###################################
# 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_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 34014
_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 $chem_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-1H TOCSY' . . . 34014 1
2 '2D 1H-1H NOESY' . . . 34014 1
3 '2D 1H-15N HSQC' . . . 34014 1
4 '2D 1H-13C HSQC' . . . 34014 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
3 $software_3 . . 34014 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 PCA CB C 13 24.155 0.2 . 1 . . . . 1 PCA CB . 34014 1
2 . 1 1 1 1 PCA CG C 13 29.208 0.2 . 1 . . . . 1 PCA CG . 34014 1
3 . 1 1 1 1 PCA HA H 1 4.663 0.01 . 1 . . . . 1 PCA HA . 34014 1
4 . 1 1 1 1 PCA HB2 H 1 2.585 0.01 . 1 . . . . 1 PCA HB2 . 34014 1
5 . 1 1 1 1 PCA HB3 H 1 2.001 0.01 . 1 . . . . 1 PCA HB3 . 34014 1
6 . 1 1 1 1 PCA HG2 H 1 2.415 0.01 . 1 . . . . 1 PCA HG2 . 34014 1
7 . 1 1 1 1 PCA HG3 H 1 2.416 0.01 . 1 . . . . 1 PCA HG3 . 34014 1
8 . 1 1 2 2 PRO HA H 1 4.415 0.01 . 1 . . . . 2 PRO HA . 34014 1
9 . 1 1 2 2 PRO HB2 H 1 2.232 0.01 . 1 . . . . 2 PRO HB2 . 34014 1
10 . 1 1 2 2 PRO HB3 H 1 1.817 0.01 . 1 . . . . 2 PRO HB3 . 34014 1
11 . 1 1 2 2 PRO HG2 H 1 1.991 0.01 . 1 . . . . 2 PRO HG2 . 34014 1
12 . 1 1 2 2 PRO HG3 H 1 1.991 0.01 . 1 . . . . 2 PRO HG3 . 34014 1
13 . 1 1 2 2 PRO HD2 H 1 3.692 0.01 . 1 . . . . 2 PRO HD2 . 34014 1
14 . 1 1 2 2 PRO HD3 H 1 3.600 0.01 . 1 . . . . 2 PRO HD3 . 34014 1
15 . 1 1 2 2 PRO CA C 13 60.483 0.2 . 1 . . . . 2 PRO CA . 34014 1
16 . 1 1 2 2 PRO CB C 13 29.164 0.2 . 1 . . . . 2 PRO CB . 34014 1
17 . 1 1 2 2 PRO CG C 13 24.557 0.2 . 1 . . . . 2 PRO CG . 34014 1
18 . 1 1 2 2 PRO CD C 13 47.362 0.2 . 1 . . . . 2 PRO CD . 34014 1
19 . 1 1 3 3 PHE H H 1 8.176 0.01 . 1 . . . . 3 PHE H . 34014 1
20 . 1 1 3 3 PHE HA H 1 4.595 0.01 . 1 . . . . 3 PHE HA . 34014 1
21 . 1 1 3 3 PHE HB2 H 1 3.111 0.01 . 1 . . . . 3 PHE HB2 . 34014 1
22 . 1 1 3 3 PHE HB3 H 1 2.996 0.01 . 1 . . . . 3 PHE HB3 . 34014 1
23 . 1 1 3 3 PHE HD1 H 1 7.214 0.01 . 1 . . . . 3 PHE HD1 . 34014 1
24 . 1 1 3 3 PHE HD2 H 1 7.214 0.01 . 1 . . . . 3 PHE HD2 . 34014 1
25 . 1 1 3 3 PHE HE1 H 1 7.315 0.01 . 1 . . . . 3 PHE HE1 . 34014 1
26 . 1 1 3 3 PHE HE2 H 1 7.315 0.01 . 1 . . . . 3 PHE HE2 . 34014 1
27 . 1 1 3 3 PHE HZ H 1 7.336 0.01 . 1 . . . . 3 PHE HZ . 34014 1
28 . 1 1 3 3 PHE CB C 13 36.775 0.2 . 1 . . . . 3 PHE CB . 34014 1
29 . 1 1 3 3 PHE CD1 C 13 129.135 0.2 . 1 . . . . 3 PHE CD1 . 34014 1
30 . 1 1 3 3 PHE CD2 C 13 129.135 0.2 . 1 . . . . 3 PHE CD2 . 34014 1
31 . 1 1 3 3 PHE CZ C 13 128.688 0.2 . 1 . . . . 3 PHE CZ . 34014 1
32 . 1 1 3 3 PHE N N 15 120.027 0.2 . 1 . . . . 3 PHE N . 34014 1
33 . 1 1 4 4 ILE H H 1 7.916 0.01 . 1 . . . . 4 ILE H . 34014 1
34 . 1 1 4 4 ILE HA H 1 4.372 0.01 . 1 . . . . 4 ILE HA . 34014 1
35 . 1 1 4 4 ILE HB H 1 1.727 0.01 . 1 . . . . 4 ILE HB . 34014 1
36 . 1 1 4 4 ILE HG12 H 1 1.410 0.01 . 1 . . . . 4 ILE HG12 . 34014 1
37 . 1 1 4 4 ILE HG13 H 1 1.073 0.01 . 1 . . . . 4 ILE HG13 . 34014 1
38 . 1 1 4 4 ILE HG21 H 1 0.838 0.01 . 1 . . . . 4 ILE HG21 . 34014 1
39 . 1 1 4 4 ILE HG22 H 1 0.838 0.01 . 1 . . . . 4 ILE HG22 . 34014 1
40 . 1 1 4 4 ILE HG23 H 1 0.838 0.01 . 1 . . . . 4 ILE HG23 . 34014 1
41 . 1 1 4 4 ILE HD11 H 1 0.839 0.01 . 1 . . . . 4 ILE HD11 . 34014 1
42 . 1 1 4 4 ILE HD12 H 1 0.839 0.01 . 1 . . . . 4 ILE HD12 . 34014 1
43 . 1 1 4 4 ILE HD13 H 1 0.839 0.01 . 1 . . . . 4 ILE HD13 . 34014 1
44 . 1 1 4 4 ILE CA C 13 55.112 0.2 . 1 . . . . 4 ILE CA . 34014 1
45 . 1 1 4 4 ILE CB C 13 36.274 0.2 . 1 . . . . 4 ILE CB . 34014 1
46 . 1 1 4 4 ILE CG1 C 13 24.264 0.2 . 1 . . . . 4 ILE CG1 . 34014 1
47 . 1 1 4 4 ILE CG2 C 13 14.104 0.2 . 1 . . . . 4 ILE CG2 . 34014 1
48 . 1 1 4 4 ILE CD1 C 13 10.268 0.2 . 1 . . . . 4 ILE CD1 . 34014 1
49 . 1 1 4 4 ILE N N 15 126.519 0.2 . 1 . . . . 4 ILE N . 34014 1
50 . 1 1 5 5 PRO HA H 1 4.276 0.01 . 1 . . . . 5 PRO HA . 34014 1
51 . 1 1 5 5 PRO HB2 H 1 2.288 0.01 . 1 . . . . 5 PRO HB2 . 34014 1
52 . 1 1 5 5 PRO HB3 H 1 1.872 0.01 . 1 . . . . 5 PRO HB3 . 34014 1
53 . 1 1 5 5 PRO HG2 H 1 1.982 0.01 . 1 . . . . 5 PRO HG2 . 34014 1
54 . 1 1 5 5 PRO HG3 H 1 1.982 0.01 . 1 . . . . 5 PRO HG3 . 34014 1
55 . 1 1 5 5 PRO HD2 H 1 3.661 0.01 . 1 . . . . 5 PRO HD2 . 34014 1
56 . 1 1 5 5 PRO HD3 H 1 3.635 0.01 . 1 . . . . 5 PRO HD3 . 34014 1
57 . 1 1 5 5 PRO CA C 13 60.162 0.2 . 1 . . . . 5 PRO CA . 34014 1
58 . 1 1 5 5 PRO CB C 13 29.348 0.2 . 1 . . . . 5 PRO CB . 34014 1
59 . 1 1 5 5 PRO CG C 13 24.540 0.2 . 1 . . . . 5 PRO CG . 34014 1
60 . 1 1 5 5 PRO CD C 13 48.217 0.2 . 1 . . . . 5 PRO CD . 34014 1
61 . 1 1 6 6 ARG H H 1 8.317 0.01 . 1 . . . . 6 ARG H . 34014 1
62 . 1 1 6 6 ARG HA H 1 4.592 0.01 . 1 . . . . 6 ARG HA . 34014 1
63 . 1 1 6 6 ARG HB2 H 1 1.831 0.01 . 1 . . . . 6 ARG HB2 . 34014 1
64 . 1 1 6 6 ARG HB3 H 1 1.831 0.01 . 1 . . . . 6 ARG HB3 . 34014 1
65 . 1 1 6 6 ARG HG2 H 1 1.716 0.01 . 1 . . . . 6 ARG HG2 . 34014 1
66 . 1 1 6 6 ARG HG3 H 1 1.716 0.01 . 1 . . . . 6 ARG HG3 . 34014 1
67 . 1 1 6 6 ARG HD2 H 1 3.221 0.01 . 1 . . . . 6 ARG HD2 . 34014 1
68 . 1 1 6 6 ARG HD3 H 1 3.221 0.01 . 1 . . . . 6 ARG HD3 . 34014 1
69 . 1 1 6 6 ARG HE H 1 7.195 0.01 . 1 . . . . 6 ARG HE . 34014 1
70 . 1 1 6 6 ARG CB C 13 27.236 0.2 . 1 . . . . 6 ARG CB . 34014 1
71 . 1 1 6 6 ARG CG C 13 24.259 0.2 . 1 . . . . 6 ARG CG . 34014 1
72 . 1 1 6 6 ARG CD C 13 40.525 0.2 . 1 . . . . 6 ARG CD . 34014 1
73 . 1 1 6 6 ARG N N 15 122.140 0.2 . 1 . . . . 6 ARG N . 34014 1
74 . 1 1 7 7 PRO HA H 1 4.431 0.01 . 1 . . . . 7 PRO HA . 34014 1
75 . 1 1 7 7 PRO HB2 H 1 2.273 0.01 . 1 . . . . 7 PRO HB2 . 34014 1
76 . 1 1 7 7 PRO HB3 H 1 1.863 0.01 . 1 . . . . 7 PRO HB3 . 34014 1
77 . 1 1 7 7 PRO HG2 H 1 2.014 0.01 . 1 . . . . 7 PRO HG2 . 34014 1
78 . 1 1 7 7 PRO HG3 H 1 2.014 0.01 . 1 . . . . 7 PRO HG3 . 34014 1
79 . 1 1 7 7 PRO HD2 H 1 3.798 0.01 . 1 . . . . 7 PRO HD2 . 34014 1
80 . 1 1 7 7 PRO HD3 H 1 3.614 0.01 . 1 . . . . 7 PRO HD3 . 34014 1
81 . 1 1 7 7 PRO CA C 13 60.483 0.2 . 1 . . . . 7 PRO CA . 34014 1
82 . 1 1 7 7 PRO CB C 13 29.334 0.2 . 1 . . . . 7 PRO CB . 34014 1
83 . 1 1 7 7 PRO CG C 13 24.534 0.2 . 1 . . . . 7 PRO CG . 34014 1
84 . 1 1 7 7 PRO CD C 13 47.844 0.2 . 1 . . . . 7 PRO CD . 34014 1
85 . 1 1 8 8 ILE H H 1 8.241 0.01 . 1 . . . . 8 ILE H . 34014 1
86 . 1 1 8 8 ILE HA H 1 4.086 0.01 . 1 . . . . 8 ILE HA . 34014 1
87 . 1 1 8 8 ILE HB H 1 1.801 0.01 . 1 . . . . 8 ILE HB . 34014 1
88 . 1 1 8 8 ILE HG12 H 1 1.504 0.01 . 1 . . . . 8 ILE HG12 . 34014 1
89 . 1 1 8 8 ILE HG13 H 1 1.198 0.01 . 1 . . . . 8 ILE HG13 . 34014 1
90 . 1 1 8 8 ILE HG21 H 1 0.872 0.01 . 1 . . . . 8 ILE HG21 . 34014 1
91 . 1 1 8 8 ILE HG22 H 1 0.872 0.01 . 1 . . . . 8 ILE HG22 . 34014 1
92 . 1 1 8 8 ILE HG23 H 1 0.872 0.01 . 1 . . . . 8 ILE HG23 . 34014 1
93 . 1 1 8 8 ILE HD11 H 1 0.879 0.01 . 1 . . . . 8 ILE HD11 . 34014 1
94 . 1 1 8 8 ILE HD12 H 1 0.879 0.01 . 1 . . . . 8 ILE HD12 . 34014 1
95 . 1 1 8 8 ILE HD13 H 1 0.879 0.01 . 1 . . . . 8 ILE HD13 . 34014 1
96 . 1 1 8 8 ILE CA C 13 58.282 0.2 . 1 . . . . 8 ILE CA . 34014 1
97 . 1 1 8 8 ILE CB C 13 36.277 0.2 . 1 . . . . 8 ILE CB . 34014 1
98 . 1 1 8 8 ILE CG1 C 13 24.671 0.2 . 1 . . . . 8 ILE CG1 . 34014 1
99 . 1 1 8 8 ILE CG2 C 13 14.791 0.2 . 1 . . . . 8 ILE CG2 . 34014 1
100 . 1 1 8 8 ILE CD1 C 13 10.247 0.2 . 1 . . . . 8 ILE CD1 . 34014 1
101 . 1 1 8 8 ILE N N 15 121.121 0.2 . 1 . . . . 8 ILE N . 34014 1
102 . 1 1 9 9 ASP H H 1 8.322 0.01 . 1 . . . . 9 ASP H . 34014 1
103 . 1 1 9 9 ASP HA H 1 4.764 0.01 . 1 . . . . 9 ASP HA . 34014 1
104 . 1 1 9 9 ASP HB2 H 1 2.865 0.01 . 1 . . . . 9 ASP HB2 . 34014 1
105 . 1 1 9 9 ASP HB3 H 1 2.666 0.01 . 1 . . . . 9 ASP HB3 . 34014 1
106 . 1 1 9 9 ASP CA C 13 50.651 0.2 . 1 . . . . 9 ASP CA . 34014 1
107 . 1 1 9 9 ASP CB C 13 38.673 0.2 . 1 . . . . 9 ASP CB . 34014 1
108 . 1 1 9 9 ASP N N 15 125.097 0.2 . 1 . . . . 9 ASP N . 34014 1
109 . 1 1 10 10 THR H H 1 8.359 0.01 . 1 . . . . 10 THR H . 34014 1
110 . 1 1 10 10 THR HA H 1 3.981 0.01 . 1 . . . . 10 THR HA . 34014 1
111 . 1 1 10 10 THR HB H 1 4.312 0.01 . 1 . . . . 10 THR HB . 34014 1
112 . 1 1 10 10 THR HG21 H 1 1.242 0.01 . 1 . . . . 10 THR HG21 . 34014 1
113 . 1 1 10 10 THR HG22 H 1 1.242 0.01 . 1 . . . . 10 THR HG22 . 34014 1
114 . 1 1 10 10 THR HG23 H 1 1.242 0.01 . 1 . . . . 10 THR HG23 . 34014 1
115 . 1 1 10 10 THR CA C 13 61.403 0.2 . 1 . . . . 10 THR CA . 34014 1
116 . 1 1 10 10 THR CB C 13 65.998 0.2 . 1 . . . . 10 THR CB . 34014 1
117 . 1 1 10 10 THR CG2 C 13 19.280 0.2 . 1 . . . . 10 THR CG2 . 34014 1
118 . 1 1 10 10 THR N N 15 116.733 0.2 . 1 . . . . 10 THR N . 34014 1
119 . 1 1 11 11 CYS H H 1 8.444 0.01 . 1 . . . . 11 CYS H . 34014 1
120 . 1 1 11 11 CYS HA H 1 4.368 0.01 . 1 . . . . 11 CYS HA . 34014 1
121 . 1 1 11 11 CYS HB2 H 1 3.081 0.01 . 1 . . . . 11 CYS HB2 . 34014 1
122 . 1 1 11 11 CYS HB3 H 1 3.079 0.01 . 1 . . . . 11 CYS HB3 . 34014 1
123 . 1 1 11 11 CYS N N 15 121.430 0.2 . 1 . . . . 11 CYS N . 34014 1
124 . 1 1 12 12 ARG H H 1 8.026 0.01 . 1 . . . . 12 ARG H . 34014 1
125 . 1 1 12 12 ARG HA H 1 4.206 0.01 . 1 . . . . 12 ARG HA . 34014 1
126 . 1 1 12 12 ARG HB2 H 1 1.834 0.01 . 1 . . . . 12 ARG HB2 . 34014 1
127 . 1 1 12 12 ARG HB3 H 1 1.834 0.01 . 1 . . . . 12 ARG HB3 . 34014 1
128 . 1 1 12 12 ARG HG2 H 1 1.725 0.01 . 1 . . . . 12 ARG HG2 . 34014 1
129 . 1 1 12 12 ARG HG3 H 1 1.671 0.01 . 1 . . . . 12 ARG HG3 . 34014 1
130 . 1 1 12 12 ARG HD2 H 1 3.273 0.01 . 1 . . . . 12 ARG HD2 . 34014 1
131 . 1 1 12 12 ARG HD3 H 1 3.235 0.01 . 1 . . . . 12 ARG HD3 . 34014 1
132 . 1 1 12 12 ARG HE H 1 7.292 0.01 . 1 . . . . 12 ARG HE . 34014 1
133 . 1 1 12 12 ARG CA C 13 56.070 0.2 . 1 . . . . 12 ARG CA . 34014 1
134 . 1 1 12 12 ARG CB C 13 27.236 0.2 . 1 . . . . 12 ARG CB . 34014 1
135 . 1 1 12 12 ARG CG C 13 24.238 0.2 . 1 . . . . 12 ARG CG . 34014 1
136 . 1 1 12 12 ARG CD C 13 40.469 0.2 . 1 . . . . 12 ARG CD . 34014 1
137 . 1 1 12 12 ARG N N 15 120.427 0.2 . 1 . . . . 12 ARG N . 34014 1
138 . 1 1 13 13 LEU H H 1 7.884 0.01 . 1 . . . . 13 LEU H . 34014 1
139 . 1 1 13 13 LEU HA H 1 4.129 0.01 . 1 . . . . 13 LEU HA . 34014 1
140 . 1 1 13 13 LEU HB2 H 1 1.750 0.01 . 1 . . . . 13 LEU HB2 . 34014 1
141 . 1 1 13 13 LEU HB3 H 1 1.652 0.01 . 1 . . . . 13 LEU HB3 . 34014 1
142 . 1 1 13 13 LEU HG H 1 1.654 0.01 . 1 . . . . 13 LEU HG . 34014 1
143 . 1 1 13 13 LEU HD11 H 1 0.882 0.01 . 1 . . . . 13 LEU HD11 . 34014 1
144 . 1 1 13 13 LEU HD12 H 1 0.882 0.01 . 1 . . . . 13 LEU HD12 . 34014 1
145 . 1 1 13 13 LEU HD13 H 1 0.882 0.01 . 1 . . . . 13 LEU HD13 . 34014 1
146 . 1 1 13 13 LEU HD21 H 1 0.882 0.01 . 1 . . . . 13 LEU HD21 . 34014 1
147 . 1 1 13 13 LEU HD22 H 1 0.882 0.01 . 1 . . . . 13 LEU HD22 . 34014 1
148 . 1 1 13 13 LEU HD23 H 1 0.882 0.01 . 1 . . . . 13 LEU HD23 . 34014 1
149 . 1 1 13 13 LEU CA C 13 54.628 0.2 . 1 . . . . 13 LEU CA . 34014 1
150 . 1 1 13 13 LEU CB C 13 39.304 0.2 . 1 . . . . 13 LEU CB . 34014 1
151 . 1 1 13 13 LEU N N 15 120.239 0.2 . 1 . . . . 13 LEU N . 34014 1
152 . 1 1 14 14 ARG H H 1 7.239 0.01 . 1 . . . . 14 ARG H . 34014 1
153 . 1 1 14 14 ARG HA H 1 4.337 0.01 . 1 . . . . 14 ARG HA . 34014 1
154 . 1 1 14 14 ARG HB2 H 1 2.044 0.01 . 1 . . . . 14 ARG HB2 . 34014 1
155 . 1 1 14 14 ARG HB3 H 1 1.595 0.01 . 1 . . . . 14 ARG HB3 . 34014 1
156 . 1 1 14 14 ARG HG2 H 1 1.741 0.01 . 1 . . . . 14 ARG HG2 . 34014 1
157 . 1 1 14 14 ARG HG3 H 1 1.741 0.01 . 1 . . . . 14 ARG HG3 . 34014 1
158 . 1 1 14 14 ARG HD2 H 1 3.099 0.01 . 1 . . . . 14 ARG HD2 . 34014 1
159 . 1 1 14 14 ARG HD3 H 1 3.099 0.01 . 1 . . . . 14 ARG HD3 . 34014 1
160 . 1 1 14 14 ARG HE H 1 6.993 0.01 . 1 . . . . 14 ARG HE . 34014 1
161 . 1 1 14 14 ARG CA C 13 52.679 0.2 . 1 . . . . 14 ARG CA . 34014 1
162 . 1 1 14 14 ARG CD C 13 41.049 0.2 . 1 . . . . 14 ARG CD . 34014 1
163 . 1 1 14 14 ARG N N 15 117.284 0.2 . 1 . . . . 14 ARG N . 34014 1
164 . 1 1 15 15 ASN H H 1 8.007 0.01 . 1 . . . . 15 ASN H . 34014 1
165 . 1 1 15 15 ASN HA H 1 4.410 0.01 . 1 . . . . 15 ASN HA . 34014 1
166 . 1 1 15 15 ASN HB2 H 1 3.147 0.01 . 1 . . . . 15 ASN HB2 . 34014 1
167 . 1 1 15 15 ASN HB3 H 1 2.912 0.01 . 1 . . . . 15 ASN HB3 . 34014 1
168 . 1 1 15 15 ASN HD21 H 1 7.530 0.01 . 1 . . . . 15 ASN HD21 . 34014 1
169 . 1 1 15 15 ASN HD22 H 1 6.882 0.01 . 1 . . . . 15 ASN HD22 . 34014 1
170 . 1 1 15 15 ASN CA C 13 51.678 0.2 . 1 . . . . 15 ASN CA . 34014 1
171 . 1 1 15 15 ASN CB C 13 34.191 0.2 . 1 . . . . 15 ASN CB . 34014 1
172 . 1 1 15 15 ASN N N 15 112.907 0.2 . 1 . . . . 15 ASN N . 34014 1
173 . 1 1 16 16 GLY H H 1 8.005 0.01 . 1 . . . . 16 GLY H . 34014 1
174 . 1 1 16 16 GLY HA2 H 1 4.511 0.01 . 1 . . . . 16 GLY HA2 . 34014 1
175 . 1 1 16 16 GLY HA3 H 1 3.239 0.01 . 1 . . . . 16 GLY HA3 . 34014 1
176 . 1 1 16 16 GLY N N 15 105.090 0.2 . 1 . . . . 16 GLY N . 34014 1
177 . 1 1 17 17 ILE H H 1 8.677 0.01 . 1 . . . . 17 ILE H . 34014 1
178 . 1 1 17 17 ILE HA H 1 4.088 0.01 . 1 . . . . 17 ILE HA . 34014 1
179 . 1 1 17 17 ILE HB H 1 1.484 0.01 . 1 . . . . 17 ILE HB . 34014 1
180 . 1 1 17 17 ILE HG12 H 1 1.045 0.01 . 1 . . . . 17 ILE HG12 . 34014 1
181 . 1 1 17 17 ILE HG13 H 1 1.045 0.01 . 1 . . . . 17 ILE HG13 . 34014 1
182 . 1 1 17 17 ILE HG21 H 1 0.326 0.01 . 1 . . . . 17 ILE HG21 . 34014 1
183 . 1 1 17 17 ILE HG22 H 1 0.326 0.01 . 1 . . . . 17 ILE HG22 . 34014 1
184 . 1 1 17 17 ILE HG23 H 1 0.326 0.01 . 1 . . . . 17 ILE HG23 . 34014 1
185 . 1 1 17 17 ILE HD11 H 1 0.811 0.01 . 1 . . . . 17 ILE HD11 . 34014 1
186 . 1 1 17 17 ILE HD12 H 1 0.811 0.01 . 1 . . . . 17 ILE HD12 . 34014 1
187 . 1 1 17 17 ILE HD13 H 1 0.811 0.01 . 1 . . . . 17 ILE HD13 . 34014 1
188 . 1 1 17 17 ILE CA C 13 56.875 0.2 . 1 . . . . 17 ILE CA . 34014 1
189 . 1 1 17 17 ILE CB C 13 38.674 0.2 . 1 . . . . 17 ILE CB . 34014 1
190 . 1 1 17 17 ILE CG1 C 13 24.598 0.2 . 1 . . . . 17 ILE CG1 . 34014 1
191 . 1 1 17 17 ILE CG2 C 13 15.058 0.2 . 1 . . . . 17 ILE CG2 . 34014 1
192 . 1 1 17 17 ILE CD1 C 13 10.183 0.2 . 1 . . . . 17 ILE CD1 . 34014 1
193 . 1 1 17 17 ILE N N 15 119.314 0.2 . 1 . . . . 17 ILE N . 34014 1
194 . 1 1 18 18 CYS H H 1 8.571 0.01 . 1 . . . . 18 CYS H . 34014 1
195 . 1 1 18 18 CYS HA H 1 5.220 0.01 . 1 . . . . 18 CYS HA . 34014 1
196 . 1 1 18 18 CYS HB2 H 1 2.831 0.01 . 1 . . . . 18 CYS HB2 . 34014 1
197 . 1 1 18 18 CYS HB3 H 1 2.831 0.01 . 1 . . . . 18 CYS HB3 . 34014 1
198 . 1 1 18 18 CYS CA C 13 51.783 0.2 . 1 . . . . 18 CYS CA . 34014 1
199 . 1 1 18 18 CYS CB C 13 37.977 0.2 . 1 . . . . 18 CYS CB . 34014 1
200 . 1 1 18 18 CYS N N 15 125.455 0.2 . 1 . . . . 18 CYS N . 34014 1
201 . 1 1 19 19 PHE H H 1 9.815 0.01 . 1 . . . . 19 PHE H . 34014 1
202 . 1 1 19 19 PHE HA H 1 4.821 0.01 . 1 . . . . 19 PHE HA . 34014 1
203 . 1 1 19 19 PHE HB2 H 1 3.071 0.01 . 1 . . . . 19 PHE HB2 . 34014 1
204 . 1 1 19 19 PHE HB3 H 1 2.817 0.01 . 1 . . . . 19 PHE HB3 . 34014 1
205 . 1 1 19 19 PHE HD1 H 1 7.151 0.01 . 1 . . . . 19 PHE HD1 . 34014 1
206 . 1 1 19 19 PHE HD2 H 1 7.151 0.01 . 1 . . . . 19 PHE HD2 . 34014 1
207 . 1 1 19 19 PHE HE1 H 1 6.808 0.01 . 1 . . . . 19 PHE HE1 . 34014 1
208 . 1 1 19 19 PHE HE2 H 1 6.808 0.01 . 1 . . . . 19 PHE HE2 . 34014 1
209 . 1 1 19 19 PHE HZ H 1 6.480 0.01 . 1 . . . . 19 PHE HZ . 34014 1
210 . 1 1 19 19 PHE CA C 13 52.612 0.2 . 1 . . . . 19 PHE CA . 34014 1
211 . 1 1 19 19 PHE CB C 13 40.386 0.2 . 1 . . . . 19 PHE CB . 34014 1
212 . 1 1 19 19 PHE CD1 C 13 129.433 0.2 . 1 . . . . 19 PHE CD1 . 34014 1
213 . 1 1 19 19 PHE CD2 C 13 129.433 0.2 . 1 . . . . 19 PHE CD2 . 34014 1
214 . 1 1 19 19 PHE CE1 C 13 128.080 0.2 . 1 . . . . 19 PHE CE1 . 34014 1
215 . 1 1 19 19 PHE CE2 C 13 128.080 0.2 . 1 . . . . 19 PHE CE2 . 34014 1
216 . 1 1 19 19 PHE CZ C 13 126.756 0.2 . 1 . . . . 19 PHE CZ . 34014 1
217 . 1 1 19 19 PHE N N 15 131.725 0.2 . 1 . . . . 19 PHE N . 34014 1
218 . 1 1 20 20 PRO HA H 1 4.677 0.01 . 1 . . . . 20 PRO HA . 34014 1
219 . 1 1 20 20 PRO HB2 H 1 2.169 0.01 . 1 . . . . 20 PRO HB2 . 34014 1
220 . 1 1 20 20 PRO HB3 H 1 2.169 0.01 . 1 . . . . 20 PRO HB3 . 34014 1
221 . 1 1 20 20 PRO HG2 H 1 2.064 0.01 . 1 . . . . 20 PRO HG2 . 34014 1
222 . 1 1 20 20 PRO HG3 H 1 2.064 0.01 . 1 . . . . 20 PRO HG3 . 34014 1
223 . 1 1 20 20 PRO HD2 H 1 3.775 0.01 . 1 . . . . 20 PRO HD2 . 34014 1
224 . 1 1 20 20 PRO HD3 H 1 3.709 0.01 . 1 . . . . 20 PRO HD3 . 34014 1
225 . 1 1 20 20 PRO CA C 13 60.406 0.2 . 1 . . . . 20 PRO CA . 34014 1
226 . 1 1 20 20 PRO CB C 13 28.232 0.2 . 1 . . . . 20 PRO CB . 34014 1
227 . 1 1 20 20 PRO CG C 13 24.434 0.2 . 1 . . . . 20 PRO CG . 34014 1
228 . 1 1 20 20 PRO CD C 13 47.673 0.2 . 1 . . . . 20 PRO CD . 34014 1
229 . 1 1 21 21 GLY H H 1 8.001 0.01 . 1 . . . . 21 GLY H . 34014 1
230 . 1 1 21 21 GLY HA2 H 1 4.206 0.01 . 1 . . . . 21 GLY HA2 . 34014 1
231 . 1 1 21 21 GLY HA3 H 1 3.892 0.01 . 1 . . . . 21 GLY HA3 . 34014 1
232 . 1 1 21 21 GLY CA C 13 42.288 0.2 . 1 . . . . 21 GLY CA . 34014 1
233 . 1 1 21 21 GLY N N 15 109.553 0.2 . 1 . . . . 21 GLY N . 34014 1
234 . 1 1 22 22 ILE H H 1 7.835 0.01 . 1 . . . . 22 ILE H . 34014 1
235 . 1 1 22 22 ILE HA H 1 4.419 0.01 . 1 . . . . 22 ILE HA . 34014 1
236 . 1 1 22 22 ILE HB H 1 1.929 0.01 . 1 . . . . 22 ILE HB . 34014 1
237 . 1 1 22 22 ILE HG12 H 1 1.300 0.01 . 1 . . . . 22 ILE HG12 . 34014 1
238 . 1 1 22 22 ILE HG13 H 1 1.161 0.01 . 1 . . . . 22 ILE HG13 . 34014 1
239 . 1 1 22 22 ILE HG21 H 1 0.939 0.01 . 1 . . . . 22 ILE HG21 . 34014 1
240 . 1 1 22 22 ILE HG22 H 1 0.939 0.01 . 1 . . . . 22 ILE HG22 . 34014 1
241 . 1 1 22 22 ILE HG23 H 1 0.939 0.01 . 1 . . . . 22 ILE HG23 . 34014 1
242 . 1 1 22 22 ILE HD11 H 1 0.840 0.01 . 1 . . . . 22 ILE HD11 . 34014 1
243 . 1 1 22 22 ILE HD12 H 1 0.840 0.01 . 1 . . . . 22 ILE HD12 . 34014 1
244 . 1 1 22 22 ILE HD13 H 1 0.840 0.01 . 1 . . . . 22 ILE HD13 . 34014 1
245 . 1 1 22 22 ILE CA C 13 57.663 0.2 . 1 . . . . 22 ILE CA . 34014 1
246 . 1 1 22 22 ILE CB C 13 37.337 0.2 . 1 . . . . 22 ILE CB . 34014 1
247 . 1 1 22 22 ILE CG1 C 13 23.721 0.2 . 1 . . . . 22 ILE CG1 . 34014 1
248 . 1 1 22 22 ILE CG2 C 13 14.870 0.2 . 1 . . . . 22 ILE CG2 . 34014 1
249 . 1 1 22 22 ILE CD1 C 13 10.268 0.2 . 1 . . . . 22 ILE CD1 . 34014 1
250 . 1 1 22 22 ILE N N 15 118.232 0.2 . 1 . . . . 22 ILE N . 34014 1
251 . 1 1 23 23 CYS H H 1 8.653 0.01 . 1 . . . . 23 CYS H . 34014 1
252 . 1 1 23 23 CYS HA H 1 4.230 0.01 . 1 . . . . 23 CYS HA . 34014 1
253 . 1 1 23 23 CYS HB2 H 1 2.750 0.01 . 1 . . . . 23 CYS HB2 . 34014 1
254 . 1 1 23 23 CYS HB3 H 1 2.476 0.01 . 1 . . . . 23 CYS HB3 . 34014 1
255 . 1 1 23 23 CYS CA C 13 50.918 0.2 . 1 . . . . 23 CYS CA . 34014 1
256 . 1 1 23 23 CYS CB C 13 36.430 0.2 . 1 . . . . 23 CYS CB . 34014 1
257 . 1 1 23 23 CYS N N 15 119.505 0.2 . 1 . . . . 23 CYS N . 34014 1
258 . 1 1 24 24 ARG H H 1 7.981 0.01 . 1 . . . . 24 ARG H . 34014 1
259 . 1 1 24 24 ARG HA H 1 4.574 0.01 . 1 . . . . 24 ARG HA . 34014 1
260 . 1 1 24 24 ARG HB2 H 1 1.815 0.01 . 1 . . . . 24 ARG HB2 . 34014 1
261 . 1 1 24 24 ARG HB3 H 1 1.815 0.01 . 1 . . . . 24 ARG HB3 . 34014 1
262 . 1 1 24 24 ARG HG2 H 1 1.612 0.01 . 1 . . . . 24 ARG HG2 . 34014 1
263 . 1 1 24 24 ARG HG3 H 1 1.609 0.01 . 1 . . . . 24 ARG HG3 . 34014 1
264 . 1 1 24 24 ARG HD2 H 1 3.184 0.01 . 1 . . . . 24 ARG HD2 . 34014 1
265 . 1 1 24 24 ARG HD3 H 1 3.184 0.01 . 1 . . . . 24 ARG HD3 . 34014 1
266 . 1 1 24 24 ARG HE H 1 7.210 0.01 . 1 . . . . 24 ARG HE . 34014 1
267 . 1 1 24 24 ARG CA C 13 51.319 0.2 . 1 . . . . 24 ARG CA . 34014 1
268 . 1 1 24 24 ARG CB C 13 29.307 0.2 . 1 . . . . 24 ARG CB . 34014 1
269 . 1 1 24 24 ARG CG C 13 24.411 0.2 . 1 . . . . 24 ARG CG . 34014 1
270 . 1 1 24 24 ARG CD C 13 40.541 0.2 . 1 . . . . 24 ARG CD . 34014 1
271 . 1 1 24 24 ARG N N 15 123.459 0.2 . 1 . . . . 24 ARG N . 34014 1
272 . 1 1 25 25 ARG HA H 1 4.294 0.01 . 1 . . . . 25 ARG HA . 34014 1
273 . 1 1 25 25 ARG HB2 H 1 1.742 0.01 . 1 . . . . 25 ARG HB2 . 34014 1
274 . 1 1 25 25 ARG HB3 H 1 1.742 0.01 . 1 . . . . 25 ARG HB3 . 34014 1
275 . 1 1 25 25 ARG HG2 H 1 1.566 0.01 . 1 . . . . 25 ARG HG2 . 34014 1
276 . 1 1 25 25 ARG HG3 H 1 1.561 0.01 . 1 . . . . 25 ARG HG3 . 34014 1
277 . 1 1 25 25 ARG HD2 H 1 3.089 0.01 . 1 . . . . 25 ARG HD2 . 34014 1
278 . 1 1 25 25 ARG HD3 H 1 3.089 0.01 . 1 . . . . 25 ARG HD3 . 34014 1
279 . 1 1 25 25 ARG HE H 1 7.131 0.01 . 1 . . . . 25 ARG HE . 34014 1
280 . 1 1 25 25 ARG CA C 13 53.161 0.2 . 1 . . . . 25 ARG CA . 34014 1
281 . 1 1 25 25 ARG CB C 13 26.641 0.2 . 1 . . . . 25 ARG CB . 34014 1
282 . 1 1 26 26 PRO HA H 1 4.447 0.01 . 1 . . . . 26 PRO HA . 34014 1
283 . 1 1 26 26 PRO HB2 H 1 2.282 0.01 . 1 . . . . 26 PRO HB2 . 34014 1
284 . 1 1 26 26 PRO HB3 H 1 1.861 0.01 . 1 . . . . 26 PRO HB3 . 34014 1
285 . 1 1 26 26 PRO HG2 H 1 2.105 0.01 . 1 . . . . 26 PRO HG2 . 34014 1
286 . 1 1 26 26 PRO HG3 H 1 1.072 0.01 . 1 . . . . 26 PRO HG3 . 34014 1
287 . 1 1 26 26 PRO HD2 H 1 3.514 0.01 . 1 . . . . 26 PRO HD2 . 34014 1
288 . 1 1 26 26 PRO HD3 H 1 3.514 0.01 . 1 . . . . 26 PRO HD3 . 34014 1
289 . 1 1 26 26 PRO CA C 13 61.318 0.2 . 1 . . . . 26 PRO CA . 34014 1
290 . 1 1 26 26 PRO CB C 13 29.346 0.2 . 1 . . . . 26 PRO CB . 34014 1
291 . 1 1 26 26 PRO CG C 13 24.390 0.2 . 1 . . . . 26 PRO CG . 34014 1
292 . 1 1 26 26 PRO CD C 13 47.561 0.2 . 1 . . . . 26 PRO CD . 34014 1
293 . 1 1 27 27 TYR H H 1 9.334 0.01 . 1 . . . . 27 TYR H . 34014 1
294 . 1 1 27 27 TYR HA H 1 5.048 0.01 . 1 . . . . 27 TYR HA . 34014 1
295 . 1 1 27 27 TYR HB2 H 1 3.036 0.01 . 1 . . . . 27 TYR HB2 . 34014 1
296 . 1 1 27 27 TYR HB3 H 1 2.680 0.01 . 1 . . . . 27 TYR HB3 . 34014 1
297 . 1 1 27 27 TYR HD1 H 1 6.936 0.01 . 1 . . . . 27 TYR HD1 . 34014 1
298 . 1 1 27 27 TYR HD2 H 1 6.936 0.01 . 1 . . . . 27 TYR HD2 . 34014 1
299 . 1 1 27 27 TYR HE1 H 1 6.872 0.01 . 1 . . . . 27 TYR HE1 . 34014 1
300 . 1 1 27 27 TYR HE2 H 1 6.872 0.01 . 1 . . . . 27 TYR HE2 . 34014 1
301 . 1 1 27 27 TYR CA C 13 55.703 0.2 . 1 . . . . 27 TYR CA . 34014 1
302 . 1 1 27 27 TYR CD1 C 13 130.296 0.2 . 1 . . . . 27 TYR CD1 . 34014 1
303 . 1 1 27 27 TYR CD2 C 13 130.296 0.2 . 1 . . . . 27 TYR CD2 . 34014 1
304 . 1 1 27 27 TYR CE1 C 13 115.857 0.2 . 1 . . . . 27 TYR CE1 . 34014 1
305 . 1 1 27 27 TYR CE2 C 13 115.857 0.2 . 1 . . . . 27 TYR CE2 . 34014 1
306 . 1 1 27 27 TYR N N 15 127.346 0.2 . 1 . . . . 27 TYR N . 34014 1
307 . 1 1 28 28 TYR H H 1 9.092 0.01 . 1 . . . . 28 TYR H . 34014 1
308 . 1 1 28 28 TYR HA H 1 4.891 0.01 . 1 . . . . 28 TYR HA . 34014 1
309 . 1 1 28 28 TYR HB2 H 1 3.076 0.01 . 1 . . . . 28 TYR HB2 . 34014 1
310 . 1 1 28 28 TYR HB3 H 1 2.968 0.01 . 1 . . . . 28 TYR HB3 . 34014 1
311 . 1 1 28 28 TYR HD1 H 1 6.994 0.01 . 1 . . . . 28 TYR HD1 . 34014 1
312 . 1 1 28 28 TYR HD2 H 1 6.994 0.01 . 1 . . . . 28 TYR HD2 . 34014 1
313 . 1 1 28 28 TYR HE1 H 1 6.585 0.01 . 1 . . . . 28 TYR HE1 . 34014 1
314 . 1 1 28 28 TYR HE2 H 1 6.585 0.01 . 1 . . . . 28 TYR HE2 . 34014 1
315 . 1 1 28 28 TYR CA C 13 53.173 0.2 . 1 . . . . 28 TYR CA . 34014 1
316 . 1 1 28 28 TYR CD1 C 13 131.434 0.2 . 1 . . . . 28 TYR CD1 . 34014 1
317 . 1 1 28 28 TYR CD2 C 13 131.434 0.2 . 1 . . . . 28 TYR CD2 . 34014 1
318 . 1 1 28 28 TYR CE1 C 13 115.047 0.2 . 1 . . . . 28 TYR CE1 . 34014 1
319 . 1 1 28 28 TYR CE2 C 13 115.047 0.2 . 1 . . . . 28 TYR CE2 . 34014 1
320 . 1 1 28 28 TYR N N 15 116.456 0.2 . 1 . . . . 28 TYR N . 34014 1
321 . 1 1 29 29 TRP H H 1 8.867 0.01 . 1 . . . . 29 TRP H . 34014 1
322 . 1 1 29 29 TRP HA H 1 4.710 0.01 . 1 . . . . 29 TRP HA . 34014 1
323 . 1 1 29 29 TRP HB2 H 1 3.373 0.01 . 1 . . . . 29 TRP HB2 . 34014 1
324 . 1 1 29 29 TRP HB3 H 1 3.307 0.01 . 1 . . . . 29 TRP HB3 . 34014 1
325 . 1 1 29 29 TRP HD1 H 1 7.429 0.01 . 1 . . . . 29 TRP HD1 . 34014 1
326 . 1 1 29 29 TRP HE1 H 1 10.209 0.01 . 1 . . . . 29 TRP HE1 . 34014 1
327 . 1 1 29 29 TRP HE3 H 1 7.463 0.01 . 1 . . . . 29 TRP HE3 . 34014 1
328 . 1 1 29 29 TRP HZ2 H 1 7.357 0.01 . 1 . . . . 29 TRP HZ2 . 34014 1
329 . 1 1 29 29 TRP HZ3 H 1 7.083 0.01 . 1 . . . . 29 TRP HZ3 . 34014 1
330 . 1 1 29 29 TRP HH2 H 1 7.189 0.01 . 1 . . . . 29 TRP HH2 . 34014 1
331 . 1 1 29 29 TRP CA C 13 57.954 0.2 . 1 . . . . 29 TRP CA . 34014 1
332 . 1 1 29 29 TRP CB C 13 28.171 0.2 . 1 . . . . 29 TRP CB . 34014 1
333 . 1 1 29 29 TRP CD1 C 13 125.639 0.2 . 1 . . . . 29 TRP CD1 . 34014 1
334 . 1 1 29 29 TRP CE3 C 13 118.393 0.2 . 1 . . . . 29 TRP CE3 . 34014 1
335 . 1 1 29 29 TRP CZ2 C 13 111.671 0.2 . 1 . . . . 29 TRP CZ2 . 34014 1
336 . 1 1 29 29 TRP CZ3 C 13 119.239 0.2 . 1 . . . . 29 TRP CZ3 . 34014 1
337 . 1 1 29 29 TRP CH2 C 13 121.867 0.2 . 1 . . . . 29 TRP CH2 . 34014 1
338 . 1 1 29 29 TRP N N 15 124.312 0.2 . 1 . . . . 29 TRP N . 34014 1
339 . 1 1 29 29 TRP NE1 N 15 131.779 0.2 . 1 . . . . 29 TRP NE1 . 34014 1
340 . 1 1 30 30 ILE H H 1 8.621 0.01 . 1 . . . . 30 ILE H . 34014 1
341 . 1 1 30 30 ILE HA H 1 4.561 0.01 . 1 . . . . 30 ILE HA . 34014 1
342 . 1 1 30 30 ILE HB H 1 1.940 0.01 . 1 . . . . 30 ILE HB . 34014 1
343 . 1 1 30 30 ILE HG12 H 1 0.514 0.01 . 1 . . . . 30 ILE HG12 . 34014 1
344 . 1 1 30 30 ILE HG13 H 1 0.514 0.01 . 1 . . . . 30 ILE HG13 . 34014 1
345 . 1 1 30 30 ILE HG21 H 1 0.827 0.01 . 1 . . . . 30 ILE HG21 . 34014 1
346 . 1 1 30 30 ILE HG22 H 1 0.827 0.01 . 1 . . . . 30 ILE HG22 . 34014 1
347 . 1 1 30 30 ILE HG23 H 1 0.827 0.01 . 1 . . . . 30 ILE HG23 . 34014 1
348 . 1 1 30 30 ILE HD11 H 1 0.617 0.01 . 1 . . . . 30 ILE HD11 . 34014 1
349 . 1 1 30 30 ILE HD12 H 1 0.617 0.01 . 1 . . . . 30 ILE HD12 . 34014 1
350 . 1 1 30 30 ILE HD13 H 1 0.617 0.01 . 1 . . . . 30 ILE HD13 . 34014 1
351 . 1 1 30 30 ILE CA C 13 58.257 0.2 . 1 . . . . 30 ILE CA . 34014 1
352 . 1 1 30 30 ILE CB C 13 37.670 0.2 . 1 . . . . 30 ILE CB . 34014 1
353 . 1 1 30 30 ILE CG1 C 13 23.520 0.2 . 1 . . . . 30 ILE CG1 . 34014 1
354 . 1 1 30 30 ILE CG2 C 13 16.108 0.2 . 1 . . . . 30 ILE CG2 . 34014 1
355 . 1 1 30 30 ILE CD1 C 13 12.179 0.2 . 1 . . . . 30 ILE CD1 . 34014 1
356 . 1 1 30 30 ILE N N 15 118.022 0.2 . 1 . . . . 30 ILE N . 34014 1
357 . 1 1 31 31 GLY H H 1 5.910 0.01 . 1 . . . . 31 GLY H . 34014 1
358 . 1 1 31 31 GLY HA2 H 1 3.718 0.01 . 1 . . . . 31 GLY HA2 . 34014 1
359 . 1 1 31 31 GLY HA3 H 1 2.980 0.01 . 1 . . . . 31 GLY HA3 . 34014 1
360 . 1 1 32 32 THR H H 1 8.265 0.01 . 1 . . . . 32 THR H . 34014 1
361 . 1 1 32 32 THR HA H 1 4.956 0.01 . 1 . . . . 32 THR HA . 34014 1
362 . 1 1 32 32 THR HB H 1 4.317 0.01 . 1 . . . . 32 THR HB . 34014 1
363 . 1 1 32 32 THR HG21 H 1 1.535 0.01 . 1 . . . . 32 THR HG21 . 34014 1
364 . 1 1 32 32 THR HG22 H 1 1.535 0.01 . 1 . . . . 32 THR HG22 . 34014 1
365 . 1 1 32 32 THR HG23 H 1 1.535 0.01 . 1 . . . . 32 THR HG23 . 34014 1
366 . 1 1 32 32 THR CA C 13 57.678 0.2 . 1 . . . . 32 THR CA . 34014 1
367 . 1 1 32 32 THR CB C 13 68.746 0.2 . 1 . . . . 32 THR CB . 34014 1
368 . 1 1 32 32 THR CG2 C 13 18.914 0.2 . 1 . . . . 32 THR CG2 . 34014 1
369 . 1 1 32 32 THR N N 15 110.239 0.2 . 1 . . . . 32 THR N . 34014 1
370 . 1 1 33 33 CYS H H 1 7.829 0.01 . 1 . . . . 33 CYS H . 34014 1
371 . 1 1 33 33 CYS HA H 1 4.852 0.01 . 1 . . . . 33 CYS HA . 34014 1
372 . 1 1 33 33 CYS HB2 H 1 3.500 0.01 . 1 . . . . 33 CYS HB2 . 34014 1
373 . 1 1 33 33 CYS HB3 H 1 3.264 0.01 . 1 . . . . 33 CYS HB3 . 34014 1
374 . 1 1 33 33 CYS CA C 13 54.044 0.2 . 1 . . . . 33 CYS CA . 34014 1
375 . 1 1 33 33 CYS N N 15 114.880 0.2 . 1 . . . . 33 CYS N . 34014 1
376 . 1 1 34 34 ASN H H 1 9.223 0.01 . 1 . . . . 34 ASN H . 34014 1
377 . 1 1 34 34 ASN HA H 1 4.390 0.01 . 1 . . . . 34 ASN HA . 34014 1
378 . 1 1 34 34 ASN HB2 H 1 3.040 0.01 . 1 . . . . 34 ASN HB2 . 34014 1
379 . 1 1 34 34 ASN HB3 H 1 2.582 0.01 . 1 . . . . 34 ASN HB3 . 34014 1
380 . 1 1 34 34 ASN HD21 H 1 7.504 0.01 . 1 . . . . 34 ASN HD21 . 34014 1
381 . 1 1 34 34 ASN HD22 H 1 6.879 0.01 . 1 . . . . 34 ASN HD22 . 34014 1
382 . 1 1 34 34 ASN CA C 13 51.260 0.2 . 1 . . . . 34 ASN CA . 34014 1
383 . 1 1 34 34 ASN CB C 13 34.391 0.2 . 1 . . . . 34 ASN CB . 34014 1
384 . 1 1 34 34 ASN N N 15 119.258 0.2 . 1 . . . . 34 ASN N . 34014 1
385 . 1 1 34 34 ASN ND2 N 15 112.686 0.2 . 1 . . . . 34 ASN ND2 . 34014 1
386 . 1 1 35 35 ASN H H 1 8.950 0.01 . 1 . . . . 35 ASN H . 34014 1
387 . 1 1 35 35 ASN HA H 1 4.328 0.01 . 1 . . . . 35 ASN HA . 34014 1
388 . 1 1 35 35 ASN HB2 H 1 3.053 0.01 . 1 . . . . 35 ASN HB2 . 34014 1
389 . 1 1 35 35 ASN HB3 H 1 2.827 0.01 . 1 . . . . 35 ASN HB3 . 34014 1
390 . 1 1 35 35 ASN HD21 H 1 7.557 0.01 . 1 . . . . 35 ASN HD21 . 34014 1
391 . 1 1 35 35 ASN HD22 H 1 6.879 0.01 . 1 . . . . 35 ASN HD22 . 34014 1
392 . 1 1 35 35 ASN CA C 13 51.620 0.2 . 1 . . . . 35 ASN CA . 34014 1
393 . 1 1 35 35 ASN CB C 13 34.709 0.2 . 1 . . . . 35 ASN CB . 34014 1
394 . 1 1 35 35 ASN N N 15 115.216 0.2 . 1 . . . . 35 ASN N . 34014 1
395 . 1 1 35 35 ASN ND2 N 15 113.198 0.2 . 1 . . . . 35 ASN ND2 . 34014 1
396 . 1 1 36 36 GLY H H 1 7.800 0.01 . 1 . . . . 36 GLY H . 34014 1
397 . 1 1 36 36 GLY HA2 H 1 4.381 0.01 . 1 . . . . 36 GLY HA2 . 34014 1
398 . 1 1 36 36 GLY HA3 H 1 3.613 0.01 . 1 . . . . 36 GLY HA3 . 34014 1
399 . 1 1 36 36 GLY N N 15 104.391 0.2 . 1 . . . . 36 GLY N . 34014 1
400 . 1 1 37 37 ILE H H 1 7.509 0.01 . 1 . . . . 37 ILE H . 34014 1
401 . 1 1 37 37 ILE HA H 1 4.391 0.01 . 1 . . . . 37 ILE HA . 34014 1
402 . 1 1 37 37 ILE HB H 1 2.128 0.01 . 1 . . . . 37 ILE HB . 34014 1
403 . 1 1 37 37 ILE HG12 H 1 1.491 0.01 . 1 . . . . 37 ILE HG12 . 34014 1
404 . 1 1 37 37 ILE HG13 H 1 1.366 0.01 . 1 . . . . 37 ILE HG13 . 34014 1
405 . 1 1 37 37 ILE HG21 H 1 0.979 0.01 . 1 . . . . 37 ILE HG21 . 34014 1
406 . 1 1 37 37 ILE HG22 H 1 0.979 0.01 . 1 . . . . 37 ILE HG22 . 34014 1
407 . 1 1 37 37 ILE HG23 H 1 0.979 0.01 . 1 . . . . 37 ILE HG23 . 34014 1
408 . 1 1 37 37 ILE HD11 H 1 0.889 0.01 . 1 . . . . 37 ILE HD11 . 34014 1
409 . 1 1 37 37 ILE HD12 H 1 0.889 0.01 . 1 . . . . 37 ILE HD12 . 34014 1
410 . 1 1 37 37 ILE HD13 H 1 0.889 0.01 . 1 . . . . 37 ILE HD13 . 34014 1
411 . 1 1 37 37 ILE CA C 13 59.028 0.2 . 1 . . . . 37 ILE CA . 34014 1
412 . 1 1 37 37 ILE CB C 13 36.201 0.2 . 1 . . . . 37 ILE CB . 34014 1
413 . 1 1 37 37 ILE CG1 C 13 24.257 0.2 . 1 . . . . 37 ILE CG1 . 34014 1
414 . 1 1 37 37 ILE CG2 C 13 14.933 0.2 . 1 . . . . 37 ILE CG2 . 34014 1
415 . 1 1 37 37 ILE CD1 C 13 10.247 0.2 . 1 . . . . 37 ILE CD1 . 34014 1
416 . 1 1 37 37 ILE N N 15 117.474 0.2 . 1 . . . . 37 ILE N . 34014 1
417 . 1 1 38 38 GLY H H 1 8.245 0.01 . 1 . . . . 38 GLY H . 34014 1
418 . 1 1 38 38 GLY HA2 H 1 4.620 0.01 . 1 . . . . 38 GLY HA2 . 34014 1
419 . 1 1 38 38 GLY HA3 H 1 3.709 0.01 . 1 . . . . 38 GLY HA3 . 34014 1
420 . 1 1 38 38 GLY N N 15 109.137 0.2 . 1 . . . . 38 GLY N . 34014 1
421 . 1 1 39 39 SER H H 1 8.966 0.01 . 1 . . . . 39 SER H . 34014 1
422 . 1 1 39 39 SER HA H 1 4.837 0.01 . 1 . . . . 39 SER HA . 34014 1
423 . 1 1 39 39 SER HB2 H 1 4.009 0.01 . 1 . . . . 39 SER HB2 . 34014 1
424 . 1 1 39 39 SER HB3 H 1 3.937 0.01 . 1 . . . . 39 SER HB3 . 34014 1
425 . 1 1 39 39 SER HG H 1 5.761 0.01 . 1 . . . . 39 SER HG . 34014 1
426 . 1 1 39 39 SER CB C 13 63.056 0.2 . 1 . . . . 39 SER CB . 34014 1
427 . 1 1 39 39 SER N N 15 117.008 0.2 . 1 . . . . 39 SER N . 34014 1
428 . 1 1 40 40 CYS H H 1 8.801 0.01 . 1 . . . . 40 CYS H . 34014 1
429 . 1 1 40 40 CYS HA H 1 4.804 0.01 . 1 . . . . 40 CYS HA . 34014 1
430 . 1 1 40 40 CYS HB2 H 1 2.214 0.01 . 1 . . . . 40 CYS HB2 . 34014 1
431 . 1 1 40 40 CYS HB3 H 1 2.093 0.01 . 1 . . . . 40 CYS HB3 . 34014 1
432 . 1 1 40 40 CYS N N 15 125.428 0.2 . 1 . . . . 40 CYS N . 34014 1
433 . 1 1 41 41 CYS H H 1 9.246 0.01 . 1 . . . . 41 CYS H . 34014 1
434 . 1 1 41 41 CYS HA H 1 5.535 0.01 . 1 . . . . 41 CYS HA . 34014 1
435 . 1 1 41 41 CYS HB2 H 1 2.990 0.01 . 1 . . . . 41 CYS HB2 . 34014 1
436 . 1 1 41 41 CYS HB3 H 1 2.686 0.01 . 1 . . . . 41 CYS HB3 . 34014 1
437 . 1 1 41 41 CYS CA C 13 49.756 0.2 . 1 . . . . 41 CYS CA . 34014 1
438 . 1 1 41 41 CYS N N 15 127.164 0.2 . 1 . . . . 41 CYS N . 34014 1
439 . 1 1 42 42 ALA H H 1 9.042 0.01 . 1 . . . . 42 ALA H . 34014 1
440 . 1 1 42 42 ALA HA H 1 4.927 0.01 . 1 . . . . 42 ALA HA . 34014 1
441 . 1 1 42 42 ALA HB1 H 1 1.070 0.01 . 1 . . . . 42 ALA HB1 . 34014 1
442 . 1 1 42 42 ALA HB2 H 1 1.070 0.01 . 1 . . . . 42 ALA HB2 . 34014 1
443 . 1 1 42 42 ALA HB3 H 1 1.070 0.01 . 1 . . . . 42 ALA HB3 . 34014 1
444 . 1 1 42 42 ALA CA C 13 47.606 0.2 . 1 . . . . 42 ALA CA . 34014 1
445 . 1 1 42 42 ALA CB C 13 19.585 0.2 . 1 . . . . 42 ALA CB . 34014 1
446 . 1 1 42 42 ALA N N 15 125.603 0.2 . 1 . . . . 42 ALA N . 34014 1
447 . 1 1 43 43 ARG H H 1 8.710 0.01 . 1 . . . . 43 ARG H . 34014 1
448 . 1 1 43 43 ARG HA H 1 4.155 0.01 . 1 . . . . 43 ARG HA . 34014 1
449 . 1 1 43 43 ARG HB2 H 1 1.517 0.01 . 1 . . . . 43 ARG HB2 . 34014 1
450 . 1 1 43 43 ARG HB3 H 1 1.442 0.01 . 1 . . . . 43 ARG HB3 . 34014 1
451 . 1 1 43 43 ARG HG2 H 1 1.277 0.01 . 1 . . . . 43 ARG HG2 . 34014 1
452 . 1 1 43 43 ARG HG3 H 1 1.069 0.01 . 1 . . . . 43 ARG HG3 . 34014 1
453 . 1 1 43 43 ARG HD2 H 1 2.820 0.01 . 1 . . . . 43 ARG HD2 . 34014 1
454 . 1 1 43 43 ARG HD3 H 1 2.757 0.01 . 1 . . . . 43 ARG HD3 . 34014 1
455 . 1 1 43 43 ARG HE H 1 7.006 0.01 . 1 . . . . 43 ARG HE . 34014 1
456 . 1 1 43 43 ARG CG C 13 24.517 0.2 . 1 . . . . 43 ARG CG . 34014 1
457 . 1 1 43 43 ARG CD C 13 40.230 0.2 . 1 . . . . 43 ARG CD . 34014 1
458 . 1 1 43 43 ARG N N 15 119.494 0.2 . 1 . . . . 43 ARG N . 34014 1
459 . 1 1 44 44 GLY H H 1 8.465 0.01 . 1 . . . . 44 GLY H . 34014 1
460 . 1 1 44 44 GLY HA2 H 1 4.224 0.01 . 1 . . . . 44 GLY HA2 . 34014 1
461 . 1 1 44 44 GLY HA3 H 1 3.888 0.01 . 1 . . . . 44 GLY HA3 . 34014 1
462 . 1 1 44 44 GLY CA C 13 42.225 0.2 . 1 . . . . 44 GLY CA . 34014 1
463 . 1 1 44 44 GLY N N 15 112.215 0.2 . 1 . . . . 44 GLY N . 34014 1
464 . 1 1 45 45 TRP H H 1 8.145 0.01 . 1 . . . . 45 TRP H . 34014 1
465 . 1 1 45 45 TRP HA H 1 4.584 0.01 . 1 . . . . 45 TRP HA . 34014 1
466 . 1 1 45 45 TRP HB2 H 1 3.255 0.01 . 1 . . . . 45 TRP HB2 . 34014 1
467 . 1 1 45 45 TRP HB3 H 1 3.184 0.01 . 1 . . . . 45 TRP HB3 . 34014 1
468 . 1 1 45 45 TRP HD1 H 1 7.225 0.01 . 1 . . . . 45 TRP HD1 . 34014 1
469 . 1 1 45 45 TRP HE1 H 1 10.095 0.01 . 1 . . . . 45 TRP HE1 . 34014 1
470 . 1 1 45 45 TRP HE3 H 1 7.565 0.01 . 1 . . . . 45 TRP HE3 . 34014 1
471 . 1 1 45 45 TRP HZ2 H 1 7.466 0.01 . 1 . . . . 45 TRP HZ2 . 34014 1
472 . 1 1 45 45 TRP HZ3 H 1 7.069 0.01 . 1 . . . . 45 TRP HZ3 . 34014 1
473 . 1 1 45 45 TRP HH2 H 1 7.191 0.01 . 1 . . . . 45 TRP HH2 . 34014 1
474 . 1 1 45 45 TRP CA C 13 54.786 0.2 . 1 . . . . 45 TRP CA . 34014 1
475 . 1 1 45 45 TRP CB C 13 27.140 0.2 . 1 . . . . 45 TRP CB . 34014 1
476 . 1 1 45 45 TRP CD1 C 13 124.518 0.2 . 1 . . . . 45 TRP CD1 . 34014 1
477 . 1 1 45 45 TRP CE3 C 13 118.143 0.2 . 1 . . . . 45 TRP CE3 . 34014 1
478 . 1 1 45 45 TRP CZ2 C 13 111.843 0.2 . 1 . . . . 45 TRP CZ2 . 34014 1
479 . 1 1 45 45 TRP CZ3 C 13 119.239 0.2 . 1 . . . . 45 TRP CZ3 . 34014 1
480 . 1 1 45 45 TRP CH2 C 13 121.867 0.2 . 1 . . . . 45 TRP CH2 . 34014 1
481 . 1 1 45 45 TRP N N 15 120.831 0.2 . 1 . . . . 45 TRP N . 34014 1
482 . 1 1 45 45 TRP NE1 N 15 129.415 0.2 . 1 . . . . 45 TRP NE1 . 34014 1
483 . 1 1 46 46 ARG H H 1 7.973 0.01 . 1 . . . . 46 ARG H . 34014 1
484 . 1 1 46 46 ARG HA H 1 4.238 0.01 . 1 . . . . 46 ARG HA . 34014 1
485 . 1 1 46 46 ARG HB2 H 1 1.734 0.01 . 1 . . . . 46 ARG HB2 . 34014 1
486 . 1 1 46 46 ARG HB3 H 1 1.546 0.01 . 1 . . . . 46 ARG HB3 . 34014 1
487 . 1 1 46 46 ARG HG2 H 1 1.366 0.01 . 1 . . . . 46 ARG HG2 . 34014 1
488 . 1 1 46 46 ARG HG3 H 1 1.366 0.01 . 1 . . . . 46 ARG HG3 . 34014 1
489 . 1 1 46 46 ARG HD2 H 1 3.033 0.01 . 1 . . . . 46 ARG HD2 . 34014 1
490 . 1 1 46 46 ARG HD3 H 1 3.033 0.01 . 1 . . . . 46 ARG HD3 . 34014 1
491 . 1 1 46 46 ARG HE H 1 7.064 0.01 . 1 . . . . 46 ARG HE . 34014 1
492 . 1 1 46 46 ARG CB C 13 28.275 0.2 . 1 . . . . 46 ARG CB . 34014 1
493 . 1 1 46 46 ARG CG C 13 24.034 0.2 . 1 . . . . 46 ARG CG . 34014 1
494 . 1 1 46 46 ARG CD C 13 40.493 0.2 . 1 . . . . 46 ARG CD . 34014 1
495 . 1 1 46 46 ARG N N 15 122.395 0.2 . 1 . . . . 46 ARG N . 34014 1
496 . 1 1 47 47 SER H H 1 7.857 0.01 . 1 . . . . 47 SER H . 34014 1
497 . 1 1 47 47 SER HA H 1 4.154 0.01 . 1 . . . . 47 SER HA . 34014 1
498 . 1 1 47 47 SER HB2 H 1 3.814 0.01 . 1 . . . . 47 SER HB2 . 34014 1
499 . 1 1 47 47 SER HB3 H 1 3.814 0.01 . 1 . . . . 47 SER HB3 . 34014 1
500 . 1 1 47 47 SER CA C 13 57.254 0.2 . 1 . . . . 47 SER CA . 34014 1
501 . 1 1 47 47 SER CB C 13 61.971 0.2 . 1 . . . . 47 SER CB . 34014 1
502 . 1 1 47 47 SER N N 15 122.525 0.2 . 1 . . . . 47 SER N . 34014 1
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