1 6.957 0.02 . 3 . . . . 16 TYR HD2 . 16666 1
179 . 1 1 16 16 TYR HE1 H 1 6.515 0.02 . 3 . . . . 16 TYR HE1 . 16666 1
180 . 1 1 16 16 TYR HE2 H 1 6.515 0.02 . 3 . . . . 16 TYR HE2 . 16666 1
181 . 1 1 16 16 TYR C C 13 176.2 0.3 . 1 . . . . 16 TYR C . 16666 1
182 . 1 1 16 16 TYR CA C 13 59.41 0.3 . 1 . . . . 16 TYR CA . 16666 1
183 . 1 1 16 16 TYR CB C 13 37.94 0.3 . 1 . . . . 16 TYR CB . 16666 1
184 . 1 1 16 16 TYR CD2 C 13 133.015 0.3 . 3 . . . . 16 TYR CD2 . 16666 1
185 . 1 1 16 16 TYR CE2 C 13 117.641 0.3 . 3 . . . . 16 TYR CE2 . 16666 1
186 . 1 1 16 16 TYR N N 15 121.4 0.3 . 1 . . . . 16 TYR N . 16666 1
187 . 1 1 17 17 LYS H H 1 7.96 0.02 . 1 . . . . 17 LYS H . 16666 1
188 . 1 1 17 17 LYS HA H 1 4.386 0.02 . 1 . . . . 17 LYS HA . 16666 1
189 . 1 1 17 17 LYS HB2 H 1 1.727 0.02 . 2 . . . . 17 LYS HB2 . 16666 1
190 . 1 1 17 17 LYS HB3 H 1 1.727 0.02 . 2 . . . . 17 LYS HB3 . 16666 1
191 . 1 1 17 17 LYS HD2 H 1 1.473 0.02 . 2 . . . . 17 LYS HD2 . 16666 1
192 . 1 1 17 17 LYS HD3 H 1 1.473 0.02 . 2 . . . . 17 LYS HD3 . 16666 1
193 . 1 1 17 17 LYS HE2 H 1 3.263 0.02 . 2 . . . . 17 LYS HE2 . 16666 1
194 . 1 1 17 17 LYS HE3 H 1 3.14 0.02 . 2 . . . . 17 LYS HE3 . 16666 1
195 . 1 1 17 17 LYS HG2 H 1 1.251 0.02 . 2 . . . . 17 LYS HG2 . 16666 1
196 . 1 1 17 17 LYS HG3 H 1 1.325 0.02 . 2 . . . . 17 LYS HG3 . 16666 1
197 . 1 1 17 17 LYS C C 13 175.28 0.3 . 1 . . . . 17 LYS C . 16666 1
198 . 1 1 17 17 LYS CA C 13 54.744 0.3 . 1 . . . . 17 LYS CA . 16666 1
199 . 1 1 17 17 LYS CB C 13 33.495 0.3 . 1 . . . . 17 LYS CB . 16666 1
200 . 1 1 17 17 LYS CD C 13 29.414 0.3 . 1 . . . . 17 LYS CD . 16666 1
201 . 1 1 17 17 LYS CE C 13 43.009 0.3 . 1 . . . . 17 LYS CE . 16666 1
202 . 1 1 17 17 LYS CG C 13 23.979 0.3 . 1 . . . . 17 LYS CG . 16666 1
203 . 1 1 17 17 LYS N N 15 128.295 0.3 . 1 . . . . 17 LYS N . 16666 1
204 . 1 1 18 18 GLY H H 1 7.254 0.02 . 1 . . . . 18 GLY H . 16666 1
205 . 1 1 18 18 GLY HA2 H 1 3.917 0.02 . 2 . . . . 18 GLY HA2 . 16666 1
206 . 1 1 18 18 GLY HA3 H 1 3.917 0.02 . 2 . . . . 18 GLY HA3 . 16666 1
207 . 1 1 18 18 GLY CA C 13 43.911 0.3 . 1 . . . . 18 GLY CA . 16666 1
208 . 1 1 18 18 GLY N N 15 107.644 0.3 . 1 . . . . 18 GLY N . 16666 1
209 . 1 1 20 20 CYS C C 13 176.2 0.3 . 1 . . . . 20 CYS C . 16666 1
210 . 1 1 21 21 ILE H H 1 8.372 0.02 . 1 . . . . 21 ILE H . 16666 1
211 . 1 1 21 21 ILE HA H 1 4.072 0.02 . 1 . . . . 21 ILE HA . 16666 1
212 . 1 1 21 21 ILE HB H 1 1.902 0.02 . 1 . . . . 21 ILE HB . 16666 1
213 . 1 1 21 21 ILE HD11 H 1 0.83 0.02 . 1 . . . . 21 ILE HD1 . 16666 1
214 . 1 1 21 21 ILE HD12 H 1 0.83 0.02 . 1 . . . . 21 ILE HD1 . 16666 1
215 . 1 1 21 21 ILE HD13 H 1 0.83 0.02 . 1 . . . . 21 ILE HD1 . 16666 1
216 . 1 1 21 21 ILE HG12 H 1 1.14 0.02 . 2 . . . . 21 ILE HG12 . 16666 1
217 . 1 1 21 21 ILE HG13 H 1 1.14 0.02 . 2 . . . . 21 ILE HG13 . 16666 1
218 . 1 1 21 21 ILE HG21 H 1 0.94 0.02 . 1 . . . . 21 ILE HG2 . 16666 1
219 . 1 1 21 21 ILE HG22 H 1 0.94 0.02 . 1 . . . . 21 ILE HG2 . 16666 1
220 . 1 1 21 21 ILE HG23 H 1 0.94 0.02 . 1 . . . . 21 ILE HG2 . 16666 1
221 . 1 1 21 21 ILE C C 13 175.97 0.3 . 1 . . . . 21 ILE C . 16666 1
222 . 1 1 21 21 ILE CA C 13 62.349 0.3 . 1 . . . . 21 ILE CA . 16666 1
223 . 1 1 21 21 ILE CB C 13 38.455 0.3 . 1 . . . . 21 ILE CB . 16666 1
224 . 1 1 21 21 ILE CD1 C 13 11.999 0.3 . 1 . . . . 21 ILE CD1 . 16666 1
225 . 1 1 21 21 ILE CG1 C 13 27.211 0.3 . 1 . . . . 21 ILE CG1 . 16666 1
226 . 1 1 21 21 ILE CG2 C 13 17.369 0.3 . 1 . . . . 21 ILE CG2 . 16666 1
227 . 1 1 21 21 ILE N N 15 111.5 0.3 . 1 . . . . 21 ILE N . 16666 1
228 . 1 1 22 22 GLN H H 1 8.117 0.02 . 1 . . . . 22 GLN H . 16666 1
229 . 1 1 22 22 GLN HA H 1 4.687 0.02 . 1 . . . . 22 GLN HA . 16666 1
230 . 1 1 22 22 GLN HB2 H 1 2.076 0.02 . 2 . . . . 22 GLN HB2 . 16666 1
231 . 1 1 22 22 GLN HB3 H 1 2.007 0.02 . 2 . . . . 22 GLN HB3 . 16666 1
232 . 1 1 22 22 GLN HE21 H 1 7.59 0.02 . 2 . . . . 22 GLN HE21 . 16666 1
233 . 1 1 22 22 GLN HE22 H 1 6.89 0.02 . 2 . . . . 22 GLN HE22 . 16666 1
234 . 1 1 22 22 GLN HG2 H 1 2.329 0.02 . 2 . . . . 22 GLN HG2 . 16666 1
235 . 1 1 22 22 GLN HG3 H 1 2.172 0.02 . 2 . . . . 22 GLN HG3 . 16666 1
236 . 1 1 22 22 GLN C C 13 175.74 0.3 . 1 . . . . 22 GLN C . 16666 1
237 . 1 1 22 22 GLN CA C 13 53.849 0.3 . 1 . . . . 22 GLN CA . 16666 1
238 . 1 1 22 22 GLN CB C 13 29.97 0.3 . 1 . . . . 22 GLN CB . 16666 1
239 . 1 1 22 22 GLN CG C 13 34.335 0.3 . 1 . . . . 22 GLN CG . 16666 1
240 . 1 1 22 22 GLN N N 15 117.946 0.3 . 1 . . . . 22 GLN N . 16666 1
241 . 1 1 22 22 GLN NE2 N 15 111.602 0.3 . 1 . . . . 22 GLN NE2 . 16666 1
242 . 1 1 23 23 ASP H H 1 8.92 0.02 . 1 . . . . 23 ASP H . 16666 1
243 . 1 1 23 23 ASP HA H 1 4.368 0.02 . 1 . . . . 23 ASP HA . 16666 1
244 . 1 1 23 23 ASP HB2 H 1 2.898 0.02 . 2 . . . . 23 ASP HB2 . 16666 1
245 . 1 1 23 23 ASP HB3 H 1 2.682 0.02 . 2 . . . . 23 ASP HB3 . 16666 1
246 . 1 1 23 23 ASP C C 13 178.46 0.3 . 1 . . . . 23 ASP C . 16666 1
247 . 1 1 23 23 ASP CA C 13 57.897 0.3 . 1 . . . . 23 ASP CA . 16666 1
248 . 1 1 23 23 ASP CB C 13 40.497 0.3 . 1 . . . . 23 ASP CB . 16666 1
249 . 1 1 23 23 ASP N N 15 125.331 0.3 . 1 . . . . 23 ASP N . 16666 1
250 . 1 1 24 24 MET H H 1 8.909 0.02 . 1 . . . . 24 MET H . 16666 1
251 . 1 1 24 24 MET HA H 1 4.306 0.02 . 1 . . . . 24 MET HA . 16666 1
252 . 1 1 24 24 MET HB2 H 1 2.118 0.02 . 2 . . . . 24 MET HB2 . 16666 1
253 . 1 1 24 24 MET HB3 H 1 2.657 0.02 . 2 . . . . 24 MET HB3 . 16666 1
254 . 1 1 24 24 MET HE1 H 1 1.915 0.02 . 1 . . . . 24 MET HE . 16666 1
255 . 1 1 24 24 MET HE2 H 1 1.915 0.02 . 1 . . . . 24 MET HE . 16666 1
256 . 1 1 24 24 MET HE3 H 1 1.915 0.02 . 1 . . . . 24 MET HE . 16666 1
257 . 1 1 24 24 MET HG2 H 1 2.326 0.02 . 2 . . . . 24 MET HG2 . 16666 1
258 . 1 1 24 24 MET HG3 H 1 2.326 0.02 . 2 . . . . 24 MET HG3 . 16666 1
259 . 1 1 24 24 MET C C 13 177.92 0.3 . 1 . . . . 24 MET C . 16666 1
260 . 1 1 24 24 MET CA C 13 58.483 0.3 . 1 . . . . 24 MET CA . 16666 1
261 . 1 1 24 24 MET CB C 13 31.329 0.3 . 1 . . . . 24 MET CB . 16666 1
262 . 1 1 24 24 MET CE C 13 16.594 0.3 . 1 . . . . 24 MET CE . 16666 1
263 . 1 1 24 24 MET CG C 13 34.273 0.3 . 1 . . . . 24 MET CG . 16666 1
264 . 1 1 24 24 MET N N 15 116.279 0.3 . 1 . . . . 24 MET N . 16666 1
265 . 1 1 25 25 ASP H H 1 7.599 0.02 . 1 . . . . 25 ASP H . 16666 1
266 . 1 1 25 25 ASP HA H 1 4.582 0.02 . 1 . . . . 25 ASP HA . 16666 1
267 . 1 1 25 25 ASP HB2 H 1 3.128 0.02 . 2 . . . . 25 ASP HB2 . 16666 1
268 . 1 1 25 25 ASP HB3 H 1 2.974 0.02 . 2 . . . . 25 ASP HB3 . 16666 1
269 . 1 1 25 25 ASP C C 13 178.37 0.3 . 1 . . . . 25 ASP C . 16666 1
270 . 1 1 25 25 ASP CA C 13 56.536 0.3 . 1 . . . . 25 ASP CA . 16666 1
271 . 1 1 25 25 ASP CB C 13 40.302 0.3 . 1 . . . . 25 ASP CB . 16666 1
272 . 1 1 25 25 ASP N N 15 119.522 0.3 . 1 . . . . 25 ASP N . 16666 1
273 . 1 1 26 26 CYS H H 1 7.014 0.02 . 1 . . . . 26 CYS H . 16666 1
274 . 1 1 26 26 CYS HA H 1 4.12 0.02 . 1 . . . . 26 CYS HA . 16666 1
275 . 1 1 26 26 CYS HB2 H 1 2.531 0.02 . 2 . . . . 26 CYS HB2 . 16666 1
276 . 1 1 26 26 CYS HB3 H 1 2.423 0.02 . 2 . . . . 26 CYS HB3 . 16666 1
277 . 1 1 26 26 CYS CA C 13 56.702 0.3 . 1 . . . . 26 CYS CA . 16666 1
278 . 1 1 26 26 CYS CB C 13 35.436 0.3 . 1 . . . . 26 CYS CB . 16666 1
279 . 1 1 26 26 CYS N N 15 119.9 0.3 . 1 . . . . 26 CYS N . 16666 1
280 . 1 1 27 27 ASN H H 1 8.214 0.02 . 1 . . . . 27 ASN H . 16666 1
281 . 1 1 27 27 ASN HA H 1 3.792 0.02 . 1 . . . . 27 ASN HA . 16666 1
282 . 1 1 27 27 ASN HB2 H 1 2.976 0.02 . 2 . . . . 27 ASN HB2 . 16666 1
283 . 1 1 27 27 ASN HB3 H 1 2.85 0.02 . 2 . . . . 27 ASN HB3 . 16666 1
284 . 1 1 27 27 ASN HD21 H 1 7.6 0.02 . 2 . . . . 27 ASN HD21 . 16666 1
285 . 1 1 27 27 ASN HD22 H 1 7.176 0.02 . 2 . . . . 27 ASN HD22 . 16666 1
286 . 1 1 27 27 ASN C C 13 175.87 0.3 . 1 . . . . 27 ASN C . 16666 1
287 . 1 1 27 27 ASN CA C 13 57.913 0.3 . 1 . . . . 27 ASN CA . 16666 1
288 . 1 1 27 27 ASN CB C 13 39.953 0.3 . 1 . . . . 27 ASN CB . 16666 1
289 . 1 1 27 27 ASN ND2 N 15 113.738 0.3 . 1 . . . . 27 ASN ND2 . 16666 1
290 . 1 1 28 28 ALA H H 1 7.852 0.02 . 1 . . . . 28 ALA H . 16666 1
291 . 1 1 28 28 ALA HA H 1 4.085 0.02 . 1 . . . . 28 ALA HA . 16666 1
292 . 1 1 28 28 ALA HB1 H 1 1.545 0.02 . 1 . . . . 28 ALA HB . 16666 1
293 . 1 1 28 28 ALA HB2 H 1 1.545 0.02 . 1 . . . . 28 ALA HB . 16666 1
294 . 1 1 28 28 ALA HB3 H 1 1.545 0.02 . 1 . . . . 28 ALA HB . 16666 1
295 . 1 1 28 28 ALA C C 13 179.95 0.3 . 1 . . . . 28 ALA C . 16666 1
296 . 1 1 28 28 ALA CA C 13 54.578 0.3 . 1 . . . . 28 ALA CA . 16666 1
297 . 1 1 28 28 ALA CB C 13 18.017 0.3 . 1 . . . . 28 ALA CB . 16666 1
298 . 1 1 28 28 ALA N N 15 117.061 0.3 . 1 . . . . 28 ALA N . 16666 1
299 . 1 1 29 29 ALA H H 1 7.486 0.02 . 1 . . . . 29 ALA H . 16666 1
300 . 1 1 29 29 ALA HA H 1 4.185 0.02 . 1 . . . . 29 ALA HA . 16666 1
301 . 1 1 29 29 ALA HB1 H 1 1.723 0.02 . 1 . . . . 29 ALA HB . 16666 1
302 . 1 1 29 29 ALA HB2 H 1 1.723 0.02 . 1 . . . . 29 ALA HB . 16666 1
303 . 1 1 29 29 ALA HB3 H 1 1.723 0.02 . 1 . . . . 29 ALA HB . 16666 1
304 . 1 1 29 29 ALA C C 13 180.58 0.3 . 1 . . . . 29 ALA C . 16666 1
305 . 1 1 29 29 ALA CA C 13 54.399 0.3 . 1 . . . . 29 ALA CA . 16666 1
306 . 1 1 29 29 ALA CB C 13 18.384 0.3 . 1 . . . . 29 ALA CB . 16666 1
307 . 1 1 29 29 ALA N N 15 119.548 0.3 . 1 . . . . 29 ALA N . 16666 1
308 . 1 1 30 30 CYS H H 1 8.568 0.02 . 1 . . . . 30 CYS H . 16666 1
309 . 1 1 30 30 CYS HA H 1 4.43 0.02 . 1 . . . . 30 CYS HA . 16666 1
310 . 1 1 30 30 CYS HB2 H 1 2.496 0.02 . 2 . . . . 30 CYS HB2 . 16666 1
311 . 1 1 30 30 CYS HB3 H 1 2.791 0.02 . 2 . . . . 30 CYS HB3 . 16666 1
312 . 1 1 30 30 CYS C C 13 176.2 0.3 . 1 . . . . 30 CYS C . 16666 1
313 . 1 1 30 30 CYS CA C 13 59.957 0.3 . 1 . . . . 30 CYS CA . 16666 1
314 . 1 1 30 30 CYS CB C 13 38.415 0.3 . 1 . . . . 30 CYS CB . 16666 1
315 . 1 1 30 30 CYS N N 15 118.405 0.3 . 1 . . . . 30 CYS N . 16666 1
316 . 1 1 31 31 VAL H H 1 7.862 0.02 . 1 . . . . 31 VAL H . 16666 1
317 . 1 1 31 31 VAL HA H 1 4.077 0.02 . 1 . . . . 31 VAL HA . 16666 1
318 . 1 1 31 31 VAL HB H 1 2.206 0.02 . 1 . . . . 31 VAL HB . 16666 1
319 . 1 1 31 31 VAL HG11 H 1 0.981 0.02 . 2 . . . . 31 VAL HG1 . 16666 1
320 . 1 1 31 31 VAL HG12 H 1 0.981 0.02 . 2 . . . . 31 VAL HG1 . 16666 1
321 . 1 1 31 31 VAL HG13 H 1 0.981 0.02 . 2 . . . . 31 VAL HG1 . 16666 1
322 . 1 1 31 31 VAL HG21 H 1 0.908 0.02 . 2 . . . . 31 VAL HG2 . 16666 1
323 . 1 1 31 31 VAL HG22 H 1 0.908 0.02 . 2 . . . . 31 VAL HG2 . 16666 1
324 . 1 1 31 31 VAL HG23 H 1 0.908 0.02 . 2 . . . . 31 VAL HG2 . 16666 1
325 . 1 1 31 31 VAL C C 13 177.61 0.3 . 1 . . . . 31 VAL C . 16666 1
326 . 1 1 31 31 VAL CA C 13 64.712 0.3 . 1 . . . . 31 VAL CA . 16666 1
327 . 1 1 31 31 VAL CB C 13 30.886 0.3 . 1 . . . . 31 VAL CB . 16666 1
328 . 1 1 31 31 VAL CG1 C 13 20.099 0.3 . 2 . . . . 31 VAL CG1 . 16666 1
329 . 1 1 31 31 VAL N N 15 113.993 0.3 . 1 . . . . 31 VAL N . 16666 1
330 . 1 1 32 32 LYS H H 1 7.122 0.02 . 1 . . . . 32 LYS H . 16666 1
331 . 1 1 32 32 LYS HA H 1 4.191 0.02 . 1 . . . . 32 LYS HA . 16666 1
332 . 1 1 32 32 LYS HB2 H 1 1.847 0.02 . 2 . . . . 32 LYS HB2 . 16666 1
333 . 1 1 32 32 LYS HB3 H 1 1.96 0.02 . 2 . . . . 32 LYS HB3 . 16666 1
334 . 1 1 32 32 LYS HD2 H 1 1.65 0.02 . 2 . . . . 32 LYS HD2 . 16666 1
335 . 1 1 32 32 LYS HD3 H 1 1.729 0.02 . 2 . . . . 32 LYS HD3 . 16666 1
336 . 1 1 32 32 LYS HE2 H 1 3.21 0.02 . 2 . . . . 32 LYS HE2 . 16666 1
337 . 1 1 32 32 LYS HE3 H 1 3.21 0.02 . 2 . . . . 32 LYS HE3 . 16666 1
338 . 1 1 32 32 LYS HG2 H 1 1.389 0.02 . 2 . . . . 32 LYS HG2 . 16666 1
339 . 1 1 32 32 LYS HG3 H 1 1.389 0.02 . 2 . . . . 32 LYS HG3 . 16666 1
340 . 1 1 32 32 LYS C C 13 177.4 0.3 . 1 . . . . 32 LYS C . 16666 1
341 . 1 1 32 32 LYS CA C 13 57.239 0.3 . 1 . . . . 32 LYS CA . 16666 1
342 . 1 1 32 32 LYS CB C 13 32.495 0.3 . 1 . . . . 32 LYS CB . 16666 1
343 . 1 1 32 32 LYS CD C 13 26.741 0.3 . 1 . . . . 32 LYS CD . 16666 1
344 . 1 1 32 32 LYS CE C 13 43.116 0.3 . 1 . . . . 32 LYS CE . 16666 1
345 . 1 1 32 32 LYS CG C 13 24.306 0.3 . 1 . . . . 32 LYS CG . 16666 1
346 . 1 1 32 32 LYS N N 15 117.375 0.3 . 1 . . . . 32 LYS N . 16666 1
347 . 1 1 33 33 GLU H H 1 8.024 0.02 . 1 . . . . 33 GLU H . 16666 1
348 . 1 1 33 33 GLU HA H 1 4.031 0.02 . 1 . . . . 33 GLU HA . 16666 1
349 . 1 1 33 33 GLU HB2 H 1 2.105 0.02 . 2 . . . . 33 GLU HB2 . 16666 1
350 . 1 1 33 33 GLU HB3 H 1 1.93 0.02 . 2 . . . . 33 GLU HB3 . 16666 1
351 . 1 1 33 33 GLU HG2 H 1 2.427 0.02 . 2 . . . . 33 GLU HG2 . 16666 1
352 . 1 1 33 33 GLU HG3 H 1 2.33 0.02 . 2 . . . . 33 GLU HG3 . 16666 1
353 . 1 1 33 33 GLU C C 13 176.94 0.3 . 1 . . . . 33 GLU C . 16666 1
354 . 1 1 33 33 GLU CA C 13 58.682 0.3 . 1 . . . . 33 GLU CA . 16666 1
355 . 1 1 33 33 GLU CB C 13 30.375 0.3 . 1 . . . . 33 GLU CB . 16666 1
356 . 1 1 33 33 GLU CG C 13 35.908 0.3 . 1 . . . . 33 GLU CG . 16666 1
357 . 1 1 33 33 GLU N N 15 122.251 0.3 . 1 . . . . 33 GLU N . 16666 1
358 . 1 1 34 34 SER H H 1 7.486 0.02 . 1 . . . . 34 SER H . 16666 1
359 . 1 1 34 34 SER HA H 1 4.423 0.02 . 1 . . . . 34 SER HA . 16666 1
360 . 1 1 34 34 SER HB2 H 1 3.763 0.02 . 2 . . . . 34 SER HB2 . 16666 1
361 . 1 1 34 34 SER HB3 H 1 3.975 0.02 . 2 . . . . 34 SER HB3 . 16666 1
362 . 1 1 34 34 SER C C 13 171.86 0.3 . 1 . . . . 34 SER C . 16666 1
363 . 1 1 34 34 SER CA C 13 57.018 0.3 . 1 . . . . 34 SER CA . 16666 1
364 . 1 1 34 34 SER CB C 13 63.237 0.3 . 1 . . . . 34 SER CB . 16666 1
365 . 1 1 34 34 SER N N 15 109.114 0.3 . 1 . . . . 34 SER N . 16666 1
366 . 1 1 35 35 GLU H H 1 8.803 0.02 . 1 . . . . 35 GLU H . 16666 1
367 . 1 1 35 35 GLU HA H 1 4.483 0.02 . 1 . . . . 35 GLU HA . 16666 1
368 . 1 1 35 35 GLU HB2 H 1 2.16 0.02 . 2 . . . . 35 GLU HB2 . 16666 1
369 . 1 1 35 35 GLU HB3 H 1 2.001 0.02 . 2 . . . . 35 GLU HB3 . 16666 1
370 . 1 1 35 35 GLU HG2 H 1 2.467 0.02 . 2 . . . . 35 GLU HG2 . 16666 1
371 . 1 1 35 35 GLU HG3 H 1 2.467 0.02 . 2 . . . . 35 GLU HG3 . 16666 1
372 . 1 1 35 35 GLU C C 13 176.2 0.3 . 1 . . . . 35 GLU C . 16666 1
373 . 1 1 35 35 GLU CA C 13 57.216 0.3 . 1 . . . . 35 GLU CA . 16666 1
374 . 1 1 35 35 GLU CB C 13 27.86 0.3 . 1 . . . . 35 GLU CB . 16666 1
375 . 1 1 35 35 GLU CG C 13 33.989 0.3 . 1 . . . . 35 GLU CG . 16666 1
376 . 1 1 35 35 GLU N N 15 126.255 0.3 . 1 . . . . 35 GLU N . 16666 1
377 . 1 1 36 36 SER H H 1 8.079 0.02 . 1 . . . . 36 SER H . 16666 1
378 . 1 1 36 36 SER HA H 1 4.27 0.02 . 1 . . . . 36 SER HA . 16666 1
379 . 1 1 36 36 SER HB2 H 1 3.768 0.02 . 2 . . . . 36 SER HB2 . 16666 1
380 . 1 1 36 36 SER HB3 H 1 3.624 0.02 . 2 . . . . 36 SER HB3 . 16666 1
381 . 1 1 36 36 SER C C 13 174.78 0.3 . 1 . . . . 36 SER C . 16666 1
382 . 1 1 36 36 SER CA C 13 58.956 0.3 . 1 . . . . 36 SER CA . 16666 1
383 . 1 1 36 36 SER CB C 13 63.253 0.3 . 1 . . . . 36 SER CB . 16666 1
384 . 1 1 36 36 SER N N 15 112.298 0.3 . 1 . . . . 36 SER N . 16666 1
385 . 1 1 37 37 TYR H H 1 7.486 0.02 . 1 . . . . 37 TYR H . 16666 1
386 . 1 1 37 37 TYR HA H 1 5.325 0.02 . 1 . . . . 37 TYR HA . 16666 1
387 . 1 1 37 37 TYR HB2 H 1 3.167 0.02 . 2 . . . . 37 TYR HB2 . 16666 1
388 . 1 1 37 37 TYR HB3 H 1 3.298 0.02 . 2 . . . . 37 TYR HB3 . 16666 1
389 . 1 1 37 37 TYR HD1 H 1 7.318 0.02 . 3 . . . . 37 TYR HD1 . 16666 1
390 . 1 1 37 37 TYR HD2 H 1 7.318 0.02 . 3 . . . . 37 TYR HD2 . 16666 1
391 . 1 1 37 37 TYR HE1 H 1 6.658 0.02 . 3 . . . . 37 TYR HE1 . 16666 1
392 . 1 1 37 37 TYR HE2 H 1 6.658 0.02 . 3 . . . . 37 TYR HE2 . 16666 1
393 . 1 1 37 37 TYR C C 13 176.45 0.3 . 1 . . . . 37 TYR C . 16666 1
394 . 1 1 37 37 TYR CA C 13 55.032 0.3 . 1 . . . . 37 TYR CA . 16666 1
395 . 1 1 37 37 TYR CB C 13 36.395 0.3 . 1 . . . . 37 TYR CB . 16666 1
396 . 1 1 37 37 TYR CD2 C 13 132.476 0.3 . 3 . . . . 37 TYR CD2 . 16666 1
397 . 1 1 37 37 TYR CE2 C 13 117.891 0.3 . 3 . . . . 37 TYR CE2 . 16666 1
398 . 1 1 37 37 TYR N N 15 118.927 0.3 . 1 . . . . 37 TYR N . 16666 1
399 . 1 1 38 38 THR H H 1 8.978 0.02 . 1 . . . . 38 THR H . 16666 1
400 . 1 1 38 38 THR HA H 1 4.52 0.02 . 1 . . . . 38 THR HA . 16666 1
401 . 1 1 38 38 THR HB H 1 4.118 0.02 . 1 . . . . 38 THR HB . 16666 1
402 . 1 1 38 38 THR HG21 H 1 1.254 0.02 . 1 . . . . 38 THR HG2 . 16666 1
403 . 1 1 38 38 THR HG22 H 1 1.254 0.02 . 1 . . . . 38 THR HG2 . 16666 1
404 . 1 1 38 38 THR HG23 H 1 1.254 0.02 . 1 . . . . 38 THR HG2 . 16666 1
405 . 1 1 38 38 THR C C 13 174.79 0.3 . 1 . . . . 38 THR C . 16666 1
406 . 1 1 38 38 THR CA C 13 60.293 0.3 . 1 . . . . 38 THR CA . 16666 1
407 . 1 1 38 38 THR CB C 13 69.45 0.3 . 1 . . . . 38 THR CB . 16666 1
408 . 1 1 38 38 THR CG2 C 13 21.267 0.3 . 1 . . . . 38 THR CG2 . 16666 1
409 . 1 1 38 38 THR N N 15 109.308 0.3 . 1 . . . . 38 THR N . 16666 1
410 . 1 1 39 39 GLY H H 1 7.569 0.02 . 1 . . . . 39 GLY H . 16666 1
411 . 1 1 39 39 GLY HA2 H 1 4.182 0.02 . 2 . . . . 39 GLY HA2 . 16666 1
412 . 1 1 39 39 GLY HA3 H 1 3.896 0.02 . 2 . . . . 39 GLY HA3 . 16666 1
413 . 1 1 39 39 GLY C C 13 171.51 0.3 . 1 . . . . 39 GLY C . 16666 1
414 . 1 1 39 39 GLY CA C 13 44.854 0.3 . 1 . . . . 39 GLY CA . 16666 1
415 . 1 1 39 39 GLY N N 15 109.173 0.3 . 1 . . . . 39 GLY N . 16666 1
416 . 1 1 40 40 GLY H H 1 8.214 0.02 . 1 . . . . 40 GLY H . 16666 1
417 . 1 1 40 40 GLY HA2 H 1 4.896 0.02 . 2 . . . . 40 GLY HA2 . 16666 1
418 . 1 1 40 40 GLY HA3 H 1 4.229 0.02 . 2 . . . . 40 GLY HA3 . 16666 1
419 . 1 1 40 40 GLY C C 13 170.22 0.3 . 1 . . . . 40 GLY C . 16666 1
420 . 1 1 40 40 GLY CA C 13 46.719 0.3 . 1 . . . . 40 GLY CA . 16666 1
421 . 1 1 40 40 GLY N N 15 107.805 0.3 . 1 . . . . 40 GLY N . 16666 1
422 . 1 1 41 41 PHE H H 1 9.116 0.02 . 1 . . . . 41 PHE H . 16666 1
423 . 1 1 41 41 PHE HA H 1 4.63 0.02 . 1 . . . . 41 PHE HA . 16666 1
424 . 1 1 41 41 PHE HB2 H 1 3.112 0.02 . 2 . . . . 41 PHE HB2 . 16666 1
425 . 1 1 41 41 PHE HB3 H 1 3.134 0.02 . 2 . . . . 41 PHE HB3 . 16666 1
426 . 1 1 41 41 PHE HD1 H 1 7.052 0.02 . 3 . . . . 41 PHE HD1 . 16666 1
427 . 1 1 41 41 PHE HD2 H 1 7.052 0.02 . 3 . . . . 41 PHE HD2 . 16666 1
428 . 1 1 41 41 PHE C C 13 172.01 0.3 . 1 . . . . 41 PHE C . 16666 1
429 . 1 1 41 41 PHE CA C 13 55.583 0.3 . 1 . . . . 41 PHE CA . 16666 1
430 . 1 1 41 41 PHE CB C 13 40.748 0.3 . 1 . . . . 41 PHE CB . 16666 1
431 . 1 1 41 41 PHE CD2 C 13 132.458 0.3 . 3 . . . . 41 PHE CD2 . 16666 1
432 . 1 1 41 41 PHE N N 15 116.362 0.3 . 1 . . . . 41 PHE N . 16666 1
433 . 1 1 42 42 CYS H H 1 8.882 0.02 . 1 . . . . 42 CYS H . 16666 1
434 . 1 1 42 42 CYS HA H 1 5.168 0.02 . 1 . . . . 42 CYS HA . 16666 1
435 . 1 1 42 42 CYS HB2 H 1 2.977 0.02 . 2 . . . . 42 CYS HB2 . 16666 1
436 . 1 1 42 42 CYS HB3 H 1 2.62 0.02 . 2 . . . . 42 CYS HB3 . 16666 1
437 . 1 1 42 42 CYS CA C 13 52.688 0.3 . 1 . . . . 42 CYS CA . 16666 1
438 . 1 1 42 42 CYS CB C 13 38.758 0.3 . 1 . . . . 42 CYS CB . 16666 1
439 . 1 1 42 42 CYS N N 15 118.9 0.3 . 1 . . . . 42 CYS N . 16666 1
440 . 1 1 43 43 ASN H H 1 9.577 0.02 . 1 . . . . 43 ASN H . 16666 1
441 . 1 1 43 43 ASN HA H 1 5.052 0.02 . 1 . . . . 43 ASN HA . 16666 1
442 . 1 1 43 43 ASN HB2 H 1 2.55 0.02 . 2 . . . . 43 ASN HB2 . 16666 1
443 . 1 1 43 43 ASN HB3 H 1 2.235 0.02 . 2 . . . . 43 ASN HB3 . 16666 1
444 . 1 1 43 43 ASN HD21 H 1 6.808 0.02 . 2 . . . . 43 ASN HD21 . 16666 1
445 . 1 1 43 43 ASN HD22 H 1 6.417 0.02 . 2 . . . . 43 ASN HD22 . 16666 1
446 . 1 1 43 43 ASN C C 13 173.84 0.3 . 1 . . . . 43 ASN C . 16666 1
447 . 1 1 43 43 ASN CA C 13 52.203 0.3 . 1 . . . . 43 ASN CA . 16666 1
448 . 1 1 43 43 ASN CB C 13 43.097 0.3 . 1 . . . . 43 ASN CB . 16666 1
449 . 1 1 43 43 ASN N N 15 124.567 0.3 . 1 . . . . 43 ASN N . 16666 1
450 . 1 1 43 43 ASN ND2 N 15 111.629 0.3 . 1 . . . . 43 ASN ND2 . 16666 1
451 . 1 1 44 44 GLY H H 1 8.455 0.02 . 1 . . . . 44 GLY H . 16666 1
452 . 1 1 44 44 GLY HA2 H 1 3.761 0.02 . 2 . . . . 44 GLY HA2 . 16666 1
453 . 1 1 44 44 GLY HA3 H 1 4.658 0.02 . 2 . . . . 44 GLY HA3 . 16666 1
454 . 1 1 44 44 GLY C C 13 172.46 0.3 . 1 . . . . 44 GLY C . 16666 1
455 . 1 1 44 44 GLY CA C 13 43.629 0.3 . 1 . . . . 44 GLY CA . 16666 1
456 . 1 1 44 44 GLY N N 15 111.814 0.3 . 1 . . . . 44 GLY N . 16666 1
457 . 1 1 45 45 ARG H H 1 8.489 0.02 . 1 . . . . 45 ARG H . 16666 1
458 . 1 1 45 45 ARG HA H 1 4.812 0.02 . 1 . . . . 45 ARG HA . 16666 1
459 . 1 1 45 45 ARG HB2 H 1 1.873 0.02 . 2 . . . . 45 ARG HB2 . 16666 1
460 . 1 1 45 45 ARG HB3 H 1 1.873 0.02 . 2 . . . . 45 ARG HB3 . 16666 1
461 . 1 1 45 45 ARG HD2 H 1 3.25 0.02 . 2 . . . . 45 ARG HD2 . 16666 1
462 . 1 1 45 45 ARG HD3 H 1 3.25 0.02 . 2 . . . . 45 ARG HD3 . 16666 1
463 . 1 1 45 45 ARG HG2 H 1 1.728 0.02 . 2 . . . . 45 ARG HG2 . 16666 1
464 . 1 1 45 45 ARG HG3 H 1 1.728 0.02 . 2 . . . . 45 ARG HG3 . 16666 1
465 . 1 1 45 45 ARG CA C 13 52.567 0.3 . 1 . . . . 45 ARG CA . 16666 1
466 . 1 1 45 45 ARG CB C 13 30.46 0.3 . 1 . . . . 45 ARG CB . 16666 1
467 . 1 1 45 45 ARG CD C 13 44.043 0.3 . 1 . . . . 45 ARG CD . 16666 1
468 . 1 1 45 45 ARG CG C 13 26.436 0.3 . 1 . . . . 45 ARG CG . 16666 1
469 . 1 1 45 45 ARG N N 15 120.702 0.3 . 1 . . . . 45 ARG N . 16666 1
470 . 1 1 46 46 PRO HA H 1 4.37 0.02 . 1 . . . . 46 PRO HA . 16666 1
471 . 1 1 46 46 PRO HB2 H 1 2.318 0.02 . 2 . . . . 46 PRO HB2 . 16666 1
472 . 1 1 46 46 PRO HB3 H 1 1.88 0.02 . 2 . . . . 46 PRO HB3 . 16666 1
473 . 1 1 46 46 PRO HD2 H 1 3.87 0.02 . 2 . . . . 46 PRO HD2 . 16666 1
474 . 1 1 46 46 PRO HD3 H 1 3.73 0.02 . 2 . . . . 46 PRO HD3 . 16666 1
475 . 1 1 46 46 PRO HG2 H 1 2.16 0.02 . 2 . . . . 46 PRO HG2 . 16666 1
476 . 1 1 46 46 PRO HG3 H 1 1.998 0.02 . 2 . . . . 46 PRO HG3 . 16666 1
477 . 1 1 46 46 PRO CA C 13 61.6 0.3 . 1 . . . . 46 PRO CA . 16666 1
478 . 1 1 46 46 PRO CB C 13 30.569 0.3 . 1 . . . . 46 PRO CB . 16666 1
479 . 1 1 46 46 PRO CD C 13 50.657 0.3 . 1 . . . . 46 PRO CD . 16666 1
480 . 1 1 46 46 PRO CG C 13 27.279 0.3 . 1 . . . . 46 PRO CG . 16666 1
481 . 1 1 47 47 PRO HA H 1 4.602 0.02 . 1 . . . . 47 PRO HA . 16666 1
482 . 1 1 47 47 PRO HB2 H 1 1.958 0.02 . 2 . . . . 47 PRO HB2 . 16666 1
483 . 1 1 47 47 PRO HB3 H 1 1.958 0.02 . 2 . . . . 47 PRO HB3 . 16666 1
484 . 1 1 47 47 PRO HD2 H 1 3.353 0.02 . 2 . . . . 47 PRO HD2 . 16666 1
485 . 1 1 47 47 PRO HD3 H 1 3.2 0.02 . 2 . . . . 47 PRO HD3 . 16666 1
486 . 1 1 47 47 PRO HG2 H 1 1.64 0.02 . 2 . . . . 47 PRO HG2 . 16666 1
487 . 1 1 47 47 PRO HG3 H 1 0.669 0.02 . 2 . . . . 47 PRO HG3 . 16666 1
488 . 1 1 47 47 PRO C C 13 175.05 0.3 . 1 . . . . 47 PRO C . 16666 1
489 . 1 1 47 47 PRO CA C 13 63.632 0.3 . 1 . . . . 47 PRO CA . 16666 1
490 . 1 1 47 47 PRO CB C 13 32.465 0.3 . 1 . . . . 47 PRO CB . 16666 1
491 . 1 1 47 47 PRO CD C 13 49.416 0.3 . 1 . . . . 47 PRO CD . 16666 1
492 . 1 1 47 47 PRO CG C 13 23.3 0.3 . 1 . . . . 47 PRO CG . 16666 1
493 . 1 1 48 48 PHE H H 1 8.607 0.02 . 1 . . . . 48 PHE H . 16666 1
494 . 1 1 48 48 PHE HA H 1 5.023 0.02 . 1 . . . . 48 PHE HA . 16666 1
495 . 1 1 48 48 PHE HB2 H 1 3.444 0.02 . 2 . . . . 48 PHE HB2 . 16666 1
496 . 1 1 48 48 PHE HB3 H 1 2.936 0.02 . 2 . . . . 48 PHE HB3 . 16666 1
497 . 1 1 48 48 PHE HD1 H 1 7.242 0.02 . 3 . . . . 48 PHE HD1 . 16666 1
498 . 1 1 48 48 PHE HD2 H 1 7.242 0.02 . 3 . . . . 48 PHE HD2 . 16666 1
499 . 1 1 48 48 PHE C C 13 175.28 0.3 . 1 . . . . 48 PHE C . 16666 1
500 . 1 1 48 48 PHE CA C 13 56.139 0.3 . 1 . . . . 48 PHE CA . 16666 1
501 . 1 1 48 48 PHE CB C 13 38.544 0.3 . 1 . . . . 48 PHE CB . 16666 1
502 . 1 1 48 48 PHE CD2 C 13 131.346 0.3 . 3 . . . . 48 PHE CD2 . 16666 1
503 . 1 1 48 48 PHE N N 15 125.157 0.3 . 1 . . . . 48 PHE N . 16666 1
504 . 1 1 49 49 LYS H H 1 7.982 0.02 . 1 . . . . 49 LYS H . 16666 1
505 . 1 1 49 49 LYS HA H 1 4.419 0.02 . 1 . . . . 49 LYS HA . 16666 1
506 . 1 1 49 49 LYS HB2 H 1 1.998 0.02 . 2 . . . . 49 LYS HB2 . 16666 1
507 . 1 1 49 49 LYS HB3 H 1 1.998 0.02 . 2 . . . . 49 LYS HB3 . 16666 1
508 . 1 1 49 49 LYS HD2 H 1 1.88 0.02 . 2 . . . . 49 LYS HD2 . 16666 1
509 . 1 1 49 49 LYS HD3 H 1 1.88 0.02 . 2 . . . . 49 LYS HD3 . 16666 1
510 . 1 1 49 49 LYS HE2 H 1 3.565 0.02 . 2 . . . . 49 LYS HE2 . 16666 1
511 . 1 1 49 49 LYS HE3 H 1 3.565 0.02 . 2 . . . . 49 LYS HE3 . 16666 1
512 . 1 1 49 49 LYS HG2 H 1 1.453 0.02 . 2 . . . . 49 LYS HG2 . 16666 1
513 . 1 1 49 49 LYS HG3 H 1 1.453 0.02 . 2 . . . . 49 LYS HG3 . 16666 1
514 . 1 1 49 49 LYS C C 13 176.44 0.3 . 1 . . . . 49 LYS C . 16666 1
515 . 1 1 49 49 LYS CA C 13 57.17 0.3 . 1 . . . . 49 LYS CA . 16666 1
516 . 1 1 49 49 LYS CB C 13 33.325 0.3 . 1 . . . . 49 LYS CB . 16666 1
517 . 1 1 49 49 LYS CD C 13 27.714 0.3 . 1 . . . . 49 LYS CD . 16666 1
518 . 1 1 49 49 LYS N N 15 120.895 0.3 . 1 . . . . 49 LYS N . 16666 1
519 . 1 1 50 50 GLN H H 1 8.406 0.02 . 1 . . . . 50 GLN H . 16666 1
520 . 1 1 50 50 GLN HA H 1 4.801 0.02 . 1 . . . . 50 GLN HA . 16666 1
521 . 1 1 50 50 GLN HB2 H 1 1.741 0.02 . 2 . . . . 50 GLN HB2 . 16666 1
522 . 1 1 50 50 GLN HB3 H 1 1.741 0.02 . 2 . . . . 50 GLN HB3 . 16666 1
523 . 1 1 50 50 GLN HE21 H 1 7.53 0.02 . 2 . . . . 50 GLN HE21 . 16666 1
524 . 1 1 50 50 GLN HE22 H 1 6.84 0.02 . 2 . . . . 50 GLN HE22 . 16666 1
525 . 1 1 50 50 GLN HG2 H 1 1.928 0.02 . 2 . . . . 50 GLN HG2 . 16666 1
526 . 1 1 50 50 GLN HG3 H 1 1.928 0.02 . 2 . . . . 50 GLN HG3 . 16666 1
527 . 1 1 50 50 GLN C C 13 174.56 0.3 . 1 . . . . 50 GLN C . 16666 1
528 . 1 1 50 50 GLN CA C 13 53.893 0.3 . 1 . . . . 50 GLN CA . 16666 1
529 . 1 1 50 50 GLN CB C 13 33.119 0.3 . 1 . . . . 50 GLN CB . 16666 1
530 . 1 1 50 50 GLN N N 15 119.063 0.3 . 1 . . . . 50 GLN N . 16666 1
531 . 1 1 50 50 GLN NE2 N 15 111.322 0.3 . 1 . . . . 50 GLN NE2 . 16666 1
532 . 1 1 51 51 CYS H H 1 9.216 0.02 . 1 . . . . 51 CYS H . 16666 1
533 . 1 1 51 51 CYS HA H 1 4.712 0.02 . 1 . . . . 51 CYS HA . 16666 1
534 . 1 1 51 51 CYS HB2 H 1 2.352 0.02 . 2 . . . . 51 CYS HB2 . 16666 1
535 . 1 1 51 51 CYS HB3 H 1 2.305 0.02 . 2 . . . . 51 CYS HB3 . 16666 1
536 . 1 1 51 51 CYS C C 13 172.71 0.3 . 1 . . . . 51 CYS C . 16666 1
537 . 1 1 51 51 CYS CA C 13 55.069 0.3 . 1 . . . . 51 CYS CA . 16666 1
538 . 1 1 51 51 CYS CB C 13 35.636 0.3 . 1 . . . . 51 CYS CB . 16666 1
539 . 1 1 51 51 CYS N N 15 121.534 0.3 . 1 . . . . 51 CYS N . 16666 1
540 . 1 1 52 52 PHE H H 1 8.96 0.02 . 1 . . . . 52 PHE H . 16666 1
541 . 1 1 52 52 PHE HA H 1 4.529 0.02 . 1 . . . . 52 PHE HA . 16666 1
542 . 1 1 52 52 PHE HB2 H 1 2.196 0.02 . 2 . . . . 52 PHE HB2 . 16666 1
543 . 1 1 52 52 PHE HB3 H 1 2.196 0.02 . 2 . . . . 52 PHE HB3 . 16666 1
544 . 1 1 52 52 PHE HD1 H 1 6.826 0.02 . 3 . . . . 52 PHE HD1 . 16666 1
545 . 1 1 52 52 PHE HD2 H 1 6.826 0.02 . 3 . . . . 52 PHE HD2 . 16666 1
546 . 1 1 52 52 PHE HE1 H 1 7.355 0.02 . 3 . . . . 52 PHE HE1 . 16666 1
547 . 1 1 52 52 PHE HE2 H 1 7.355 0.02 . 3 . . . . 52 PHE HE2 . 16666 1
548 . 1 1 52 52 PHE HZ H 1 7.007 0.02 . 1 . . . . 52 PHE HZ . 16666 1
549 . 1 1 52 52 PHE C C 13 172.46 0.3 . 1 . . . . 52 PHE C . 16666 1
550 . 1 1 52 52 PHE CA C 13 56.4 0.3 . 1 . . . . 52 PHE CA . 16666 1
551 . 1 1 52 52 PHE CB C 13 41.4 0.3 . 1 . . . . 52 PHE CB . 16666 1
552 . 1 1 52 52 PHE CD2 C 13 130.496 0.3 . 3 . . . . 52 PHE CD2 . 16666 1
553 . 1 1 52 52 PHE CE2 C 13 131.596 0.3 . 3 . . . . 52 PHE CE2 . 16666 1
554 . 1 1 52 52 PHE CZ C 13 129.922 0.3 . 1 . . . . 52 PHE CZ . 16666 1
555 . 1 1 52 52 PHE N N 15 131.266 0.3 . 1 . . . . 52 PHE N . 16666 1
556 . 1 1 53 53 CYS H H 1 8.841 0.02 . 1 . . . . 53 CYS H . 16666 1
557 . 1 1 53 53 CYS HA H 1 5.401 0.02 . 1 . . . . 53 CYS HA . 16666 1
558 . 1 1 53 53 CYS HB2 H 1 1.998 0.02 . 2 . . . . 53 CYS HB2 . 16666 1
559 . 1 1 53 53 CYS HB3 H 1 1.334 0.02 . 2 . . . . 53 CYS HB3 . 16666 1
560 . 1 1 53 53 CYS C C 13 175.28 0.3 . 1 . . . . 53 CYS C . 16666 1
561 . 1 1 53 53 CYS CA C 13 50.648 0.3 . 1 . . . . 53 CYS CA . 16666 1
562 . 1 1 53 53 CYS CB C 13 34.836 0.3 . 1 . . . . 53 CYS CB . 16666 1
563 . 1 1 53 53 CYS N N 15 118.529 0.3 . 1 . . . . 53 CYS N . 16666 1
564 . 1 1 54 54 THR H H 1 8.418 0.02 . 1 . . . . 54 THR H . 16666 1
565 . 1 1 54 54 THR HA H 1 5.206 0.02 . 1 . . . . 54 THR HA . 16666 1
566 . 1 1 54 54 THR HG21 H 1 1.099 0.02 . 1 . . . . 54 THR HG2 . 16666 1
567 . 1 1 54 54 THR HG22 H 1 1.099 0.02 . 1 . . . . 54 THR HG2 . 16666 1
568 . 1 1 54 54 THR HG23 H 1 1.099 0.02 . 1 . . . . 54 THR HG2 . 16666 1
569 . 1 1 54 54 THR C C 13 173.64 0.3 . 1 . . . . 54 THR C . 16666 1
570 . 1 1 54 54 THR CA C 13 59.32 0.3 . 1 . . . . 54 THR CA . 16666 1
571 . 1 1 54 54 THR CB C 13 70.874 0.3 . 1 . . . . 54 THR CB . 16666 1
572 . 1 1 54 54 THR CG2 C 13 21.862 0.3 . 1 . . . . 54 THR CG2 . 16666 1
573 . 1 1 54 54 THR N N 15 112.664 0.3 . 1 . . . . 54 THR N . 16666 1
574 . 1 1 55 55 LYS H H 1 8.413 0.02 . 1 . . . . 55 LYS H . 16666 1
575 . 1 1 55 55 LYS HA H 1 5.17 0.02 . 1 . . . . 55 LYS HA . 16666 1
576 . 1 1 55 55 LYS HB2 H 1 2.243 0.02 . 2 . . . . 55 LYS HB2 . 16666 1
577 . 1 1 55 55 LYS HB3 H 1 1.998 0.02 . 2 . . . . 55 LYS HB3 . 16666 1
578 . 1 1 55 55 LYS HD2 H 1 1.318 0.02 . 2 . . . . 55 LYS HD2 . 16666 1
579 . 1 1 55 55 LYS HD3 H 1 1.318 0.02 . 2 . . . . 55 LYS HD3 . 16666 1
580 . 1 1 55 55 LYS HE2 H 1 2.857 0.02 . 2 . . . . 55 LYS HE2 . 16666 1
581 . 1 1 55 55 LYS HE3 H 1 2.857 0.02 . 2 . . . . 55 LYS HE3 . 16666 1
582 . 1 1 55 55 LYS HG2 H 1 1.223 0.02 . 2 . . . . 55 LYS HG2 . 16666 1
583 . 1 1 55 55 LYS HG3 H 1 1.223 0.02 . 2 . . . . 55 LYS HG3 . 16666 1
584 . 1 1 55 55 LYS CA C 13 53.482 0.3 . 1 . . . . 55 LYS CA . 16666 1
585 . 1 1 55 55 LYS CB C 13 33.595 0.3 . 1 . . . . 55 LYS CB . 16666 1
586 . 1 1 55 55 LYS CD C 13 26.798 0.3 . 1 . . . . 55 LYS CD . 16666 1
587 . 1 1 55 55 LYS CE C 13 41.861 0.3 . 1 . . . . 55 LYS CE . 16666 1
588 . 1 1 55 55 LYS CG C 13 22.082 0.3 . 1 . . . . 55 LYS CG . 16666 1
589 . 1 1 55 55 LYS N N 15 117.292 0.3 . 1 . . . . 55 LYS N . 16666 1
590 . 1 1 56 56 PRO HA H 1 4.7 0.02 . 1 . . . . 56 PRO HA . 16666 1
591 . 1 1 56 56 PRO HB2 H 1 2.294 0.02 . 2 . . . . 56 PRO HB2 . 16666 1
592 . 1 1 56 56 PRO HB3 H 1 1.889 0.02 . 2 . . . . 56 PRO HB3 . 16666 1
593 . 1 1 56 56 PRO HD2 H 1 3.836 0.02 . 2 . . . . 56 PRO HD2 . 16666 1
594 . 1 1 56 56 PRO HD3 H 1 3.718 0.02 . 2 . . . . 56 PRO HD3 . 16666 1
595 . 1 1 56 56 PRO HG2 H 1 2.171 0.02 . 2 . . . . 56 PRO HG2 . 16666 1
596 . 1 1 56 56 PRO HG3 H 1 2 0.02 . 2 . . . . 56 PRO HG3 . 16666 1
597 . 1 1 56 56 PRO C C 13 177.4 0.3 . 1 . . . . 56 PRO C . 16666 1
598 . 1 1 56 56 PRO CA C 13 62.748 0.3 . 1 . . . . 56 PRO CA . 16666 1
599 . 1 1 56 56 PRO CB C 13 31.885 0.3 . 1 . . . . 56 PRO CB . 16666 1
600 . 1 1 56 56 PRO CD C 13 50.616 0.3 . 1 . . . . 56 PRO CD . 16666 1
601 . 1 1 56 56 PRO CG C 13 27.7 0.3 . 1 . . . . 56 PRO CG . 16666 1
602 . 1 1 57 57 CYS H H 1 8.762 0.02 . 1 . . . . 57 CYS H . 16666 1
603 . 1 1 57 57 CYS HA H 1 4.579 0.02 . 1 . . . . 57 CYS HA . 16666 1
604 . 1 1 57 57 CYS HB2 H 1 3.209 0.02 . 2 . . . . 57 CYS HB2 . 16666 1
605 . 1 1 57 57 CYS HB3 H 1 2.781 0.02 . 2 . . . . 57 CYS HB3 . 16666 1
606 . 1 1 57 57 CYS C C 13 174.33 0.3 . 1 . . . . 57 CYS C . 16666 1
607 . 1 1 57 57 CYS CA C 13 54.973 0.3 . 1 . . . . 57 CYS CA . 16666 1
608 . 1 1 57 57 CYS CB C 13 41.789 0.3 . 1 . . . . 57 CYS CB . 16666 1
609 . 1 1 57 57 CYS N N 15 121.509 0.3 . 1 . . . . 57 CYS N . 16666 1
610 . 1 1 58 58 LYS H H 1 8.327 0.02 . 1 . . . . 58 LYS H . 16666 1
611 . 1 1 58 58 LYS HA H 1 4.387 0.02 . 1 . . . . 58 LYS HA . 16666 1
612 . 1 1 58 58 LYS HB2 H 1 1.957 0.02 . 2 . . . . 58 LYS HB2 . 16666 1
613 . 1 1 58 58 LYS HB3 H 1 1.705 0.02 . 2 . . . . 58 LYS HB3 . 16666 1
614 . 1 1 58 58 LYS HD2 H 1 1.489 0.02 . 2 . . . . 58 LYS HD2 . 16666 1
615 . 1 1 58 58 LYS HD3 H 1 1.489 0.02 . 2 . . . . 58 LYS HD3 . 16666 1
616 . 1 1 58 58 LYS HE2 H 1 2.936 0.02 . 2 . . . . 58 LYS HE2 . 16666 1
617 . 1 1 58 58 LYS HE3 H 1 2.936 0.02 . 2 . . . . 58 LYS HE3 . 16666 1
618 . 1 1 58 58 LYS HG2 H 1 1.326 0.02 . 2 . . . . 58 LYS HG2 . 16666 1
619 . 1 1 58 58 LYS HG3 H 1 1.251 0.02 . 2 . . . . 58 LYS HG3 . 16666 1
620 . 1 1 58 58 LYS C C 13 175.74 0.3 . 1 . . . . 58 LYS C . 16666 1
621 . 1 1 58 58 LYS CA C 13 54.908 0.3 . 1 . . . . 58 LYS CA . 16666 1
622 . 1 1 58 58 LYS CB C 13 33.303 0.3 . 1 . . . . 58 LYS CB . 16666 1
623 . 1 1 58 58 LYS CD C 13 33.654 0.3 . 1 . . . . 58 LYS CD . 16666 1
624 . 1 1 58 58 LYS CE C 13 41.851 0.3 . 1 . . . . 58 LYS CE . 16666 1
625 . 1 1 58 58 LYS CG C 13 24.034 0.3 . 1 . . . . 58 LYS CG . 16666 1
626 . 1 1 58 58 LYS N N 15 120.818 0.3 . 1 . . . . 58 LYS N . 16666 1
627 . 1 1 59 59 ARG H H 1 8.411 0.02 . 1 . . . . 59 ARG H . 16666 1
628 . 1 1 59 59 ARG HA H 1 4.306 0.02 . 1 . . . . 59 ARG HA . 16666 1
629 . 1 1 59 59 ARG HB2 H 1 1.735 0.02 . 2 . . . . 59 ARG HB2 . 16666 1
630 . 1 1 59 59 ARG HB3 H 1 1.836 0.02 . 2 . . . . 59 ARG HB3 . 16666 1
631 . 1 1 59 59 ARG HD2 H 1 3.204 0.02 . 2 . . . . 59 ARG HD2 . 16666 1
632 . 1 1 59 59 ARG HD3 H 1 3.204 0.02 . 2 . . . . 59 ARG HD3 . 16666 1
633 . 1 1 59 59 ARG HG2 H 1 1.646 0.02 . 2 . . . . 59 ARG HG2 . 16666 1
634 . 1 1 59 59 ARG HG3 H 1 1.646 0.02 . 2 . . . . 59 ARG HG3 . 16666 1
635 . 1 1 59 59 ARG C C 13 175.86 0.3 . 1 . . . . 59 ARG C . 16666 1
636 . 1 1 59 59 ARG CA C 13 55.872 0.3 . 1 . . . . 59 ARG CA . 16666 1
637 . 1 1 59 59 ARG CB C 13 30.521 0.3 . 1 . . . . 59 ARG CB . 16666 1
638 . 1 1 59 59 ARG CD C 13 43 0.3 . 1 . . . . 59 ARG CD . 16666 1
639 . 1 1 59 59 ARG CG C 13 29.575 0.3 . 1 . . . . 59 ARG CG . 16666 1
640 . 1 1 59 59 ARG N N 15 123.344 0.3 . 1 . . . . 59 ARG N . 16666 1
641 . 1 1 60 60 GLU H H 1 8.542 0.02 . 1 . . . . 60 GLU H . 16666 1
642 . 1 1 60 60 GLU HA H 1 4.476 0.02 . 1 . . . . 60 GLU HA . 16666 1
643 . 1 1 60 60 GLU HB2 H 1 1.962 0.02 . 2 . . . . 60 GLU HB2 . 16666 1
644 . 1 1 60 60 GLU HB3 H 1 1.994 0.02 . 2 . . . . 60 GLU HB3 . 16666 1
645 . 1 1 60 60 GLU HG2 H 1 2.487 0.02 . 2 . . . . 60 GLU HG2 . 16666 1
646 . 1 1 60 60 GLU HG3 H 1 2.427 0.02 . 2 . . . . 60 GLU HG3 . 16666 1
647 . 1 1 60 60 GLU C C 13 175.95 0.3 . 1 . . . . 60 GLU C . 16666 1
648 . 1 1 60 60 GLU CA C 13 55.595 0.3 . 1 . . . . 60 GLU CA . 16666 1
649 . 1 1 60 60 GLU CB C 13 29.68 0.3 . 1 . . . . 60 GLU CB . 16666 1
650 . 1 1 60 60 GLU CG C 13 34.026 0.3 . 1 . . . . 60 GLU CG . 16666 1
651 . 1 1 60 60 GLU N N 15 123.1 0.3 . 1 . . . . 60 GLU N . 16666 1
652 . 1 1 61 61 ARG H H 1 8.42 0.02 . 1 . . . . 61 ARG H . 16666 1
653 . 1 1 61 61 ARG HA H 1 4.055 0.02 . 1 . . . . 61 ARG HA . 16666 1
654 . 1 1 61 61 ARG HB2 H 1 1.919 0.02 . 2 . . . . 61 ARG HB2 . 16666 1
655 . 1 1 61 61 ARG HB3 H 1 1.919 0.02 . 2 . . . . 61 ARG HB3 . 16666 1
656 . 1 1 61 61 ARG HD2 H 1 3.156 0.02 . 2 . . . . 61 ARG HD2 . 16666 1
657 . 1 1 61 61 ARG HD3 H 1 3.156 0.02 . 2 . . . . 61 ARG HD3 . 16666 1
658 . 1 1 61 61 ARG HG2 H 1 1.612 0.02 . 2 . . . . 61 ARG HG2 . 16666 1
659 . 1 1 61 61 ARG HG3 H 1 1.612 0.02 . 2 . . . . 61 ARG HG3 . 16666 1
660 . 1 1 61 61 ARG C C 13 175.55 0.3 . 1 . . . . 61 ARG C . 16666 1
661 . 1 1 61 61 ARG CA C 13 56.102 0.3 . 1 . . . . 61 ARG CA . 16666 1
662 . 1 1 61 61 ARG CB C 13 30.35 0.3 . 1 . . . . 61 ARG CB . 16666 1
663 . 1 1 61 61 ARG CD C 13 39.014 0.3 . 1 . . . . 61 ARG CD . 16666 1
664 . 1 1 61 61 ARG CG C 13 26.824 0.3 . 1 . . . . 61 ARG CG . 16666 1
665 . 1 1 61 61 ARG N N 15 122.467 0.3 . 1 . . . . 61 ARG N . 16666 1
666 . 1 1 62 62 ALA H H 1 8.324 0.02 . 1 . . . . 62 ALA H . 16666 1
667 . 1 1 62 62 ALA HA H 1 4.15 0.02 . 1 . . . . 62 ALA HA . 16666 1
668 . 1 1 62 62 ALA HB1 H 1 1.547 0.02 . 1 . . . . 62 ALA HB . 16666 1
669 . 1 1 62 62 ALA HB2 H 1 1.547 0.02 . 1 . . . . 62 ALA HB . 16666 1
670 . 1 1 62 62 ALA HB3 H 1 1.547 0.02 . 1 . . . . 62 ALA HB . 16666 1
671 . 1 1 62 62 ALA C C 13 177.15 0.3 . 1 . . . . 62 ALA C . 16666 1
672 . 1 1 62 62 ALA CA C 13 51.522 0.3 . 1 . . . . 62 ALA CA . 16666 1
673 . 1 1 62 62 ALA CB C 13 17.938 0.3 . 1 . . . . 62 ALA CB . 16666 1
674 . 1 1 62 62 ALA N N 15 125.625 0.3 . 1 . . . . 62 ALA N . 16666 1
675 . 1 1 63 63 ALA H H 1 8.261 0.02 . 1 . . . . 63 ALA H . 16666 1
676 . 1 1 63 63 ALA HA H 1 4.277 0.02 . 1 . . . . 63 ALA HA . 16666 1
677 . 1 1 63 63 ALA HB1 H 1 1.378 0.02 . 1 . . . . 63 ALA HB . 16666 1
678 . 1 1 63 63 ALA HB2 H 1 1.378 0.02 . 1 . . . . 63 ALA HB . 16666 1
679 . 1 1 63 63 ALA HB3 H 1 1.378 0.02 . 1 . . . . 63 ALA HB . 16666 1
680 . 1 1 63 63 ALA C C 13 177.15 0.3 . 1 . . . . 63 ALA C . 16666 1
681 . 1 1 63 63 ALA CA C 13 52.105 0.3 . 1 . . . . 63 ALA CA . 16666 1
682 . 1 1 63 63 ALA CB C 13 18.799 0.3 . 1 . . . . 63 ALA CB . 16666 1
683 . 1 1 63 63 ALA N N 15 123.467 0.3 . 1 . . . . 63 ALA N . 16666 1
684 . 1 1 64 64 ALA H H 1 8.254 0.02 . 1 . . . . 64 ALA H . 16666 1
685 . 1 1 64 64 ALA HA H 1 4.331 0.02 . 1 . . . . 64 ALA HA . 16666 1
686 . 1 1 64 64 ALA HB1 H 1 1.396 0.02 . 1 . . . . 64 ALA HB . 16666 1
687 . 1 1 64 64 ALA HB2 H 1 1.396 0.02 . 1 . . . . 64 ALA HB . 16666 1
688 . 1 1 64 64 ALA HB3 H 1 1.396 0.02 . 1 . . . . 64 ALA HB . 16666 1
689 . 1 1 64 64 ALA C C 13 177.61 0.3 . 1 . . . . 64 ALA C . 16666 1
690 . 1 1 64 64 ALA CA C 13 52.299 0.3 . 1 . . . . 64 ALA CA . 16666 1
691 . 1 1 64 64 ALA CB C 13 18.849 0.3 . 1 . . . . 64 ALA CB . 16666 1
692 . 1 1 64 64 ALA N N 15 122.914 0.3 . 1 . . . . 64 ALA N . 16666 1
693 . 1 1 65 65 THR H H 1 7.985 0.02 . 1 . . . . 65 THR H . 16666 1
694 . 1 1 65 65 THR HA H 1 4.487 0.02 . 1 . . . . 65 THR HA . 16666 1
695 . 1 1 65 65 THR HB H 1 3.835 0.02 . 1 . . . . 65 THR HB . 16666 1
696 . 1 1 65 65 THR HG21 H 1 1.249 0.02 . 1 . . . . 65 THR HG2 . 16666 1
697 . 1 1 65 65 THR HG22 H 1 1.249 0.02 . 1 . . . . 65 THR HG2 . 16666 1
698 . 1 1 65 65 THR HG23 H 1 1.249 0.02 . 1 . . . . 65 THR HG2 . 16666 1
699 . 1 1 65 65 THR C C 13 173.39 0.3 . 1 . . . . 65 THR C . 16666 1
700 . 1 1 65 65 THR CA C 13 61.577 0.3 . 1 . . . . 65 THR CA . 16666 1
701 . 1 1 65 65 THR CB C 13 69.353 0.3 . 1 . . . . 65 THR CB . 16666 1
702 . 1 1 65 65 THR CG2 C 13 22.271 0.3 . 1 . . . . 65 THR CG2 . 16666 1
703 . 1 1 65 65 THR N N 15 112.938 0.3 . 1 . . . . 65 THR N . 16666 1
704 . 1 1 66 66 LEU H H 1 8.148 0.02 . 1 . . . . 66 LEU H . 16666 1
705 . 1 1 66 66 LEU HA H 1 4.244 0.02 . 1 . . . . 66 LEU HA . 16666 1
706 . 1 1 66 66 LEU HB2 H 1 1.718 0.02 . 2 . . . . 66 LEU HB2 . 16666 1
707 . 1 1 66 66 LEU HB3 H 1 1.542 0.02 . 2 . . . . 66 LEU HB3 . 16666 1
708 . 1 1 66 66 LEU HD11 H 1 0.891 0.02 . 2 . . . . 66 LEU HD1 . 16666 1
709 . 1 1 66 66 LEU HD12 H 1 0.891 0.02 . 2 . . . . 66 LEU HD1 . 16666 1
710 . 1 1 66 66 LEU HD13 H 1 0.891 0.02 . 2 . . . . 66 LEU HD1 . 16666 1
711 . 1 1 66 66 LEU HD21 H 1 0.825 0.02 . 2 . . . . 66 LEU HD2 . 16666 1
712 . 1 1 66 66 LEU HD22 H 1 0.825 0.02 . 2 . . . . 66 LEU HD2 . 16666 1
713 . 1 1 66 66 LEU HD23 H 1 0.825 0.02 . 2 . . . . 66 LEU HD2 . 16666 1
714 . 1 1 66 66 LEU HG H 1 1.428 0.02 . 1 . . . . 66 LEU HG . 16666 1
715 . 1 1 66 66 LEU C C 13 176.45 0.3 . 1 . . . . 66 LEU C . 16666 1
716 . 1 1 66 66 LEU CA C 13 54.981 0.3 . 1 . . . . 66 LEU CA . 16666 1
717 . 1 1 66 66 LEU CB C 13 42.064 0.3 . 1 . . . . 66 LEU CB . 16666 1
718 . 1 1 66 66 LEU CD1 C 13 24.84 0.3 . 2 . . . . 66 LEU CD1 . 16666 1
719 . 1 1 66 66 LEU CD2 C 13 23.224 0.3 . 2 . . . . 66 LEU CD2 . 16666 1
720 . 1 1 66 66 LEU N N 15 124.75 0.3 . 1 . . . . 66 LEU N . 16666 1
721 . 1 1 67 67 ARG H H 1 8.203 0.02 . 1 . . . . 67 ARG H . 16666 1
722 . 1 1 67 67 ARG HA H 1 4.4 0.02 . 1 . . . . 67 ARG HA . 16666 1
723 . 1 1 67 67 ARG HB2 H 1 1.824 0.02 . 2 . . . . 67 ARG HB2 . 16666 1
724 . 1 1 67 67 ARG HB3 H 1 1.718 0.02 . 2 . . . . 67 ARG HB3 . 16666 1
725 . 1 1 67 67 ARG HD2 H 1 3.209 0.02 . 2 . . . . 67 ARG HD . 16666 1
726 . 1 1 67 67 ARG HD3 H 1 3.209 0.02 . 2 . . . . 67 ARG HD . 16666 1
727 . 1 1 67 67 ARG HG2 H 1 1.598 0.02 . 2 . . . . 67 ARG HG2 . 16666 1
728 . 1 1 67 67 ARG HG3 H 1 1.598 0.02 . 2 . . . . 67 ARG HG3 . 16666 1
729 . 1 1 67 67 ARG C C 13 174.58 0.3 . 1 . . . . 67 ARG C . 16666 1
730 . 1 1 67 67 ARG CA C 13 55.856 0.3 . 1 . . . . 67 ARG CA . 16666 1
731 . 1 1 67 67 ARG CB C 13 30.776 0.3 . 1 . . . . 67 ARG CB . 16666 1
732 . 1 1 67 67 ARG CD C 13 42.951 0.3 . 1 . . . . 67 ARG CD . 16666 1
733 . 1 1 67 67 ARG CG C 13 26.798 0.3 . 1 . . . . 67 ARG CG . 16666 1
734 . 1 1 67 67 ARG N N 15 121.84 0.3 . 1 . . . . 67 ARG N . 16666 1
735 . 1 1 68 68 TRP H H 1 8.202 0.02 . 1 . . . . 68 TRP H . 16666 1
736 . 1 1 68 68 TRP HA H 1 4.64 0.02 . 1 . . . . 68 TRP HA . 16666 1
737 . 1 1 68 68 TRP HB2 H 1 3.082 0.02 . 2 . . . . 68 TRP HB2 . 16666 1
738 . 1 1 68 68 TRP HB3 H 1 2.954 0.02 . 2 . . . . 68 TRP HB3 . 16666 1
739 . 1 1 68 68 TRP HD1 H 1 7.318 0.02 . 1 . . . . 68 TRP HD1 . 16666 1
740 . 1 1 68 68 TRP HE1 H 1 10.14 0.02 . 1 . . . . 68 TRP HE1 . 16666 1
741 . 1 1 68 68 TRP HE3 H 1 7.738 0.02 . 1 . . . . 68 TRP HE3 . 16666 1
742 . 1 1 68 68 TRP HH2 H 1 7.27 0.02 . 1 . . . . 68 TRP HH2 . 16666 1
743 . 1 1 68 68 TRP HZ2 H 1 7.53 0.02 . 1 . . . . 68 TRP HZ2 . 16666 1
744 . 1 1 68 68 TRP HZ3 H 1 7.197 0.02 . 1 . . . . 68 TRP HZ3 . 16666 1
745 . 1 1 68 68 TRP CA C 13 55.5 0.3 . 1 . . . . 68 TRP CA . 16666 1
746 . 1 1 68 68 TRP CB C 13 30.14 0.3 . 1 . . . . 68 TRP CB . 16666 1
747 . 1 1 68 68 TRP CD1 C 13 127.295 0.3 . 1 . . . . 68 TRP CD1 . 16666 1
748 . 1 1 68 68 TRP CE3 C 13 120.404 0.3 . 1 . . . . 68 TRP CE3 . 16666 1
749 . 1 1 68 68 TRP CH2 C 13 124.54 0.3 . 1 . . . . 68 TRP CH2 . 16666 1
750 . 1 1 68 68 TRP CZ2 C 13 114.493 0.3 . 1 . . . . 68 TRP CZ2 . 16666 1
751 . 1 1 68 68 TRP CZ3 C 13 122.043 0.3 . 1 . . . . 68 TRP CZ3 . 16666 1
752 . 1 1 68 68 TRP N N 15 124.144 0.3 . 1 . . . . 68 TRP N . 16666 1
753 . 1 1 69 69 PRO HA H 1 5.1 0.02 . 1 . . . . 69 PRO HA . 16666 1
754 . 1 1 69 69 PRO HB2 H 1 2.296 0.02 . 2 . . . . 69 PRO HB2 . 16666 1
755 . 1 1 69 69 PRO HB3 H 1 2.296 0.02 . 2 . . . . 69 PRO HB3 . 16666 1
756 . 1 1 69 69 PRO HD2 H 1 3.852 0.02 . 2 . . . . 69 PRO HD2 . 16666 1
757 . 1 1 69 69 PRO HD3 H 1 3.716 0.02 . 2 . . . . 69 PRO HD3 . 16666 1
758 . 1 1 69 69 PRO HG2 H 1 1.883 0.02 . 2 . . . . 69 PRO HG2 . 16666 1
759 . 1 1 69 69 PRO HG3 H 1 1.883 0.02 . 2 . . . . 69 PRO HG3 . 16666 1
760 . 1 1 69 69 PRO C C 13 176.94 0.3 . 1 . . . . 69 PRO C . 16666 1
761 . 1 1 69 69 PRO CA C 13 62.753 0.3 . 1 . . . . 69 PRO CA . 16666 1
762 . 1 1 69 69 PRO CB C 13 31.371 0.3 . 1 . . . . 69 PRO CB . 16666 1
763 . 1 1 70 70 GLY H H 1 7.764 0.02 . 1 . . . . 70 GLY H . 16666 1
764 . 1 1 70 70 GLY HA2 H 1 3.84 0.02 . 2 . . . . 70 GLY HA2 . 16666 1
765 . 1 1 70 70 GLY HA3 H 1 3.84 0.02 . 2 . . . . 70 GLY HA3 . 16666 1
766 . 1 1 70 70 GLY C C 13 172.92 0.3 . 1 . . . . 70 GLY C . 16666 1
767 . 1 1 70 70 GLY CA C 13 45.082 0.3 . 1 . . . . 70 GLY CA . 16666 1
768 . 1 1 70 70 GLY N N 15 108.495 0.3 . 1 . . . . 70 GLY N . 16666 1
769 . 1 1 71 71 LEU H H 1 7.726 0.02 . 1 . . . . 71 LEU H . 16666 1
770 . 1 1 71 71 LEU HA H 1 4.372 0.02 . 1 . . . . 71 LEU HA . 16666 1
771 . 1 1 71 71 LEU HB2 H 1 1.614 0.02 . 2 . . . . 71 LEU HB2 . 16666 1
772 . 1 1 71 71 LEU HB3 H 1 1.614 0.02 . 2 . . . . 71 LEU HB3 . 16666 1
773 . 1 1 71 71 LEU HD11 H 1 0.921 0.02 . 2 . . . . 71 LEU HD1 . 16666 1
774 . 1 1 71 71 LEU HD12 H 1 0.921 0.02 . 2 . . . . 71 LEU HD1 . 16666 1
775 . 1 1 71 71 LEU HD13 H 1 0.921 0.02 . 2 . . . . 71 LEU HD1 . 16666 1
776 . 1 1 71 71 LEU HD21 H 1 0.896 0.02 . 2 . . . . 71 LEU HD2 . 16666 1
777 . 1 1 71 71 LEU HD22 H 1 0.896 0.02 . 2 . . . . 71 LEU HD2 . 16666 1
778 . 1 1 71 71 LEU HD23 H 1 0.896 0.02 . 2 . . . . 71 LEU HD2 . 16666 1
779 . 1 1 71 71 LEU HG H 1 1.527 0.02 . 1 . . . . 71 LEU HG . 16666 1
780 . 1 1 71 71 LEU CA C 13 55.841 0.3 . 1 . . . . 71 LEU CA . 16666 1
781 . 1 1 71 71 LEU CB C 13 42.828 0.3 . 1 . . . . 71 LEU CB . 16666 1
782 . 1 1 71 71 LEU CD1 C 13 24.714 0.3 . 2 . . . . 71 LEU CD1 . 16666 1
783 . 1 1 71 71 LEU CG C 13 26.841 0.3 . 1 . . . . 71 LEU CG . 16666 1
784 . 1 1 71 71 LEU N N 15 125.226 0.3 . 1 . . . . 71 LEU N . 16666 1
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