###################################
# 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 25484
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 25484 1
3 '3D CBCA(CO)NH' . . . 25484 1
4 '3D HNCACB' . . . 25484 1
5 '3D HNCO' . . . 25484 1
6 '3D HN(CA)CO' . . . 25484 1
7 '3D HNCA' . . . 25484 1
8 '3D H(CCO)NH' . . . 25484 1
9 '3D HCCH-TOCSY' . . . 25484 1
10 '3D HNHA' . . . 25484 1
23 '3D HBHA(CO)NH' . . . 25484 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 2 2 THR HA H 1 4.415 0.04 . 1 . . . A 2 THR HA . 25484 1
2 . 1 1 2 2 THR HB H 1 4.220 0.04 . 1 . . . A 2 THR HB . 25484 1
3 . 1 1 2 2 THR HG21 H 1 1.269 0.04 . 1 . . . A 2 THR HG21 . 25484 1
4 . 1 1 2 2 THR HG22 H 1 1.269 0.04 . 1 . . . A 2 THR HG22 . 25484 1
5 . 1 1 2 2 THR HG23 H 1 1.269 0.04 . 1 . . . A 2 THR HG23 . 25484 1
6 . 1 1 2 2 THR C C 13 174.580 0.04 . 1 . . . A 2 THR C . 25484 1
7 . 1 1 2 2 THR CA C 13 62.450 0.04 . 1 . . . A 2 THR CA . 25484 1
8 . 1 1 2 2 THR CB C 13 70.050 0.04 . 1 . . . A 2 THR CB . 25484 1
9 . 1 1 2 2 THR CG2 C 13 21.250 0.04 . 1 . . . A 2 THR CG2 . 25484 1
10 . 1 1 3 3 GLN H H 1 8.536 0.04 . 1 . . . A 3 GLN H . 25484 1
11 . 1 1 3 3 GLN HA H 1 4.480 0.04 . 1 . . . A 3 GLN HA . 25484 1
12 . 1 1 3 3 GLN HB2 H 1 2.035 0.04 . 1 . . . A 3 GLN HB2 . 25484 1
13 . 1 1 3 3 GLN HB3 H 1 2.135 0.04 . 1 . . . A 3 GLN HB3 . 25484 1
14 . 1 1 3 3 GLN HG2 H 1 2.405 0.04 . 2 . . . A 3 GLN HG2 . 25484 1
15 . 1 1 3 3 GLN HG3 H 1 2.405 0.04 . 2 . . . A 3 GLN HG3 . 25484 1
16 . 1 1 3 3 GLN C C 13 176.040 0.04 . 1 . . . A 3 GLN C . 25484 1
17 . 1 1 3 3 GLN CA C 13 55.950 0.04 . 1 . . . A 3 GLN CA . 25484 1
18 . 1 1 3 3 GLN CB C 13 30.550 0.04 . 1 . . . A 3 GLN CB . 25484 1
19 . 1 1 3 3 GLN CG C 13 34.350 0.04 . 1 . . . A 3 GLN CG . 25484 1
20 . 1 1 3 3 GLN N N 15 123.423 0.04 . 1 . . . A 3 GLN N . 25484 1
21 . 1 1 4 4 SER H H 1 8.150 0.04 . 1 . . . A 4 SER H . 25484 1
22 . 1 1 4 4 SER HA H 1 4.834 0.04 . 1 . . . A 4 SER HA . 25484 1
23 . 1 1 4 4 SER HB2 H 1 3.937 0.04 . 2 . . . A 4 SER HB2 . 25484 1
24 . 1 1 4 4 SER HB3 H 1 3.937 0.04 . 2 . . . A 4 SER HB3 . 25484 1
25 . 1 1 4 4 SER C C 13 173.640 0.04 . 1 . . . A 4 SER C . 25484 1
26 . 1 1 4 4 SER CA C 13 56.250 0.04 . 1 . . . A 4 SER CA . 25484 1
27 . 1 1 4 4 SER CB C 13 63.400 0.04 . 1 . . . A 4 SER CB . 25484 1
28 . 1 1 4 4 SER N N 15 119.390 0.04 . 1 . . . A 4 SER N . 25484 1
29 . 1 1 5 5 PRO HA H 1 4.480 0.04 . 1 . . . A 5 PRO HA . 25484 1
30 . 1 1 5 5 PRO HB2 H 1 2.020 0.04 . 1 . . . A 5 PRO HB2 . 25484 1
31 . 1 1 5 5 PRO HB3 H 1 2.370 0.04 . 1 . . . A 5 PRO HB3 . 25484 1
32 . 1 1 5 5 PRO HG2 H 1 2.070 0.04 . 1 . . . A 5 PRO HG2 . 25484 1
33 . 1 1 5 5 PRO HG3 H 1 2.120 0.04 . 1 . . . A 5 PRO HG3 . 25484 1
34 . 1 1 5 5 PRO HD2 H 1 3.830 0.04 . 1 . . . A 5 PRO HD2 . 25484 1
35 . 1 1 5 5 PRO HD3 H 1 3.890 0.04 . 1 . . . A 5 PRO HD3 . 25484 1
36 . 1 1 5 5 PRO C C 13 178.180 0.04 . 1 . . . A 5 PRO C . 25484 1
37 . 1 1 5 5 PRO CA C 13 64.040 0.04 . 1 . . . A 5 PRO CA . 25484 1
38 . 1 1 5 5 PRO CB C 13 32.120 0.04 . 1 . . . A 5 PRO CB . 25484 1
39 . 1 1 5 5 PRO CG C 13 27.350 0.04 . 1 . . . A 5 PRO CG . 25484 1
40 . 1 1 5 5 PRO CD C 13 50.950 0.04 . 1 . . . A 5 PRO CD . 25484 1
41 . 1 1 6 6 GLY H H 1 8.470 0.04 . 1 . . . A 6 GLY H . 25484 1
42 . 1 1 6 6 GLY HA2 H 1 4.010 0.04 . 2 . . . A 6 GLY HA2 . 25484 1
43 . 1 1 6 6 GLY HA3 H 1 4.010 0.04 . 2 . . . A 6 GLY HA3 . 25484 1
44 . 1 1 6 6 GLY C C 13 174.930 0.04 . 1 . . . A 6 GLY C . 25484 1
45 . 1 1 6 6 GLY CA C 13 45.750 0.04 . 1 . . . A 6 GLY CA . 25484 1
46 . 1 1 6 6 GLY N N 15 108.600 0.04 . 1 . . . A 6 GLY N . 25484 1
47 . 1 1 7 7 ASP H H 1 8.130 0.04 . 1 . . . A 7 ASP H . 25484 1
48 . 1 1 7 7 ASP HA H 1 4.660 0.04 . 1 . . . A 7 ASP HA . 25484 1
49 . 1 1 7 7 ASP HB2 H 1 2.772 0.04 . 2 . . . A 7 ASP HB2 . 25484 1
50 . 1 1 7 7 ASP HB3 H 1 2.772 0.04 . 2 . . . A 7 ASP HB3 . 25484 1
51 . 1 1 7 7 ASP C C 13 177.580 0.04 . 1 . . . A 7 ASP C . 25484 1
52 . 1 1 7 7 ASP CA C 13 55.200 0.04 . 1 . . . A 7 ASP CA . 25484 1
53 . 1 1 7 7 ASP CB C 13 41.400 0.04 . 1 . . . A 7 ASP CB . 25484 1
54 . 1 1 7 7 ASP N N 15 121.260 0.04 . 1 . . . A 7 ASP N . 25484 1
55 . 1 1 8 8 SER H H 1 8.372 0.04 . 1 . . . A 8 SER H . 25484 1
56 . 1 1 8 8 SER HA H 1 4.340 0.04 . 1 . . . A 8 SER HA . 25484 1
57 . 1 1 8 8 SER HB2 H 1 4.010 0.04 . 2 . . . A 8 SER HB2 . 25484 1
58 . 1 1 8 8 SER HB3 H 1 4.010 0.04 . 2 . . . A 8 SER HB3 . 25484 1
59 . 1 1 8 8 SER C C 13 176.310 0.04 . 1 . . . A 8 SER C . 25484 1
60 . 1 1 8 8 SER CA C 13 60.050 0.04 . 1 . . . A 8 SER CA . 25484 1
61 . 1 1 8 8 SER CB C 13 63.190 0.04 . 1 . . . A 8 SER CB . 25484 1
62 . 1 1 8 8 SER N N 15 116.818 0.04 . 1 . . . A 8 SER N . 25484 1
63 . 1 1 9 9 ARG H H 1 8.308 0.04 . 1 . . . A 9 ARG H . 25484 1
64 . 1 1 9 9 ARG HA H 1 4.260 0.04 . 1 . . . A 9 ARG HA . 25484 1
65 . 1 1 9 9 ARG HB2 H 1 1.915 0.04 . 2 . . . A 9 ARG HB2 . 25484 1
66 . 1 1 9 9 ARG HB3 H 1 1.915 0.04 . 2 . . . A 9 ARG HB3 . 25484 1
67 . 1 1 9 9 ARG HG2 H 1 1.692 0.04 . 1 . . . A 9 ARG HG2 . 25484 1
68 . 1 1 9 9 ARG HG3 H 1 1.692 0.04 . 1 . . . A 9 ARG HG3 . 25484 1
69 . 1 1 9 9 ARG HD2 H 1 3.222 0.04 . 1 . . . A 9 ARG HD2 . 25484 1
70 . 1 1 9 9 ARG HD3 H 1 3.222 0.04 . 1 . . . A 9 ARG HD3 . 25484 1
71 . 1 1 9 9 ARG C C 13 177.710 0.04 . 1 . . . A 9 ARG C . 25484 1
72 . 1 1 9 9 ARG CA C 13 58.050 0.04 . 1 . . . A 9 ARG CA . 25484 1
73 . 1 1 9 9 ARG CB C 13 30.350 0.04 . 1 . . . A 9 ARG CB . 25484 1
74 . 1 1 9 9 ARG CG C 13 27.350 0.04 . 1 . . . A 9 ARG CG . 25484 1
75 . 1 1 9 9 ARG CD C 13 43.350 0.04 . 1 . . . A 9 ARG CD . 25484 1
76 . 1 1 9 9 ARG N N 15 123.150 0.04 . 1 . . . A 9 ARG N . 25484 1
77 . 1 1 10 10 ARG H H 1 8.075 0.04 . 1 . . . A 10 ARG H . 25484 1
78 . 1 1 10 10 ARG HA H 1 4.110 0.04 . 1 . . . A 10 ARG HA . 25484 1
79 . 1 1 10 10 ARG HB2 H 1 1.908 0.04 . 1 . . . A 10 ARG HB2 . 25484 1
80 . 1 1 10 10 ARG HB3 H 1 1.908 0.04 . 1 . . . A 10 ARG HB3 . 25484 1
81 . 1 1 10 10 ARG HG2 H 1 1.647 0.04 . 1 . . . A 10 ARG HG2 . 25484 1
82 . 1 1 10 10 ARG HG3 H 1 1.647 0.04 . 1 . . . A 10 ARG HG3 . 25484 1
83 . 1 1 10 10 ARG HD2 H 1 3.260 0.04 . 1 . . . A 10 ARG HD2 . 25484 1
84 . 1 1 10 10 ARG HD3 H 1 3.260 0.04 . 1 . . . A 10 ARG HD3 . 25484 1
85 . 1 1 10 10 ARG C C 13 178.180 0.04 . 1 . . . A 10 ARG C . 25484 1
86 . 1 1 10 10 ARG CA C 13 58.420 0.04 . 1 . . . A 10 ARG CA . 25484 1
87 . 1 1 10 10 ARG CB C 13 30.260 0.04 . 1 . . . A 10 ARG CB . 25484 1
88 . 1 1 10 10 ARG CG C 13 27.350 0.04 . 1 . . . A 10 ARG CG . 25484 1
89 . 1 1 10 10 ARG CD C 13 43.150 0.04 . 1 . . . A 10 ARG CD . 25484 1
90 . 1 1 10 10 ARG N N 15 119.940 0.04 . 1 . . . A 10 ARG N . 25484 1
91 . 1 1 11 11 LEU H H 1 8.160 0.04 . 1 . . . A 11 LEU H . 25484 1
92 . 1 1 11 11 LEU HA H 1 4.225 0.04 . 1 . . . A 11 LEU HA . 25484 1
93 . 1 1 11 11 LEU HB2 H 1 1.652 0.04 . 1 . . . A 11 LEU HB2 . 25484 1
94 . 1 1 11 11 LEU HB3 H 1 1.770 0.04 . 1 . . . A 11 LEU HB3 . 25484 1
95 . 1 1 11 11 LEU HG H 1 1.690 0.04 . 1 . . . A 11 LEU HG . 25484 1
96 . 1 1 11 11 LEU HD11 H 1 0.940 0.04 . 1 . . . A 11 LEU HD11 . 25484 1
97 . 1 1 11 11 LEU HD12 H 1 0.940 0.04 . 1 . . . A 11 LEU HD12 . 25484 1
98 . 1 1 11 11 LEU HD13 H 1 0.940 0.04 . 1 . . . A 11 LEU HD13 . 25484 1
99 . 1 1 11 11 LEU HD21 H 1 0.915 0.04 . 1 . . . A 11 LEU HD21 . 25484 1
100 . 1 1 11 11 LEU HD22 H 1 0.915 0.04 . 1 . . . A 11 LEU HD22 . 25484 1
101 . 1 1 11 11 LEU HD23 H 1 0.915 0.04 . 1 . . . A 11 LEU HD23 . 25484 1
102 . 1 1 11 11 LEU C C 13 179.950 0.04 . 1 . . . A 11 LEU C . 25484 1
103 . 1 1 11 11 LEU CA C 13 57.450 0.04 . 1 . . . A 11 LEU CA . 25484 1
104 . 1 1 11 11 LEU CB C 13 41.910 0.04 . 1 . . . A 11 LEU CB . 25484 1
105 . 1 1 11 11 LEU CG C 13 27.150 0.04 . 1 . . . A 11 LEU CG . 25484 1
106 . 1 1 11 11 LEU CD1 C 13 24.850 0.04 . 1 . . . A 11 LEU CD1 . 25484 1
107 . 1 1 11 11 LEU CD2 C 13 25.050 0.04 . 1 . . . A 11 LEU CD2 . 25484 1
108 . 1 1 11 11 LEU N N 15 121.060 0.04 . 1 . . . A 11 LEU N . 25484 1
109 . 1 1 12 12 SER H H 1 8.179 0.04 . 1 . . . A 12 SER H . 25484 1
110 . 1 1 12 12 SER HA H 1 4.317 0.04 . 1 . . . A 12 SER HA . 25484 1
111 . 1 1 12 12 SER HB2 H 1 3.980 0.04 . 1 . . . A 12 SER HB2 . 25484 1
112 . 1 1 12 12 SER HB3 H 1 4.080 0.04 . 1 . . . A 12 SER HB3 . 25484 1
113 . 1 1 12 12 SER C C 13 176.960 0.04 . 1 . . . A 12 SER C . 25484 1
114 . 1 1 12 12 SER CA C 13 60.760 0.04 . 1 . . . A 12 SER CA . 25484 1
115 . 1 1 12 12 SER CB C 13 63.350 0.04 . 1 . . . A 12 SER CB . 25484 1
116 . 1 1 12 12 SER N N 15 116.470 0.04 . 1 . . . A 12 SER N . 25484 1
117 . 1 1 13 13 ILE H H 1 8.130 0.04 . 1 . . . A 13 ILE H . 25484 1
118 . 1 1 13 13 ILE HA H 1 3.690 0.04 . 1 . . . A 13 ILE HA . 25484 1
119 . 1 1 13 13 ILE HB H 1 1.785 0.04 . 1 . . . A 13 ILE HB . 25484 1
120 . 1 1 13 13 ILE HG12 H 1 0.910 0.04 . 1 . . . A 13 ILE HG12 . 25484 1
121 . 1 1 13 13 ILE HG13 H 1 1.507 0.04 . 1 . . . A 13 ILE HG13 . 25484 1
122 . 1 1 13 13 ILE HG21 H 1 0.615 0.04 . 1 . . . A 13 ILE HG21 . 25484 1
123 . 1 1 13 13 ILE HG22 H 1 0.615 0.04 . 1 . . . A 13 ILE HG22 . 25484 1
124 . 1 1 13 13 ILE HG23 H 1 0.615 0.04 . 1 . . . A 13 ILE HG23 . 25484 1
125 . 1 1 13 13 ILE HD11 H 1 0.608 0.04 . 1 . . . A 13 ILE HD11 . 25484 1
126 . 1 1 13 13 ILE HD12 H 1 0.608 0.04 . 1 . . . A 13 ILE HD12 . 25484 1
127 . 1 1 13 13 ILE HD13 H 1 0.608 0.04 . 1 . . . A 13 ILE HD13 . 25484 1
128 . 1 1 13 13 ILE C C 13 177.660 0.04 . 1 . . . A 13 ILE C . 25484 1
129 . 1 1 13 13 ILE CA C 13 64.930 0.04 . 1 . . . A 13 ILE CA . 25484 1
130 . 1 1 13 13 ILE CB C 13 37.650 0.04 . 1 . . . A 13 ILE CB . 25484 1
131 . 1 1 13 13 ILE CG1 C 13 29.100 0.04 . 1 . . . A 13 ILE CG1 . 25484 1
132 . 1 1 13 13 ILE CG2 C 13 17.450 0.04 . 1 . . . A 13 ILE CG2 . 25484 1
133 . 1 1 13 13 ILE CD1 C 13 13.150 0.04 . 1 . . . A 13 ILE CD1 . 25484 1
134 . 1 1 13 13 ILE N N 15 123.740 0.04 . 1 . . . A 13 ILE N . 25484 1
135 . 1 1 14 14 GLN H H 1 8.113 0.04 . 1 . . . A 14 GLN H . 25484 1
136 . 1 1 14 14 GLN HA H 1 4.040 0.04 . 1 . . . A 14 GLN HA . 25484 1
137 . 1 1 14 14 GLN HB2 H 1 2.208 0.04 . 2 . . . A 14 GLN HB2 . 25484 1
138 . 1 1 14 14 GLN HB3 H 1 2.208 0.04 . 2 . . . A 14 GLN HB3 . 25484 1
139 . 1 1 14 14 GLN HG2 H 1 2.527 0.04 . 2 . . . A 14 GLN HG2 . 25484 1
140 . 1 1 14 14 GLN HG3 H 1 2.527 0.04 . 2 . . . A 14 GLN HG3 . 25484 1
141 . 1 1 14 14 GLN C C 13 179.490 0.04 . 1 . . . A 14 GLN C . 25484 1
142 . 1 1 14 14 GLN CA C 13 59.750 0.04 . 1 . . . A 14 GLN CA . 25484 1
143 . 1 1 14 14 GLN CB C 13 27.730 0.04 . 1 . . . A 14 GLN CB . 25484 1
144 . 1 1 14 14 GLN CG C 13 33.850 0.04 . 1 . . . A 14 GLN CG . 25484 1
145 . 1 1 14 14 GLN N N 15 119.220 0.04 . 1 . . . A 14 GLN N . 25484 1
146 . 1 1 15 15 ARG H H 1 8.200 0.04 . 1 . . . A 15 ARG H . 25484 1
147 . 1 1 15 15 ARG HA H 1 4.150 0.04 . 1 . . . A 15 ARG HA . 25484 1
148 . 1 1 15 15 ARG HB2 H 1 1.924 0.04 . 2 . . . A 15 ARG HB2 . 25484 1
149 . 1 1 15 15 ARG HB3 H 1 1.924 0.04 . 2 . . . A 15 ARG HB3 . 25484 1
150 . 1 1 15 15 ARG HG2 H 1 1.677 0.04 . 1 . . . A 15 ARG HG2 . 25484 1
151 . 1 1 15 15 ARG HG3 H 1 1.677 0.04 . 1 . . . A 15 ARG HG3 . 25484 1
152 . 1 1 15 15 ARG HD2 H 1 3.260 0.04 . 1 . . . A 15 ARG HD2 . 25484 1
153 . 1 1 15 15 ARG HD3 H 1 3.260 0.04 . 1 . . . A 15 ARG HD3 . 25484 1
154 . 1 1 15 15 ARG C C 13 179.460 0.04 . 1 . . . A 15 ARG C . 25484 1
155 . 1 1 15 15 ARG CA C 13 59.150 0.04 . 1 . . . A 15 ARG CA . 25484 1
156 . 1 1 15 15 ARG CB C 13 30.090 0.04 . 1 . . . A 15 ARG CB . 25484 1
157 . 1 1 15 15 ARG CG C 13 27.650 0.04 . 1 . . . A 15 ARG CG . 25484 1
158 . 1 1 15 15 ARG CD C 13 43.650 0.04 . 1 . . . A 15 ARG CD . 25484 1
159 . 1 1 15 15 ARG N N 15 119.160 0.04 . 1 . . . A 15 ARG N . 25484 1
160 . 1 1 16 16 ALA H H 1 8.071 0.04 . 1 . . . A 16 ALA H . 25484 1
161 . 1 1 16 16 ALA HA H 1 3.990 0.04 . 1 . . . A 16 ALA HA . 25484 1
162 . 1 1 16 16 ALA HB1 H 1 1.438 0.04 . 1 . . . A 16 ALA HB1 . 25484 1
163 . 1 1 16 16 ALA HB2 H 1 1.438 0.04 . 1 . . . A 16 ALA HB2 . 25484 1
164 . 1 1 16 16 ALA HB3 H 1 1.438 0.04 . 1 . . . A 16 ALA HB3 . 25484 1
165 . 1 1 16 16 ALA C C 13 180.230 0.04 . 1 . . . A 16 ALA C . 25484 1
166 . 1 1 16 16 ALA CA C 13 55.550 0.04 . 1 . . . A 16 ALA CA . 25484 1
167 . 1 1 16 16 ALA CB C 13 18.750 0.04 . 1 . . . A 16 ALA CB . 25484 1
168 . 1 1 16 16 ALA N N 15 124.140 0.04 . 1 . . . A 16 ALA N . 25484 1
169 . 1 1 17 17 ILE H H 1 8.534 0.04 . 1 . . . A 17 ILE H . 25484 1
170 . 1 1 17 17 ILE HA H 1 3.712 0.04 . 1 . . . A 17 ILE HA . 25484 1
171 . 1 1 17 17 ILE HB H 1 2.125 0.04 . 1 . . . A 17 ILE HB . 25484 1
172 . 1 1 17 17 ILE HG12 H 1 1.283 0.04 . 1 . . . A 17 ILE HG12 . 25484 1
173 . 1 1 17 17 ILE HG13 H 1 1.918 0.04 . 1 . . . A 17 ILE HG13 . 25484 1
174 . 1 1 17 17 ILE HG21 H 1 1.095 0.04 . 1 . . . A 17 ILE HG21 . 25484 1
175 . 1 1 17 17 ILE HG22 H 1 1.095 0.04 . 1 . . . A 17 ILE HG22 . 25484 1
176 . 1 1 17 17 ILE HG23 H 1 1.095 0.04 . 1 . . . A 17 ILE HG23 . 25484 1
177 . 1 1 17 17 ILE HD11 H 1 0.975 0.04 . 1 . . . A 17 ILE HD11 . 25484 1
178 . 1 1 17 17 ILE HD12 H 1 0.975 0.04 . 1 . . . A 17 ILE HD12 . 25484 1
179 . 1 1 17 17 ILE HD13 H 1 0.975 0.04 . 1 . . . A 17 ILE HD13 . 25484 1
180 . 1 1 17 17 ILE C C 13 178.210 0.04 . 1 . . . A 17 ILE C . 25484 1
181 . 1 1 17 17 ILE CA C 13 64.870 0.04 . 1 . . . A 17 ILE CA . 25484 1
182 . 1 1 17 17 ILE CB C 13 37.640 0.04 . 1 . . . A 17 ILE CB . 25484 1
183 . 1 1 17 17 ILE CG1 C 13 29.550 0.04 . 1 . . . A 17 ILE CG1 . 25484 1
184 . 1 1 17 17 ILE CG2 C 13 18.650 0.04 . 1 . . . A 17 ILE CG2 . 25484 1
185 . 1 1 17 17 ILE CD1 C 13 14.450 0.04 . 1 . . . A 17 ILE CD1 . 25484 1
186 . 1 1 17 17 ILE N N 15 118.180 0.04 . 1 . . . A 17 ILE N . 25484 1
187 . 1 1 18 18 GLN H H 1 8.200 0.04 . 1 . . . A 18 GLN H . 25484 1
188 . 1 1 18 18 GLN HA H 1 4.134 0.04 . 1 . . . A 18 GLN HA . 25484 1
189 . 1 1 18 18 GLN HB2 H 1 1.927 0.04 . 1 . . . A 18 GLN HB2 . 25484 1
190 . 1 1 18 18 GLN HB3 H 1 2.230 0.04 . 1 . . . A 18 GLN HB3 . 25484 1
191 . 1 1 18 18 GLN HG2 H 1 2.560 0.04 . 1 . . . A 18 GLN HG2 . 25484 1
192 . 1 1 18 18 GLN HG3 H 1 2.550 0.04 . 1 . . . A 18 GLN HG3 . 25484 1
193 . 1 1 18 18 GLN C C 13 180.050 0.04 . 1 . . . A 18 GLN C . 25484 1
194 . 1 1 18 18 GLN CA C 13 59.340 0.04 . 1 . . . A 18 GLN CA . 25484 1
195 . 1 1 18 18 GLN CB C 13 28.030 0.04 . 1 . . . A 18 GLN CB . 25484 1
196 . 1 1 18 18 GLN CG C 13 33.950 0.04 . 1 . . . A 18 GLN CG . 25484 1
197 . 1 1 18 18 GLN N N 15 118.960 0.04 . 1 . . . A 18 GLN N . 25484 1
198 . 1 1 19 19 SER H H 1 8.190 0.04 . 1 . . . A 19 SER H . 25484 1
199 . 1 1 19 19 SER HA H 1 4.388 0.04 . 1 . . . A 19 SER HA . 25484 1
200 . 1 1 19 19 SER HB2 H 1 3.937 0.04 . 1 . . . A 19 SER HB2 . 25484 1
201 . 1 1 19 19 SER HB3 H 1 4.120 0.04 . 1 . . . A 19 SER HB3 . 25484 1
202 . 1 1 19 19 SER C C 13 176.460 0.04 . 1 . . . A 19 SER C . 25484 1
203 . 1 1 19 19 SER CA C 13 62.250 0.04 . 1 . . . A 19 SER CA . 25484 1
204 . 1 1 19 19 SER CB C 13 63.270 0.04 . 1 . . . A 19 SER CB . 25484 1
205 . 1 1 19 19 SER N N 15 116.320 0.04 . 1 . . . A 19 SER N . 25484 1
206 . 1 1 20 20 LEU H H 1 8.290 0.04 . 1 . . . A 20 LEU H . 25484 1
207 . 1 1 20 20 LEU HA H 1 4.075 0.04 . 1 . . . A 20 LEU HA . 25484 1
208 . 1 1 20 20 LEU HB2 H 1 1.735 0.04 . 1 . . . A 20 LEU HB2 . 25484 1
209 . 1 1 20 20 LEU HB3 H 1 2.095 0.04 . 1 . . . A 20 LEU HB3 . 25484 1
210 . 1 1 20 20 LEU HG H 1 1.547 0.04 . 1 . . . A 20 LEU HG . 25484 1
211 . 1 1 20 20 LEU HD11 H 1 0.930 0.04 . 1 . . . A 20 LEU HD11 . 25484 1
212 . 1 1 20 20 LEU HD12 H 1 0.930 0.04 . 1 . . . A 20 LEU HD12 . 25484 1
213 . 1 1 20 20 LEU HD13 H 1 0.930 0.04 . 1 . . . A 20 LEU HD13 . 25484 1
214 . 1 1 20 20 LEU HD21 H 1 0.883 0.04 . 1 . . . A 20 LEU HD21 . 25484 1
215 . 1 1 20 20 LEU HD22 H 1 0.883 0.04 . 1 . . . A 20 LEU HD22 . 25484 1
216 . 1 1 20 20 LEU HD23 H 1 0.883 0.04 . 1 . . . A 20 LEU HD23 . 25484 1
217 . 1 1 20 20 LEU C C 13 177.640 0.04 . 1 . . . A 20 LEU C . 25484 1
218 . 1 1 20 20 LEU CA C 13 58.750 0.04 . 1 . . . A 20 LEU CA . 25484 1
219 . 1 1 20 20 LEU CB C 13 42.390 0.04 . 1 . . . A 20 LEU CB . 25484 1
220 . 1 1 20 20 LEU CG C 13 27.350 0.04 . 1 . . . A 20 LEU CG . 25484 1
221 . 1 1 20 20 LEU CD1 C 13 25.550 0.04 . 1 . . . A 20 LEU CD1 . 25484 1
222 . 1 1 20 20 LEU CD2 C 13 26.050 0.04 . 1 . . . A 20 LEU CD2 . 25484 1
223 . 1 1 20 20 LEU N N 15 125.540 0.04 . 1 . . . A 20 LEU N . 25484 1
224 . 1 1 21 21 VAL H H 1 8.532 0.04 . 1 . . . A 21 VAL H . 25484 1
225 . 1 1 21 21 VAL HA H 1 3.356 0.04 . 1 . . . A 21 VAL HA . 25484 1
226 . 1 1 21 21 VAL HB H 1 2.128 0.04 . 1 . . . A 21 VAL HB . 25484 1
227 . 1 1 21 21 VAL HG11 H 1 0.965 0.04 . 1 . . . A 21 VAL HG11 . 25484 1
228 . 1 1 21 21 VAL HG12 H 1 0.965 0.04 . 1 . . . A 21 VAL HG12 . 25484 1
229 . 1 1 21 21 VAL HG13 H 1 0.965 0.04 . 1 . . . A 21 VAL HG13 . 25484 1
230 . 1 1 21 21 VAL HG21 H 1 0.942 0.04 . 1 . . . A 21 VAL HG21 . 25484 1
231 . 1 1 21 21 VAL HG22 H 1 0.942 0.04 . 1 . . . A 21 VAL HG22 . 25484 1
232 . 1 1 21 21 VAL HG23 H 1 0.942 0.04 . 1 . . . A 21 VAL HG23 . 25484 1
233 . 1 1 21 21 VAL C C 13 178.770 0.04 . 1 . . . A 21 VAL C . 25484 1
234 . 1 1 21 21 VAL CA C 13 66.850 0.04 . 1 . . . A 21 VAL CA . 25484 1
235 . 1 1 21 21 VAL CB C 13 31.450 0.04 . 1 . . . A 21 VAL CB . 25484 1
236 . 1 1 21 21 VAL CG1 C 13 23.580 0.04 . 1 . . . A 21 VAL CG1 . 25484 1
237 . 1 1 21 21 VAL CG2 C 13 23.250 0.04 . 1 . . . A 21 VAL CG2 . 25484 1
238 . 1 1 21 21 VAL N N 15 118.690 0.04 . 1 . . . A 21 VAL N . 25484 1
239 . 1 1 22 22 HIS H H 1 7.980 0.04 . 1 . . . A 22 HIS H . 25484 1
240 . 1 1 22 22 HIS HA H 1 4.230 0.04 . 1 . . . A 22 HIS HA . 25484 1
241 . 1 1 22 22 HIS HB2 H 1 3.340 0.04 . 2 . . . A 22 HIS HB2 . 25484 1
242 . 1 1 22 22 HIS HB3 H 1 3.340 0.04 . 2 . . . A 22 HIS HB3 . 25484 1
243 . 1 1 22 22 HIS C C 13 178.420 0.04 . 1 . . . A 22 HIS C . 25484 1
244 . 1 1 22 22 HIS CA C 13 59.980 0.04 . 1 . . . A 22 HIS CA . 25484 1
245 . 1 1 22 22 HIS CB C 13 27.830 0.04 . 1 . . . A 22 HIS CB . 25484 1
246 . 1 1 22 22 HIS N N 15 116.230 0.04 . 1 . . . A 22 HIS N . 25484 1
247 . 1 1 23 23 ALA H H 1 8.640 0.04 . 1 . . . A 23 ALA H . 25484 1
248 . 1 1 23 23 ALA HA H 1 4.225 0.04 . 1 . . . A 23 ALA HA . 25484 1
249 . 1 1 23 23 ALA HB1 H 1 1.580 0.04 . 1 . . . A 23 ALA HB1 . 25484 1
250 . 1 1 23 23 ALA HB2 H 1 1.580 0.04 . 1 . . . A 23 ALA HB2 . 25484 1
251 . 1 1 23 23 ALA HB3 H 1 1.580 0.04 . 1 . . . A 23 ALA HB3 . 25484 1
252 . 1 1 23 23 ALA C C 13 179.540 0.04 . 1 . . . A 23 ALA C . 25484 1
253 . 1 1 23 23 ALA CA C 13 55.250 0.04 . 1 . . . A 23 ALA CA . 25484 1
254 . 1 1 23 23 ALA CB C 13 19.550 0.04 . 1 . . . A 23 ALA CB . 25484 1
255 . 1 1 23 23 ALA N N 15 121.520 0.04 . 1 . . . A 23 ALA N . 25484 1
256 . 1 1 24 24 ALA H H 1 8.260 0.04 . 1 . . . A 24 ALA H . 25484 1
257 . 1 1 24 24 ALA HA H 1 4.100 0.04 . 1 . . . A 24 ALA HA . 25484 1
258 . 1 1 24 24 ALA HB1 H 1 1.430 0.04 . 1 . . . A 24 ALA HB1 . 25484 1
259 . 1 1 24 24 ALA HB2 H 1 1.430 0.04 . 1 . . . A 24 ALA HB2 . 25484 1
260 . 1 1 24 24 ALA HB3 H 1 1.430 0.04 . 1 . . . A 24 ALA HB3 . 25484 1
261 . 1 1 24 24 ALA C C 13 178.130 0.04 . 1 . . . A 24 ALA C . 25484 1
262 . 1 1 24 24 ALA CA C 13 54.090 0.04 . 1 . . . A 24 ALA CA . 25484 1
263 . 1 1 24 24 ALA CB C 13 18.750 0.04 . 1 . . . A 24 ALA CB . 25484 1
264 . 1 1 24 24 ALA N N 15 116.860 0.04 . 1 . . . A 24 ALA N . 25484 1
265 . 1 1 25 25 GLN H H 1 7.260 0.04 . 1 . . . A 25 GLN H . 25484 1
266 . 1 1 25 25 GLN HA H 1 4.495 0.04 . 1 . . . A 25 GLN HA . 25484 1
267 . 1 1 25 25 GLN HB2 H 1 2.030 0.04 . 1 . . . A 25 GLN HB2 . 25484 1
268 . 1 1 25 25 GLN HB3 H 1 2.152 0.04 . 1 . . . A 25 GLN HB3 . 25484 1
269 . 1 1 25 25 GLN HG2 H 1 2.303 0.04 . 1 . . . A 25 GLN HG2 . 25484 1
270 . 1 1 25 25 GLN HG3 H 1 2.485 0.04 . 1 . . . A 25 GLN HG3 . 25484 1
271 . 1 1 25 25 GLN C C 13 174.940 0.04 . 1 . . . A 25 GLN C . 25484 1
272 . 1 1 25 25 GLN CA C 13 54.650 0.04 . 1 . . . A 25 GLN CA . 25484 1
273 . 1 1 25 25 GLN CB C 13 30.650 0.04 . 1 . . . A 25 GLN CB . 25484 1
274 . 1 1 25 25 GLN CG C 13 33.450 0.04 . 1 . . . A 25 GLN CG . 25484 1
275 . 1 1 25 25 GLN N N 15 112.450 0.04 . 1 . . . A 25 GLN N . 25484 1
276 . 1 1 26 26 CYS H H 1 7.365 0.04 . 1 . . . A 26 CYS H . 25484 1
277 . 1 1 26 26 CYS HA H 1 3.915 0.04 . 1 . . . A 26 CYS HA . 25484 1
278 . 1 1 26 26 CYS HB2 H 1 2.090 0.04 . 1 . . . A 26 CYS HB2 . 25484 1
279 . 1 1 26 26 CYS HB3 H 1 2.560 0.04 . 1 . . . A 26 CYS HB3 . 25484 1
280 . 1 1 26 26 CYS C C 13 176.690 0.04 . 1 . . . A 26 CYS C . 25484 1
281 . 1 1 26 26 CYS CA C 13 60.980 0.04 . 1 . . . A 26 CYS CA . 25484 1
282 . 1 1 26 26 CYS CB C 13 29.350 0.04 . 1 . . . A 26 CYS CB . 25484 1
283 . 1 1 26 26 CYS N N 15 124.510 0.04 . 1 . . . A 26 CYS N . 25484 1
284 . 1 1 27 27 ARG H H 1 8.880 0.04 . 1 . . . A 27 ARG H . 25484 1
285 . 1 1 27 27 ARG HA H 1 4.635 0.04 . 1 . . . A 27 ARG HA . 25484 1
286 . 1 1 27 27 ARG HB2 H 1 1.690 0.04 . 1 . . . A 27 ARG HB2 . 25484 1
287 . 1 1 27 27 ARG HB3 H 1 2.158 0.04 . 1 . . . A 27 ARG HB3 . 25484 1
288 . 1 1 27 27 ARG HG2 H 1 1.625 0.04 . 1 . . . A 27 ARG HG2 . 25484 1
289 . 1 1 27 27 ARG HG3 H 1 1.680 0.04 . 1 . . . A 27 ARG HG3 . 25484 1
290 . 1 1 27 27 ARG HD2 H 1 3.206 0.04 . 1 . . . A 27 ARG HD2 . 25484 1
291 . 1 1 27 27 ARG HD3 H 1 3.206 0.04 . 1 . . . A 27 ARG HD3 . 25484 1
292 . 1 1 27 27 ARG C C 13 175.660 0.04 . 1 . . . A 27 ARG C . 25484 1
293 . 1 1 27 27 ARG CA C 13 54.550 0.04 . 1 . . . A 27 ARG CA . 25484 1
294 . 1 1 27 27 ARG CB C 13 30.350 0.04 . 1 . . . A 27 ARG CB . 25484 1
295 . 1 1 27 27 ARG CG C 13 26.550 0.04 . 1 . . . A 27 ARG CG . 25484 1
296 . 1 1 27 27 ARG CD C 13 43.350 0.04 . 1 . . . A 27 ARG CD . 25484 1
297 . 1 1 27 27 ARG N N 15 129.870 0.04 . 1 . . . A 27 ARG N . 25484 1
298 . 1 1 28 28 ASN H H 1 7.980 0.04 . 1 . . . A 28 ASN H . 25484 1
299 . 1 1 28 28 ASN HA H 1 4.870 0.04 . 1 . . . A 28 ASN HA . 25484 1
300 . 1 1 28 28 ASN HB2 H 1 2.895 0.04 . 1 . . . A 28 ASN HB2 . 25484 1
301 . 1 1 28 28 ASN HB3 H 1 2.985 0.04 . 1 . . . A 28 ASN HB3 . 25484 1
302 . 1 1 28 28 ASN C C 13 176.120 0.04 . 1 . . . A 28 ASN C . 25484 1
303 . 1 1 28 28 ASN CA C 13 51.930 0.04 . 1 . . . A 28 ASN CA . 25484 1
304 . 1 1 28 28 ASN CB C 13 39.060 0.04 . 1 . . . A 28 ASN CB . 25484 1
305 . 1 1 28 28 ASN N N 15 120.810 0.04 . 1 . . . A 28 ASN N . 25484 1
306 . 1 1 29 29 ALA H H 1 9.134 0.04 . 1 . . . A 29 ALA H . 25484 1
307 . 1 1 29 29 ALA HA H 1 4.133 0.04 . 1 . . . A 29 ALA HA . 25484 1
308 . 1 1 29 29 ALA HB1 H 1 1.459 0.04 . 1 . . . A 29 ALA HB1 . 25484 1
309 . 1 1 29 29 ALA HB2 H 1 1.459 0.04 . 1 . . . A 29 ALA HB2 . 25484 1
310 . 1 1 29 29 ALA HB3 H 1 1.459 0.04 . 1 . . . A 29 ALA HB3 . 25484 1
311 . 1 1 29 29 ALA C C 13 178.380 0.04 . 1 . . . A 29 ALA C . 25484 1
312 . 1 1 29 29 ALA CA C 13 54.290 0.04 . 1 . . . A 29 ALA CA . 25484 1
313 . 1 1 29 29 ALA CB C 13 18.370 0.04 . 1 . . . A 29 ALA CB . 25484 1
314 . 1 1 29 29 ALA N N 15 130.470 0.04 . 1 . . . A 29 ALA N . 25484 1
315 . 1 1 30 30 ASN H H 1 8.114 0.04 . 1 . . . A 30 ASN H . 25484 1
316 . 1 1 30 30 ASN HA H 1 4.875 0.04 . 1 . . . A 30 ASN HA . 25484 1
317 . 1 1 30 30 ASN HB2 H 1 2.630 0.04 . 1 . . . A 30 ASN HB2 . 25484 1
318 . 1 1 30 30 ASN HB3 H 1 2.975 0.04 . 1 . . . A 30 ASN HB3 . 25484 1
319 . 1 1 30 30 ASN C C 13 174.530 0.04 . 1 . . . A 30 ASN C . 25484 1
320 . 1 1 30 30 ASN CA C 13 51.930 0.04 . 1 . . . A 30 ASN CA . 25484 1
321 . 1 1 30 30 ASN CB C 13 38.910 0.04 . 1 . . . A 30 ASN CB . 25484 1
322 . 1 1 30 30 ASN N N 15 114.590 0.04 . 1 . . . A 30 ASN N . 25484 1
323 . 1 1 31 31 CYS H H 1 7.210 0.04 . 1 . . . A 31 CYS H . 25484 1
324 . 1 1 31 31 CYS HA H 1 4.050 0.04 . 1 . . . A 31 CYS HA . 25484 1
325 . 1 1 31 31 CYS HB2 H 1 2.950 0.04 . 1 . . . A 31 CYS HB2 . 25484 1
326 . 1 1 31 31 CYS HB3 H 1 3.045 0.04 . 1 . . . A 31 CYS HB3 . 25484 1
327 . 1 1 31 31 CYS C C 13 177.170 0.04 . 1 . . . A 31 CYS C . 25484 1
328 . 1 1 31 31 CYS CA C 13 61.880 0.04 . 1 . . . A 31 CYS CA . 25484 1
329 . 1 1 31 31 CYS CB C 13 30.010 0.04 . 1 . . . A 31 CYS CB . 25484 1
330 . 1 1 31 31 CYS N N 15 123.270 0.04 . 1 . . . A 31 CYS N . 25484 1
331 . 1 1 32 32 SER H H 1 8.767 0.04 . 1 . . . A 32 SER H . 25484 1
332 . 1 1 32 32 SER HA H 1 4.609 0.04 . 1 . . . A 32 SER HA . 25484 1
333 . 1 1 32 32 SER HB2 H 1 3.900 0.04 . 1 . . . A 32 SER HB2 . 25484 1
334 . 1 1 32 32 SER HB3 H 1 4.137 0.04 . 1 . . . A 32 SER HB3 . 25484 1
335 . 1 1 32 32 SER C C 13 175.020 0.04 . 1 . . . A 32 SER C . 25484 1
336 . 1 1 32 32 SER CA C 13 58.010 0.04 . 1 . . . A 32 SER CA . 25484 1
337 . 1 1 32 32 SER CB C 13 64.120 0.04 . 1 . . . A 32 SER CB . 25484 1
338 . 1 1 32 32 SER N N 15 124.300 0.04 . 1 . . . A 32 SER N . 25484 1
339 . 1 1 33 33 LEU H H 1 8.546 0.04 . 1 . . . A 33 LEU H . 25484 1
340 . 1 1 33 33 LEU HA H 1 4.538 0.04 . 1 . . . A 33 LEU HA . 25484 1
341 . 1 1 33 33 LEU HB2 H 1 1.457 0.04 . 1 . . . A 33 LEU HB2 . 25484 1
342 . 1 1 33 33 LEU HB3 H 1 1.627 0.04 . 1 . . . A 33 LEU HB3 . 25484 1
343 . 1 1 33 33 LEU HG H 1 1.626 0.04 . 1 . . . A 33 LEU HG . 25484 1
344 . 1 1 33 33 LEU HD11 H 1 0.580 0.04 . 1 . . . A 33 LEU HD11 . 25484 1
345 . 1 1 33 33 LEU HD12 H 1 0.580 0.04 . 1 . . . A 33 LEU HD12 . 25484 1
346 . 1 1 33 33 LEU HD13 H 1 0.580 0.04 . 1 . . . A 33 LEU HD13 . 25484 1
347 . 1 1 33 33 LEU HD21 H 1 0.620 0.04 . 1 . . . A 33 LEU HD21 . 25484 1
348 . 1 1 33 33 LEU HD22 H 1 0.620 0.04 . 1 . . . A 33 LEU HD22 . 25484 1
349 . 1 1 33 33 LEU HD23 H 1 0.620 0.04 . 1 . . . A 33 LEU HD23 . 25484 1
350 . 1 1 33 33 LEU C C 13 177.230 0.04 . 1 . . . A 33 LEU C . 25484 1
351 . 1 1 33 33 LEU CA C 13 54.450 0.04 . 1 . . . A 33 LEU CA . 25484 1
352 . 1 1 33 33 LEU CB C 13 40.970 0.04 . 1 . . . A 33 LEU CB . 25484 1
353 . 1 1 33 33 LEU CG C 13 27.350 0.04 . 1 . . . A 33 LEU CG . 25484 1
354 . 1 1 33 33 LEU CD1 C 13 24.350 0.04 . 1 . . . A 33 LEU CD1 . 25484 1
355 . 1 1 33 33 LEU CD2 C 13 23.350 0.04 . 1 . . . A 33 LEU CD2 . 25484 1
356 . 1 1 33 33 LEU N N 15 128.860 0.04 . 1 . . . A 33 LEU N . 25484 1
357 . 1 1 34 34 PRO HA H 1 4.370 0.04 . 1 . . . A 34 PRO HA . 25484 1
358 . 1 1 34 34 PRO HB2 H 1 2.059 0.04 . 1 . . . A 34 PRO HB2 . 25484 1
359 . 1 1 34 34 PRO HB3 H 1 2.467 0.04 . 1 . . . A 34 PRO HB3 . 25484 1
360 . 1 1 34 34 PRO HG2 H 1 2.140 0.04 . 2 . . . A 34 PRO HG2 . 25484 1
361 . 1 1 34 34 PRO HG3 H 1 2.140 0.04 . 2 . . . A 34 PRO HG3 . 25484 1
362 . 1 1 34 34 PRO HD2 H 1 3.850 0.04 . 1 . . . A 34 PRO HD2 . 25484 1
363 . 1 1 34 34 PRO HD3 H 1 3.850 0.04 . 1 . . . A 34 PRO HD3 . 25484 1
364 . 1 1 34 34 PRO C C 13 178.640 0.04 . 1 . . . A 34 PRO C . 25484 1
365 . 1 1 34 34 PRO CA C 13 65.530 0.04 . 1 . . . A 34 PRO CA . 25484 1
366 . 1 1 34 34 PRO CB C 13 31.970 0.04 . 1 . . . A 34 PRO CB . 25484 1
367 . 1 1 34 34 PRO CG C 13 27.950 0.04 . 1 . . . A 34 PRO CG . 25484 1
368 . 1 1 34 34 PRO CD C 13 50.950 0.04 . 1 . . . A 34 PRO CD . 25484 1
369 . 1 1 35 35 SER H H 1 8.350 0.04 . 1 . . . A 35 SER H . 25484 1
370 . 1 1 35 35 SER HA H 1 4.127 0.04 . 1 . . . A 35 SER HA . 25484 1
371 . 1 1 35 35 SER HB2 H 1 3.945 0.04 . 1 . . . A 35 SER HB2 . 25484 1
372 . 1 1 35 35 SER HB3 H 1 3.945 0.04 . 1 . . . A 35 SER HB3 . 25484 1
373 . 1 1 35 35 SER C C 13 174.750 0.04 . 1 . . . A 35 SER C . 25484 1
374 . 1 1 35 35 SER CA C 13 60.100 0.04 . 1 . . . A 35 SER CA . 25484 1
375 . 1 1 35 35 SER CB C 13 62.910 0.04 . 1 . . . A 35 SER CB . 25484 1
376 . 1 1 35 35 SER N N 15 111.940 0.04 . 1 . . . A 35 SER N . 25484 1
377 . 1 1 36 36 CYS H H 1 7.490 0.04 . 1 . . . A 36 CYS H . 25484 1
378 . 1 1 36 36 CYS HA H 1 4.215 0.04 . 1 . . . A 36 CYS HA . 25484 1
379 . 1 1 36 36 CYS HB2 H 1 2.795 0.04 . 1 . . . A 36 CYS HB2 . 25484 1
380 . 1 1 36 36 CYS HB3 H 1 3.228 0.04 . 1 . . . A 36 CYS HB3 . 25484 1
381 . 1 1 36 36 CYS C C 13 177.070 0.04 . 1 . . . A 36 CYS C . 25484 1
382 . 1 1 36 36 CYS CA C 13 63.900 0.04 . 1 . . . A 36 CYS CA . 25484 1
383 . 1 1 36 36 CYS CB C 13 29.650 0.04 . 1 . . . A 36 CYS CB . 25484 1
384 . 1 1 36 36 CYS N N 15 125.790 0.04 . 1 . . . A 36 CYS N . 25484 1
385 . 1 1 37 37 GLN H H 1 8.170 0.04 . 1 . . . A 37 GLN H . 25484 1
386 . 1 1 37 37 GLN HA H 1 4.010 0.04 . 1 . . . A 37 GLN HA . 25484 1
387 . 1 1 37 37 GLN HB2 H 1 2.185 0.04 . 2 . . . A 37 GLN HB2 . 25484 1
388 . 1 1 37 37 GLN HB3 H 1 2.185 0.04 . 2 . . . A 37 GLN HB3 . 25484 1
389 . 1 1 37 37 GLN HG2 H 1 2.490 0.04 . 1 . . . A 37 GLN HG2 . 25484 1
390 . 1 1 37 37 GLN HG3 H 1 2.550 0.04 . 1 . . . A 37 GLN HG3 . 25484 1
391 . 1 1 37 37 GLN C C 13 179.690 0.04 . 1 . . . A 37 GLN C . 25484 1
392 . 1 1 37 37 GLN CA C 13 59.980 0.04 . 1 . . . A 37 GLN CA . 25484 1
393 . 1 1 37 37 GLN CB C 13 27.820 0.04 . 1 . . . A 37 GLN CB . 25484 1
394 . 1 1 37 37 GLN CG C 13 34.050 0.04 . 1 . . . A 37 GLN CG . 25484 1
395 . 1 1 37 37 GLN N N 15 115.860 0.04 . 1 . . . A 37 GLN N . 25484 1
396 . 1 1 38 38 LYS H H 1 7.920 0.04 . 1 . . . A 38 LYS H . 25484 1
397 . 1 1 38 38 LYS HA H 1 4.060 0.04 . 1 . . . A 38 LYS HA . 25484 1
398 . 1 1 38 38 LYS HB2 H 1 1.740 0.04 . 1 . . . A 38 LYS HB2 . 25484 1
399 . 1 1 38 38 LYS HB3 H 1 1.830 0.04 . 1 . . . A 38 LYS HB3 . 25484 1
400 . 1 1 38 38 LYS HG2 H 1 1.380 0.04 . 1 . . . A 38 LYS HG2 . 25484 1
401 . 1 1 38 38 LYS HG3 H 1 1.520 0.04 . 1 . . . A 38 LYS HG3 . 25484 1
402 . 1 1 38 38 LYS HD2 H 1 1.590 0.04 . 2 . . . A 38 LYS HD2 . 25484 1
403 . 1 1 38 38 LYS HD3 H 1 1.590 0.04 . 2 . . . A 38 LYS HD3 . 25484 1
404 . 1 1 38 38 LYS HE2 H 1 2.880 0.04 . 2 . . . A 38 LYS HE2 . 25484 1
405 . 1 1 38 38 LYS HE3 H 1 2.880 0.04 . 2 . . . A 38 LYS HE3 . 25484 1
406 . 1 1 38 38 LYS C C 13 179.230 0.04 . 1 . . . A 38 LYS C . 25484 1
407 . 1 1 38 38 LYS CA C 13 59.450 0.04 . 1 . . . A 38 LYS CA . 25484 1
408 . 1 1 38 38 LYS CB C 13 32.650 0.04 . 1 . . . A 38 LYS CB . 25484 1
409 . 1 1 38 38 LYS CG C 13 25.350 0.04 . 1 . . . A 38 LYS CG . 25484 1
410 . 1 1 38 38 LYS CD C 13 29.350 0.04 . 1 . . . A 38 LYS CD . 25484 1
411 . 1 1 38 38 LYS CE C 13 41.910 0.04 . 1 . . . A 38 LYS CE . 25484 1
412 . 1 1 38 38 LYS N N 15 117.470 0.04 . 1 . . . A 38 LYS N . 25484 1
413 . 1 1 39 39 MET H H 1 8.370 0.04 . 1 . . . A 39 MET H . 25484 1
414 . 1 1 39 39 MET HA H 1 4.559 0.04 . 1 . . . A 39 MET HA . 25484 1
415 . 1 1 39 39 MET HB2 H 1 1.928 0.04 . 1 . . . A 39 MET HB2 . 25484 1
416 . 1 1 39 39 MET HB3 H 1 2.354 0.04 . 1 . . . A 39 MET HB3 . 25484 1
417 . 1 1 39 39 MET HG2 H 1 2.590 0.04 . 1 . . . A 39 MET HG2 . 25484 1
418 . 1 1 39 39 MET HG3 H 1 2.754 0.04 . 1 . . . A 39 MET HG3 . 25484 1
419 . 1 1 39 39 MET C C 13 179.720 0.04 . 1 . . . A 39 MET C . 25484 1
420 . 1 1 39 39 MET CA C 13 57.250 0.04 . 1 . . . A 39 MET CA . 25484 1
421 . 1 1 39 39 MET CB C 13 32.550 0.04 . 1 . . . A 39 MET CB . 25484 1
422 . 1 1 39 39 MET CG C 13 33.650 0.04 . 1 . . . A 39 MET CG . 25484 1
423 . 1 1 39 39 MET N N 15 118.050 0.04 . 1 . . . A 39 MET N . 25484 1
424 . 1 1 40 40 LYS H H 1 9.490 0.04 . 1 . . . A 40 LYS H . 25484 1
425 . 1 1 40 40 LYS HA H 1 3.840 0.04 . 1 . . . A 40 LYS HA . 25484 1
426 . 1 1 40 40 LYS HB2 H 1 1.999 0.04 . 1 . . . A 40 LYS HB2 . 25484 1
427 . 1 1 40 40 LYS HB3 H 1 2.153 0.04 . 1 . . . A 40 LYS HB3 . 25484 1
428 . 1 1 40 40 LYS HG2 H 1 1.418 0.04 . 2 . . . A 40 LYS HG2 . 25484 1
429 . 1 1 40 40 LYS HG3 H 1 1.418 0.04 . 2 . . . A 40 LYS HG3 . 25484 1
430 . 1 1 40 40 LYS HD2 H 1 1.702 0.04 . 2 . . . A 40 LYS HD2 . 25484 1
431 . 1 1 40 40 LYS HD3 H 1 1.702 0.04 . 2 . . . A 40 LYS HD3 . 25484 1
432 . 1 1 40 40 LYS HE2 H 1 3.150 0.04 . 1 . . . A 40 LYS HE2 . 25484 1
433 . 1 1 40 40 LYS HE3 H 1 3.284 0.04 . 1 . . . A 40 LYS HE3 . 25484 1
434 . 1 1 40 40 LYS C C 13 180.150 0.04 . 1 . . . A 40 LYS C . 25484 1
435 . 1 1 40 40 LYS CA C 13 61.520 0.04 . 1 . . . A 40 LYS CA . 25484 1
436 . 1 1 40 40 LYS CB C 13 32.620 0.04 . 1 . . . A 40 LYS CB . 25484 1
437 . 1 1 40 40 LYS CG C 13 27.350 0.04 . 1 . . . A 40 LYS CG . 25484 1
438 . 1 1 40 40 LYS CD C 13 30.150 0.04 . 1 . . . A 40 LYS CD . 25484 1
439 . 1 1 40 40 LYS CE C 13 43.350 0.04 . 1 . . . A 40 LYS CE . 25484 1
440 . 1 1 40 40 LYS N N 15 121.630 0.04 . 1 . . . A 40 LYS N . 25484 1
441 . 1 1 41 41 ARG H H 1 7.610 0.04 . 1 . . . A 41 ARG H . 25484 1
442 . 1 1 41 41 ARG HA H 1 4.180 0.04 . 1 . . . A 41 ARG HA . 25484 1
443 . 1 1 41 41 ARG HB2 H 1 2.040 0.04 . 1 . . . A 41 ARG HB2 . 25484 1
444 . 1 1 41 41 ARG HB3 H 1 2.210 0.04 . 1 . . . A 41 ARG HB3 . 25484 1
445 . 1 1 41 41 ARG HG2 H 1 1.780 0.04 . 1 . . . A 41 ARG HG2 . 25484 1
446 . 1 1 41 41 ARG HG3 H 1 1.990 0.04 . 1 . . . A 41 ARG HG3 . 25484 1
447 . 1 1 41 41 ARG HD2 H 1 3.294 0.04 . 1 . . . A 41 ARG HD2 . 25484 1
448 . 1 1 41 41 ARG HD3 H 1 3.294 0.04 . 1 . . . A 41 ARG HD3 . 25484 1
449 . 1 1 41 41 ARG C C 13 180.080 0.04 . 1 . . . A 41 ARG C . 25484 1
450 . 1 1 41 41 ARG CA C 13 59.750 0.04 . 1 . . . A 41 ARG CA . 25484 1
451 . 1 1 41 41 ARG CB C 13 30.010 0.04 . 1 . . . A 41 ARG CB . 25484 1
452 . 1 1 41 41 ARG CG C 13 27.650 0.04 . 1 . . . A 41 ARG CG . 25484 1
453 . 1 1 41 41 ARG CD C 13 43.550 0.04 . 1 . . . A 41 ARG CD . 25484 1
454 . 1 1 41 41 ARG N N 15 118.300 0.04 . 1 . . . A 41 ARG N . 25484 1
455 . 1 1 42 42 VAL H H 1 7.760 0.04 . 1 . . . A 42 VAL H . 25484 1
456 . 1 1 42 42 VAL HA H 1 3.745 0.04 . 1 . . . A 42 VAL HA . 25484 1
457 . 1 1 42 42 VAL HB H 1 2.454 0.04 . 1 . . . A 42 VAL HB . 25484 1
458 . 1 1 42 42 VAL HG11 H 1 1.116 0.04 . 1 . . . A 42 VAL HG11 . 25484 1
459 . 1 1 42 42 VAL HG12 H 1 1.116 0.04 . 1 . . . A 42 VAL HG12 . 25484 1
460 . 1 1 42 42 VAL HG13 H 1 1.116 0.04 . 1 . . . A 42 VAL HG13 . 25484 1
461 . 1 1 42 42 VAL HG21 H 1 0.960 0.04 . 1 . . . A 42 VAL HG21 . 25484 1
462 . 1 1 42 42 VAL HG22 H 1 0.960 0.04 . 1 . . . A 42 VAL HG22 . 25484 1
463 . 1 1 42 42 VAL HG23 H 1 0.960 0.04 . 1 . . . A 42 VAL HG23 . 25484 1
464 . 1 1 42 42 VAL C C 13 178.130 0.04 . 1 . . . A 42 VAL C . 25484 1
465 . 1 1 42 42 VAL CA C 13 66.760 0.04 . 1 . . . A 42 VAL CA . 25484 1
466 . 1 1 42 42 VAL CB C 13 31.520 0.04 . 1 . . . A 42 VAL CB . 25484 1
467 . 1 1 42 42 VAL CG1 C 13 22.860 0.04 . 1 . . . A 42 VAL CG1 . 25484 1
468 . 1 1 42 42 VAL CG2 C 13 22.750 0.04 . 1 . . . A 42 VAL CG2 . 25484 1
469 . 1 1 42 42 VAL N N 15 121.750 0.04 . 1 . . . A 42 VAL N . 25484 1
470 . 1 1 43 43 VAL H H 1 8.500 0.04 . 1 . . . A 43 VAL H . 25484 1
471 . 1 1 43 43 VAL HA H 1 3.531 0.04 . 1 . . . A 43 VAL HA . 25484 1
472 . 1 1 43 43 VAL HB H 1 2.221 0.04 . 1 . . . A 43 VAL HB . 25484 1
473 . 1 1 43 43 VAL HG11 H 1 0.958 0.04 . 1 . . . A 43 VAL HG11 . 25484 1
474 . 1 1 43 43 VAL HG12 H 1 0.958 0.04 . 1 . . . A 43 VAL HG12 . 25484 1
475 . 1 1 43 43 VAL HG13 H 1 0.958 0.04 . 1 . . . A 43 VAL HG13 . 25484 1
476 . 1 1 43 43 VAL HG21 H 1 0.975 0.04 . 1 . . . A 43 VAL HG21 . 25484 1
477 . 1 1 43 43 VAL HG22 H 1 0.975 0.04 . 1 . . . A 43 VAL HG22 . 25484 1
478 . 1 1 43 43 VAL HG23 H 1 0.975 0.04 . 1 . . . A 43 VAL HG23 . 25484 1
479 . 1 1 43 43 VAL C C 13 179.310 0.04 . 1 . . . A 43 VAL C . 25484 1
480 . 1 1 43 43 VAL CA C 13 67.120 0.04 . 1 . . . A 43 VAL CA . 25484 1
481 . 1 1 43 43 VAL CB C 13 31.510 0.04 . 1 . . . A 43 VAL CB . 25484 1
482 . 1 1 43 43 VAL CG1 C 13 21.750 0.04 . 1 . . . A 43 VAL CG1 . 25484 1
483 . 1 1 43 43 VAL CG2 C 13 21.980 0.04 . 1 . . . A 43 VAL CG2 . 25484 1
484 . 1 1 43 43 VAL N N 15 120.580 0.04 . 1 . . . A 43 VAL N . 25484 1
485 . 1 1 44 44 GLN H H 1 8.400 0.04 . 1 . . . A 44 GLN H . 25484 1
486 . 1 1 44 44 GLN HA H 1 4.010 0.04 . 1 . . . A 44 GLN HA . 25484 1
487 . 1 1 44 44 GLN HB2 H 1 2.253 0.04 . 2 . . . A 44 GLN HB2 . 25484 1
488 . 1 1 44 44 GLN HB3 H 1 2.253 0.04 . 2 . . . A 44 GLN HB3 . 25484 1
489 . 1 1 44 44 GLN HG2 H 1 2.530 0.04 . 2 . . . A 44 GLN HG2 . 25484 1
490 . 1 1 44 44 GLN HG3 H 1 2.530 0.04 . 2 . . . A 44 GLN HG3 . 25484 1
491 . 1 1 44 44 GLN C C 13 179.330 0.04 . 1 . . . A 44 GLN C . 25484 1
492 . 1 1 44 44 GLN CA C 13 59.060 0.04 . 1 . . . A 44 GLN CA . 25484 1
493 . 1 1 44 44 GLN CB C 13 28.030 0.04 . 1 . . . A 44 GLN CB . 25484 1
494 . 1 1 44 44 GLN CG C 13 34.250 0.04 . 1 . . . A 44 GLN CG . 25484 1
495 . 1 1 44 44 GLN N N 15 119.280 0.04 . 1 . . . A 44 GLN N . 25484 1
496 . 1 1 45 45 HIS H H 1 8.1900 0.04 . 1 . . . A 45 HIS H . 25484 1
497 . 1 1 45 45 HIS HA H 1 4.283 0.04 . 1 . . . A 45 HIS HA . 25484 1
498 . 1 1 45 45 HIS HB2 H 1 3.380 0.04 . 2 . . . A 45 HIS HB2 . 25484 1
499 . 1 1 45 45 HIS HB3 H 1 3.380 0.04 . 2 . . . A 45 HIS HB3 . 25484 1
500 . 1 1 45 45 HIS C C 13 178.250 0.04 . 1 . . . A 45 HIS C . 25484 1
501 . 1 1 45 45 HIS CA C 13 59.950 0.04 . 1 . . . A 45 HIS CA . 25484 1
502 . 1 1 45 45 HIS CB C 13 27.150 0.04 . 1 . . . A 45 HIS CB . 25484 1
503 . 1 1 45 45 HIS N N 15 119.160 0.04 . 1 . . . A 45 HIS N . 25484 1
504 . 1 1 46 46 THR H H 1 7.980 0.04 . 1 . . . A 46 THR H . 25484 1
505 . 1 1 46 46 THR HA H 1 3.859 0.04 . 1 . . . A 46 THR HA . 25484 1
506 . 1 1 46 46 THR HB H 1 4.225 0.04 . 1 . . . A 46 THR HB . 25484 1
507 . 1 1 46 46 THR HG21 H 1 1.669 0.04 . 1 . . . A 46 THR HG21 . 25484 1
508 . 1 1 46 46 THR HG22 H 1 1.669 0.04 . 1 . . . A 46 THR HG22 . 25484 1
509 . 1 1 46 46 THR HG23 H 1 1.669 0.04 . 1 . . . A 46 THR HG23 . 25484 1
510 . 1 1 46 46 THR C C 13 176.350 0.04 . 1 . . . A 46 THR C . 25484 1
511 . 1 1 46 46 THR CA C 13 65.670 0.04 . 1 . . . A 46 THR CA . 25484 1
512 . 1 1 46 46 THR CB C 13 69.190 0.04 . 1 . . . A 46 THR CB . 25484 1
513 . 1 1 46 46 THR CG2 C 13 22.250 0.04 . 1 . . . A 46 THR CG2 . 25484 1
514 . 1 1 46 46 THR N N 15 111.110 0.04 . 1 . . . A 46 THR N . 25484 1
515 . 1 1 47 47 LYS H H 1 7.410 0.04 . 1 . . . A 47 LYS H . 25484 1
516 . 1 1 47 47 LYS HA H 1 4.090 0.04 . 1 . . . A 47 LYS HA . 25484 1
517 . 1 1 47 47 LYS HB2 H 1 1.899 0.04 . 2 . . . A 47 LYS HB2 . 25484 1
518 . 1 1 47 47 LYS HB3 H 1 1.899 0.04 . 2 . . . A 47 LYS HB3 . 25484 1
519 . 1 1 47 47 LYS HG2 H 1 1.490 0.04 . 2 . . . A 47 LYS HG2 . 25484 1
520 . 1 1 47 47 LYS HG3 H 1 1.490 0.04 . 2 . . . A 47 LYS HG3 . 25484 1
521 . 1 1 47 47 LYS HD2 H 1 1.660 0.04 . 1 . . . A 47 LYS HD2 . 25484 1
522 . 1 1 47 47 LYS HD3 H 1 1.660 0.04 . 1 . . . A 47 LYS HD3 . 25484 1
523 . 1 1 47 47 LYS HE2 H 1 2.920 0.04 . 1 . . . A 47 LYS HE2 . 25484 1
524 . 1 1 47 47 LYS HE3 H 1 2.920 0.04 . 1 . . . A 47 LYS HE3 . 25484 1
525 . 1 1 47 47 LYS C C 13 178.150 0.04 . 1 . . . A 47 LYS C . 25484 1
526 . 1 1 47 47 LYS CA C 13 58.750 0.04 . 1 . . . A 47 LYS CA . 25484 1
527 . 1 1 47 47 LYS CB C 13 32.360 0.04 . 1 . . . A 47 LYS CB . 25484 1
528 . 1 1 47 47 LYS CG C 13 25.500 0.04 . 1 . . . A 47 LYS CG . 25484 1
529 . 1 1 47 47 LYS CD C 13 29.250 0.04 . 1 . . . A 47 LYS CD . 25484 1
530 . 1 1 47 47 LYS CE C 13 42.250 0.04 . 1 . . . A 47 LYS CE . 25484 1
531 . 1 1 47 47 LYS N N 15 120.510 0.04 . 1 . . . A 47 LYS N . 25484 1
532 . 1 1 48 48 GLY H H 1 7.180 0.04 . 1 . . . A 48 GLY H . 25484 1
533 . 1 1 48 48 GLY HA2 H 1 3.656 0.04 . 1 . . . A 48 GLY HA2 . 25484 1
534 . 1 1 48 48 GLY HA3 H 1 4.409 0.04 . 1 . . . A 48 GLY HA3 . 25484 1
535 . 1 1 48 48 GLY C C 13 174.220 0.04 . 1 . . . A 48 GLY C . 25484 1
536 . 1 1 48 48 GLY CA C 13 44.753 0.04 . 1 . . . A 48 GLY CA . 25484 1
537 . 1 1 48 48 GLY N N 15 104.210 0.04 . 1 . . . A 48 GLY N . 25484 1
538 . 1 1 49 49 CYS H H 1 6.981 0.04 . 1 . . . A 49 CYS H . 25484 1
539 . 1 1 49 49 CYS HA H 1 4.010 0.04 . 1 . . . A 49 CYS HA . 25484 1
540 . 1 1 49 49 CYS HB2 H 1 2.085 0.04 . 1 . . . A 49 CYS HB2 . 25484 1
541 . 1 1 49 49 CYS HB3 H 1 2.730 0.04 . 1 . . . A 49 CYS HB3 . 25484 1
542 . 1 1 49 49 CYS C C 13 177.230 0.04 . 1 . . . A 49 CYS C . 25484 1
543 . 1 1 49 49 CYS CA C 13 61.230 0.04 . 1 . . . A 49 CYS CA . 25484 1
544 . 1 1 49 49 CYS CB C 13 29.850 0.04 . 1 . . . A 49 CYS CB . 25484 1
545 . 1 1 49 49 CYS N N 15 123.560 0.04 . 1 . . . A 49 CYS N . 25484 1
546 . 1 1 50 50 LYS H H 1 8.999 0.04 . 1 . . . A 50 LYS H . 25484 1
547 . 1 1 50 50 LYS HA H 1 4.524 0.04 . 1 . . . A 50 LYS HA . 25484 1
548 . 1 1 50 50 LYS HB2 H 1 1.877 0.04 . 1 . . . A 50 LYS HB2 . 25484 1
549 . 1 1 50 50 LYS HB3 H 1 2.090 0.04 . 1 . . . A 50 LYS HB3 . 25484 1
550 . 1 1 50 50 LYS HG2 H 1 1.650 0.04 . 1 . . . A 50 LYS HG2 . 25484 1
551 . 1 1 50 50 LYS HG3 H 1 1.570 0.04 . 1 . . . A 50 LYS HG3 . 25484 1
552 . 1 1 50 50 LYS HD2 H 1 1.775 0.04 . 1 . . . A 50 LYS HD2 . 25484 1
553 . 1 1 50 50 LYS HD3 H 1 1.775 0.04 . 1 . . . A 50 LYS HD3 . 25484 1
554 . 1 1 50 50 LYS HE2 H 1 3.090 0.04 . 1 . . . A 50 LYS HE2 . 25484 1
555 . 1 1 50 50 LYS HE3 H 1 3.090 0.04 . 1 . . . A 50 LYS HE3 . 25484 1
556 . 1 1 50 50 LYS C C 13 178.040 0.04 . 1 . . . A 50 LYS C . 25484 1
557 . 1 1 50 50 LYS CA C 13 56.750 0.04 . 1 . . . A 50 LYS CA . 25484 1
558 . 1 1 50 50 LYS CB C 13 32.950 0.04 . 1 . . . A 50 LYS CB . 25484 1
559 . 1 1 50 50 LYS CG C 13 25.050 0.04 . 1 . . . A 50 LYS CG . 25484 1
560 . 1 1 50 50 LYS CD C 13 28.850 0.04 . 1 . . . A 50 LYS CD . 25484 1
561 . 1 1 50 50 LYS CE C 13 42.410 0.04 . 1 . . . A 50 LYS CE . 25484 1
562 . 1 1 50 50 LYS N N 15 128.350 0.04 . 1 . . . A 50 LYS N . 25484 1
563 . 1 1 51 51 ARG H H 1 8.558 0.04 . 1 . . . A 51 ARG H . 25484 1
564 . 1 1 51 51 ARG HA H 1 4.428 0.04 . 1 . . . A 51 ARG HA . 25484 1
565 . 1 1 51 51 ARG HB2 H 1 1.837 0.04 . 1 . . . A 51 ARG HB2 . 25484 1
566 . 1 1 51 51 ARG HB3 H 1 1.890 0.04 . 1 . . . A 51 ARG HB3 . 25484 1
567 . 1 1 51 51 ARG HG2 H 1 1.760 0.04 . 1 . . . A 51 ARG HG2 . 25484 1
568 . 1 1 51 51 ARG HG3 H 1 1.810 0.04 . 1 . . . A 51 ARG HG3 . 25484 1
569 . 1 1 51 51 ARG HD2 H 1 3.330 0.04 . 1 . . . A 51 ARG HD2 . 25484 1
570 . 1 1 51 51 ARG HD3 H 1 3.330 0.04 . 1 . . . A 51 ARG HD3 . 25484 1
571 . 1 1 51 51 ARG C C 13 177.410 0.04 . 1 . . . A 51 ARG C . 25484 1
572 . 1 1 51 51 ARG CA C 13 57.750 0.04 . 1 . . . A 51 ARG CA . 25484 1
573 . 1 1 51 51 ARG CB C 13 31.860 0.04 . 1 . . . A 51 ARG CB . 25484 1
574 . 1 1 51 51 ARG CG C 13 27.550 0.04 . 1 . . . A 51 ARG CG . 25484 1
575 . 1 1 51 51 ARG CD C 13 43.650 0.04 . 1 . . . A 51 ARG CD . 25484 1
576 . 1 1 51 51 ARG N N 15 122.550 0.04 . 1 . . . A 51 ARG N . 25484 1
577 . 1 1 52 52 LYS H H 1 8.490 0.04 . 1 . . . A 52 LYS H . 25484 1
578 . 1 1 52 52 LYS HA H 1 4.534 0.04 . 1 . . . A 52 LYS HA . 25484 1
579 . 1 1 52 52 LYS HB2 H 1 2.140 0.04 . 1 . . . A 52 LYS HB2 . 25484 1
580 . 1 1 52 52 LYS HB3 H 1 2.330 0.04 . 1 . . . A 52 LYS HB3 . 25484 1
581 . 1 1 52 52 LYS HG2 H 1 1.650 0.04 . 1 . . . A 52 LYS HG2 . 25484 1
582 . 1 1 52 52 LYS HG3 H 1 1.420 0.04 . 1 . . . A 52 LYS HG3 . 25484 1
583 . 1 1 52 52 LYS HD2 H 1 2.080 0.04 . 1 . . . A 52 LYS HD2 . 25484 1
584 . 1 1 52 52 LYS HD3 H 1 1.820 0.04 . 1 . . . A 52 LYS HD3 . 25484 1
585 . 1 1 52 52 LYS HE2 H 1 3.210 0.04 . 1 . . . A 52 LYS HE2 . 25484 1
586 . 1 1 52 52 LYS HE3 H 1 3.210 0.04 . 1 . . . A 52 LYS HE3 . 25484 1
587 . 1 1 52 52 LYS C C 13 177.610 0.04 . 1 . . . A 52 LYS C . 25484 1
588 . 1 1 52 52 LYS CA C 13 57.970 0.04 . 1 . . . A 52 LYS CA . 25484 1
589 . 1 1 52 52 LYS CB C 13 32.350 0.04 . 1 . . . A 52 LYS CB . 25484 1
590 . 1 1 52 52 LYS CG C 13 25.050 0.04 . 1 . . . A 52 LYS CG . 25484 1
591 . 1 1 52 52 LYS CD C 13 29.350 0.04 . 1 . . . A 52 LYS CD . 25484 1
592 . 1 1 52 52 LYS CE C 13 42.650 0.04 . 1 . . . A 52 LYS CE . 25484 1
593 . 1 1 52 52 LYS N N 15 119.040 0.04 . 1 . . . A 52 LYS N . 25484 1
594 . 1 1 53 53 THR H H 1 7.760 0.04 . 1 . . . A 53 THR H . 25484 1
595 . 1 1 53 53 THR HA H 1 4.160 0.04 . 1 . . . A 53 THR HA . 25484 1
596 . 1 1 53 53 THR HB H 1 4.256 0.04 . 1 . . . A 53 THR HB . 25484 1
597 . 1 1 53 53 THR HG21 H 1 1.213 0.04 . 1 . . . A 53 THR HG21 . 25484 1
598 . 1 1 53 53 THR HG22 H 1 1.213 0.04 . 1 . . . A 53 THR HG22 . 25484 1
599 . 1 1 53 53 THR HG23 H 1 1.213 0.04 . 1 . . . A 53 THR HG23 . 25484 1
600 . 1 1 53 53 THR C C 13 175.610 0.04 . 1 . . . A 53 THR C . 25484 1
601 . 1 1 53 53 THR CA C 13 64.050 0.04 . 1 . . . A 53 THR CA . 25484 1
602 . 1 1 53 53 THR CB C 13 69.120 0.04 . 1 . . . A 53 THR CB . 25484 1
603 . 1 1 53 53 THR CG2 C 13 22.450 0.04 . 1 . . . A 53 THR CG2 . 25484 1
604 . 1 1 53 53 THR N N 15 113.034 0.04 . 1 . . . A 53 THR N . 25484 1
605 . 1 1 54 54 ASN H H 1 8.290 0.04 . 1 . . . A 54 ASN H . 25484 1
606 . 1 1 54 54 ASN HA H 1 4.920 0.04 . 1 . . . A 54 ASN HA . 25484 1
607 . 1 1 54 54 ASN HB2 H 1 2.930 0.04 . 2 . . . A 54 ASN HB2 . 25484 1
608 . 1 1 54 54 ASN HB3 H 1 2.930 0.04 . 2 . . . A 54 ASN HB3 . 25484 1
609 . 1 1 54 54 ASN C C 13 176.330 0.04 . 1 . . . A 54 ASN C . 25484 1
610 . 1 1 54 54 ASN CA C 13 53.720 0.04 . 1 . . . A 54 ASN CA . 25484 1
611 . 1 1 54 54 ASN CB C 13 38.350 0.04 . 1 . . . A 54 ASN CB . 25484 1
612 . 1 1 54 54 ASN N N 15 119.860 0.04 . 1 . . . A 54 ASN N . 25484 1
613 . 1 1 55 55 GLY H H 1 8.006 0.04 . 1 . . . A 55 GLY H . 25484 1
614 . 1 1 55 55 GLY HA2 H 1 4.030 0.04 . 1 . . . A 55 GLY HA2 . 25484 1
615 . 1 1 55 55 GLY HA3 H 1 4.030 0.04 . 1 . . . A 55 GLY HA3 . 25484 1
616 . 1 1 55 55 GLY C C 13 175.660 0.04 . 1 . . . A 55 GLY C . 25484 1
617 . 1 1 55 55 GLY CA C 13 45.938 0.04 . 1 . . . A 55 GLY CA . 25484 1
618 . 1 1 55 55 GLY N N 15 107.570 0.04 . 1 . . . A 55 GLY N . 25484 1
619 . 1 1 56 56 GLY H H 1 7.840 0.04 . 1 . . . A 56 GLY H . 25484 1
620 . 1 1 56 56 GLY HA2 H 1 4.015 0.04 . 1 . . . A 56 GLY HA2 . 25484 1
621 . 1 1 56 56 GLY HA3 H 1 4.015 0.04 . 1 . . . A 56 GLY HA3 . 25484 1
622 . 1 1 56 56 GLY C C 13 173.710 0.04 . 1 . . . A 56 GLY C . 25484 1
623 . 1 1 56 56 GLY CA C 13 45.570 0.04 . 1 . . . A 56 GLY CA . 25484 1
624 . 1 1 56 56 GLY N N 15 107.290 0.04 . 1 . . . A 56 GLY N . 25484 1
625 . 1 1 57 57 CYS H H 1 8.048 0.04 . 1 . . . A 57 CYS H . 25484 1
626 . 1 1 57 57 CYS HA H 1 4.505 0.04 . 1 . . . A 57 CYS HA . 25484 1
627 . 1 1 57 57 CYS HB2 H 1 2.901 0.04 . 1 . . . A 57 CYS HB2 . 25484 1
628 . 1 1 57 57 CYS HB3 H 1 2.978 0.04 . 1 . . . A 57 CYS HB3 . 25484 1
629 . 1 1 57 57 CYS C C 13 175.090 0.04 . 1 . . . A 57 CYS C . 25484 1
630 . 1 1 57 57 CYS CA C 13 55.950 0.04 . 1 . . . A 57 CYS CA . 25484 1
631 . 1 1 57 57 CYS CB C 13 30.760 0.04 . 1 . . . A 57 CYS CB . 25484 1
632 . 1 1 57 57 CYS N N 15 122.730 0.04 . 1 . . . A 57 CYS N . 25484 1
633 . 1 1 58 58 PRO HA H 1 4.338 0.04 . 1 . . . A 58 PRO HA . 25484 1
634 . 1 1 58 58 PRO HB2 H 1 2.020 0.04 . 1 . . . A 58 PRO HB2 . 25484 1
635 . 1 1 58 58 PRO HB3 H 1 2.420 0.04 . 1 . . . A 58 PRO HB3 . 25484 1
636 . 1 1 58 58 PRO HG2 H 1 2.107 0.04 . 1 . . . A 58 PRO HG2 . 25484 1
637 . 1 1 58 58 PRO HG3 H 1 2.215 0.04 . 1 . . . A 58 PRO HG3 . 25484 1
638 . 1 1 58 58 PRO HD2 H 1 3.815 0.04 . 1 . . . A 58 PRO HD2 . 25484 1
639 . 1 1 58 58 PRO HD3 H 1 4.085 0.04 . 1 . . . A 58 PRO HD3 . 25484 1
640 . 1 1 58 58 PRO CA C 13 65.050 0.04 . 1 . . . A 58 PRO CA . 25484 1
641 . 1 1 58 58 PRO CB C 13 32.620 0.04 . 1 . . . A 58 PRO CB . 25484 1
642 . 1 1 58 58 PRO CG C 13 27.855 0.04 . 1 . . . A 58 PRO CG . 25484 1
643 . 1 1 58 58 PRO CD C 13 51.150 0.04 . 1 . . . A 58 PRO CD . 25484 1
644 . 1 1 59 59 ILE H H 1 7.900 0.04 . 1 . . . A 59 ILE H . 25484 1
645 . 1 1 59 59 ILE HA H 1 3.818 0.04 . 1 . . . A 59 ILE HA . 25484 1
646 . 1 1 59 59 ILE HB H 1 1.547 0.04 . 1 . . . A 59 ILE HB . 25484 1
647 . 1 1 59 59 ILE HG12 H 1 0.935 0.04 . 1 . . . A 59 ILE HG12 . 25484 1
648 . 1 1 59 59 ILE HG13 H 1 1.435 0.04 . 1 . . . A 59 ILE HG13 . 25484 1
649 . 1 1 59 59 ILE HG21 H 1 0.725 0.04 . 1 . . . A 59 ILE HG21 . 25484 1
650 . 1 1 59 59 ILE HG22 H 1 0.725 0.04 . 1 . . . A 59 ILE HG22 . 25484 1
651 . 1 1 59 59 ILE HG23 H 1 0.725 0.04 . 1 . . . A 59 ILE HG23 . 25484 1
652 . 1 1 59 59 ILE HD11 H 1 0.480 0.04 . 1 . . . A 59 ILE HD11 . 25484 1
653 . 1 1 59 59 ILE HD12 H 1 0.480 0.04 . 1 . . . A 59 ILE HD12 . 25484 1
654 . 1 1 59 59 ILE HD13 H 1 0.480 0.04 . 1 . . . A 59 ILE HD13 . 25484 1
655 . 1 1 59 59 ILE C C 13 178.820 0.04 . 1 . . . A 59 ILE C . 25484 1
656 . 1 1 59 59 ILE CA C 13 64.590 0.04 . 1 . . . A 59 ILE CA . 25484 1
657 . 1 1 59 59 ILE CB C 13 38.890 0.04 . 1 . . . A 59 ILE CB . 25484 1
658 . 1 1 59 59 ILE CG1 C 13 28.100 0.04 . 1 . . . A 59 ILE CG1 . 25484 1
659 . 1 1 59 59 ILE CG2 C 13 18.650 0.04 . 1 . . . A 59 ILE CG2 . 25484 1
660 . 1 1 59 59 ILE CD1 C 13 12.850 0.04 . 1 . . . A 59 ILE CD1 . 25484 1
661 . 1 1 59 59 ILE N N 15 121.256 0.04 . 1 . . . A 59 ILE N . 25484 1
662 . 1 1 60 60 CYS H H 1 8.914 0.04 . 1 . . . A 60 CYS H . 25484 1
663 . 1 1 60 60 CYS HA H 1 4.117 0.04 . 1 . . . A 60 CYS HA . 25484 1
664 . 1 1 60 60 CYS HB2 H 1 2.806 0.04 . 1 . . . A 60 CYS HB2 . 25484 1
665 . 1 1 60 60 CYS HB3 H 1 3.005 0.04 . 1 . . . A 60 CYS HB3 . 25484 1
666 . 1 1 60 60 CYS C C 13 178.110 0.04 . 1 . . . A 60 CYS C . 25484 1
667 . 1 1 60 60 CYS CA C 13 66.090 0.04 . 1 . . . A 60 CYS CA . 25484 1
668 . 1 1 60 60 CYS CB C 13 29.150 0.04 . 1 . . . A 60 CYS CB . 25484 1
669 . 1 1 60 60 CYS N N 15 123.970 0.04 . 1 . . . A 60 CYS N . 25484 1
670 . 1 1 61 61 LYS H H 1 8.090 0.04 . 1 . . . A 61 LYS H . 25484 1
671 . 1 1 61 61 LYS HA H 1 3.910 0.04 . 1 . . . A 61 LYS HA . 25484 1
672 . 1 1 61 61 LYS HB2 H 1 1.780 0.04 . 1 . . . A 61 LYS HB2 . 25484 1
673 . 1 1 61 61 LYS HB3 H 1 1.890 0.04 . 1 . . . A 61 LYS HB3 . 25484 1
674 . 1 1 61 61 LYS HG2 H 1 1.400 0.04 . 1 . . . A 61 LYS HG2 . 25484 1
675 . 1 1 61 61 LYS HG3 H 1 1.550 0.04 . 1 . . . A 61 LYS HG3 . 25484 1
676 . 1 1 61 61 LYS HD2 H 1 1.640 0.04 . 2 . . . A 61 LYS HD2 . 25484 1
677 . 1 1 61 61 LYS HD3 H 1 1.640 0.04 . 2 . . . A 61 LYS HD3 . 25484 1
678 . 1 1 61 61 LYS HE2 H 1 2.950 0.04 . 2 . . . A 61 LYS HE2 . 25484 1
679 . 1 1 61 61 LYS HE3 H 1 2.950 0.04 . 2 . . . A 61 LYS HE3 . 25484 1
680 . 1 1 61 61 LYS C C 13 179.460 0.04 . 1 . . . A 61 LYS C . 25484 1
681 . 1 1 61 61 LYS CA C 13 59.970 0.04 . 1 . . . A 61 LYS CA . 25484 1
682 . 1 1 61 61 LYS CB C 13 32.650 0.04 . 1 . . . A 61 LYS CB . 25484 1
683 . 1 1 61 61 LYS CG C 13 25.350 0.04 . 1 . . . A 61 LYS CG . 25484 1
684 . 1 1 61 61 LYS CD C 13 29.550 0.04 . 1 . . . A 61 LYS CD . 25484 1
685 . 1 1 61 61 LYS CE C 13 42.150 0.04 . 1 . . . A 61 LYS CE . 25484 1
686 . 1 1 61 61 LYS N N 15 117.210 0.04 . 1 . . . A 61 LYS N . 25484 1
687 . 1 1 62 62 GLN H H 1 7.360 0.04 . 1 . . . A 62 GLN H . 25484 1
688 . 1 1 62 62 GLN HA H 1 4.203 0.04 . 1 . . . A 62 GLN HA . 25484 1
689 . 1 1 62 62 GLN HB2 H 1 2.000 0.04 . 1 . . . A 62 GLN HB2 . 25484 1
690 . 1 1 62 62 GLN HB3 H 1 2.000 0.04 . 1 . . . A 62 GLN HB3 . 25484 1
691 . 1 1 62 62 GLN HG2 H 1 2.270 0.04 . 1 . . . A 62 GLN HG2 . 25484 1
692 . 1 1 62 62 GLN HG3 H 1 2.480 0.04 . 1 . . . A 62 GLN HG3 . 25484 1
693 . 1 1 62 62 GLN C C 13 178.564 0.04 . 1 . . . A 62 GLN C . 25484 1
694 . 1 1 62 62 GLN CA C 13 58.450 0.04 . 1 . . . A 62 GLN CA . 25484 1
695 . 1 1 62 62 GLN CB C 13 29.140 0.04 . 1 . . . A 62 GLN CB . 25484 1
696 . 1 1 62 62 GLN CG C 13 34.350 0.04 . 1 . . . A 62 GLN CG . 25484 1
697 . 1 1 62 62 GLN N N 15 117.780 0.04 . 1 . . . A 62 GLN N . 25484 1
698 . 1 1 63 63 LEU H H 1 8.075 0.04 . 1 . . . A 63 LEU H . 25484 1
699 . 1 1 63 63 LEU HA H 1 4.218 0.04 . 1 . . . A 63 LEU HA . 25484 1
700 . 1 1 63 63 LEU HB2 H 1 1.960 0.04 . 2 . . . A 63 LEU HB2 . 25484 1
701 . 1 1 63 63 LEU HB3 H 1 1.960 0.04 . 2 . . . A 63 LEU HB3 . 25484 1
702 . 1 1 63 63 LEU HG H 1 1.925 0.04 . 1 . . . A 63 LEU HG . 25484 1
703 . 1 1 63 63 LEU HD11 H 1 1.054 0.04 . 1 . . . A 63 LEU HD11 . 25484 1
704 . 1 1 63 63 LEU HD12 H 1 1.054 0.04 . 1 . . . A 63 LEU HD12 . 25484 1
705 . 1 1 63 63 LEU HD13 H 1 1.054 0.04 . 1 . . . A 63 LEU HD13 . 25484 1
706 . 1 1 63 63 LEU HD21 H 1 1.025 0.04 . 1 . . . A 63 LEU HD21 . 25484 1
707 . 1 1 63 63 LEU HD22 H 1 1.025 0.04 . 1 . . . A 63 LEU HD22 . 25484 1
708 . 1 1 63 63 LEU HD23 H 1 1.025 0.04 . 1 . . . A 63 LEU HD23 . 25484 1
709 . 1 1 63 63 LEU C C 13 179.440 0.04 . 1 . . . A 63 LEU C . 25484 1
710 . 1 1 63 63 LEU CA C 13 58.550 0.04 . 1 . . . A 63 LEU CA . 25484 1
711 . 1 1 63 63 LEU CB C 13 41.910 0.04 . 1 . . . A 63 LEU CB . 25484 1
712 . 1 1 63 63 LEU CG C 13 27.750 0.04 . 1 . . . A 63 LEU CG . 25484 1
713 . 1 1 63 63 LEU CD1 C 13 25.350 0.04 . 1 . . . A 63 LEU CD1 . 25484 1
714 . 1 1 63 63 LEU CD2 C 13 24.850 0.04 . 1 . . . A 63 LEU CD2 . 25484 1
715 . 1 1 63 63 LEU N N 15 119.930 0.04 . 1 . . . A 63 LEU N . 25484 1
716 . 1 1 64 64 ILE H H 1 8.466 0.04 . 1 . . . A 64 ILE H . 25484 1
717 . 1 1 64 64 ILE HA H 1 3.600 0.04 . 1 . . . A 64 ILE HA . 25484 1
718 . 1 1 64 64 ILE HB H 1 1.489 0.04 . 1 . . . A 64 ILE HB . 25484 1
719 . 1 1 64 64 ILE HG12 H 1 0.445 0.04 . 1 . . . A 64 ILE HG12 . 25484 1
720 . 1 1 64 64 ILE HG13 H 1 1.115 0.04 . 1 . . . A 64 ILE HG13 . 25484 1
721 . 1 1 64 64 ILE HG21 H 1 0.827 0.04 . 1 . . . A 64 ILE HG21 . 25484 1
722 . 1 1 64 64 ILE HG22 H 1 0.827 0.04 . 1 . . . A 64 ILE HG22 . 25484 1
723 . 1 1 64 64 ILE HG23 H 1 0.827 0.04 . 1 . . . A 64 ILE HG23 . 25484 1
724 . 1 1 64 64 ILE HD11 H 1 0.449 0.04 . 1 . . . A 64 ILE HD11 . 25484 1
725 . 1 1 64 64 ILE HD12 H 1 0.449 0.04 . 1 . . . A 64 ILE HD12 . 25484 1
726 . 1 1 64 64 ILE HD13 H 1 0.449 0.04 . 1 . . . A 64 ILE HD13 . 25484 1
727 . 1 1 64 64 ILE C C 13 177.950 0.04 . 1 . . . A 64 ILE C . 25484 1
728 . 1 1 64 64 ILE CA C 13 65.250 0.04 . 1 . . . A 64 ILE CA . 25484 1
729 . 1 1 64 64 ILE CB C 13 37.320 0.04 . 1 . . . A 64 ILE CB . 25484 1
730 . 1 1 64 64 ILE CG1 C 13 29.850 0.04 . 1 . . . A 64 ILE CG1 . 25484 1
731 . 1 1 64 64 ILE CG2 C 13 17.200 0.04 . 1 . . . A 64 ILE CG2 . 25484 1
732 . 1 1 64 64 ILE CD1 C 13 13.450 0.04 . 1 . . . A 64 ILE CD1 . 25484 1
733 . 1 1 64 64 ILE N N 15 120.280 0.04 . 1 . . . A 64 ILE N . 25484 1
734 . 1 1 65 65 ALA H H 1 7.496 0.04 . 1 . . . A 65 ALA H . 25484 1
735 . 1 1 65 65 ALA HA H 1 4.185 0.04 . 1 . . . A 65 ALA HA . 25484 1
736 . 1 1 65 65 ALA HB1 H 1 1.550 0.04 . 1 . . . A 65 ALA HB1 . 25484 1
737 . 1 1 65 65 ALA HB2 H 1 1.550 0.04 . 1 . . . A 65 ALA HB2 . 25484 1
738 . 1 1 65 65 ALA HB3 H 1 1.550 0.04 . 1 . . . A 65 ALA HB3 . 25484 1
739 . 1 1 65 65 ALA C C 13 181.010 0.04 . 1 . . . A 65 ALA C . 25484 1
740 . 1 1 65 65 ALA CA C 13 55.220 0.04 . 1 . . . A 65 ALA CA . 25484 1
741 . 1 1 65 65 ALA CB C 13 18.450 0.04 . 1 . . . A 65 ALA CB . 25484 1
742 . 1 1 65 65 ALA N N 15 122.590 0.04 . 1 . . . A 65 ALA N . 25484 1
743 . 1 1 66 66 LEU H H 1 8.139 0.04 . 1 . . . A 66 LEU H . 25484 1
744 . 1 1 66 66 LEU HA H 1 4.100 0.04 . 1 . . . A 66 LEU HA . 25484 1
745 . 1 1 66 66 LEU HB2 H 1 1.598 0.04 . 1 . . . A 66 LEU HB2 . 25484 1
746 . 1 1 66 66 LEU HB3 H 1 1.766 0.04 . 1 . . . A 66 LEU HB3 . 25484 1
747 . 1 1 66 66 LEU HG H 1 1.804 0.04 . 1 . . . A 66 LEU HG . 25484 1
748 . 1 1 66 66 LEU HD11 H 1 0.973 0.04 . 1 . . . A 66 LEU HD11 . 25484 1
749 . 1 1 66 66 LEU HD12 H 1 0.973 0.04 . 1 . . . A 66 LEU HD12 . 25484 1
750 . 1 1 66 66 LEU HD13 H 1 0.973 0.04 . 1 . . . A 66 LEU HD13 . 25484 1
751 . 1 1 66 66 LEU HD21 H 1 0.970 0.04 . 1 . . . A 66 LEU HD21 . 25484 1
752 . 1 1 66 66 LEU HD22 H 1 0.970 0.04 . 1 . . . A 66 LEU HD22 . 25484 1
753 . 1 1 66 66 LEU HD23 H 1 0.970 0.04 . 1 . . . A 66 LEU HD23 . 25484 1
754 . 1 1 66 66 LEU C C 13 179.380 0.04 . 1 . . . A 66 LEU C . 25484 1
755 . 1 1 66 66 LEU CA C 13 57.930 0.04 . 1 . . . A 66 LEU CA . 25484 1
756 . 1 1 66 66 LEU CB C 13 41.410 0.04 . 1 . . . A 66 LEU CB . 25484 1
757 . 1 1 66 66 LEU CG C 13 27.550 0.04 . 1 . . . A 66 LEU CG . 25484 1
758 . 1 1 66 66 LEU CD1 C 13 25.150 0.04 . 1 . . . A 66 LEU CD1 . 25484 1
759 . 1 1 66 66 LEU CD2 C 13 24.050 0.04 . 1 . . . A 66 LEU CD2 . 25484 1
760 . 1 1 66 66 LEU N N 15 115.599 0.04 . 1 . . . A 66 LEU N . 25484 1
761 . 1 1 67 67 ALA H H 1 8.770 0.04 . 1 . . . A 67 ALA H . 25484 1
762 . 1 1 67 67 ALA HA H 1 3.958 0.04 . 1 . . . A 67 ALA HA . 25484 1
763 . 1 1 67 67 ALA HB1 H 1 1.695 0.04 . 1 . . . A 67 ALA HB1 . 25484 1
764 . 1 1 67 67 ALA HB2 H 1 1.695 0.04 . 1 . . . A 67 ALA HB2 . 25484 1
765 . 1 1 67 67 ALA HB3 H 1 1.695 0.04 . 1 . . . A 67 ALA HB3 . 25484 1
766 . 1 1 67 67 ALA C C 13 180.060 0.04 . 1 . . . A 67 ALA C . 25484 1
767 . 1 1 67 67 ALA CA C 13 55.750 0.04 . 1 . . . A 67 ALA CA . 25484 1
768 . 1 1 67 67 ALA CB C 13 19.220 0.04 . 1 . . . A 67 ALA CB . 25484 1
769 . 1 1 67 67 ALA N N 15 122.670 0.04 . 1 . . . A 67 ALA N . 25484 1
770 . 1 1 68 68 ALA H H 1 8.604 0.04 . 1 . . . A 68 ALA H . 25484 1
771 . 1 1 68 68 ALA HA H 1 4.142 0.04 . 1 . . . A 68 ALA HA . 25484 1
772 . 1 1 68 68 ALA HB1 H 1 1.542 0.04 . 1 . . . A 68 ALA HB1 . 25484 1
773 . 1 1 68 68 ALA HB2 H 1 1.542 0.04 . 1 . . . A 68 ALA HB2 . 25484 1
774 . 1 1 68 68 ALA HB3 H 1 1.542 0.04 . 1 . . . A 68 ALA HB3 . 25484 1
775 . 1 1 68 68 ALA C C 13 179.540 0.04 . 1 . . . A 68 ALA C . 25484 1
776 . 1 1 68 68 ALA CA C 13 55.450 0.04 . 1 . . . A 68 ALA CA . 25484 1
777 . 1 1 68 68 ALA CB C 13 18.220 0.04 . 1 . . . A 68 ALA CB . 25484 1
778 . 1 1 68 68 ALA N N 15 120.580 0.04 . 1 . . . A 68 ALA N . 25484 1
779 . 1 1 69 69 TYR HA H 1 4.345 0.04 . 1 . . . A 69 TYR HA . 25484 1
780 . 1 1 69 69 TYR HB2 H 1 2.850 0.04 . 1 . . . A 69 TYR HB2 . 25484 1
781 . 1 1 69 69 TYR HB3 H 1 2.968 0.04 . 1 . . . A 69 TYR HB3 . 25484 1
782 . 1 1 69 69 TYR CA C 13 57.750 0.04 . 1 . . . A 69 TYR CA . 25484 1
783 . 1 1 69 69 TYR CB C 13 38.580 0.04 . 1 . . . A 69 TYR CB . 25484 1
784 . 1 1 71 71 ALA HA H 1 4.000 0.04 . 1 . . . A 71 ALA HA . 25484 1
785 . 1 1 71 71 ALA HB1 H 1 1.625 0.04 . 1 . . . A 71 ALA HB1 . 25484 1
786 . 1 1 71 71 ALA HB2 H 1 1.625 0.04 . 1 . . . A 71 ALA HB2 . 25484 1
787 . 1 1 71 71 ALA HB3 H 1 1.625 0.04 . 1 . . . A 71 ALA HB3 . 25484 1
788 . 1 1 71 71 ALA C C 13 179.540 0.04 . 1 . . . A 71 ALA C . 25484 1
789 . 1 1 71 71 ALA CA C 13 54.850 0.04 . 1 . . . A 71 ALA CA . 25484 1
790 . 1 1 71 71 ALA CB C 13 19.650 0.04 . 1 . . . A 71 ALA CB . 25484 1
791 . 1 1 72 72 LYS H H 1 7.080 0.04 . 1 . . . A 72 LYS H . 25484 1
792 . 1 1 72 72 LYS HA H 1 3.904 0.04 . 1 . . . A 72 LYS HA . 25484 1
793 . 1 1 72 72 LYS HB2 H 1 1.495 0.04 . 1 . . . A 72 LYS HB2 . 25484 1
794 . 1 1 72 72 LYS HB3 H 1 1.622 0.04 . 1 . . . A 72 LYS HB3 . 25484 1
795 . 1 1 72 72 LYS HG2 H 1 1.260 0.04 . 1 . . . A 72 LYS HG2 . 25484 1
796 . 1 1 72 72 LYS HG3 H 1 1.370 0.04 . 1 . . . A 72 LYS HG3 . 25484 1
797 . 1 1 72 72 LYS HD2 H 1 1.380 0.04 . 1 . . . A 72 LYS HD2 . 25484 1
798 . 1 1 72 72 LYS HD3 H 1 1.380 0.04 . 1 . . . A 72 LYS HD3 . 25484 1
799 . 1 1 72 72 LYS HE2 H 1 2.946 0.04 . 1 . . . A 72 LYS HE2 . 25484 1
800 . 1 1 72 72 LYS HE3 H 1 2.946 0.04 . 1 . . . A 72 LYS HE3 . 25484 1
801 . 1 1 72 72 LYS C C 13 177.120 0.04 . 1 . . . A 72 LYS C . 25484 1
802 . 1 1 72 72 LYS CA C 13 58.230 0.04 . 1 . . . A 72 LYS CA . 25484 1
803 . 1 1 72 72 LYS CB C 13 32.340 0.04 . 1 . . . A 72 LYS CB . 25484 1
804 . 1 1 72 72 LYS CG C 13 24.540 0.04 . 1 . . . A 72 LYS CG . 25484 1
805 . 1 1 72 72 LYS CD C 13 25.360 0.04 . 1 . . . A 72 LYS CD . 25484 1
806 . 1 1 72 72 LYS CE C 13 42.050 0.04 . 1 . . . A 72 LYS CE . 25484 1
807 . 1 1 72 72 LYS N N 15 114.680 0.04 . 1 . . . A 72 LYS N . 25484 1
808 . 1 1 73 73 HIS H H 1 7.250 0.04 . 1 . . . A 73 HIS H . 25484 1
809 . 1 1 73 73 HIS HA H 1 4.826 0.04 . 1 . . . A 73 HIS HA . 25484 1
810 . 1 1 73 73 HIS HB2 H 1 2.940 0.04 . 1 . . . A 73 HIS HB2 . 25484 1
811 . 1 1 73 73 HIS HB3 H 1 3.445 0.04 . 1 . . . A 73 HIS HB3 . 25484 1
812 . 1 1 73 73 HIS C C 13 173.660 0.04 . 1 . . . A 73 HIS C . 25484 1
813 . 1 1 73 73 HIS CA C 13 54.380 0.04 . 1 . . . A 73 HIS CA . 25484 1
814 . 1 1 73 73 HIS CB C 13 30.350 0.04 . 1 . . . A 73 HIS CB . 25484 1
815 . 1 1 73 73 HIS N N 15 113.498 0.04 . 1 . . . A 73 HIS N . 25484 1
816 . 1 1 74 74 CYS H H 1 7.140 0.04 . 1 . . . A 74 CYS H . 25484 1
817 . 1 1 74 74 CYS HA H 1 4.150 0.04 . 1 . . . A 74 CYS HA . 25484 1
818 . 1 1 74 74 CYS HB2 H 1 1.820 0.04 . 1 . . . A 74 CYS HB2 . 25484 1
819 . 1 1 74 74 CYS HB3 H 1 2.480 0.04 . 1 . . . A 74 CYS HB3 . 25484 1
820 . 1 1 74 74 CYS C C 13 176.480 0.04 . 1 . . . A 74 CYS C . 25484 1
821 . 1 1 74 74 CYS CA C 13 60.250 0.04 . 1 . . . A 74 CYS CA . 25484 1
822 . 1 1 74 74 CYS CB C 13 29.930 0.04 . 1 . . . A 74 CYS CB . 25484 1
823 . 1 1 74 74 CYS N N 15 123.830 0.04 . 1 . . . A 74 CYS N . 25484 1
824 . 1 1 75 75 GLN H H 1 9.088 0.04 . 1 . . . A 75 GLN H . 25484 1
825 . 1 1 75 75 GLN HA H 1 4.685 0.04 . 1 . . . A 75 GLN HA . 25484 1
826 . 1 1 75 75 GLN HB2 H 1 2.347 0.04 . 2 . . . A 75 GLN HB2 . 25484 1
827 . 1 1 75 75 GLN HB3 H 1 2.347 0.04 . 2 . . . A 75 GLN HB3 . 25484 1
828 . 1 1 75 75 GLN HG2 H 1 2.370 0.04 . 1 . . . A 75 GLN HG2 . 25484 1
829 . 1 1 75 75 GLN HG3 H 1 2.370 0.04 . 1 . . . A 75 GLN HG3 . 25484 1
830 . 1 1 75 75 GLN C C 13 176.090 0.04 . 1 . . . A 75 GLN C . 25484 1
831 . 1 1 75 75 GLN CA C 13 54.900 0.04 . 1 . . . A 75 GLN CA . 25484 1
832 . 1 1 75 75 GLN CB C 13 29.840 0.04 . 1 . . . A 75 GLN CB . 25484 1
833 . 1 1 75 75 GLN CG C 13 33.850 0.04 . 1 . . . A 75 GLN CG . 25484 1
834 . 1 1 75 75 GLN N N 15 128.740 0.04 . 1 . . . A 75 GLN N . 25484 1
835 . 1 1 76 76 GLU H H 1 8.390 0.04 . 1 . . . A 76 GLU H . 25484 1
836 . 1 1 76 76 GLU HA H 1 4.480 0.04 . 1 . . . A 76 GLU HA . 25484 1
837 . 1 1 76 76 GLU HB2 H 1 2.150 0.04 . 1 . . . A 76 GLU HB2 . 25484 1
838 . 1 1 76 76 GLU HB3 H 1 2.080 0.04 . 1 . . . A 76 GLU HB3 . 25484 1
839 . 1 1 76 76 GLU HG2 H 1 2.480 0.04 . 1 . . . A 76 GLU HG2 . 25484 1
840 . 1 1 76 76 GLU HG3 H 1 2.480 0.04 . 1 . . . A 76 GLU HG3 . 25484 1
841 . 1 1 76 76 GLU C C 13 177.030 0.04 . 1 . . . A 76 GLU C . 25484 1
842 . 1 1 76 76 GLU CA C 13 56.210 0.04 . 1 . . . A 76 GLU CA . 25484 1
843 . 1 1 76 76 GLU CB C 13 30.660 0.04 . 1 . . . A 76 GLU CB . 25484 1
844 . 1 1 76 76 GLU CG C 13 34.350 0.04 . 1 . . . A 76 GLU CG . 25484 1
845 . 1 1 76 76 GLU N N 15 123.190 0.04 . 1 . . . A 76 GLU N . 25484 1
846 . 1 1 77 77 ASN H H 1 8.848 0.04 . 1 . . . A 77 ASN H . 25484 1
847 . 1 1 77 77 ASN HA H 1 4.549 0.04 . 1 . . . A 77 ASN HA . 25484 1
848 . 1 1 77 77 ASN HB2 H 1 2.855 0.04 . 2 . . . A 77 ASN HB2 . 25484 1
849 . 1 1 77 77 ASN HB3 H 1 2.855 0.04 . 2 . . . A 77 ASN HB3 . 25484 1
850 . 1 1 77 77 ASN C C 13 176.070 0.04 . 1 . . . A 77 ASN C . 25484 1
851 . 1 1 77 77 ASN CA C 13 55.100 0.04 . 1 . . . A 77 ASN CA . 25484 1
852 . 1 1 77 77 ASN CB C 13 38.650 0.04 . 1 . . . A 77 ASN CB . 25484 1
853 . 1 1 77 77 ASN N N 15 124.760 0.04 . 1 . . . A 77 ASN N . 25484 1
854 . 1 1 78 78 LYS H H 1 8.636 0.04 . 1 . . . A 78 LYS H . 25484 1
855 . 1 1 78 78 LYS HA H 1 4.460 0.04 . 1 . . . A 78 LYS HA . 25484 1
856 . 1 1 78 78 LYS HB2 H 1 1.690 0.04 . 1 . . . A 78 LYS HB2 . 25484 1
857 . 1 1 78 78 LYS HB3 H 1 1.960 0.04 . 1 . . . A 78 LYS HB3 . 25484 1
858 . 1 1 78 78 LYS HG2 H 1 1.380 0.04 . 1 . . . A 78 LYS HG2 . 25484 1
859 . 1 1 78 78 LYS HG3 H 1 1.441 0.04 . 1 . . . A 78 LYS HG3 . 25484 1
860 . 1 1 78 78 LYS HD2 H 1 1.740 0.04 . 1 . . . A 78 LYS HD2 . 25484 1
861 . 1 1 78 78 LYS HD3 H 1 1.740 0.04 . 1 . . . A 78 LYS HD3 . 25484 1
862 . 1 1 78 78 LYS HE2 H 1 3.044 0.04 . 1 . . . A 78 LYS HE2 . 25484 1
863 . 1 1 78 78 LYS HE3 H 1 3.044 0.04 . 1 . . . A 78 LYS HE3 . 25484 1
864 . 1 1 78 78 LYS C C 13 175.230 0.04 . 1 . . . A 78 LYS C . 25484 1
865 . 1 1 78 78 LYS CA C 13 54.920 0.04 . 1 . . . A 78 LYS CA . 25484 1
866 . 1 1 78 78 LYS CB C 13 31.020 0.04 . 1 . . . A 78 LYS CB . 25484 1
867 . 1 1 78 78 LYS CG C 13 24.250 0.04 . 1 . . . A 78 LYS CG . 25484 1
868 . 1 1 78 78 LYS CD C 13 28.950 0.04 . 1 . . . A 78 LYS CD . 25484 1
869 . 1 1 78 78 LYS CE C 13 42.050 0.04 . 1 . . . A 78 LYS CE . 25484 1
870 . 1 1 78 78 LYS N N 15 120.810 0.04 . 1 . . . A 78 LYS N . 25484 1
871 . 1 1 80 80 PRO HA H 1 4.710 0.04 . 1 . . . A 80 PRO HA . 25484 1
872 . 1 1 80 80 PRO HB2 H 1 2.080 0.04 . 1 . . . A 80 PRO HB2 . 25484 1
873 . 1 1 80 80 PRO HB3 H 1 2.170 0.04 . 1 . . . A 80 PRO HB3 . 25484 1
874 . 1 1 80 80 PRO HG2 H 1 1.690 0.04 . 1 . . . A 80 PRO HG2 . 25484 1
875 . 1 1 80 80 PRO HG3 H 1 2.080 0.04 . 1 . . . A 80 PRO HG3 . 25484 1
876 . 1 1 80 80 PRO HD2 H 1 3.880 0.04 . 1 . . . A 80 PRO HD2 . 25484 1
877 . 1 1 80 80 PRO HD3 H 1 4.214 0.04 . 1 . . . A 80 PRO HD3 . 25484 1
878 . 1 1 80 80 PRO CA C 13 62.850 0.04 . 1 . . . A 80 PRO CA . 25484 1
879 . 1 1 80 80 PRO CB C 13 32.150 0.04 . 1 . . . A 80 PRO CB . 25484 1
880 . 1 1 80 80 PRO CG C 13 26.950 0.04 . 1 . . . A 80 PRO CG . 25484 1
881 . 1 1 80 80 PRO CD C 13 51.450 0.04 . 1 . . . A 80 PRO CD . 25484 1
882 . 1 1 81 81 VAL HA H 1 3.578 0.04 . 1 . . . A 81 VAL HA . 25484 1
883 . 1 1 81 81 VAL HB H 1 2.230 0.04 . 1 . . . A 81 VAL HB . 25484 1
884 . 1 1 81 81 VAL HG11 H 1 0.691 0.04 . 1 . . . A 81 VAL HG11 . 25484 1
885 . 1 1 81 81 VAL HG12 H 1 0.691 0.04 . 1 . . . A 81 VAL HG12 . 25484 1
886 . 1 1 81 81 VAL HG13 H 1 0.691 0.04 . 1 . . . A 81 VAL HG13 . 25484 1
887 . 1 1 81 81 VAL HG21 H 1 0.441 0.04 . 1 . . . A 81 VAL HG21 . 25484 1
888 . 1 1 81 81 VAL HG22 H 1 0.441 0.04 . 1 . . . A 81 VAL HG22 . 25484 1
889 . 1 1 81 81 VAL HG23 H 1 0.441 0.04 . 1 . . . A 81 VAL HG23 . 25484 1
890 . 1 1 81 81 VAL CA C 13 62.350 0.04 . 1 . . . A 81 VAL CA . 25484 1
891 . 1 1 81 81 VAL CB C 13 31.616 0.04 . 1 . . . A 81 VAL CB . 25484 1
892 . 1 1 81 81 VAL CG1 C 13 19.980 0.04 . 1 . . . A 81 VAL CG1 . 25484 1
893 . 1 1 81 81 VAL CG2 C 13 24.080 0.04 . 1 . . . A 81 VAL CG2 . 25484 1
894 . 1 1 82 82 PRO HA H 1 4.850 0.04 . 1 . . . A 82 PRO HA . 25484 1
895 . 1 1 82 82 PRO HB2 H 1 2.000 0.04 . 1 . . . A 82 PRO HB2 . 25484 1
896 . 1 1 82 82 PRO HB3 H 1 2.403 0.04 . 1 . . . A 82 PRO HB3 . 25484 1
897 . 1 1 82 82 PRO HG2 H 1 1.910 0.04 . 1 . . . A 82 PRO HG2 . 25484 1
898 . 1 1 82 82 PRO HG3 H 1 2.240 0.04 . 1 . . . A 82 PRO HG3 . 25484 1
899 . 1 1 82 82 PRO HD2 H 1 3.580 0.04 . 1 . . . A 82 PRO HD2 . 25484 1
900 . 1 1 82 82 PRO HD3 H 1 3.690 0.04 . 1 . . . A 82 PRO HD3 . 25484 1
901 . 1 1 82 82 PRO CA C 13 63.350 0.04 . 1 . . . A 82 PRO CA . 25484 1
902 . 1 1 82 82 PRO CB C 13 32.050 0.04 . 1 . . . A 82 PRO CB . 25484 1
903 . 1 1 82 82 PRO CG C 13 27.250 0.04 . 1 . . . A 82 PRO CG . 25484 1
904 . 1 1 82 82 PRO CD C 13 49.950 0.04 . 1 . . . A 82 PRO CD . 25484 1
905 . 1 1 83 83 PHE HA H 1 4.160 0.04 . 1 . . . A 83 PHE HA . 25484 1
906 . 1 1 83 83 PHE HB2 H 1 3.290 0.04 . 2 . . . A 83 PHE HB2 . 25484 1
907 . 1 1 83 83 PHE HB3 H 1 3.290 0.04 . 2 . . . A 83 PHE HB3 . 25484 1
908 . 1 1 83 83 PHE CA C 13 58.950 0.04 . 1 . . . A 83 PHE CA . 25484 1
909 . 1 1 83 83 PHE CB C 13 38.250 0.04 . 1 . . . A 83 PHE CB . 25484 1
910 . 1 1 84 84 CYS HA H 1 4.597 0.04 . 1 . . . A 84 CYS HA . 25484 1
911 . 1 1 84 84 CYS HB2 H 1 2.600 0.04 . 1 . . . A 84 CYS HB2 . 25484 1
912 . 1 1 84 84 CYS HB3 H 1 2.740 0.04 . 1 . . . A 84 CYS HB3 . 25484 1
913 . 1 1 84 84 CYS CA C 13 56.750 0.04 . 1 . . . A 84 CYS CA . 25484 1
914 . 1 1 84 84 CYS CB C 13 30.150 0.04 . 1 . . . A 84 CYS CB . 25484 1
915 . 1 1 85 85 LEU H H 1 8.220 0.04 . 1 . . . A 85 LEU H . 25484 1
916 . 1 1 85 85 LEU HA H 1 3.958 0.04 . 1 . . . A 85 LEU HA . 25484 1
917 . 1 1 85 85 LEU HB2 H 1 1.577 0.04 . 1 . . . A 85 LEU HB2 . 25484 1
918 . 1 1 85 85 LEU HB3 H 1 1.928 0.04 . 1 . . . A 85 LEU HB3 . 25484 1
919 . 1 1 85 85 LEU HG H 1 1.203 0.04 . 1 . . . A 85 LEU HG . 25484 1
920 . 1 1 85 85 LEU HD11 H 1 0.875 0.04 . 1 . . . A 85 LEU HD11 . 25484 1
921 . 1 1 85 85 LEU HD12 H 1 0.875 0.04 . 1 . . . A 85 LEU HD12 . 25484 1
922 . 1 1 85 85 LEU HD13 H 1 0.875 0.04 . 1 . . . A 85 LEU HD13 . 25484 1
923 . 1 1 85 85 LEU HD21 H 1 0.875 0.04 . 1 . . . A 85 LEU HD21 . 25484 1
924 . 1 1 85 85 LEU HD22 H 1 0.875 0.04 . 1 . . . A 85 LEU HD22 . 25484 1
925 . 1 1 85 85 LEU HD23 H 1 0.875 0.04 . 1 . . . A 85 LEU HD23 . 25484 1
926 . 1 1 85 85 LEU CA C 13 59.350 0.04 . 1 . . . A 85 LEU CA . 25484 1
927 . 1 1 85 85 LEU CB C 13 38.180 0.04 . 1 . . . A 85 LEU CB . 25484 1
928 . 1 1 85 85 LEU CG C 13 28.270 0.04 . 1 . . . A 85 LEU CG . 25484 1
929 . 1 1 85 85 LEU CD1 C 13 25.350 0.04 . 1 . . . A 85 LEU CD1 . 25484 1
930 . 1 1 85 85 LEU CD2 C 13 24.550 0.04 . 1 . . . A 85 LEU CD2 . 25484 1
931 . 1 1 85 85 LEU N N 15 119.930 0.04 . 1 . . . A 85 LEU N . 25484 1
932 . 1 1 86 86 ASN H H 1 7.789 0.04 . 1 . . . A 86 ASN H . 25484 1
933 . 1 1 86 86 ASN HA H 1 4.580 0.04 . 1 . . . A 86 ASN HA . 25484 1
934 . 1 1 86 86 ASN HB2 H 1 2.855 0.04 . 1 . . . A 86 ASN HB2 . 25484 1
935 . 1 1 86 86 ASN HB3 H 1 3.035 0.04 . 1 . . . A 86 ASN HB3 . 25484 1
936 . 1 1 86 86 ASN CA C 13 51.860 0.04 . 1 . . . A 86 ASN CA . 25484 1
937 . 1 1 86 86 ASN CB C 13 38.610 0.04 . 1 . . . A 86 ASN CB . 25484 1
938 . 1 1 86 86 ASN N N 15 115.750 0.04 . 1 . . . A 86 ASN N . 25484 1
939 . 1 1 87 87 ILE H H 1 7.160 0.04 . 1 . . . A 87 ILE H . 25484 1
940 . 1 1 87 87 ILE HA H 1 4.220 0.04 . 1 . . . A 87 ILE HA . 25484 1
941 . 1 1 87 87 ILE HB H 1 1.830 0.04 . 1 . . . A 87 ILE HB . 25484 1
942 . 1 1 87 87 ILE HG12 H 1 1.520 0.04 . 1 . . . A 87 ILE HG12 . 25484 1
943 . 1 1 87 87 ILE HG13 H 1 1.520 0.04 . 1 . . . A 87 ILE HG13 . 25484 1
944 . 1 1 87 87 ILE HG21 H 1 0.996 0.04 . 1 . . . A 87 ILE HG21 . 25484 1
945 . 1 1 87 87 ILE HG22 H 1 0.996 0.04 . 1 . . . A 87 ILE HG22 . 25484 1
946 . 1 1 87 87 ILE HG23 H 1 0.996 0.04 . 1 . . . A 87 ILE HG23 . 25484 1
947 . 1 1 87 87 ILE HD11 H 1 0.670 0.04 . 1 . . . A 87 ILE HD11 . 25484 1
948 . 1 1 87 87 ILE HD12 H 1 0.670 0.04 . 1 . . . A 87 ILE HD12 . 25484 1
949 . 1 1 87 87 ILE HD13 H 1 0.670 0.04 . 1 . . . A 87 ILE HD13 . 25484 1
950 . 1 1 87 87 ILE CA C 13 61.850 0.04 . 1 . . . A 87 ILE CA . 25484 1
951 . 1 1 87 87 ILE CB C 13 41.330 0.04 . 1 . . . A 87 ILE CB . 25484 1
952 . 1 1 87 87 ILE N N 15 123.260 0.04 . 1 . . . A 87 ILE N . 25484 1
953 . 1 1 88 88 LYS HA H 1 4.450 0.04 . 1 . . . A 88 LYS HA . 25484 1
954 . 1 1 88 88 LYS HB2 H 1 1.960 0.04 . 1 . . . A 88 LYS HB2 . 25484 1
955 . 1 1 88 88 LYS HB3 H 1 1.960 0.04 . 1 . . . A 88 LYS HB3 . 25484 1
956 . 1 1 88 88 LYS HG2 H 1 1.384 0.04 . 1 . . . A 88 LYS HG2 . 25484 1
957 . 1 1 88 88 LYS HG3 H 1 1.446 0.04 . 1 . . . A 88 LYS HG3 . 25484 1
958 . 1 1 88 88 LYS HD2 H 1 1.750 0.04 . 1 . . . A 88 LYS HD2 . 25484 1
959 . 1 1 88 88 LYS HD3 H 1 1.750 0.04 . 1 . . . A 88 LYS HD3 . 25484 1
960 . 1 1 88 88 LYS HE2 H 1 3.040 0.04 . 1 . . . A 88 LYS HE2 . 25484 1
961 . 1 1 88 88 LYS HE3 H 1 3.040 0.04 . 1 . . . A 88 LYS HE3 . 25484 1
962 . 1 1 88 88 LYS CA C 13 54.530 0.04 . 1 . . . A 88 LYS CA . 25484 1
963 . 1 1 88 88 LYS CB C 13 31.450 0.04 . 1 . . . A 88 LYS CB . 25484 1
964 . 1 1 88 88 LYS CG C 13 24.380 0.04 . 1 . . . A 88 LYS CG . 25484 1
965 . 1 1 88 88 LYS CD C 13 28.950 0.04 . 1 . . . A 88 LYS CD . 25484 1
966 . 1 1 88 88 LYS CE C 13 42.050 0.04 . 1 . . . A 88 LYS CE . 25484 1
967 . 1 1 89 89 GLN HA H 1 4.450 0.04 . 1 . . . A 89 GLN HA . 25484 1
968 . 1 1 89 89 GLN HB2 H 1 2.040 0.04 . 1 . . . A 89 GLN HB2 . 25484 1
969 . 1 1 89 89 GLN HB3 H 1 2.140 0.04 . 1 . . . A 89 GLN HB3 . 25484 1
970 . 1 1 89 89 GLN HG2 H 1 2.410 0.04 . 2 . . . A 89 GLN HG2 . 25484 1
971 . 1 1 89 89 GLN HG3 H 1 2.410 0.04 . 2 . . . A 89 GLN HG3 . 25484 1
972 . 1 1 89 89 GLN CA C 13 56.210 0.04 . 1 . . . A 89 GLN CA . 25484 1
973 . 1 1 89 89 GLN CB C 13 29.250 0.04 . 1 . . . A 89 GLN CB . 25484 1
974 . 1 1 89 89 GLN CG C 13 33.950 0.04 . 1 . . . A 89 GLN CG . 25484 1
975 . 1 1 90 90 LYS H H 1 7.750 0.04 . 1 . . . A 90 LYS H . 25484 1
976 . 1 1 90 90 LYS HA H 1 4.180 0.04 . 1 . . . A 90 LYS HA . 25484 1
977 . 1 1 90 90 LYS HB2 H 1 1.784 0.04 . 1 . . . A 90 LYS HB2 . 25484 1
978 . 1 1 90 90 LYS HB3 H 1 1.884 0.04 . 1 . . . A 90 LYS HB3 . 25484 1
979 . 1 1 90 90 LYS HG2 H 1 1.480 0.04 . 1 . . . A 90 LYS HG2 . 25484 1
980 . 1 1 90 90 LYS HG3 H 1 1.480 0.04 . 1 . . . A 90 LYS HG3 . 25484 1
981 . 1 1 90 90 LYS HD2 H 1 1.720 0.04 . 1 . . . A 90 LYS HD2 . 25484 1
982 . 1 1 90 90 LYS HD3 H 1 1.720 0.04 . 1 . . . A 90 LYS HD3 . 25484 1
983 . 1 1 90 90 LYS HE2 H 1 3.050 0.04 . 1 . . . A 90 LYS HE2 . 25484 1
984 . 1 1 90 90 LYS HE3 H 1 3.050 0.04 . 1 . . . A 90 LYS HE3 . 25484 1
985 . 1 1 90 90 LYS CA C 13 58.040 0.04 . 1 . . . A 90 LYS CA . 25484 1
986 . 1 1 90 90 LYS CB C 13 33.370 0.04 . 1 . . . A 90 LYS CB . 25484 1
987 . 1 1 90 90 LYS CG C 13 25.350 0.04 . 1 . . . A 90 LYS CG . 25484 1
988 . 1 1 90 90 LYS CD C 13 29.150 0.04 . 1 . . . A 90 LYS CD . 25484 1
989 . 1 1 90 90 LYS CE C 13 42.150 0.04 . 1 . . . A 90 LYS CE . 25484 1
990 . 1 1 90 90 LYS N N 15 127.480 0.04 . 1 . . . A 90 LYS N . 25484 1
stop_
save_
###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chem_shift_list_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2
_Assigned_chem_shift_list.Entry_ID 25484
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
13 '2D 1H-15N HSQC' . . . 25484 2
14 '3D CBCA(CO)NH' . . . 25484 2
15 '3D HNCACB' . . . 25484 2
16 '3D HNCA' . . . 25484 2
17 '3D HNCO' . . . 25484 2
18 '3D HN(CA)CO' . . . 25484 2
19 '3D H(CCO)NH' . . . 25484 2
20 '3D HCCH-TOCSY' . . . 25484 2
24 '3D HBHA(CO)NH' . . . 25484 2
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 2 2 1 1 LEU H H 1 7.752 . . . . . . B 1 LEU H1 . 25484 2
2 . 2 2 1 1 LEU HA H 1 4.713 . . . . . . B 1 LEU HA . 25484 2
3 . 2 2 1 1 LEU HB2 H 1 1.645 . . . . . . B 1 LEU HB2 . 25484 2
4 . 2 2 1 1 LEU HB3 H 1 1.645 . . . . . . B 1 LEU HB3 . 25484 2
5 . 2 2 1 1 LEU HG H 1 1.746 . . . . . . B 1 LEU HG . 25484 2
6 . 2 2 1 1 LEU HD11 H 1 0.995 . . . . . . B 1 LEU HD11 . 25484 2
7 . 2 2 1 1 LEU HD12 H 1 0.995 . . . . . . B 1 LEU HD12 . 25484 2
8 . 2 2 1 1 LEU HD13 H 1 0.995 . . . . . . B 1 LEU HD13 . 25484 2
9 . 2 2 1 1 LEU HD21 H 1 0.983 . . . . . . B 1 LEU HD21 . 25484 2
10 . 2 2 1 1 LEU HD22 H 1 0.983 . . . . . . B 1 LEU HD22 . 25484 2
11 . 2 2 1 1 LEU HD23 H 1 0.983 . . . . . . B 1 LEU HD23 . 25484 2
12 . 2 2 1 1 LEU CA C 13 53.010 . . . . . . B 1 LEU CA . 25484 2
13 . 2 2 1 1 LEU CB C 13 41.880 . . . . . . B 1 LEU CB . 25484 2
14 . 2 2 1 1 LEU CG C 13 27.150 . . . . . . B 1 LEU CG . 25484 2
15 . 2 2 1 1 LEU CD1 C 13 24.950 . . . . . . B 1 LEU CD1 . 25484 2
16 . 2 2 1 1 LEU CD2 C 13 23.350 . . . . . . B 1 LEU CD2 . 25484 2
17 . 2 2 1 1 LEU N N 15 120.830 . . . . . . B 1 LEU N . 25484 2
18 . 2 2 2 2 PRO HA H 1 4.520 . . . . . . B 2 PRO HA . 25484 2
19 . 2 2 2 2 PRO HB2 H 1 2.250 . . . . . . B 2 PRO HB2 . 25484 2
20 . 2 2 2 2 PRO HB3 H 1 2.385 . . . . . . B 2 PRO HB3 . 25484 2
21 . 2 2 2 2 PRO HG2 H 1 2.050 . . . . . . B 2 PRO HG2 . 25484 2
22 . 2 2 2 2 PRO HG3 H 1 2.120 . . . . . . B 2 PRO HG3 . 25484 2
23 . 2 2 2 2 PRO HD2 H 1 3.725 . . . . . . B 2 PRO HD2 . 25484 2
24 . 2 2 2 2 PRO HD3 H 1 3.924 . . . . . . B 2 PRO HD3 . 25484 2
25 . 2 2 2 2 PRO C C 13 176.940 . . . . . . B 2 PRO C . 25484 2
26 . 2 2 2 2 PRO CA C 13 63.580 . . . . . . B 2 PRO CA . 25484 2
27 . 2 2 2 2 PRO CB C 13 31.850 . . . . . . B 2 PRO CB . 25484 2
28 . 2 2 2 2 PRO CG C 13 27.150 . . . . . . B 2 PRO CG . 25484 2
29 . 2 2 2 2 PRO CD C 13 50.350 . . . . . . B 2 PRO CD . 25484 2
30 . 2 2 3 3 SER H H 1 8.310 . . . . . . B 3 SER H . 25484 2
31 . 2 2 3 3 SER HA H 1 4.440 . . . . . . B 3 SER HA . 25484 2
32 . 2 2 3 3 SER HB2 H 1 3.959 . . . . . . B 3 SER HB2 . 25484 2
33 . 2 2 3 3 SER HB3 H 1 3.959 . . . . . . B 3 SER HB3 . 25484 2
34 . 2 2 3 3 SER C C 13 174.990 . . . . . . B 3 SER C . 25484 2
35 . 2 2 3 3 SER CA C 13 58.490 . . . . . . B 3 SER CA . 25484 2
36 . 2 2 3 3 SER CB C 13 63.590 . . . . . . B 3 SER CB . 25484 2
37 . 2 2 3 3 SER N N 15 115.350 . . . . . . B 3 SER N . 25484 2
38 . 2 2 4 4 GLN H H 1 8.356 . . . . . . B 4 GLN H . 25484 2
39 . 2 2 4 4 GLN HA H 1 4.440 . . . . . . B 4 GLN HA . 25484 2
40 . 2 2 4 4 GLN HB2 H 1 2.058 . . . . . . B 4 GLN HB2 . 25484 2
41 . 2 2 4 4 GLN HB3 H 1 2.153 . . . . . . B 4 GLN HB3 . 25484 2
42 . 2 2 4 4 GLN HG2 H 1 2.434 . . . . . . B 4 GLN HG2 . 25484 2
43 . 2 2 4 4 GLN HG3 H 1 2.434 . . . . . . B 4 GLN HG3 . 25484 2
44 . 2 2 4 4 GLN HE21 H 1 7.579 . . . . . . B 4 GLN HE21 . 25484 2
45 . 2 2 4 4 GLN HE22 H 1 6.860 . . . . . . B 4 GLN HE22 . 25484 2
46 . 2 2 4 4 GLN C C 13 175.950 . . . . . . B 4 GLN C . 25484 2
47 . 2 2 4 4 GLN CA C 13 55.850 . . . . . . B 4 GLN CA . 25484 2
48 . 2 2 4 4 GLN CB C 13 29.010 . . . . . . B 4 GLN CB . 25484 2
49 . 2 2 4 4 GLN CG C 13 34.350 . . . . . . B 4 GLN CG . 25484 2
50 . 2 2 4 4 GLN N N 15 121.810 . . . . . . B 4 GLN N . 25484 2
51 . 2 2 4 4 GLN NE2 N 15 112.200 . . . . . . B 4 GLN NE2 . 25484 2
52 . 2 2 5 5 ALA H H 1 8.240 . . . . . . B 5 ALA H . 25484 2
53 . 2 2 5 5 ALA HA H 1 4.239 . . . . . . B 5 ALA HA . 25484 2
54 . 2 2 5 5 ALA HB1 H 1 1.465 . . . . . . B 5 ALA HB1 . 25484 2
55 . 2 2 5 5 ALA HB2 H 1 1.465 . . . . . . B 5 ALA HB2 . 25484 2
56 . 2 2 5 5 ALA HB3 H 1 1.465 . . . . . . B 5 ALA HB3 . 25484 2
57 . 2 2 5 5 ALA C C 13 178.140 . . . . . . B 5 ALA C . 25484 2
58 . 2 2 5 5 ALA CA C 13 52.880 . . . . . . B 5 ALA CA . 25484 2
59 . 2 2 5 5 ALA CB C 13 18.850 . . . . . . B 5 ALA CB . 25484 2
60 . 2 2 5 5 ALA N N 15 124.430 . . . . . . B 5 ALA N . 25484 2
61 . 2 2 6 6 MET H H 1 8.268 . . . . . . B 6 MET H . 25484 2
62 . 2 2 6 6 MET HA H 1 4.483 . . . . . . B 6 MET HA . 25484 2
63 . 2 2 6 6 MET HB2 H 1 2.087 . . . . . . B 6 MET HB2 . 25484 2
64 . 2 2 6 6 MET HB3 H 1 2.087 . . . . . . B 6 MET HB3 . 25484 2
65 . 2 2 6 6 MET HG2 H 1 2.615 . . . . . . B 6 MET HG2 . 25484 2
66 . 2 2 6 6 MET HG3 H 1 2.615 . . . . . . B 6 MET HG3 . 25484 2
67 . 2 2 6 6 MET C C 13 176.480 . . . . . . B 6 MET C . 25484 2
68 . 2 2 6 6 MET CA C 13 55.650 . . . . . . B 6 MET CA . 25484 2
69 . 2 2 6 6 MET CB C 13 32.580 . . . . . . B 6 MET CB . 25484 2
70 . 2 2 6 6 MET CG C 13 32.160 . . . . . . B 6 MET CG . 25484 2
71 . 2 2 6 6 MET N N 15 118.630 . . . . . . B 6 MET N . 25484 2
72 . 2 2 7 7 ASP H H 1 8.205 . . . . . . B 7 ASP H . 25484 2
73 . 2 2 7 7 ASP HA H 1 4.505 . . . . . . B 7 ASP HA . 25484 2
74 . 2 2 7 7 ASP HB2 H 1 2.695 . . . . . . B 7 ASP HB2 . 25484 2
75 . 2 2 7 7 ASP HB3 H 1 2.695 . . . . . . B 7 ASP HB3 . 25484 2
76 . 2 2 7 7 ASP C C 13 176.550 . . . . . . B 7 ASP C . 25484 2
77 . 2 2 7 7 ASP CA C 13 55.230 . . . . . . B 7 ASP CA . 25484 2
78 . 2 2 7 7 ASP CB C 13 41.150 . . . . . . B 7 ASP CB . 25484 2
79 . 2 2 7 7 ASP N N 15 120.450 . . . . . . B 7 ASP N . 25484 2
80 . 2 2 8 8 ASP H H 1 8.210 . . . . . . B 8 ASP H . 25484 2
81 . 2 2 8 8 ASP HA H 1 4.590 . . . . . . B 8 ASP HA . 25484 2
82 . 2 2 8 8 ASP HB2 H 1 2.719 . . . . . . B 8 ASP HB2 . 25484 2
83 . 2 2 8 8 ASP HB3 H 1 2.719 . . . . . . B 8 ASP HB3 . 25484 2
84 . 2 2 8 8 ASP C C 13 176.580 . . . . . . B 8 ASP C . 25484 2
85 . 2 2 8 8 ASP CA C 13 54.650 . . . . . . B 8 ASP CA . 25484 2
86 . 2 2 8 8 ASP CB C 13 40.950 . . . . . . B 8 ASP CB . 25484 2
87 . 2 2 8 8 ASP N N 15 119.550 . . . . . . B 8 ASP N . 25484 2
88 . 2 2 9 9 LEU H H 1 8.001 . . . . . . B 9 LEU H . 25484 2
89 . 2 2 9 9 LEU HA H 1 4.305 . . . . . . B 9 LEU HA . 25484 2
90 . 2 2 9 9 LEU HB2 H 1 1.688 . . . . . . B 9 LEU HB2 . 25484 2
91 . 2 2 9 9 LEU HB3 H 1 1.688 . . . . . . B 9 LEU HB3 . 25484 2
92 . 2 2 9 9 LEU HG H 1 1.665 . . . . . . B 9 LEU HG . 25484 2
93 . 2 2 9 9 LEU HD11 H 1 0.934 . . . . . . B 9 LEU HD11 . 25484 2
94 . 2 2 9 9 LEU HD12 H 1 0.934 . . . . . . B 9 LEU HD12 . 25484 2
95 . 2 2 9 9 LEU HD13 H 1 0.934 . . . . . . B 9 LEU HD13 . 25484 2
96 . 2 2 9 9 LEU HD21 H 1 0.875 . . . . . . B 9 LEU HD21 . 25484 2
97 . 2 2 9 9 LEU HD22 H 1 0.875 . . . . . . B 9 LEU HD22 . 25484 2
98 . 2 2 9 9 LEU HD23 H 1 0.875 . . . . . . B 9 LEU HD23 . 25484 2
99 . 2 2 9 9 LEU C C 13 176.950 . . . . . . B 9 LEU C . 25484 2
100 . 2 2 9 9 LEU CA C 13 55.390 . . . . . . B 9 LEU CA . 25484 2
101 . 2 2 9 9 LEU CB C 13 42.390 . . . . . . B 9 LEU CB . 25484 2
102 . 2 2 9 9 LEU CG C 13 27.550 . . . . . . B 9 LEU CG . 25484 2
103 . 2 2 9 9 LEU CD1 C 13 25.520 . . . . . . B 9 LEU CD1 . 25484 2
104 . 2 2 9 9 LEU N N 15 120.800 . . . . . . B 9 LEU N . 25484 2
105 . 2 2 10 10 MET H H 1 8.088 . . . . . . B 10 MET H . 25484 2
106 . 2 2 10 10 MET HA H 1 4.485 . . . . . . B 10 MET HA . 25484 2
107 . 2 2 10 10 MET HB2 H 1 2.095 . . . . . . B 10 MET HB2 . 25484 2
108 . 2 2 10 10 MET HB3 H 1 2.095 . . . . . . B 10 MET HB3 . 25484 2
109 . 2 2 10 10 MET HG2 H 1 2.575 . . . . . . B 10 MET HG2 . 25484 2
110 . 2 2 10 10 MET HG3 H 1 2.615 . . . . . . B 10 MET HG3 . 25484 2
111 . 2 2 10 10 MET C C 13 176.050 . . . . . . B 10 MET C . 25484 2
112 . 2 2 10 10 MET CA C 13 55.400 . . . . . . B 10 MET CA . 25484 2
113 . 2 2 10 10 MET CB C 13 32.140 . . . . . . B 10 MET CB . 25484 2
114 . 2 2 10 10 MET CG C 13 32.140 . . . . . . B 10 MET CG . 25484 2
115 . 2 2 10 10 MET N N 15 118.720 . . . . . . B 10 MET N . 25484 2
116 . 2 2 11 11 LEU H H 1 7.950 . . . . . . B 11 LEU H . 25484 2
117 . 2 2 11 11 LEU HA H 1 4.453 . . . . . . B 11 LEU HA . 25484 2
118 . 2 2 11 11 LEU HB2 H 1 1.575 . . . . . . B 11 LEU HB2 . 25484 2
119 . 2 2 11 11 LEU HB3 H 1 1.625 . . . . . . B 11 LEU HB3 . 25484 2
120 . 2 2 11 11 LEU HG H 1 1.626 . . . . . . B 11 LEU HG . 25484 2
121 . 2 2 11 11 LEU HD11 H 1 0.881 . . . . . . B 11 LEU HD11 . 25484 2
122 . 2 2 11 11 LEU HD12 H 1 0.881 . . . . . . B 11 LEU HD12 . 25484 2
123 . 2 2 11 11 LEU HD13 H 1 0.881 . . . . . . B 11 LEU HD13 . 25484 2
124 . 2 2 11 11 LEU HD21 H 1 0.883 . . . . . . B 11 LEU HD21 . 25484 2
125 . 2 2 11 11 LEU HD22 H 1 0.883 . . . . . . B 11 LEU HD22 . 25484 2
126 . 2 2 11 11 LEU HD23 H 1 0.883 . . . . . . B 11 LEU HD23 . 25484 2
127 . 2 2 11 11 LEU C C 13 177.570 . . . . . . B 11 LEU C . 25484 2
128 . 2 2 11 11 LEU CA C 13 54.680 . . . . . . B 11 LEU CA . 25484 2
129 . 2 2 11 11 LEU CB C 13 42.880 . . . . . . B 11 LEU CB . 25484 2
130 . 2 2 11 11 LEU CG C 13 27.450 . . . . . . B 11 LEU CG . 25484 2
131 . 2 2 11 11 LEU CD1 C 13 25.250 . . . . . . B 11 LEU CD1 . 25484 2
132 . 2 2 11 11 LEU CD2 C 13 23.650 . . . . . . B 11 LEU CD2 . 25484 2
133 . 2 2 11 11 LEU N N 15 121.830 . . . . . . B 11 LEU N . 25484 2
134 . 2 2 12 12 SER H H 1 8.590 . . . . . . B 12 SER H . 25484 2
135 . 2 2 12 12 SER HA H 1 4.875 . . . . . . B 12 SER HA . 25484 2
136 . 2 2 12 12 SER HB2 H 1 3.915 . . . . . . B 12 SER HB2 . 25484 2
137 . 2 2 12 12 SER HB3 H 1 4.035 . . . . . . B 12 SER HB3 . 25484 2
138 . 2 2 12 12 SER CA C 13 55.550 . . . . . . B 12 SER CA . 25484 2
139 . 2 2 12 12 SER CB C 13 63.680 . . . . . . B 12 SER CB . 25484 2
140 . 2 2 12 12 SER N N 15 117.880 . . . . . . B 12 SER N . 25484 2
141 . 2 2 13 13 PRO HA H 1 4.345 . . . . . . B 13 PRO HA . 25484 2
142 . 2 2 13 13 PRO HB2 H 1 2.024 . . . . . . B 13 PRO HB2 . 25484 2
143 . 2 2 13 13 PRO HB3 H 1 2.297 . . . . . . B 13 PRO HB3 . 25484 2
144 . 2 2 13 13 PRO HG2 H 1 1.994 . . . . . . B 13 PRO HG2 . 25484 2
145 . 2 2 13 13 PRO HG3 H 1 2.108 . . . . . . B 13 PRO HG3 . 25484 2
146 . 2 2 13 13 PRO HD2 H 1 3.870 . . . . . . B 13 PRO HD2 . 25484 2
147 . 2 2 13 13 PRO HD3 H 1 3.870 . . . . . . B 13 PRO HD3 . 25484 2
148 . 2 2 13 13 PRO C C 13 177.390 . . . . . . B 13 PRO C . 25484 2
149 . 2 2 13 13 PRO CA C 13 64.450 . . . . . . B 13 PRO CA . 25484 2
150 . 2 2 13 13 PRO CB C 13 31.760 . . . . . . B 13 PRO CB . 25484 2
151 . 2 2 13 13 PRO CG C 13 27.450 . . . . . . B 13 PRO CG . 25484 2
152 . 2 2 13 13 PRO CD C 13 50.250 . . . . . . B 13 PRO CD . 25484 2
153 . 2 2 14 14 ASP H H 1 8.101 . . . . . . B 14 ASP H . 25484 2
154 . 2 2 14 14 ASP HA H 1 4.480 . . . . . . B 14 ASP HA . 25484 2
155 . 2 2 14 14 ASP HB2 H 1 2.550 . . . . . . B 14 ASP HB2 . 25484 2
156 . 2 2 14 14 ASP HB3 H 1 2.700 . . . . . . B 14 ASP HB3 . 25484 2
157 . 2 2 14 14 ASP C C 13 177.110 . . . . . . B 14 ASP C . 25484 2
158 . 2 2 14 14 ASP CA C 13 55.390 . . . . . . B 14 ASP CA . 25484 2
159 . 2 2 14 14 ASP CB C 13 40.950 . . . . . . B 14 ASP CB . 25484 2
160 . 2 2 14 14 ASP N N 15 117.110 . . . . . . B 14 ASP N . 25484 2
161 . 2 2 15 15 ASP H H 1 7.862 . . . . . . B 15 ASP H . 25484 2
162 . 2 2 15 15 ASP HA H 1 4.502 . . . . . . B 15 ASP HA . 25484 2
163 . 2 2 15 15 ASP HB2 H 1 2.700 . . . . . . B 15 ASP HB2 . 25484 2
164 . 2 2 15 15 ASP HB3 H 1 2.700 . . . . . . B 15 ASP HB3 . 25484 2
165 . 2 2 15 15 ASP C C 13 177.230 . . . . . . B 15 ASP C . 25484 2
166 . 2 2 15 15 ASP CA C 13 55.390 . . . . . . B 15 ASP CA . 25484 2
167 . 2 2 15 15 ASP CB C 13 41.120 . . . . . . B 15 ASP CB . 25484 2
168 . 2 2 15 15 ASP N N 15 119.620 . . . . . . B 15 ASP N . 25484 2
169 . 2 2 16 16 ILE H H 1 7.620 . . . . . . B 16 ILE H . 25484 2
170 . 2 2 16 16 ILE HA H 1 3.380 . . . . . . B 16 ILE HA . 25484 2
171 . 2 2 16 16 ILE HB H 1 1.739 . . . . . . B 16 ILE HB . 25484 2
172 . 2 2 16 16 ILE HG12 H 1 1.349 . . . . . . B 16 ILE HG12 . 25484 2
173 . 2 2 16 16 ILE HG13 H 1 0.970 . . . . . . B 16 ILE HG13 . 25484 2
174 . 2 2 16 16 ILE HG21 H 1 0.760 . . . . . . B 16 ILE HG21 . 25484 2
175 . 2 2 16 16 ILE HG22 H 1 0.760 . . . . . . B 16 ILE HG22 . 25484 2
176 . 2 2 16 16 ILE HG23 H 1 0.760 . . . . . . B 16 ILE HG23 . 25484 2
177 . 2 2 16 16 ILE HD11 H 1 0.748 . . . . . . B 16 ILE HD11 . 25484 2
178 . 2 2 16 16 ILE HD12 H 1 0.748 . . . . . . B 16 ILE HD12 . 25484 2
179 . 2 2 16 16 ILE HD13 H 1 0.748 . . . . . . B 16 ILE HD13 . 25484 2
180 . 2 2 16 16 ILE C C 13 176.950 . . . . . . B 16 ILE C . 25484 2
181 . 2 2 16 16 ILE CA C 13 62.740 . . . . . . B 16 ILE CA . 25484 2
182 . 2 2 16 16 ILE CB C 13 37.880 . . . . . . B 16 ILE CB . 25484 2
183 . 2 2 16 16 ILE CG1 C 13 28.390 . . . . . . B 16 ILE CG1 . 25484 2
184 . 2 2 16 16 ILE CG2 C 13 17.570 . . . . . . B 16 ILE CG2 . 25484 2
185 . 2 2 16 16 ILE CD1 C 13 13.810 . . . . . . B 16 ILE CD1 . 25484 2
186 . 2 2 16 16 ILE N N 15 119.210 . . . . . . B 16 ILE N . 25484 2
187 . 2 2 17 17 GLU H H 1 8.065 . . . . . . B 17 GLU H . 25484 2
188 . 2 2 17 17 GLU HA H 1 4.049 . . . . . . B 17 GLU HA . 25484 2
189 . 2 2 17 17 GLU HB2 H 1 2.038 . . . . . . B 17 GLU HB2 . 25484 2
190 . 2 2 17 17 GLU HB3 H 1 2.038 . . . . . . B 17 GLU HB3 . 25484 2
191 . 2 2 17 17 GLU HG2 H 1 2.287 . . . . . . B 17 GLU HG2 . 25484 2
192 . 2 2 17 17 GLU HG3 H 1 2.320 . . . . . . B 17 GLU HG3 . 25484 2
193 . 2 2 17 17 GLU C C 13 178.190 . . . . . . B 17 GLU C . 25484 2
194 . 2 2 17 17 GLU CA C 13 58.450 . . . . . . B 17 GLU CA . 25484 2
195 . 2 2 17 17 GLU CB C 13 29.480 . . . . . . B 17 GLU CB . 25484 2
196 . 2 2 17 17 GLU CG C 13 36.550 . . . . . . B 17 GLU CG . 25484 2
197 . 2 2 17 17 GLU N N 15 119.710 . . . . . . B 17 GLU N . 25484 2
198 . 2 2 18 18 GLN H H 1 7.801 . . . . . . B 18 GLN H . 25484 2
199 . 2 2 18 18 GLN HA H 1 4.232 . . . . . . B 18 GLN HA . 25484 2
200 . 2 2 18 18 GLN HB2 H 1 2.150 . . . . . . B 18 GLN HB2 . 25484 2
201 . 2 2 18 18 GLN HB3 H 1 2.150 . . . . . . B 18 GLN HB3 . 25484 2
202 . 2 2 18 18 GLN HG2 H 1 2.320 . . . . . . B 18 GLN HG2 . 25484 2
203 . 2 2 18 18 GLN HG3 H 1 2.320 . . . . . . B 18 GLN HG3 . 25484 2
204 . 2 2 18 18 GLN HE21 H 1 7.470 . . . . . . B 18 GLN HE21 . 25484 2
205 . 2 2 18 18 GLN HE22 H 1 6.770 . . . . . . B 18 GLN HE22 . 25484 2
206 . 2 2 18 18 GLN C C 13 177.110 . . . . . . B 18 GLN C . 25484 2
207 . 2 2 18 18 GLN CA C 13 56.920 . . . . . . B 18 GLN CA . 25484 2
208 . 2 2 18 18 GLN CB C 13 28.640 . . . . . . B 18 GLN CB . 25484 2
209 . 2 2 18 18 GLN CG C 13 34.050 . . . . . . B 18 GLN CG . 25484 2
210 . 2 2 18 18 GLN N N 15 116.780 . . . . . . B 18 GLN N . 25484 2
211 . 2 2 18 18 GLN NE2 N 15 111.960 . . . . . . B 18 GLN NE2 . 25484 2
212 . 2 2 19 19 TRP H H 1 7.865 . . . . . . B 19 TRP H . 25484 2
213 . 2 2 19 19 TRP HA H 1 4.526 . . . . . . B 19 TRP HA . 25484 2
214 . 2 2 19 19 TRP HB2 H 1 2.874 . . . . . . B 19 TRP HB2 . 25484 2
215 . 2 2 19 19 TRP HB3 H 1 3.051 . . . . . . B 19 TRP HB3 . 25484 2
216 . 2 2 19 19 TRP HD1 H 1 7.370 . . . . . . B 19 TRP HD1 . 25484 2
217 . 2 2 19 19 TRP HE1 H 1 10.020 . . . . . . B 19 TRP HE1 . 25484 2
218 . 2 2 19 19 TRP C C 13 176.820 . . . . . . B 19 TRP C . 25484 2
219 . 2 2 19 19 TRP CA C 13 57.750 . . . . . . B 19 TRP CA . 25484 2
220 . 2 2 19 19 TRP CB C 13 29.280 . . . . . . B 19 TRP CB . 25484 2
221 . 2 2 19 19 TRP N N 15 119.620 . . . . . . B 19 TRP N . 25484 2
222 . 2 2 19 19 TRP NE1 N 15 128.220 . . . . . . B 19 TRP NE1 . 25484 2
223 . 2 2 20 20 PHE H H 1 7.943 . . . . . . B 20 PHE H . 25484 2
224 . 2 2 20 20 PHE HA H 1 4.726 . . . . . . B 20 PHE HA . 25484 2
225 . 2 2 20 20 PHE HB2 H 1 3.032 . . . . . . B 20 PHE HB2 . 25484 2
226 . 2 2 20 20 PHE HB3 H 1 3.295 . . . . . . B 20 PHE HB3 . 25484 2
227 . 2 2 20 20 PHE HD1 H 1 7.320 . . . . . . B 20 PHE HD1 . 25484 2
228 . 2 2 20 20 PHE HD2 H 1 7.320 . . . . . . B 20 PHE HD2 . 25484 2
229 . 2 2 20 20 PHE HE1 H 1 7.039 . . . . . . B 20 PHE HE1 . 25484 2
230 . 2 2 20 20 PHE HE2 H 1 7.039 . . . . . . B 20 PHE HE2 . 25484 2
231 . 2 2 20 20 PHE C C 13 175.820 . . . . . . B 20 PHE C . 25484 2
232 . 2 2 20 20 PHE CA C 13 57.620 . . . . . . B 20 PHE CA . 25484 2
233 . 2 2 20 20 PHE CB C 13 39.040 . . . . . . B 20 PHE CB . 25484 2
234 . 2 2 20 20 PHE N N 15 116.350 . . . . . . B 20 PHE N . 25484 2
235 . 2 2 21 21 THR H H 1 7.770 . . . . . . B 21 THR H . 25484 2
236 . 2 2 21 21 THR HA H 1 4.404 . . . . . . B 21 THR HA . 25484 2
237 . 2 2 21 21 THR HB H 1 4.299 . . . . . . B 21 THR HB . 25484 2
238 . 2 2 21 21 THR HG21 H 1 1.264 . . . . . . B 21 THR HG21 . 25484 2
239 . 2 2 21 21 THR HG22 H 1 1.264 . . . . . . B 21 THR HG22 . 25484 2
240 . 2 2 21 21 THR HG23 H 1 1.264 . . . . . . B 21 THR HG23 . 25484 2
241 . 2 2 21 21 THR C C 13 174.460 . . . . . . B 21 THR C . 25484 2
242 . 2 2 21 21 THR CA C 13 61.980 . . . . . . B 21 THR CA . 25484 2
243 . 2 2 21 21 THR CB C 13 66.990 . . . . . . B 21 THR CB . 25484 2
244 . 2 2 21 21 THR CG2 C 13 21.950 . . . . . . B 21 THR CG2 . 25484 2
245 . 2 2 21 21 THR N N 15 115.610 . . . . . . B 21 THR N . 25484 2
246 . 2 2 22 22 GLU H H 1 8.278 . . . . . . B 22 GLU H . 25484 2
247 . 2 2 22 22 GLU HA H 1 4.380 . . . . . . B 22 GLU HA . 25484 2
248 . 2 2 22 22 GLU HB2 H 1 1.970 . . . . . . B 22 GLU HB2 . 25484 2
249 . 2 2 22 22 GLU HB3 H 1 2.090 . . . . . . B 22 GLU HB3 . 25484 2
250 . 2 2 22 22 GLU HG2 H 1 2.315 . . . . . . B 22 GLU HG2 . 25484 2
251 . 2 2 22 22 GLU HG3 H 1 2.315 . . . . . . B 22 GLU HG3 . 25484 2
252 . 2 2 22 22 GLU C C 13 175.840 . . . . . . B 22 GLU C . 25484 2
253 . 2 2 22 22 GLU CA C 13 56.150 . . . . . . B 22 GLU CA . 25484 2
254 . 2 2 22 22 GLU CB C 13 30.400 . . . . . . B 22 GLU CB . 25484 2
255 . 2 2 22 22 GLU CG C 13 36.250 . . . . . . B 22 GLU CG . 25484 2
256 . 2 2 22 22 GLU N N 15 122.470 . . . . . . B 22 GLU N . 25484 2
257 . 2 2 23 23 ASP H H 1 8.362 . . . . . . B 23 ASP H . 25484 2
258 . 2 2 23 23 ASP HA H 1 4.920 . . . . . . B 23 ASP HA . 25484 2
259 . 2 2 23 23 ASP HB2 H 1 2.600 . . . . . . B 23 ASP HB2 . 25484 2
260 . 2 2 23 23 ASP HB3 H 1 2.795 . . . . . . B 23 ASP HB3 . 25484 2
261 . 2 2 23 23 ASP CA C 13 52.170 . . . . . . B 23 ASP CA . 25484 2
262 . 2 2 23 23 ASP CB C 13 41.190 . . . . . . B 23 ASP CB . 25484 2
263 . 2 2 23 23 ASP N N 15 122.810 . . . . . . B 23 ASP N . 25484 2
264 . 2 2 24 24 PRO HA H 1 4.490 . . . . . . B 24 PRO HA . 25484 2
265 . 2 2 24 24 PRO HB2 H 1 2.100 . . . . . . B 24 PRO HB2 . 25484 2
266 . 2 2 24 24 PRO HB3 H 1 2.250 . . . . . . B 24 PRO HB3 . 25484 2
267 . 2 2 24 24 PRO HG2 H 1 2.047 . . . . . . B 24 PRO HG2 . 25484 2
268 . 2 2 24 24 PRO HG3 H 1 2.047 . . . . . . B 24 PRO HG3 . 25484 2
269 . 2 2 24 24 PRO HD2 H 1 3.880 . . . . . . B 24 PRO HD2 . 25484 2
270 . 2 2 24 24 PRO HD3 H 1 3.880 . . . . . . B 24 PRO HD3 . 25484 2
271 . 2 2 24 24 PRO C C 13 176.640 . . . . . . B 24 PRO C . 25484 2
272 . 2 2 24 24 PRO CA C 13 63.430 . . . . . . B 24 PRO CA . 25484 2
273 . 2 2 24 24 PRO CB C 13 31.950 . . . . . . B 24 PRO CB . 25484 2
274 . 2 2 24 24 PRO CG C 13 27.450 . . . . . . B 24 PRO CG . 25484 2
275 . 2 2 24 24 PRO CD C 13 50.750 . . . . . . B 24 PRO CD . 25484 2
276 . 2 2 25 25 GLY H H 1 8.064 . . . . . . B 25 GLY H . 25484 2
277 . 2 2 25 25 GLY HA2 H 1 3.765 . . . . . . B 25 GLY HA2 . 25484 2
278 . 2 2 25 25 GLY HA3 H 1 3.825 . . . . . . B 25 GLY HA3 . 25484 2
279 . 2 2 25 25 GLY CA C 13 46.150 . . . . . . B 25 GLY CA . 25484 2
280 . 2 2 25 25 GLY N N 15 115.030 . . . . . . B 25 GLY N . 25484 2
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