###################################
# 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_assignments_hbn
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assignments_hbn
_Assigned_chem_shift_list.Entry_ID 17226
_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 0.03
_Assigned_chem_shift_list.Chem_shift_13C_err 0.3
_Assigned_chem_shift_list.Chem_shift_15N_err 0.3
_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' . . . 17226 1
4 '2D 1H-15N HSQC' . . . 17226 1
5 '3D CBCA(CO)NH' . . . 17226 1
6 '3D C(CO)NH' . . . 17226 1
7 '3D HNCO' . . . 17226 1
8 '3D HNCACB' . . . 17226 1
9 '3D HCCH-TOCSY' . . . 17226 1
10 '3D H(CCO)NH' . . . 17226 1
11 '3D HNHB' . . . 17226 1
12 '3D 1H-13C NOESY' . . . 17226 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 3 3 LEU HA H 1 4.319 0.03 . 1 . . . . 3 LEU HA . 17226 1
2 . 1 1 3 3 LEU HB2 H 1 1.622 0.03 . 2 . . . . 3 LEU HB1 . 17226 1
3 . 1 1 3 3 LEU HD11 H 1 0.882 0.03 . 2 . . . . 3 LEU HD11 . 17226 1
4 . 1 1 3 3 LEU HD12 H 1 0.882 0.03 . 2 . . . . 3 LEU HD11 . 17226 1
5 . 1 1 3 3 LEU HD13 H 1 0.882 0.03 . 2 . . . . 3 LEU HD11 . 17226 1
6 . 1 1 3 3 LEU HD21 H 1 0.929 0.03 . 2 . . . . 3 LEU HD21 . 17226 1
7 . 1 1 3 3 LEU HD22 H 1 0.929 0.03 . 2 . . . . 3 LEU HD21 . 17226 1
8 . 1 1 3 3 LEU HD23 H 1 0.929 0.03 . 2 . . . . 3 LEU HD21 . 17226 1
9 . 1 1 3 3 LEU HG H 1 1.636 0.03 . 1 . . . . 3 LEU HG . 17226 1
10 . 1 1 3 3 LEU C C 13 177.750 0.30 . 1 . . . . 3 LEU C . 17226 1
11 . 1 1 3 3 LEU CA C 13 55.860 0.30 . 1 . . . . 3 LEU CA . 17226 1
12 . 1 1 3 3 LEU CB C 13 42.610 0.30 . 1 . . . . 3 LEU CB . 17226 1
13 . 1 1 3 3 LEU CD1 C 13 23.880 0.30 . 1 . . . . 3 LEU CD1 . 17226 1
14 . 1 1 3 3 LEU CD2 C 13 24.834 0.30 . 1 . . . . 3 LEU CD2 . 17226 1
15 . 1 1 3 3 LEU CG C 13 27.033 0.30 . 1 . . . . 3 LEU CG . 17226 1
16 . 1 1 4 4 LEU H H 1 8.440 0.03 . 1 . . . . 4 LEU HN . 17226 1
17 . 1 1 4 4 LEU HA H 1 4.307 0.03 . 1 . . . . 4 LEU HA . 17226 1
18 . 1 1 4 4 LEU HB2 H 1 1.613 0.03 . 2 . . . . 4 LEU HB1 . 17226 1
19 . 1 1 4 4 LEU HB3 H 1 1.652 0.03 . 2 . . . . 4 LEU HB2 . 17226 1
20 . 1 1 4 4 LEU CA C 13 55.577 0.30 . 1 . . . . 4 LEU CA . 17226 1
21 . 1 1 4 4 LEU CB C 13 42.070 0.30 . 1 . . . . 4 LEU CB . 17226 1
22 . 1 1 4 4 LEU N N 15 122.137 0.3 . 1 . . . . 4 LEU N . 17226 1
23 . 1 1 5 5 SER H H 1 8.220 0.03 . 1 . . . . 5 SER HN . 17226 1
24 . 1 1 5 5 SER N N 15 116.510 0.3 . 1 . . . . 5 SER N . 17226 1
25 . 1 1 6 6 ARG HA H 1 4.342 0.03 . 1 . . . . 6 ARG HA . 17226 1
26 . 1 1 6 6 ARG HB2 H 1 1.851 0.03 . 2 . . . . 6 ARG HB1 . 17226 1
27 . 1 1 6 6 ARG HB3 H 1 1.775 0.03 . 2 . . . . 6 ARG HB2 . 17226 1
28 . 1 1 6 6 ARG C C 13 176.310 0.30 . 1 . . . . 6 ARG C . 17226 1
29 . 1 1 6 6 ARG CA C 13 56.430 0.30 . 1 . . . . 6 ARG CA . 17226 1
30 . 1 1 6 6 ARG CB C 13 30.560 0.30 . 1 . . . . 6 ARG CB . 17226 1
31 . 1 1 6 6 ARG CG C 13 27.190 0.30 . 1 . . . . 6 ARG CG . 17226 1
32 . 1 1 7 7 LEU H H 1 8.091 0.03 . 1 . . . . 7 LEU HN . 17226 1
33 . 1 1 7 7 LEU HA H 1 4.325 0.03 . 1 . . . . 7 LEU HA . 17226 1
34 . 1 1 7 7 LEU HB2 H 1 1.643 0.03 . 2 . . . . 7 LEU HB1 . 17226 1
35 . 1 1 7 7 LEU C C 13 177.236 0.30 . 1 . . . . 7 LEU C . 17226 1
36 . 1 1 7 7 LEU CA C 13 55.310 0.30 . 1 . . . . 7 LEU CA . 17226 1
37 . 1 1 7 7 LEU CB C 13 42.270 0.30 . 1 . . . . 7 LEU CB . 17226 1
38 . 1 1 7 7 LEU N N 15 122.040 0.3 . 1 . . . . 7 LEU N . 17226 1
39 . 1 1 8 8 ARG H H 1 8.214 0.03 . 1 . . . . 8 ARG HN . 17226 1
40 . 1 1 8 8 ARG CA C 13 56.050 0.30 . 1 . . . . 8 ARG CA . 17226 1
41 . 1 1 8 8 ARG CB C 13 30.816 0.30 . 1 . . . . 8 ARG CB . 17226 1
42 . 1 1 8 8 ARG N N 15 121.835 0.3 . 1 . . . . 8 ARG N . 17226 1
43 . 1 1 9 9 LYS C C 13 176.220 0.30 . 1 . . . . 9 LYS C . 17226 1
44 . 1 1 9 9 LYS CA C 13 56.376 0.30 . 1 . . . . 9 LYS CA . 17226 1
45 . 1 1 9 9 LYS CB C 13 33.130 0.30 . 1 . . . . 9 LYS CB . 17226 1
46 . 1 1 9 9 LYS CD C 13 29.233 0.30 . 1 . . . . 9 LYS CD . 17226 1
47 . 1 1 10 10 ARG H H 1 8.380 0.03 . 1 . . . . 10 ARG HN . 17226 1
48 . 1 1 10 10 ARG HA H 1 4.323 0.03 . 1 . . . . 10 ARG HA . 17226 1
49 . 1 1 10 10 ARG HB2 H 1 1.842 0.03 . 2 . . . . 10 ARG HB1 . 17226 1
50 . 1 1 10 10 ARG HB3 H 1 1.774 0.03 . 2 . . . . 10 ARG HB2 . 17226 1
51 . 1 1 10 10 ARG HD2 H 1 3.208 0.03 . 2 . . . . 10 ARG HD1 . 17226 1
52 . 1 1 10 10 ARG HD3 H 1 3.313 0.03 . 2 . . . . 10 ARG HD2 . 17226 1
53 . 1 1 10 10 ARG C C 13 175.900 0.30 . 1 . . . . 10 ARG C . 17226 1
54 . 1 1 10 10 ARG CA C 13 56.060 0.30 . 1 . . . . 10 ARG CA . 17226 1
55 . 1 1 10 10 ARG CB C 13 30.980 0.30 . 1 . . . . 10 ARG CB . 17226 1
56 . 1 1 10 10 ARG CD C 13 43.517 0.30 . 1 . . . . 10 ARG CD . 17226 1
57 . 1 1 10 10 ARG CG C 13 27.070 0.30 . 1 . . . . 10 ARG CG . 17226 1
58 . 1 1 10 10 ARG N N 15 122.308 0.3 . 1 . . . . 10 ARG N . 17226 1
59 . 1 1 11 11 GLU H H 1 8.425 0.03 . 1 . . . . 11 GLU HN . 17226 1
60 . 1 1 11 11 GLU HA H 1 4.580 0.03 . 1 . . . . 11 GLU HA . 17226 1
61 . 1 1 11 11 GLU HB2 H 1 2.050 0.03 . 2 . . . . 11 GLU HB1 . 17226 1
62 . 1 1 11 11 GLU HB3 H 1 1.890 0.03 . 2 . . . . 11 GLU HB2 . 17226 1
63 . 1 1 11 11 GLU CA C 13 54.430 0.30 . 1 . . . . 11 GLU CA . 17226 1
64 . 1 1 11 11 GLU CB C 13 29.597 0.30 . 1 . . . . 11 GLU CB . 17226 1
65 . 1 1 11 11 GLU N N 15 123.269 0.3 . 1 . . . . 11 GLU N . 17226 1
66 . 1 1 12 12 PRO HA H 1 4.458 0.03 . 1 . . . . 12 PRO HA . 17226 1
67 . 1 1 12 12 PRO HB2 H 1 2.286 0.03 . 2 . . . . 12 PRO HB1 . 17226 1
68 . 1 1 12 12 PRO HB3 H 1 1.982 0.03 . 2 . . . . 12 PRO HB2 . 17226 1
69 . 1 1 12 12 PRO HD2 H 1 3.831 0.03 . 2 . . . . 12 PRO HD1 . 17226 1
70 . 1 1 12 12 PRO HD3 H 1 3.685 0.03 . 2 . . . . 12 PRO HD2 . 17226 1
71 . 1 1 12 12 PRO HG2 H 1 2.052 0.03 . 2 . . . . 12 PRO HG1 . 17226 1
72 . 1 1 12 12 PRO C C 13 176.360 0.30 . 1 . . . . 12 PRO C . 17226 1
73 . 1 1 12 12 PRO CA C 13 63.170 0.30 . 1 . . . . 12 PRO CA . 17226 1
74 . 1 1 12 12 PRO CB C 13 31.930 0.30 . 1 . . . . 12 PRO CB . 17226 1
75 . 1 1 12 12 PRO CG C 13 27.460 0.30 . 1 . . . . 12 PRO CG . 17226 1
76 . 1 1 13 13 ILE H H 1 8.360 0.03 . 1 . . . . 13 ILE HN . 17226 1
77 . 1 1 13 13 ILE HA H 1 4.363 0.03 . 1 . . . . 13 ILE HA . 17226 1
78 . 1 1 13 13 ILE HB H 1 1.890 0.03 . 1 . . . . 13 ILE HB . 17226 1
79 . 1 1 13 13 ILE HD11 H 1 0.854 0.03 . 1 . . . . 13 ILE HD11 . 17226 1
80 . 1 1 13 13 ILE HD12 H 1 0.854 0.03 . 1 . . . . 13 ILE HD11 . 17226 1
81 . 1 1 13 13 ILE HD13 H 1 0.854 0.03 . 1 . . . . 13 ILE HD11 . 17226 1
82 . 1 1 13 13 ILE HG21 H 1 0.978 0.03 . 1 . . . . 13 ILE HG21 . 17226 1
83 . 1 1 13 13 ILE HG22 H 1 0.978 0.03 . 1 . . . . 13 ILE HG21 . 17226 1
84 . 1 1 13 13 ILE HG23 H 1 0.978 0.03 . 1 . . . . 13 ILE HG21 . 17226 1
85 . 1 1 13 13 ILE C C 13 175.920 0.30 . 1 . . . . 13 ILE C . 17226 1
86 . 1 1 13 13 ILE CA C 13 61.030 0.30 . 1 . . . . 13 ILE CA . 17226 1
87 . 1 1 13 13 ILE CB C 13 39.590 0.30 . 1 . . . . 13 ILE CB . 17226 1
88 . 1 1 13 13 ILE CD1 C 13 13.114 0.30 . 1 . . . . 13 ILE CD1 . 17226 1
89 . 1 1 13 13 ILE CG1 C 13 27.210 0.30 . 1 . . . . 13 ILE CG1 . 17226 1
90 . 1 1 13 13 ILE CG2 C 13 17.518 0.30 . 1 . . . . 13 ILE CG2 . 17226 1
91 . 1 1 13 13 ILE N N 15 120.808 0.3 . 1 . . . . 13 ILE N . 17226 1
92 . 1 1 14 14 SER H H 1 8.738 0.03 . 1 . . . . 14 SER HN . 17226 1
93 . 1 1 14 14 SER HA H 1 4.568 0.03 . 1 . . . . 14 SER HA . 17226 1
94 . 1 1 14 14 SER HB2 H 1 4.199 0.03 . 2 . . . . 14 SER HB1 . 17226 1
95 . 1 1 14 14 SER C C 13 175.020 0.30 . 1 . . . . 14 SER C . 17226 1
96 . 1 1 14 14 SER CA C 13 57.210 0.30 . 1 . . . . 14 SER CA . 17226 1
97 . 1 1 14 14 SER CB C 13 65.560 0.30 . 1 . . . . 14 SER CB . 17226 1
98 . 1 1 14 14 SER N N 15 120.053 0.3 . 1 . . . . 14 SER N . 17226 1
99 . 1 1 15 15 ILE H H 1 9.197 0.03 . 1 . . . . 15 ILE HN . 17226 1
100 . 1 1 15 15 ILE HA H 1 3.558 0.03 . 1 . . . . 15 ILE HA . 17226 1
101 . 1 1 15 15 ILE HB H 1 1.939 0.03 . 1 . . . . 15 ILE HB . 17226 1
102 . 1 1 15 15 ILE C C 13 177.010 0.30 . 1 . . . . 15 ILE C . 17226 1
103 . 1 1 15 15 ILE CA C 13 66.310 0.30 . 1 . . . . 15 ILE CA . 17226 1
104 . 1 1 15 15 ILE CB C 13 37.290 0.30 . 1 . . . . 15 ILE CB . 17226 1
105 . 1 1 15 15 ILE CG2 C 13 19.560 0.30 . 1 . . . . 15 ILE CG2 . 17226 1
106 . 1 1 15 15 ILE N N 15 123.057 0.3 . 1 . . . . 15 ILE N . 17226 1
107 . 1 1 16 16 TYR H H 1 8.289 0.03 . 1 . . . . 16 TYR HN . 17226 1
108 . 1 1 16 16 TYR HA H 1 3.675 0.03 . 1 . . . . 16 TYR HA . 17226 1
109 . 1 1 16 16 TYR HB2 H 1 2.772 0.03 . 2 . . . . 16 TYR HB1 . 17226 1
110 . 1 1 16 16 TYR HB3 H 1 2.582 0.03 . 2 . . . . 16 TYR HB2 . 17226 1
111 . 1 1 16 16 TYR C C 13 175.650 0.30 . 1 . . . . 16 TYR C . 17226 1
112 . 1 1 16 16 TYR CA C 13 61.968 0.30 . 1 . . . . 16 TYR CA . 17226 1
113 . 1 1 16 16 TYR CB C 13 39.077 0.30 . 1 . . . . 16 TYR CB . 17226 1
114 . 1 1 16 16 TYR N N 15 118.150 0.3 . 1 . . . . 16 TYR N . 17226 1
115 . 1 1 17 17 ASP H H 1 8.075 0.03 . 1 . . . . 17 ASP HN . 17226 1
116 . 1 1 17 17 ASP HA H 1 4.291 0.03 . 1 . . . . 17 ASP HA . 17226 1
117 . 1 1 17 17 ASP HB2 H 1 2.870 0.03 . 2 . . . . 17 ASP HB1 . 17226 1
118 . 1 1 17 17 ASP HB3 H 1 2.664 0.03 . 2 . . . . 17 ASP HB2 . 17226 1
119 . 1 1 17 17 ASP C C 13 179.864 0.30 . 1 . . . . 17 ASP C . 17226 1
120 . 1 1 17 17 ASP CA C 13 57.130 0.30 . 1 . . . . 17 ASP CA . 17226 1
121 . 1 1 17 17 ASP CB C 13 41.084 0.30 . 1 . . . . 17 ASP CB . 17226 1
122 . 1 1 17 17 ASP N N 15 118.560 0.3 . 1 . . . . 17 ASP N . 17226 1
123 . 1 1 18 18 LYS H H 1 8.390 0.03 . 1 . . . . 18 LYS HN . 17226 1
124 . 1 1 18 18 LYS HA H 1 3.983 0.03 . 1 . . . . 18 LYS HA . 17226 1
125 . 1 1 18 18 LYS HB2 H 1 2.026 0.03 . 2 . . . . 18 LYS HB1 . 17226 1
126 . 1 1 18 18 LYS HB3 H 1 1.957 0.03 . 2 . . . . 18 LYS HB2 . 17226 1
127 . 1 1 18 18 LYS C C 13 179.240 0.30 . 1 . . . . 18 LYS C . 17226 1
128 . 1 1 18 18 LYS CA C 13 60.035 0.30 . 1 . . . . 18 LYS CA . 17226 1
129 . 1 1 18 18 LYS CB C 13 32.950 0.30 . 1 . . . . 18 LYS CB . 17226 1
130 . 1 1 18 18 LYS N N 15 121.690 0.3 . 1 . . . . 18 LYS N . 17226 1
131 . 1 1 19 19 ILE H H 1 8.058 0.03 . 1 . . . . 19 ILE HN . 17226 1
132 . 1 1 19 19 ILE HA H 1 4.394 0.03 . 1 . . . . 19 ILE HA . 17226 1
133 . 1 1 19 19 ILE HB H 1 2.040 0.03 . 1 . . . . 19 ILE HB . 17226 1
134 . 1 1 19 19 ILE C C 13 174.670 0.30 . 1 . . . . 19 ILE C . 17226 1
135 . 1 1 19 19 ILE CA C 13 61.873 0.30 . 1 . . . . 19 ILE CA . 17226 1
136 . 1 1 19 19 ILE CB C 13 38.570 0.30 . 1 . . . . 19 ILE CB . 17226 1
137 . 1 1 19 19 ILE N N 15 110.065 0.3 . 1 . . . . 19 ILE N . 17226 1
138 . 1 1 20 20 GLY H H 1 7.155 0.03 . 1 . . . . 20 GLY HN . 17226 1
139 . 1 1 20 20 GLY HA2 H 1 4.454 0.03 . 2 . . . . 20 GLY HA1 . 17226 1
140 . 1 1 20 20 GLY HA3 H 1 3.640 0.03 . 2 . . . . 20 GLY HA2 . 17226 1
141 . 1 1 20 20 GLY C C 13 175.650 0.30 . 1 . . . . 20 GLY C . 17226 1
142 . 1 1 20 20 GLY CA C 13 44.740 0.30 . 1 . . . . 20 GLY CA . 17226 1
143 . 1 1 20 20 GLY N N 15 105.040 0.3 . 1 . . . . 20 GLY N . 17226 1
144 . 1 1 21 21 GLY H H 1 8.110 0.03 . 1 . . . . 21 GLY HN . 17226 1
145 . 1 1 21 21 GLY HA2 H 1 3.652 0.03 . 2 . . . . 21 GLY HA1 . 17226 1
146 . 1 1 21 21 GLY HA3 H 1 1.821 0.03 . 2 . . . . 21 GLY HA2 . 17226 1
147 . 1 1 21 21 GLY C C 13 173.706 0.30 . 1 . . . . 21 GLY C . 17226 1
148 . 1 1 21 21 GLY CA C 13 44.500 0.30 . 1 . . . . 21 GLY CA . 17226 1
149 . 1 1 21 21 GLY N N 15 109.413 0.3 . 1 . . . . 21 GLY N . 17226 1
150 . 1 1 22 22 HIS H H 1 8.132 0.03 . 1 . . . . 22 HIS HN . 17226 1
151 . 1 1 22 22 HIS HA H 1 3.782 0.03 . 1 . . . . 22 HIS HA . 17226 1
152 . 1 1 22 22 HIS HB2 H 1 3.404 0.03 . 2 . . . . 22 HIS HB1 . 17226 1
153 . 1 1 22 22 HIS HB3 H 1 3.231 0.03 . 2 . . . . 22 HIS HB2 . 17226 1
154 . 1 1 22 22 HIS C C 13 176.970 0.30 . 1 . . . . 22 HIS C . 17226 1
155 . 1 1 22 22 HIS CA C 13 62.050 0.30 . 1 . . . . 22 HIS CA . 17226 1
156 . 1 1 22 22 HIS CB C 13 30.470 0.30 . 1 . . . . 22 HIS CB . 17226 1
157 . 1 1 22 22 HIS N N 15 120.543 0.3 . 1 . . . . 22 HIS N . 17226 1
158 . 1 1 23 23 GLU H H 1 9.120 0.03 . 1 . . . . 23 GLU HN . 17226 1
159 . 1 1 23 23 GLU HA H 1 4.127 0.03 . 1 . . . . 23 GLU HA . 17226 1
160 . 1 1 23 23 GLU HB2 H 1 2.425 0.03 . 2 . . . . 23 GLU HB1 . 17226 1
161 . 1 1 23 23 GLU HB3 H 1 2.110 0.03 . 2 . . . . 23 GLU HB2 . 17226 1
162 . 1 1 23 23 GLU C C 13 178.780 0.30 . 1 . . . . 23 GLU C . 17226 1
163 . 1 1 23 23 GLU CA C 13 59.910 0.30 . 1 . . . . 23 GLU CA . 17226 1
164 . 1 1 23 23 GLU CB C 13 29.417 0.30 . 1 . . . . 23 GLU CB . 17226 1
165 . 1 1 23 23 GLU N N 15 116.550 0.3 . 1 . . . . 23 GLU N . 17226 1
166 . 1 1 24 24 ALA H H 1 6.712 0.03 . 1 . . . . 24 ALA HN . 17226 1
167 . 1 1 24 24 ALA HA H 1 4.280 0.03 . 1 . . . . 24 ALA HA . 17226 1
168 . 1 1 24 24 ALA HB1 H 1 1.363 0.03 . 1 . . . . 24 ALA HB1 . 17226 1
169 . 1 1 24 24 ALA HB2 H 1 1.363 0.03 . 1 . . . . 24 ALA HB1 . 17226 1
170 . 1 1 24 24 ALA HB3 H 1 1.363 0.03 . 1 . . . . 24 ALA HB1 . 17226 1
171 . 1 1 24 24 ALA C C 13 179.826 0.30 . 1 . . . . 24 ALA C . 17226 1
172 . 1 1 24 24 ALA CA C 13 54.455 0.30 . 1 . . . . 24 ALA CA . 17226 1
173 . 1 1 24 24 ALA CB C 13 19.683 0.30 . 1 . . . . 24 ALA CB . 17226 1
174 . 1 1 24 24 ALA N N 15 119.810 0.3 . 1 . . . . 24 ALA N . 17226 1
175 . 1 1 25 25 ILE H H 1 7.775 0.03 . 1 . . . . 25 ILE HN . 17226 1
176 . 1 1 25 25 ILE HA H 1 3.437 0.03 . 1 . . . . 25 ILE HA . 17226 1
177 . 1 1 25 25 ILE HB H 1 1.959 0.03 . 1 . . . . 25 ILE HB . 17226 1
178 . 1 1 25 25 ILE C C 13 177.390 0.30 . 1 . . . . 25 ILE C . 17226 1
179 . 1 1 25 25 ILE CA C 13 65.380 0.30 . 1 . . . . 25 ILE CA . 17226 1
180 . 1 1 25 25 ILE CB C 13 37.360 0.30 . 1 . . . . 25 ILE CB . 17226 1
181 . 1 1 25 25 ILE CG1 C 13 30.064 0.30 . 1 . . . . 25 ILE CG1 . 17226 1
182 . 1 1 25 25 ILE N N 15 117.560 0.3 . 1 . . . . 25 ILE N . 17226 1
183 . 1 1 26 26 GLU H H 1 8.538 0.03 . 1 . . . . 26 GLU HN . 17226 1
184 . 1 1 26 26 GLU HA H 1 4.042 0.03 . 1 . . . . 26 GLU HA . 17226 1
185 . 1 1 26 26 GLU HB2 H 1 2.340 0.03 . 2 . . . . 26 GLU HB1 . 17226 1
186 . 1 1 26 26 GLU HB3 H 1 2.240 0.03 . 2 . . . . 26 GLU HB2 . 17226 1
187 . 1 1 26 26 GLU C C 13 178.910 0.30 . 1 . . . . 26 GLU C . 17226 1
188 . 1 1 26 26 GLU CA C 13 61.022 0.30 . 1 . . . . 26 GLU CA . 17226 1
189 . 1 1 26 26 GLU CB C 13 29.959 0.30 . 1 . . . . 26 GLU CB . 17226 1
190 . 1 1 26 26 GLU N N 15 119.061 0.3 . 1 . . . . 26 GLU N . 17226 1
191 . 1 1 27 27 VAL H H 1 7.312 0.03 . 1 . . . . 27 VAL HN . 17226 1
192 . 1 1 27 27 VAL HA H 1 3.948 0.03 . 1 . . . . 27 VAL HA . 17226 1
193 . 1 1 27 27 VAL HB H 1 2.373 0.03 . 1 . . . . 27 VAL HB . 17226 1
194 . 1 1 27 27 VAL HG11 H 1 1.262 0.03 . 2 . . . . 27 VAL HG11 . 17226 1
195 . 1 1 27 27 VAL HG12 H 1 1.262 0.03 . 2 . . . . 27 VAL HG11 . 17226 1
196 . 1 1 27 27 VAL HG13 H 1 1.262 0.03 . 2 . . . . 27 VAL HG11 . 17226 1
197 . 1 1 27 27 VAL HG21 H 1 1.148 0.03 . 2 . . . . 27 VAL HG21 . 17226 1
198 . 1 1 27 27 VAL HG22 H 1 1.148 0.03 . 2 . . . . 27 VAL HG21 . 17226 1
199 . 1 1 27 27 VAL HG23 H 1 1.148 0.03 . 2 . . . . 27 VAL HG21 . 17226 1
200 . 1 1 27 27 VAL C C 13 179.238 0.30 . 1 . . . . 27 VAL C . 17226 1
201 . 1 1 27 27 VAL CA C 13 66.387 0.30 . 1 . . . . 27 VAL CA . 17226 1
202 . 1 1 27 27 VAL CB C 13 32.330 0.30 . 1 . . . . 27 VAL CB . 17226 1
203 . 1 1 27 27 VAL CG1 C 13 22.607 0.30 . 1 . . . . 27 VAL CG1 . 17226 1
204 . 1 1 27 27 VAL CG2 C 13 21.253 0.30 . 1 . . . . 27 VAL CG2 . 17226 1
205 . 1 1 27 27 VAL N N 15 118.128 0.3 . 1 . . . . 27 VAL N . 17226 1
206 . 1 1 28 28 VAL H H 1 8.069 0.03 . 1 . . . . 28 VAL HN . 17226 1
207 . 1 1 28 28 VAL HA H 1 3.857 0.03 . 1 . . . . 28 VAL HA . 17226 1
208 . 1 1 28 28 VAL HB H 1 2.222 0.03 . 1 . . . . 28 VAL HB . 17226 1
209 . 1 1 28 28 VAL HG11 H 1 1.019 0.03 . 2 . . . . 28 VAL HG11 . 17226 1
210 . 1 1 28 28 VAL HG12 H 1 1.019 0.03 . 2 . . . . 28 VAL HG11 . 17226 1
211 . 1 1 28 28 VAL HG13 H 1 1.019 0.03 . 2 . . . . 28 VAL HG11 . 17226 1
212 . 1 1 28 28 VAL HG21 H 1 0.812 0.03 . 2 . . . . 28 VAL HG21 . 17226 1
213 . 1 1 28 28 VAL HG22 H 1 0.812 0.03 . 2 . . . . 28 VAL HG21 . 17226 1
214 . 1 1 28 28 VAL HG23 H 1 0.812 0.03 . 2 . . . . 28 VAL HG21 . 17226 1
215 . 1 1 28 28 VAL C C 13 177.730 0.30 . 1 . . . . 28 VAL C . 17226 1
216 . 1 1 28 28 VAL CA C 13 66.667 0.30 . 1 . . . . 28 VAL CA . 17226 1
217 . 1 1 28 28 VAL CB C 13 31.960 0.30 . 1 . . . . 28 VAL CB . 17226 1
218 . 1 1 28 28 VAL CG1 C 13 23.408 0.30 . 1 . . . . 28 VAL CG1 . 17226 1
219 . 1 1 28 28 VAL CG2 C 13 20.600 0.30 . 1 . . . . 28 VAL CG2 . 17226 1
220 . 1 1 28 28 VAL N N 15 121.437 0.3 . 1 . . . . 28 VAL N . 17226 1
221 . 1 1 29 29 VAL H H 1 9.144 0.03 . 1 . . . . 29 VAL HN . 17226 1
222 . 1 1 29 29 VAL HA H 1 4.149 0.03 . 1 . . . . 29 VAL HA . 17226 1
223 . 1 1 29 29 VAL HB H 1 2.573 0.03 . 1 . . . . 29 VAL HB . 17226 1
224 . 1 1 29 29 VAL HG11 H 1 1.279 0.03 . 2 . . . . 29 VAL HG11 . 17226 1
225 . 1 1 29 29 VAL HG12 H 1 1.279 0.03 . 2 . . . . 29 VAL HG11 . 17226 1
226 . 1 1 29 29 VAL HG13 H 1 1.279 0.03 . 2 . . . . 29 VAL HG11 . 17226 1
227 . 1 1 29 29 VAL HG21 H 1 2.135 0.03 . 2 . . . . 29 VAL HG21 . 17226 1
228 . 1 1 29 29 VAL HG22 H 1 2.135 0.03 . 2 . . . . 29 VAL HG21 . 17226 1
229 . 1 1 29 29 VAL HG23 H 1 2.135 0.03 . 2 . . . . 29 VAL HG21 . 17226 1
230 . 1 1 29 29 VAL C C 13 177.550 0.30 . 1 . . . . 29 VAL C . 17226 1
231 . 1 1 29 29 VAL CA C 13 68.040 0.30 . 1 . . . . 29 VAL CA . 17226 1
232 . 1 1 29 29 VAL CB C 13 31.756 0.30 . 1 . . . . 29 VAL CB . 17226 1
233 . 1 1 29 29 VAL CG1 C 13 25.060 0.30 . 1 . . . . 29 VAL CG1 . 17226 1
234 . 1 1 29 29 VAL CG2 C 13 23.271 0.30 . 1 . . . . 29 VAL CG2 . 17226 1
235 . 1 1 29 29 VAL N N 15 119.696 0.3 . 1 . . . . 29 VAL N . 17226 1
236 . 1 1 30 30 GLU H H 1 8.240 0.03 . 1 . . . . 30 GLU HN . 17226 1
237 . 1 1 30 30 GLU HA H 1 4.579 0.03 . 1 . . . . 30 GLU HA . 17226 1
238 . 1 1 30 30 GLU HB2 H 1 2.460 0.03 . 2 . . . . 30 GLU HB1 . 17226 1
239 . 1 1 30 30 GLU HG2 H 1 2.710 0.03 . 2 . . . . 30 GLU HG1 . 17226 1
240 . 1 1 30 30 GLU HG3 H 1 2.570 0.03 . 2 . . . . 30 GLU HG2 . 17226 1
241 . 1 1 30 30 GLU C C 13 179.017 0.30 . 1 . . . . 30 GLU C . 17226 1
242 . 1 1 30 30 GLU CA C 13 60.345 0.30 . 1 . . . . 30 GLU CA . 17226 1
243 . 1 1 30 30 GLU CB C 13 29.679 0.30 . 1 . . . . 30 GLU CB . 17226 1
244 . 1 1 30 30 GLU CG C 13 35.570 0.30 . 1 . . . . 30 GLU CG . 17226 1
245 . 1 1 30 30 GLU N N 15 119.440 0.3 . 1 . . . . 30 GLU N . 17226 1
246 . 1 1 31 31 ASP H H 1 7.839 0.03 . 1 . . . . 31 ASP HN . 17226 1
247 . 1 1 31 31 ASP HA H 1 4.753 0.03 . 1 . . . . 31 ASP HA . 17226 1
248 . 1 1 31 31 ASP HB2 H 1 3.047 0.03 . 2 . . . . 31 ASP HB1 . 17226 1
249 . 1 1 31 31 ASP C C 13 178.023 0.30 . 1 . . . . 31 ASP C . 17226 1
250 . 1 1 31 31 ASP CA C 13 57.878 0.30 . 1 . . . . 31 ASP CA . 17226 1
251 . 1 1 31 31 ASP CB C 13 42.877 0.30 . 1 . . . . 31 ASP CB . 17226 1
252 . 1 1 31 31 ASP N N 15 119.117 0.3 . 1 . . . . 31 ASP N . 17226 1
253 . 1 1 32 32 PHE H H 1 9.595 0.03 . 1 . . . . 32 PHE HN . 17226 1
254 . 1 1 32 32 PHE HA H 1 4.102 0.03 . 1 . . . . 32 PHE HA . 17226 1
255 . 1 1 32 32 PHE HB2 H 1 3.359 0.03 . 2 . . . . 32 PHE HB1 . 17226 1
256 . 1 1 32 32 PHE C C 13 177.053 0.30 . 1 . . . . 32 PHE C . 17226 1
257 . 1 1 32 32 PHE CA C 13 60.980 0.30 . 1 . . . . 32 PHE CA . 17226 1
258 . 1 1 32 32 PHE CB C 13 39.930 0.30 . 1 . . . . 32 PHE CB . 17226 1
259 . 1 1 32 32 PHE N N 15 120.187 0.3 . 1 . . . . 32 PHE N . 17226 1
260 . 1 1 33 33 TYR H H 1 8.793 0.03 . 1 . . . . 33 TYR HN . 17226 1
261 . 1 1 33 33 TYR HA H 1 4.874 0.03 . 1 . . . . 33 TYR HA . 17226 1
262 . 1 1 33 33 TYR HB2 H 1 3.761 0.03 . 2 . . . . 33 TYR HB1 . 17226 1
263 . 1 1 33 33 TYR HB3 H 1 3.585 0.03 . 2 . . . . 33 TYR HB2 . 17226 1
264 . 1 1 33 33 TYR C C 13 179.046 0.30 . 1 . . . . 33 TYR C . 17226 1
265 . 1 1 33 33 TYR CA C 13 65.230 0.30 . 1 . . . . 33 TYR CA . 17226 1
266 . 1 1 33 33 TYR CB C 13 38.936 0.30 . 1 . . . . 33 TYR CB . 17226 1
267 . 1 1 33 33 TYR N N 15 115.228 0.3 . 1 . . . . 33 TYR N . 17226 1
268 . 1 1 34 34 VAL H H 1 8.203 0.03 . 1 . . . . 34 VAL HN . 17226 1
269 . 1 1 34 34 VAL HA H 1 3.883 0.03 . 1 . . . . 34 VAL HA . 17226 1
270 . 1 1 34 34 VAL HB H 1 2.740 0.03 . 1 . . . . 34 VAL HB . 17226 1
271 . 1 1 34 34 VAL HG11 H 1 1.415 0.03 . 2 . . . . 34 VAL HG11 . 17226 1
272 . 1 1 34 34 VAL HG12 H 1 1.415 0.03 . 2 . . . . 34 VAL HG11 . 17226 1
273 . 1 1 34 34 VAL HG13 H 1 1.415 0.03 . 2 . . . . 34 VAL HG11 . 17226 1
274 . 1 1 34 34 VAL HG21 H 1 1.090 0.03 . 2 . . . . 34 VAL HG21 . 17226 1
275 . 1 1 34 34 VAL HG22 H 1 1.090 0.03 . 2 . . . . 34 VAL HG21 . 17226 1
276 . 1 1 34 34 VAL HG23 H 1 1.090 0.03 . 2 . . . . 34 VAL HG21 . 17226 1
277 . 1 1 34 34 VAL C C 13 179.360 0.30 . 1 . . . . 34 VAL C . 17226 1
278 . 1 1 34 34 VAL CA C 13 67.549 0.30 . 1 . . . . 34 VAL CA . 17226 1
279 . 1 1 34 34 VAL CB C 13 31.320 0.30 . 1 . . . . 34 VAL CB . 17226 1
280 . 1 1 34 34 VAL CG1 C 13 23.394 0.30 . 1 . . . . 34 VAL CG1 . 17226 1
281 . 1 1 34 34 VAL CG2 C 13 21.580 0.30 . 1 . . . . 34 VAL CG2 . 17226 1
282 . 1 1 34 34 VAL N N 15 123.021 0.3 . 1 . . . . 34 VAL N . 17226 1
283 . 1 1 35 35 ARG H H 1 7.801 0.03 . 1 . . . . 35 ARG HN . 17226 1
284 . 1 1 35 35 ARG HA H 1 3.840 0.03 . 1 . . . . 35 ARG HA . 17226 1
285 . 1 1 35 35 ARG HB2 H 1 2.053 0.03 . 2 . . . . 35 ARG HB1 . 17226 1
286 . 1 1 35 35 ARG HB3 H 1 1.882 0.03 . 2 . . . . 35 ARG HB2 . 17226 1
287 . 1 1 35 35 ARG C C 13 178.889 0.30 . 1 . . . . 35 ARG C . 17226 1
288 . 1 1 35 35 ARG CA C 13 58.962 0.30 . 1 . . . . 35 ARG CA . 17226 1
289 . 1 1 35 35 ARG CB C 13 29.235 0.30 . 1 . . . . 35 ARG CB . 17226 1
290 . 1 1 35 35 ARG N N 15 119.340 0.3 . 1 . . . . 35 ARG N . 17226 1
291 . 1 1 36 36 VAL H H 1 8.423 0.03 . 1 . . . . 36 VAL HN . 17226 1
292 . 1 1 36 36 VAL HA H 1 3.162 0.03 . 1 . . . . 36 VAL HA . 17226 1
293 . 1 1 36 36 VAL HB H 1 2.324 0.03 . 1 . . . . 36 VAL HB . 17226 1
294 . 1 1 36 36 VAL HG11 H 1 0.772 0.03 . 2 . . . . 36 VAL HG11 . 17226 1
295 . 1 1 36 36 VAL HG12 H 1 0.772 0.03 . 2 . . . . 36 VAL HG11 . 17226 1
296 . 1 1 36 36 VAL HG13 H 1 0.772 0.03 . 2 . . . . 36 VAL HG11 . 17226 1
297 . 1 1 36 36 VAL HG21 H 1 1.172 0.03 . 2 . . . . 36 VAL HG21 . 17226 1
298 . 1 1 36 36 VAL HG22 H 1 1.172 0.03 . 2 . . . . 36 VAL HG21 . 17226 1
299 . 1 1 36 36 VAL HG23 H 1 1.172 0.03 . 2 . . . . 36 VAL HG21 . 17226 1
300 . 1 1 36 36 VAL C C 13 177.649 0.30 . 1 . . . . 36 VAL C . 17226 1
301 . 1 1 36 36 VAL CA C 13 66.760 0.30 . 1 . . . . 36 VAL CA . 17226 1
302 . 1 1 36 36 VAL CB C 13 33.263 0.30 . 1 . . . . 36 VAL CB . 17226 1
303 . 1 1 36 36 VAL CG1 C 13 23.820 0.30 . 1 . . . . 36 VAL CG1 . 17226 1
304 . 1 1 36 36 VAL CG2 C 13 22.912 0.30 . 1 . . . . 36 VAL CG2 . 17226 1
305 . 1 1 36 36 VAL N N 15 119.018 0.3 . 1 . . . . 36 VAL N . 17226 1
306 . 1 1 37 37 LEU H H 1 8.494 0.03 . 1 . . . . 37 LEU HN . 17226 1
307 . 1 1 37 37 LEU HA H 1 4.095 0.03 . 1 . . . . 37 LEU HA . 17226 1
308 . 1 1 37 37 LEU HB2 H 1 2.202 0.03 . 2 . . . . 37 LEU HB1 . 17226 1
309 . 1 1 37 37 LEU HB3 H 1 1.713 0.03 . 2 . . . . 37 LEU HB2 . 17226 1
310 . 1 1 37 37 LEU C C 13 178.525 0.30 . 1 . . . . 37 LEU C . 17226 1
311 . 1 1 37 37 LEU CA C 13 57.088 0.30 . 1 . . . . 37 LEU CA . 17226 1
312 . 1 1 37 37 LEU CB C 13 40.705 0.30 . 1 . . . . 37 LEU CB . 17226 1
313 . 1 1 37 37 LEU N N 15 114.550 0.3 . 1 . . . . 37 LEU N . 17226 1
314 . 1 1 38 38 ALA H H 1 7.280 0.03 . 1 . . . . 38 ALA HN . 17226 1
315 . 1 1 38 38 ALA HA H 1 4.428 0.03 . 1 . . . . 38 ALA HA . 17226 1
316 . 1 1 38 38 ALA HB1 H 1 1.540 0.03 . 1 . . . . 38 ALA HB1 . 17226 1
317 . 1 1 38 38 ALA HB2 H 1 1.540 0.03 . 1 . . . . 38 ALA HB1 . 17226 1
318 . 1 1 38 38 ALA HB3 H 1 1.540 0.03 . 1 . . . . 38 ALA HB1 . 17226 1
319 . 1 1 38 38 ALA C C 13 176.263 0.30 . 1 . . . . 38 ALA C . 17226 1
320 . 1 1 38 38 ALA CA C 13 52.044 0.30 . 1 . . . . 38 ALA CA . 17226 1
321 . 1 1 38 38 ALA CB C 13 19.015 0.30 . 1 . . . . 38 ALA CB . 17226 1
322 . 1 1 38 38 ALA N N 15 119.429 0.3 . 1 . . . . 38 ALA N . 17226 1
323 . 1 1 39 39 ASP H H 1 7.499 0.03 . 1 . . . . 39 ASP HN . 17226 1
324 . 1 1 39 39 ASP HA H 1 4.732 0.03 . 1 . . . . 39 ASP HA . 17226 1
325 . 1 1 39 39 ASP HB2 H 1 3.521 0.03 . 2 . . . . 39 ASP HB1 . 17226 1
326 . 1 1 39 39 ASP HB3 H 1 2.598 0.03 . 2 . . . . 39 ASP HB2 . 17226 1
327 . 1 1 39 39 ASP C C 13 177.302 0.30 . 1 . . . . 39 ASP C . 17226 1
328 . 1 1 39 39 ASP CA C 13 53.444 0.30 . 1 . . . . 39 ASP CA . 17226 1
329 . 1 1 39 39 ASP CB C 13 42.000 0.30 . 1 . . . . 39 ASP CB . 17226 1
330 . 1 1 39 39 ASP N N 15 121.640 0.3 . 1 . . . . 39 ASP N . 17226 1
331 . 1 1 40 40 ASP H H 1 9.049 0.03 . 1 . . . . 40 ASP HN . 17226 1
332 . 1 1 40 40 ASP HA H 1 4.491 0.03 . 1 . . . . 40 ASP HA . 17226 1
333 . 1 1 40 40 ASP HB2 H 1 2.812 0.03 . 2 . . . . 40 ASP HB1 . 17226 1
334 . 1 1 40 40 ASP C C 13 178.506 0.30 . 1 . . . . 40 ASP C . 17226 1
335 . 1 1 40 40 ASP CA C 13 56.723 0.30 . 1 . . . . 40 ASP CA . 17226 1
336 . 1 1 40 40 ASP CB C 13 40.414 0.30 . 1 . . . . 40 ASP CB . 17226 1
337 . 1 1 40 40 ASP N N 15 128.005 0.3 . 1 . . . . 40 ASP N . 17226 1
338 . 1 1 41 41 GLN H H 1 9.190 0.03 . 1 . . . . 41 GLN HN . 17226 1
339 . 1 1 41 41 GLN HA H 1 4.315 0.03 . 1 . . . . 41 GLN HA . 17226 1
340 . 1 1 41 41 GLN HB2 H 1 2.110 0.03 . 2 . . . . 41 GLN HB1 . 17226 1
341 . 1 1 41 41 GLN C C 13 176.655 0.30 . 1 . . . . 41 GLN C . 17226 1
342 . 1 1 41 41 GLN CA C 13 57.560 0.30 . 1 . . . . 41 GLN CA . 17226 1
343 . 1 1 41 41 GLN CB C 13 30.547 0.30 . 1 . . . . 41 GLN CB . 17226 1
344 . 1 1 41 41 GLN N N 15 117.696 0.3 . 1 . . . . 41 GLN N . 17226 1
345 . 1 1 42 42 LEU H H 1 7.920 0.03 . 1 . . . . 42 LEU HN . 17226 1
346 . 1 1 42 42 LEU HA H 1 4.730 0.03 . 1 . . . . 42 LEU HA . 17226 1
347 . 1 1 42 42 LEU HB2 H 1 2.416 0.03 . 2 . . . . 42 LEU HB1 . 17226 1
348 . 1 1 42 42 LEU HB3 H 1 1.315 0.03 . 2 . . . . 42 LEU HB2 . 17226 1
349 . 1 1 42 42 LEU C C 13 178.740 0.30 . 1 . . . . 42 LEU C . 17226 1
350 . 1 1 42 42 LEU CA C 13 54.417 0.30 . 1 . . . . 42 LEU CA . 17226 1
351 . 1 1 42 42 LEU CB C 13 45.811 0.30 . 1 . . . . 42 LEU CB . 17226 1
352 . 1 1 42 42 LEU N N 15 116.240 0.3 . 1 . . . . 42 LEU N . 17226 1
353 . 1 1 43 43 SER H H 1 8.558 0.03 . 1 . . . . 43 SER HN . 17226 1
354 . 1 1 43 43 SER HA H 1 4.063 0.03 . 1 . . . . 43 SER HA . 17226 1
355 . 1 1 43 43 SER C C 13 177.789 0.30 . 1 . . . . 43 SER C . 17226 1
356 . 1 1 43 43 SER CA C 13 62.955 0.30 . 1 . . . . 43 SER CA . 17226 1
357 . 1 1 43 43 SER CB C 13 63.810 0.30 . 1 . . . . 43 SER CB . 17226 1
358 . 1 1 43 43 SER N N 15 114.538 0.3 . 1 . . . . 43 SER N . 17226 1
359 . 1 1 44 44 ALA H H 1 8.689 0.03 . 1 . . . . 44 ALA HN . 17226 1
360 . 1 1 44 44 ALA HA H 1 4.100 0.03 . 1 . . . . 44 ALA HA . 17226 1
361 . 1 1 44 44 ALA HB1 H 1 1.134 0.03 . 1 . . . . 44 ALA HB1 . 17226 1
362 . 1 1 44 44 ALA HB2 H 1 1.134 0.03 . 1 . . . . 44 ALA HB1 . 17226 1
363 . 1 1 44 44 ALA HB3 H 1 1.134 0.03 . 1 . . . . 44 ALA HB1 . 17226 1
364 . 1 1 44 44 ALA C C 13 180.343 0.30 . 1 . . . . 44 ALA C . 17226 1
365 . 1 1 44 44 ALA CA C 13 54.766 0.30 . 1 . . . . 44 ALA CA . 17226 1
366 . 1 1 44 44 ALA CB C 13 17.956 0.30 . 1 . . . . 44 ALA CB . 17226 1
367 . 1 1 44 44 ALA N N 15 123.278 0.3 . 1 . . . . 44 ALA N . 17226 1
368 . 1 1 45 45 PHE H H 1 7.587 0.03 . 1 . . . . 45 PHE HN . 17226 1
369 . 1 1 45 45 PHE HA H 1 3.559 0.03 . 1 . . . . 45 PHE HA . 17226 1
370 . 1 1 45 45 PHE HB2 H 1 2.160 0.03 . 2 . . . . 45 PHE HB1 . 17226 1
371 . 1 1 45 45 PHE HB3 H 1 1.479 0.03 . 2 . . . . 45 PHE HB2 . 17226 1
372 . 1 1 45 45 PHE C C 13 176.310 0.30 . 1 . . . . 45 PHE C . 17226 1
373 . 1 1 45 45 PHE CA C 13 61.251 0.30 . 1 . . . . 45 PHE CA . 17226 1
374 . 1 1 45 45 PHE CB C 13 37.568 0.30 . 1 . . . . 45 PHE CB . 17226 1
375 . 1 1 45 45 PHE N N 15 113.687 0.3 . 1 . . . . 45 PHE N . 17226 1
376 . 1 1 46 46 PHE H H 1 7.382 0.03 . 1 . . . . 46 PHE HN . 17226 1
377 . 1 1 46 46 PHE HA H 1 4.567 0.03 . 1 . . . . 46 PHE HA . 17226 1
378 . 1 1 46 46 PHE HB2 H 1 3.938 0.03 . 2 . . . . 46 PHE HB1 . 17226 1
379 . 1 1 46 46 PHE HB3 H 1 2.812 0.03 . 2 . . . . 46 PHE HB2 . 17226 1
380 . 1 1 46 46 PHE C C 13 176.865 0.30 . 1 . . . . 46 PHE C . 17226 1
381 . 1 1 46 46 PHE CA C 13 57.846 0.30 . 1 . . . . 46 PHE CA . 17226 1
382 . 1 1 46 46 PHE CB C 13 40.246 0.30 . 1 . . . . 46 PHE CB . 17226 1
383 . 1 1 46 46 PHE N N 15 114.515 0.3 . 1 . . . . 46 PHE N . 17226 1
384 . 1 1 47 47 SER H H 1 7.203 0.03 . 1 . . . . 47 SER HN . 17226 1
385 . 1 1 47 47 SER HA H 1 4.237 0.03 . 1 . . . . 47 SER HA . 17226 1
386 . 1 1 47 47 SER HB2 H 1 3.898 0.03 . 2 . . . . 47 SER HB1 . 17226 1
387 . 1 1 47 47 SER C C 13 175.356 0.30 . 1 . . . . 47 SER C . 17226 1
388 . 1 1 47 47 SER CA C 13 61.035 0.30 . 1 . . . . 47 SER CA . 17226 1
389 . 1 1 47 47 SER CB C 13 62.972 0.30 . 1 . . . . 47 SER CB . 17226 1
390 . 1 1 47 47 SER N N 15 116.578 0.3 . 1 . . . . 47 SER N . 17226 1
391 . 1 1 48 48 GLY H H 1 8.700 0.03 . 1 . . . . 48 GLY HN . 17226 1
392 . 1 1 48 48 GLY HA2 H 1 4.224 0.03 . 2 . . . . 48 GLY HA1 . 17226 1
393 . 1 1 48 48 GLY HA3 H 1 3.691 0.03 . 2 . . . . 48 GLY HA2 . 17226 1
394 . 1 1 48 48 GLY C C 13 174.353 0.30 . 1 . . . . 48 GLY C . 17226 1
395 . 1 1 48 48 GLY CA C 13 44.840 0.30 . 1 . . . . 48 GLY CA . 17226 1
396 . 1 1 48 48 GLY N N 15 112.319 0.3 . 1 . . . . 48 GLY N . 17226 1
397 . 1 1 49 49 THR H H 1 7.534 0.03 . 1 . . . . 49 THR HN . 17226 1
398 . 1 1 49 49 THR HB H 1 4.160 0.03 . 1 . . . . 49 THR HB . 17226 1
399 . 1 1 49 49 THR C C 13 173.720 0.30 . 1 . . . . 49 THR C . 17226 1
400 . 1 1 49 49 THR CA C 13 63.776 0.30 . 1 . . . . 49 THR CA . 17226 1
401 . 1 1 49 49 THR CB C 13 70.520 0.30 . 1 . . . . 49 THR CB . 17226 1
402 . 1 1 49 49 THR N N 15 120.436 0.3 . 1 . . . . 49 THR N . 17226 1
403 . 1 1 50 50 ASN H H 1 8.530 0.03 . 1 . . . . 50 ASN HN . 17226 1
404 . 1 1 50 50 ASN HA H 1 4.673 0.03 . 1 . . . . 50 ASN HA . 17226 1
405 . 1 1 50 50 ASN HB2 H 1 2.846 0.03 . 2 . . . . 50 ASN HB1 . 17226 1
406 . 1 1 50 50 ASN C C 13 175.080 0.30 . 1 . . . . 50 ASN C . 17226 1
407 . 1 1 50 50 ASN CA C 13 52.220 0.30 . 1 . . . . 50 ASN CA . 17226 1
408 . 1 1 50 50 ASN CB C 13 36.920 0.30 . 1 . . . . 50 ASN CB . 17226 1
409 . 1 1 50 50 ASN N N 15 123.760 0.3 . 1 . . . . 50 ASN N . 17226 1
410 . 1 1 51 51 MET H H 1 8.820 0.03 . 1 . . . . 51 MET HN . 17226 1
411 . 1 1 51 51 MET HA H 1 4.724 0.03 . 1 . . . . 51 MET HA . 17226 1
412 . 1 1 51 51 MET HB2 H 1 2.252 0.03 . 2 . . . . 51 MET HB1 . 17226 1
413 . 1 1 51 51 MET C C 13 178.870 0.30 . 1 . . . . 51 MET C . 17226 1
414 . 1 1 51 51 MET CA C 13 55.780 0.30 . 1 . . . . 51 MET CA . 17226 1
415 . 1 1 51 51 MET CB C 13 29.110 0.30 . 1 . . . . 51 MET CB . 17226 1
416 . 1 1 51 51 MET N N 15 127.510 0.3 . 1 . . . . 51 MET N . 17226 1
417 . 1 1 52 52 SER H H 1 8.480 0.03 . 1 . . . . 52 SER HN . 17226 1
418 . 1 1 52 52 SER HA H 1 4.320 0.03 . 1 . . . . 52 SER HA . 17226 1
419 . 1 1 52 52 SER C C 13 177.270 0.30 . 1 . . . . 52 SER C . 17226 1
420 . 1 1 52 52 SER CA C 13 62.250 0.30 . 1 . . . . 52 SER CA . 17226 1
421 . 1 1 52 52 SER N N 15 116.300 0.3 . 1 . . . . 52 SER N . 17226 1
422 . 1 1 53 53 ARG H H 1 7.420 0.03 . 1 . . . . 53 ARG HN . 17226 1
423 . 1 1 53 53 ARG HA H 1 3.930 0.03 . 1 . . . . 53 ARG HA . 17226 1
424 . 1 1 53 53 ARG HB2 H 1 1.570 0.03 . 2 . . . . 53 ARG HB1 . 17226 1
425 . 1 1 53 53 ARG HD2 H 1 2.995 0.03 . 2 . . . . 53 ARG HD1 . 17226 1
426 . 1 1 53 53 ARG CA C 13 58.270 0.30 . 1 . . . . 53 ARG CA . 17226 1
427 . 1 1 53 53 ARG CB C 13 29.720 0.30 . 1 . . . . 53 ARG CB . 17226 1
428 . 1 1 53 53 ARG CD C 13 42.768 0.30 . 1 . . . . 53 ARG CD . 17226 1
429 . 1 1 53 53 ARG CG C 13 26.795 0.30 . 1 . . . . 53 ARG CG . 17226 1
430 . 1 1 53 53 ARG N N 15 122.930 0.3 . 1 . . . . 53 ARG N . 17226 1
431 . 1 1 54 54 LEU H H 1 7.850 0.03 . 1 . . . . 54 LEU HN . 17226 1
432 . 1 1 54 54 LEU HA H 1 3.494 0.03 . 1 . . . . 54 LEU HA . 17226 1
433 . 1 1 54 54 LEU HB2 H 1 2.123 0.03 . 2 . . . . 54 LEU HB1 . 17226 1
434 . 1 1 54 54 LEU C C 13 178.040 0.30 . 1 . . . . 54 LEU C . 17226 1
435 . 1 1 54 54 LEU CA C 13 58.500 0.30 . 1 . . . . 54 LEU CA . 17226 1
436 . 1 1 54 54 LEU CB C 13 42.070 0.30 . 1 . . . . 54 LEU CB . 17226 1
437 . 1 1 54 54 LEU N N 15 121.440 0.3 . 1 . . . . 54 LEU N . 17226 1
438 . 1 1 55 55 LYS H H 1 8.900 0.03 . 1 . . . . 55 LYS HN . 17226 1
439 . 1 1 55 55 LYS HA H 1 4.667 0.03 . 1 . . . . 55 LYS HA . 17226 1
440 . 1 1 55 55 LYS HB2 H 1 2.310 0.03 . 2 . . . . 55 LYS HB1 . 17226 1
441 . 1 1 55 55 LYS C C 13 178.950 0.30 . 1 . . . . 55 LYS C . 17226 1
442 . 1 1 55 55 LYS CA C 13 61.800 0.30 . 1 . . . . 55 LYS CA . 17226 1
443 . 1 1 55 55 LYS CB C 13 32.330 0.30 . 1 . . . . 55 LYS CB . 17226 1
444 . 1 1 55 55 LYS N N 15 117.210 0.3 . 1 . . . . 55 LYS N . 17226 1
445 . 1 1 56 56 GLY H H 1 7.550 0.03 . 1 . . . . 56 GLY HN . 17226 1
446 . 1 1 56 56 GLY HA2 H 1 4.010 0.03 . 2 . . . . 56 GLY HA1 . 17226 1
447 . 1 1 56 56 GLY C C 13 177.390 0.30 . 1 . . . . 56 GLY C . 17226 1
448 . 1 1 56 56 GLY CA C 13 47.490 0.30 . 1 . . . . 56 GLY CA . 17226 1
449 . 1 1 56 56 GLY N N 15 103.060 0.3 . 1 . . . . 56 GLY N . 17226 1
450 . 1 1 57 57 LYS H H 1 7.810 0.03 . 1 . . . . 57 LYS HN . 17226 1
451 . 1 1 57 57 LYS HA H 1 4.006 0.03 . 1 . . . . 57 LYS HA . 17226 1
452 . 1 1 57 57 LYS HB2 H 1 1.518 0.03 . 2 . . . . 57 LYS HB1 . 17226 1
453 . 1 1 57 57 LYS HB3 H 1 1.099 0.03 . 2 . . . . 57 LYS HB2 . 17226 1
454 . 1 1 57 57 LYS C C 13 177.590 0.30 . 1 . . . . 57 LYS C . 17226 1
455 . 1 1 57 57 LYS CA C 13 56.900 0.30 . 1 . . . . 57 LYS CA . 17226 1
456 . 1 1 57 57 LYS CB C 13 31.760 0.30 . 1 . . . . 57 LYS CB . 17226 1
457 . 1 1 57 57 LYS CD C 13 27.240 0.30 . 1 . . . . 57 LYS CD . 17226 1
458 . 1 1 57 57 LYS CG C 13 23.500 0.30 . 1 . . . . 57 LYS CG . 17226 1
459 . 1 1 57 57 LYS N N 15 121.270 0.3 . 1 . . . . 57 LYS N . 17226 1
460 . 1 1 58 58 GLN H H 1 9.284 0.03 . 1 . . . . 58 GLN HN . 17226 1
461 . 1 1 58 58 GLN HA H 1 4.653 0.03 . 1 . . . . 58 GLN HA . 17226 1
462 . 1 1 58 58 GLN HB2 H 1 3.547 0.03 . 2 . . . . 58 GLN HB1 . 17226 1
463 . 1 1 58 58 GLN HB3 H 1 3.273 0.03 . 2 . . . . 58 GLN HB2 . 17226 1
464 . 1 1 58 58 GLN HG2 H 1 3.891 0.03 . 2 . . . . 58 GLN HG1 . 17226 1
465 . 1 1 58 58 GLN HG3 H 1 2.887 0.03 . 2 . . . . 58 GLN HG2 . 17226 1
466 . 1 1 58 58 GLN C C 13 179.106 0.30 . 1 . . . . 58 GLN C . 17226 1
467 . 1 1 58 58 GLN CA C 13 57.330 0.30 . 1 . . . . 58 GLN CA . 17226 1
468 . 1 1 58 58 GLN CB C 13 31.899 0.30 . 1 . . . . 58 GLN CB . 17226 1
469 . 1 1 58 58 GLN CG C 13 34.590 0.30 . 1 . . . . 58 GLN CG . 17226 1
470 . 1 1 58 58 GLN N N 15 122.376 0.3 . 1 . . . . 58 GLN N . 17226 1
471 . 1 1 59 59 VAL H H 1 8.826 0.03 . 1 . . . . 59 VAL HN . 17226 1
472 . 1 1 59 59 VAL HA H 1 3.755 0.03 . 1 . . . . 59 VAL HA . 17226 1
473 . 1 1 59 59 VAL HB H 1 2.444 0.03 . 1 . . . . 59 VAL HB . 17226 1
474 . 1 1 59 59 VAL HG11 H 1 1.416 0.03 . 2 . . . . 59 VAL HG11 . 17226 1
475 . 1 1 59 59 VAL HG12 H 1 1.416 0.03 . 2 . . . . 59 VAL HG11 . 17226 1
476 . 1 1 59 59 VAL HG13 H 1 1.416 0.03 . 2 . . . . 59 VAL HG11 . 17226 1
477 . 1 1 59 59 VAL HG21 H 1 0.972 0.03 . 2 . . . . 59 VAL HG21 . 17226 1
478 . 1 1 59 59 VAL HG22 H 1 0.972 0.03 . 2 . . . . 59 VAL HG21 . 17226 1
479 . 1 1 59 59 VAL HG23 H 1 0.972 0.03 . 2 . . . . 59 VAL HG21 . 17226 1
480 . 1 1 59 59 VAL C C 13 177.526 0.30 . 1 . . . . 59 VAL C . 17226 1
481 . 1 1 59 59 VAL CA C 13 67.340 0.30 . 1 . . . . 59 VAL CA . 17226 1
482 . 1 1 59 59 VAL CB C 13 31.593 0.30 . 1 . . . . 59 VAL CB . 17226 1
483 . 1 1 59 59 VAL CG1 C 13 24.362 0.30 . 1 . . . . 59 VAL CG1 . 17226 1
484 . 1 1 59 59 VAL CG2 C 13 21.388 0.30 . 1 . . . . 59 VAL CG2 . 17226 1
485 . 1 1 59 59 VAL N N 15 120.210 0.3 . 1 . . . . 59 VAL N . 17226 1
486 . 1 1 60 60 GLU H H 1 7.504 0.03 . 1 . . . . 60 GLU HN . 17226 1
487 . 1 1 60 60 GLU HA H 1 4.001 0.03 . 1 . . . . 60 GLU HA . 17226 1
488 . 1 1 60 60 GLU HB2 H 1 2.360 0.03 . 2 . . . . 60 GLU HB1 . 17226 1
489 . 1 1 60 60 GLU HG2 H 1 2.609 0.03 . 2 . . . . 60 GLU HG1 . 17226 1
490 . 1 1 60 60 GLU HG3 H 1 2.324 0.03 . 2 . . . . 60 GLU HG2 . 17226 1
491 . 1 1 60 60 GLU C C 13 179.657 0.30 . 1 . . . . 60 GLU C . 17226 1
492 . 1 1 60 60 GLU CA C 13 59.337 0.30 . 1 . . . . 60 GLU CA . 17226 1
493 . 1 1 60 60 GLU CB C 13 30.899 0.30 . 1 . . . . 60 GLU CB . 17226 1
494 . 1 1 60 60 GLU CG C 13 36.760 0.30 . 1 . . . . 60 GLU CG . 17226 1
495 . 1 1 60 60 GLU N N 15 117.090 0.3 . 1 . . . . 60 GLU N . 17226 1
496 . 1 1 61 61 PHE H H 1 8.997 0.03 . 1 . . . . 61 PHE HN . 17226 1
497 . 1 1 61 61 PHE HA H 1 3.140 0.03 . 1 . . . . 61 PHE HA . 17226 1
498 . 1 1 61 61 PHE HB2 H 1 2.882 0.03 . 2 . . . . 61 PHE HB1 . 17226 1
499 . 1 1 61 61 PHE HB3 H 1 2.064 0.03 . 2 . . . . 61 PHE HB2 . 17226 1
500 . 1 1 61 61 PHE C C 13 178.066 0.30 . 1 . . . . 61 PHE C . 17226 1
501 . 1 1 61 61 PHE CA C 13 62.693 0.30 . 1 . . . . 61 PHE CA . 17226 1
502 . 1 1 61 61 PHE CB C 13 38.200 0.30 . 1 . . . . 61 PHE CB . 17226 1
503 . 1 1 61 61 PHE N N 15 121.370 0.3 . 1 . . . . 61 PHE N . 17226 1
504 . 1 1 62 62 PHE H H 1 9.398 0.03 . 1 . . . . 62 PHE HN . 17226 1
505 . 1 1 62 62 PHE HA H 1 3.829 0.03 . 1 . . . . 62 PHE HA . 17226 1
506 . 1 1 62 62 PHE HB2 H 1 3.321 0.03 . 2 . . . . 62 PHE HB1 . 17226 1
507 . 1 1 62 62 PHE HB3 H 1 2.759 0.03 . 2 . . . . 62 PHE HB2 . 17226 1
508 . 1 1 62 62 PHE C C 13 177.780 0.30 . 1 . . . . 62 PHE C . 17226 1
509 . 1 1 62 62 PHE CA C 13 61.475 0.30 . 1 . . . . 62 PHE CA . 17226 1
510 . 1 1 62 62 PHE CB C 13 39.047 0.30 . 1 . . . . 62 PHE CB . 17226 1
511 . 1 1 62 62 PHE N N 15 119.641 0.3 . 1 . . . . 62 PHE N . 17226 1
512 . 1 1 63 63 ALA H H 1 8.937 0.03 . 1 . . . . 63 ALA HN . 17226 1
513 . 1 1 63 63 ALA HA H 1 3.940 0.03 . 1 . . . . 63 ALA HA . 17226 1
514 . 1 1 63 63 ALA HB1 H 1 1.545 0.03 . 1 . . . . 63 ALA HB1 . 17226 1
515 . 1 1 63 63 ALA HB2 H 1 1.545 0.03 . 1 . . . . 63 ALA HB1 . 17226 1
516 . 1 1 63 63 ALA HB3 H 1 1.545 0.03 . 1 . . . . 63 ALA HB1 . 17226 1
517 . 1 1 63 63 ALA C C 13 179.070 0.30 . 1 . . . . 63 ALA C . 17226 1
518 . 1 1 63 63 ALA CA C 13 56.444 0.30 . 1 . . . . 63 ALA CA . 17226 1
519 . 1 1 63 63 ALA CB C 13 18.423 0.30 . 1 . . . . 63 ALA CB . 17226 1
520 . 1 1 63 63 ALA N N 15 119.523 0.3 . 1 . . . . 63 ALA N . 17226 1
521 . 1 1 64 64 ALA H H 1 7.417 0.03 . 1 . . . . 64 ALA HN . 17226 1
522 . 1 1 64 64 ALA HA H 1 3.842 0.03 . 1 . . . . 64 ALA HA . 17226 1
523 . 1 1 64 64 ALA HB1 H 1 1.340 0.03 . 1 . . . . 64 ALA HB1 . 17226 1
524 . 1 1 64 64 ALA HB2 H 1 1.340 0.03 . 1 . . . . 64 ALA HB1 . 17226 1
525 . 1 1 64 64 ALA HB3 H 1 1.340 0.03 . 1 . . . . 64 ALA HB1 . 17226 1
526 . 1 1 64 64 ALA C C 13 181.560 0.30 . 1 . . . . 64 ALA C . 17226 1
527 . 1 1 64 64 ALA CA C 13 54.776 0.30 . 1 . . . . 64 ALA CA . 17226 1
528 . 1 1 64 64 ALA CB C 13 18.711 0.30 . 1 . . . . 64 ALA CB . 17226 1
529 . 1 1 64 64 ALA N N 15 118.303 0.3 . 1 . . . . 64 ALA N . 17226 1
530 . 1 1 65 65 ALA H H 1 8.360 0.03 . 1 . . . . 65 ALA HN . 17226 1
531 . 1 1 65 65 ALA HA H 1 3.754 0.03 . 1 . . . . 65 ALA HA . 17226 1
532 . 1 1 65 65 ALA HB1 H 1 0.792 0.03 . 1 . . . . 65 ALA HB1 . 17226 1
533 . 1 1 65 65 ALA HB2 H 1 0.792 0.03 . 1 . . . . 65 ALA HB1 . 17226 1
534 . 1 1 65 65 ALA HB3 H 1 0.792 0.03 . 1 . . . . 65 ALA HB1 . 17226 1
535 . 1 1 65 65 ALA C C 13 179.032 0.30 . 1 . . . . 65 ALA C . 17226 1
536 . 1 1 65 65 ALA CA C 13 54.250 0.30 . 1 . . . . 65 ALA CA . 17226 1
537 . 1 1 65 65 ALA CB C 13 16.881 0.30 . 1 . . . . 65 ALA CB . 17226 1
538 . 1 1 65 65 ALA N N 15 121.847 0.3 . 1 . . . . 65 ALA N . 17226 1
539 . 1 1 66 66 LEU H H 1 7.699 0.03 . 1 . . . . 66 LEU HN . 17226 1
540 . 1 1 66 66 LEU HA H 1 4.355 0.03 . 1 . . . . 66 LEU HA . 17226 1
541 . 1 1 66 66 LEU HB2 H 1 1.775 0.03 . 2 . . . . 66 LEU HB1 . 17226 1
542 . 1 1 66 66 LEU HB3 H 1 1.701 0.03 . 2 . . . . 66 LEU HB2 . 17226 1
543 . 1 1 66 66 LEU C C 13 175.673 0.30 . 1 . . . . 66 LEU C . 17226 1
544 . 1 1 66 66 LEU CA C 13 54.036 0.30 . 1 . . . . 66 LEU CA . 17226 1
545 . 1 1 66 66 LEU CB C 13 39.825 0.30 . 1 . . . . 66 LEU CB . 17226 1
546 . 1 1 66 66 LEU N N 15 113.329 0.3 . 1 . . . . 66 LEU N . 17226 1
547 . 1 1 67 67 GLY H H 1 7.552 0.03 . 1 . . . . 67 GLY HN . 17226 1
548 . 1 1 67 67 GLY HA2 H 1 4.384 0.03 . 2 . . . . 67 GLY HA1 . 17226 1
549 . 1 1 67 67 GLY HA3 H 1 3.782 0.03 . 2 . . . . 67 GLY HA2 . 17226 1
550 . 1 1 67 67 GLY C C 13 175.260 0.30 . 1 . . . . 67 GLY C . 17226 1
551 . 1 1 67 67 GLY CA C 13 45.579 0.30 . 1 . . . . 67 GLY CA . 17226 1
552 . 1 1 67 67 GLY N N 15 106.148 0.3 . 1 . . . . 67 GLY N . 17226 1
553 . 1 1 68 68 GLY H H 1 8.628 0.03 . 1 . . . . 68 GLY HN . 17226 1
554 . 1 1 68 68 GLY CA C 13 43.600 0.30 . 1 . . . . 68 GLY CA . 17226 1
555 . 1 1 68 68 GLY N N 15 110.440 0.3 . 1 . . . . 68 GLY N . 17226 1
556 . 1 1 69 69 PRO HA H 1 4.287 0.03 . 1 . . . . 69 PRO HA . 17226 1
557 . 1 1 69 69 PRO C C 13 177.070 0.30 . 1 . . . . 69 PRO C . 17226 1
558 . 1 1 69 69 PRO CA C 13 64.110 0.30 . 1 . . . . 69 PRO CA . 17226 1
559 . 1 1 69 69 PRO CB C 13 32.480 0.30 . 1 . . . . 69 PRO CB . 17226 1
560 . 1 1 70 70 GLU H H 1 8.567 0.03 . 1 . . . . 70 GLU HN . 17226 1
561 . 1 1 70 70 GLU HB2 H 1 1.950 0.03 . 2 . . . . 70 GLU HB1 . 17226 1
562 . 1 1 70 70 GLU HB3 H 1 1.790 0.03 . 2 . . . . 70 GLU HB2 . 17226 1
563 . 1 1 70 70 GLU CA C 13 53.390 0.30 . 1 . . . . 70 GLU CA . 17226 1
564 . 1 1 70 70 GLU CB C 13 29.950 0.30 . 1 . . . . 70 GLU CB . 17226 1
565 . 1 1 70 70 GLU N N 15 121.675 0.3 . 1 . . . . 70 GLU N . 17226 1
566 . 1 1 71 71 PRO HA H 1 4.327 0.03 . 1 . . . . 71 PRO HA . 17226 1
567 . 1 1 71 71 PRO C C 13 175.710 0.30 . 1 . . . . 71 PRO C . 17226 1
568 . 1 1 71 71 PRO CA C 13 62.050 0.30 . 1 . . . . 71 PRO CA . 17226 1
569 . 1 1 71 71 PRO CB C 13 32.260 0.30 . 1 . . . . 71 PRO CB . 17226 1
570 . 1 1 71 71 PRO CG C 13 26.826 0.30 . 1 . . . . 71 PRO CG . 17226 1
571 . 1 1 72 72 TYR H H 1 8.445 0.03 . 1 . . . . 72 TYR HN . 17226 1
572 . 1 1 72 72 TYR HA H 1 4.577 0.03 . 1 . . . . 72 TYR HA . 17226 1
573 . 1 1 72 72 TYR HB2 H 1 2.600 0.03 . 2 . . . . 72 TYR HB1 . 17226 1
574 . 1 1 72 72 TYR C C 13 176.700 0.30 . 1 . . . . 72 TYR C . 17226 1
575 . 1 1 72 72 TYR CA C 13 57.220 0.30 . 1 . . . . 72 TYR CA . 17226 1
576 . 1 1 72 72 TYR CB C 13 38.730 0.30 . 1 . . . . 72 TYR CB . 17226 1
577 . 1 1 72 72 TYR N N 15 120.196 0.3 . 1 . . . . 72 TYR N . 17226 1
578 . 1 1 73 73 THR H H 1 8.460 0.03 . 1 . . . . 73 THR HN . 17226 1
579 . 1 1 73 73 THR HB H 1 4.170 0.03 . 1 . . . . 73 THR HB . 17226 1
580 . 1 1 73 73 THR CA C 13 61.080 0.30 . 1 . . . . 73 THR CA . 17226 1
581 . 1 1 73 73 THR CB C 13 69.320 0.30 . 1 . . . . 73 THR CB . 17226 1
582 . 1 1 73 73 THR N N 15 119.720 0.3 . 1 . . . . 73 THR N . 17226 1
583 . 1 1 74 74 GLY HA2 H 1 3.701 0.03 . 2 . . . . 74 GLY HA1 . 17226 1
584 . 1 1 74 74 GLY HA3 H 1 2.988 0.03 . 2 . . . . 74 GLY HA2 . 17226 1
585 . 1 1 74 74 GLY C C 13 171.243 0.30 . 1 . . . . 74 GLY C . 17226 1
586 . 1 1 74 74 GLY CA C 13 43.919 0.30 . 1 . . . . 74 GLY CA . 17226 1
587 . 1 1 75 75 ALA H H 1 8.510 0.03 . 1 . . . . 75 ALA HN . 17226 1
588 . 1 1 75 75 ALA HA H 1 4.330 0.03 . 1 . . . . 75 ALA HA . 17226 1
589 . 1 1 75 75 ALA HB1 H 1 0.876 0.03 . 1 . . . . 75 ALA HB1 . 17226 1
590 . 1 1 75 75 ALA HB2 H 1 0.876 0.03 . 1 . . . . 75 ALA HB1 . 17226 1
591 . 1 1 75 75 ALA HB3 H 1 0.876 0.03 . 1 . . . . 75 ALA HB1 . 17226 1
592 . 1 1 75 75 ALA CA C 13 50.175 0.30 . 1 . . . . 75 ALA CA . 17226 1
593 . 1 1 75 75 ALA CB C 13 17.987 0.30 . 1 . . . . 75 ALA CB . 17226 1
594 . 1 1 75 75 ALA N N 15 123.104 0.3 . 1 . . . . 75 ALA N . 17226 1
595 . 1 1 76 76 PRO HA H 1 4.776 0.03 . 1 . . . . 76 PRO HA . 17226 1
596 . 1 1 76 76 PRO HB2 H 1 2.831 0.03 . 2 . . . . 76 PRO HB1 . 17226 1
597 . 1 1 76 76 PRO HB3 H 1 2.390 0.03 . 2 . . . . 76 PRO HB2 . 17226 1
598 . 1 1 76 76 PRO C C 13 177.810 0.30 . 1 . . . . 76 PRO C . 17226 1
599 . 1 1 76 76 PRO CA C 13 62.760 0.30 . 1 . . . . 76 PRO CA . 17226 1
600 . 1 1 76 76 PRO CB C 13 32.730 0.30 . 1 . . . . 76 PRO CB . 17226 1
601 . 1 1 76 76 PRO CG C 13 28.200 0.30 . 1 . . . . 76 PRO CG . 17226 1
602 . 1 1 77 77 MET H H 1 9.506 0.03 . 1 . . . . 77 MET HN . 17226 1
603 . 1 1 77 77 MET HA H 1 6.452 0.03 . 1 . . . . 77 MET HA . 17226 1
604 . 1 1 77 77 MET HB2 H 1 3.698 0.03 . 2 . . . . 77 MET HB1 . 17226 1
605 . 1 1 77 77 MET HB3 H 1 3.395 0.03 . 2 . . . . 77 MET HB2 . 17226 1
606 . 1 1 77 77 MET C C 13 182.800 0.30 . 1 . . . . 77 MET C . 17226 1
607 . 1 1 77 77 MET CA C 13 59.000 0.30 . 1 . . . . 77 MET CA . 17226 1
608 . 1 1 77 77 MET CB C 13 37.940 0.30 . 1 . . . . 77 MET CB . 17226 1
609 . 1 1 77 77 MET CG C 13 33.500 0.30 . 1 . . . . 77 MET CG . 17226 1
610 . 1 1 77 77 MET N N 15 120.018 0.3 . 1 . . . . 77 MET N . 17226 1
611 . 1 1 78 78 LYS H H 1 10.473 0.03 . 1 . . . . 78 LYS HN . 17226 1
612 . 1 1 78 78 LYS HA H 1 6.141 0.03 . 1 . . . . 78 LYS HA . 17226 1
613 . 1 1 78 78 LYS HB2 H 1 2.628 0.03 . 2 . . . . 78 LYS HB1 . 17226 1
614 . 1 1 78 78 LYS C C 13 178.934 0.30 . 1 . . . . 78 LYS C . 17226 1
615 . 1 1 78 78 LYS CA C 13 60.470 0.30 . 1 . . . . 78 LYS CA . 17226 1
616 . 1 1 78 78 LYS CB C 13 33.520 0.30 . 1 . . . . 78 LYS CB . 17226 1
617 . 1 1 78 78 LYS CD C 13 30.140 0.30 . 1 . . . . 78 LYS CD . 17226 1
618 . 1 1 78 78 LYS CE C 13 42.637 0.30 . 1 . . . . 78 LYS CE . 17226 1
619 . 1 1 78 78 LYS CG C 13 25.541 0.30 . 1 . . . . 78 LYS CG . 17226 1
620 . 1 1 78 78 LYS N N 15 122.151 0.3 . 1 . . . . 78 LYS N . 17226 1
621 . 1 1 79 79 GLN H H 1 7.920 0.03 . 1 . . . . 79 GLN HN . 17226 1
622 . 1 1 79 79 GLN HA H 1 4.746 0.03 . 1 . . . . 79 GLN HA . 17226 1
623 . 1 1 79 79 GLN HB2 H 1 2.580 0.03 . 2 . . . . 79 GLN HB1 . 17226 1
624 . 1 1 79 79 GLN HB3 H 1 2.440 0.03 . 2 . . . . 79 GLN HB2 . 17226 1
625 . 1 1 79 79 GLN HG2 H 1 2.715 0.03 . 2 . . . . 79 GLN HG1 . 17226 1
626 . 1 1 79 79 GLN HG3 H 1 2.628 0.03 . 2 . . . . 79 GLN HG2 . 17226 1
627 . 1 1 79 79 GLN C C 13 179.540 0.30 . 1 . . . . 79 GLN C . 17226 1
628 . 1 1 79 79 GLN CA C 13 59.750 0.30 . 1 . . . . 79 GLN CA . 17226 1
629 . 1 1 79 79 GLN CB C 13 29.820 0.30 . 1 . . . . 79 GLN CB . 17226 1
630 . 1 1 79 79 GLN CG C 13 34.268 0.30 . 1 . . . . 79 GLN CG . 17226 1
631 . 1 1 79 79 GLN N N 15 117.970 0.3 . 1 . . . . 79 GLN N . 17226 1
632 . 1 1 80 80 VAL H H 1 9.000 0.03 . 1 . . . . 80 VAL HN . 17226 1
633 . 1 1 80 80 VAL HA H 1 4.386 0.03 . 1 . . . . 80 VAL HA . 17226 1
634 . 1 1 80 80 VAL HB H 1 2.331 0.03 . 1 . . . . 80 VAL HB . 17226 1
635 . 1 1 80 80 VAL HG11 H 1 -0.150 0.03 . 2 . . . . 80 VAL HG11 . 17226 1
636 . 1 1 80 80 VAL HG12 H 1 -0.150 0.03 . 2 . . . . 80 VAL HG11 . 17226 1
637 . 1 1 80 80 VAL HG13 H 1 -0.150 0.03 . 2 . . . . 80 VAL HG11 . 17226 1
638 . 1 1 80 80 VAL HG21 H 1 0.409 0.03 . 2 . . . . 80 VAL HG21 . 17226 1
639 . 1 1 80 80 VAL HG22 H 1 0.409 0.03 . 2 . . . . 80 VAL HG21 . 17226 1
640 . 1 1 80 80 VAL HG23 H 1 0.409 0.03 . 2 . . . . 80 VAL HG21 . 17226 1
641 . 1 1 80 80 VAL C C 13 177.880 0.30 . 1 . . . . 80 VAL C . 17226 1
642 . 1 1 80 80 VAL CA C 13 65.100 0.30 . 1 . . . . 80 VAL CA . 17226 1
643 . 1 1 80 80 VAL CB C 13 32.440 0.30 . 1 . . . . 80 VAL CB . 17226 1
644 . 1 1 80 80 VAL CG1 C 13 22.100 0.30 . 1 . . . . 80 VAL CG1 . 17226 1
645 . 1 1 80 80 VAL CG2 C 13 19.149 0.30 . 1 . . . . 80 VAL CG2 . 17226 1
646 . 1 1 80 80 VAL N N 15 115.410 0.3 . 1 . . . . 80 VAL N . 17226 1
647 . 1 1 81 81 HIS H H 1 10.614 0.03 . 1 . . . . 81 HIS HN . 17226 1
648 . 1 1 81 81 HIS HB2 H 1 10.940 0.03 . 2 . . . . 81 HIS HB1 . 17226 1
649 . 1 1 81 81 HIS HB3 H 1 8.690 0.03 . 2 . . . . 81 HIS HB2 . 17226 1
650 . 1 1 81 81 HIS C C 13 175.880 0.30 . 1 . . . . 81 HIS C . 17226 1
651 . 1 1 81 81 HIS CA C 13 73.660 0.30 . 1 . . . . 81 HIS CA . 17226 1
652 . 1 1 81 81 HIS CB C 13 28.860 0.30 . 1 . . . . 81 HIS CB . 17226 1
653 . 1 1 81 81 HIS N N 15 118.413 0.3 . 1 . . . . 81 HIS N . 17226 1
654 . 1 1 82 82 GLN H H 1 9.247 0.03 . 1 . . . . 82 GLN HN . 17226 1
655 . 1 1 82 82 GLN HA H 1 5.410 0.03 . 1 . . . . 82 GLN HA . 17226 1
656 . 1 1 82 82 GLN HB2 H 1 3.263 0.03 . 2 . . . . 82 GLN HB1 . 17226 1
657 . 1 1 82 82 GLN HB3 H 1 3.011 0.03 . 2 . . . . 82 GLN HB2 . 17226 1
658 . 1 1 82 82 GLN C C 13 177.530 0.30 . 1 . . . . 82 GLN C . 17226 1
659 . 1 1 82 82 GLN CA C 13 58.250 0.30 . 1 . . . . 82 GLN CA . 17226 1
660 . 1 1 82 82 GLN CB C 13 28.920 0.30 . 1 . . . . 82 GLN CB . 17226 1
661 . 1 1 82 82 GLN N N 15 122.141 0.3 . 1 . . . . 82 GLN N . 17226 1
662 . 1 1 83 83 GLY H H 1 9.550 0.03 . 1 . . . . 83 GLY HN . 17226 1
663 . 1 1 83 83 GLY HA2 H 1 4.420 0.03 . 2 . . . . 83 GLY HA1 . 17226 1
664 . 1 1 83 83 GLY HA3 H 1 4.207 0.03 . 2 . . . . 83 GLY HA2 . 17226 1
665 . 1 1 83 83 GLY C C 13 175.660 0.30 . 1 . . . . 83 GLY C . 17226 1
666 . 1 1 83 83 GLY CA C 13 46.540 0.30 . 1 . . . . 83 GLY CA . 17226 1
667 . 1 1 83 83 GLY N N 15 110.910 0.3 . 1 . . . . 83 GLY N . 17226 1
668 . 1 1 84 84 ARG H H 1 8.330 0.03 . 1 . . . . 84 ARG HN . 17226 1
669 . 1 1 84 84 ARG HA H 1 4.543 0.03 . 1 . . . . 84 ARG HA . 17226 1
670 . 1 1 84 84 ARG HB2 H 1 2.054 0.03 . 2 . . . . 84 ARG HB1 . 17226 1
671 . 1 1 84 84 ARG C C 13 176.580 0.30 . 1 . . . . 84 ARG C . 17226 1
672 . 1 1 84 84 ARG CA C 13 56.840 0.30 . 1 . . . . 84 ARG CA . 17226 1
673 . 1 1 84 84 ARG CB C 13 31.930 0.30 . 1 . . . . 84 ARG CB . 17226 1
674 . 1 1 84 84 ARG N N 15 117.440 0.3 . 1 . . . . 84 ARG N . 17226 1
675 . 1 1 85 85 GLY H H 1 9.055 0.03 . 1 . . . . 85 GLY HN . 17226 1
676 . 1 1 85 85 GLY HA2 H 1 4.090 0.03 . 2 . . . . 85 GLY HA1 . 17226 1
677 . 1 1 85 85 GLY HA3 H 1 3.874 0.03 . 2 . . . . 85 GLY HA2 . 17226 1
678 . 1 1 85 85 GLY C C 13 174.175 0.30 . 1 . . . . 85 GLY C . 17226 1
679 . 1 1 85 85 GLY CA C 13 46.170 0.30 . 1 . . . . 85 GLY CA . 17226 1
680 . 1 1 85 85 GLY N N 15 109.748 0.3 . 1 . . . . 85 GLY N . 17226 1
681 . 1 1 86 86 ILE H H 1 8.028 0.03 . 1 . . . . 86 ILE HN . 17226 1
682 . 1 1 86 86 ILE HA H 1 3.591 0.03 . 1 . . . . 86 ILE HA . 17226 1
683 . 1 1 86 86 ILE HB H 1 2.165 0.03 . 1 . . . . 86 ILE HB . 17226 1
684 . 1 1 86 86 ILE HG21 H 1 -0.092 0.03 . 1 . . . . 86 ILE HG21 . 17226 1
685 . 1 1 86 86 ILE HG22 H 1 -0.092 0.03 . 1 . . . . 86 ILE HG21 . 17226 1
686 . 1 1 86 86 ILE HG23 H 1 -0.092 0.03 . 1 . . . . 86 ILE HG21 . 17226 1
687 . 1 1 86 86 ILE C C 13 176.632 0.30 . 1 . . . . 86 ILE C . 17226 1
688 . 1 1 86 86 ILE CA C 13 62.163 0.30 . 1 . . . . 86 ILE CA . 17226 1
689 . 1 1 86 86 ILE CB C 13 37.717 0.30 . 1 . . . . 86 ILE CB . 17226 1
690 . 1 1 86 86 ILE CD1 C 13 15.160 0.30 . 1 . . . . 86 ILE CD1 . 17226 1
691 . 1 1 86 86 ILE CG1 C 13 28.650 0.30 . 1 . . . . 86 ILE CG1 . 17226 1
692 . 1 1 86 86 ILE CG2 C 13 18.540 0.30 . 1 . . . . 86 ILE CG2 . 17226 1
693 . 1 1 86 86 ILE N N 15 120.649 0.3 . 1 . . . . 86 ILE N . 17226 1
694 . 1 1 87 87 THR H H 1 10.266 0.03 . 1 . . . . 87 THR HN . 17226 1
695 . 1 1 87 87 THR HA H 1 4.658 0.03 . 1 . . . . 87 THR HA . 17226 1
696 . 1 1 87 87 THR C C 13 176.419 0.30 . 1 . . . . 87 THR C . 17226 1
697 . 1 1 87 87 THR CA C 13 60.023 0.30 . 1 . . . . 87 THR CA . 17226 1
698 . 1 1 87 87 THR CB C 13 72.879 0.30 . 1 . . . . 87 THR CB . 17226 1
699 . 1 1 87 87 THR N N 15 122.990 0.3 . 1 . . . . 87 THR N . 17226 1
700 . 1 1 88 88 MET H H 1 9.123 0.03 . 1 . . . . 88 MET HN . 17226 1
701 . 1 1 88 88 MET HB2 H 1 1.983 0.03 . 2 . . . . 88 MET HB1 . 17226 1
702 . 1 1 88 88 MET HG2 H 1 2.578 0.03 . 2 . . . . 88 MET HG1 . 17226 1
703 . 1 1 88 88 MET C C 13 178.108 0.30 . 1 . . . . 88 MET C . 17226 1
704 . 1 1 88 88 MET CA C 13 56.656 0.30 . 1 . . . . 88 MET CA . 17226 1
705 . 1 1 88 88 MET CB C 13 30.390 0.30 . 1 . . . . 88 MET CB . 17226 1
706 . 1 1 88 88 MET CG C 13 32.279 0.30 . 1 . . . . 88 MET CG . 17226 1
707 . 1 1 88 88 MET N N 15 119.634 0.3 . 1 . . . . 88 MET N . 17226 1
708 . 1 1 89 89 HIS H H 1 8.013 0.03 . 1 . . . . 89 HIS HN . 17226 1
709 . 1 1 89 89 HIS HA H 1 4.118 0.03 . 1 . . . . 89 HIS HA . 17226 1
710 . 1 1 89 89 HIS HB2 H 1 2.811 0.03 . 2 . . . . 89 HIS HB1 . 17226 1
711 . 1 1 89 89 HIS HB3 H 1 2.396 0.03 . 2 . . . . 89 HIS HB2 . 17226 1
712 . 1 1 89 89 HIS C C 13 177.077 0.30 . 1 . . . . 89 HIS C . 17226 1
713 . 1 1 89 89 HIS CA C 13 59.459 0.30 . 1 . . . . 89 HIS CA . 17226 1
714 . 1 1 89 89 HIS CB C 13 30.539 0.30 . 1 . . . . 89 HIS CB . 17226 1
715 . 1 1 89 89 HIS N N 15 120.343 0.3 . 1 . . . . 89 HIS N . 17226 1
716 . 1 1 90 90 HIS H H 1 6.694 0.03 . 1 . . . . 90 HIS HN . 17226 1
717 . 1 1 90 90 HIS HA H 1 3.384 0.03 . 1 . . . . 90 HIS HA . 17226 1
718 . 1 1 90 90 HIS HB2 H 1 2.617 0.03 . 2 . . . . 90 HIS HB1 . 17226 1
719 . 1 1 90 90 HIS HB3 H 1 2.001 0.03 . 2 . . . . 90 HIS HB2 . 17226 1
720 . 1 1 90 90 HIS C C 13 176.932 0.30 . 1 . . . . 90 HIS C . 17226 1
721 . 1 1 90 90 HIS CA C 13 60.590 0.30 . 1 . . . . 90 HIS CA . 17226 1
722 . 1 1 90 90 HIS CB C 13 30.982 0.30 . 1 . . . . 90 HIS CB . 17226 1
723 . 1 1 90 90 HIS N N 15 117.286 0.3 . 1 . . . . 90 HIS N . 17226 1
724 . 1 1 91 91 PHE H H 1 7.713 0.03 . 1 . . . . 91 PHE HN . 17226 1
725 . 1 1 91 91 PHE HA H 1 2.067 0.03 . 1 . . . . 91 PHE HA . 17226 1
726 . 1 1 91 91 PHE HB2 H 1 2.901 0.03 . 2 . . . . 91 PHE HB1 . 17226 1
727 . 1 1 91 91 PHE HB3 H 1 1.716 0.03 . 2 . . . . 91 PHE HB2 . 17226 1
728 . 1 1 91 91 PHE C C 13 175.446 0.30 . 1 . . . . 91 PHE C . 17226 1
729 . 1 1 91 91 PHE CA C 13 61.410 0.30 . 1 . . . . 91 PHE CA . 17226 1
730 . 1 1 91 91 PHE CB C 13 38.914 0.30 . 1 . . . . 91 PHE CB . 17226 1
731 . 1 1 91 91 PHE N N 15 118.177 0.3 . 1 . . . . 91 PHE N . 17226 1
732 . 1 1 92 92 SER H H 1 8.101 0.03 . 1 . . . . 92 SER HN . 17226 1
733 . 1 1 92 92 SER HB2 H 1 3.730 0.03 . 2 . . . . 92 SER HB1 . 17226 1
734 . 1 1 92 92 SER C C 13 177.170 0.30 . 1 . . . . 92 SER C . 17226 1
735 . 1 1 92 92 SER CA C 13 61.350 0.30 . 1 . . . . 92 SER CA . 17226 1
736 . 1 1 92 92 SER CB C 13 62.250 0.30 . 1 . . . . 92 SER CB . 17226 1
737 . 1 1 92 92 SER N N 15 114.483 0.3 . 1 . . . . 92 SER N . 17226 1
738 . 1 1 93 93 LEU H H 1 7.276 0.03 . 1 . . . . 93 LEU HN . 17226 1
739 . 1 1 93 93 LEU HA H 1 3.678 0.03 . 1 . . . . 93 LEU HA . 17226 1
740 . 1 1 93 93 LEU HB2 H 1 1.639 0.03 . 2 . . . . 93 LEU HB1 . 17226 1
741 . 1 1 93 93 LEU HB3 H 1 0.977 0.03 . 2 . . . . 93 LEU HB2 . 17226 1
742 . 1 1 93 93 LEU C C 13 179.439 0.30 . 1 . . . . 93 LEU C . 17226 1
743 . 1 1 93 93 LEU CA C 13 56.936 0.30 . 1 . . . . 93 LEU CA . 17226 1
744 . 1 1 93 93 LEU CB C 13 42.057 0.30 . 1 . . . . 93 LEU CB . 17226 1
745 . 1 1 93 93 LEU N N 15 121.983 0.3 . 1 . . . . 93 LEU N . 17226 1
746 . 1 1 94 94 VAL H H 1 7.228 0.03 . 1 . . . . 94 VAL HN . 17226 1
747 . 1 1 94 94 VAL HA H 1 3.130 0.03 . 1 . . . . 94 VAL HA . 17226 1
748 . 1 1 94 94 VAL HB H 1 0.487 0.03 . 1 . . . . 94 VAL HB . 17226 1
749 . 1 1 94 94 VAL HG11 H 1 -0.449 0.03 . 2 . . . . 94 VAL HG11 . 17226 1
750 . 1 1 94 94 VAL HG12 H 1 -0.449 0.03 . 2 . . . . 94 VAL HG11 . 17226 1
751 . 1 1 94 94 VAL HG13 H 1 -0.449 0.03 . 2 . . . . 94 VAL HG11 . 17226 1
752 . 1 1 94 94 VAL HG21 H 1 -0.675 0.03 . 2 . . . . 94 VAL HG21 . 17226 1
753 . 1 1 94 94 VAL HG22 H 1 -0.675 0.03 . 2 . . . . 94 VAL HG21 . 17226 1
754 . 1 1 94 94 VAL HG23 H 1 -0.675 0.03 . 2 . . . . 94 VAL HG21 . 17226 1
755 . 1 1 94 94 VAL C C 13 176.460 0.30 . 1 . . . . 94 VAL C . 17226 1
756 . 1 1 94 94 VAL CA C 13 67.718 0.30 . 1 . . . . 94 VAL CA . 17226 1
757 . 1 1 94 94 VAL CB C 13 30.390 0.30 . 1 . . . . 94 VAL CB . 17226 1
758 . 1 1 94 94 VAL CG1 C 13 24.776 0.30 . 1 . . . . 94 VAL CG1 . 17226 1
759 . 1 1 94 94 VAL CG2 C 13 19.492 0.30 . 1 . . . . 94 VAL CG2 . 17226 1
760 . 1 1 94 94 VAL N N 15 120.785 0.3 . 1 . . . . 94 VAL N . 17226 1
761 . 1 1 95 95 ALA H H 1 7.896 0.03 . 1 . . . . 95 ALA HN . 17226 1
762 . 1 1 95 95 ALA HA H 1 3.236 0.03 . 1 . . . . 95 ALA HA . 17226 1
763 . 1 1 95 95 ALA HB1 H 1 0.767 0.03 . 1 . . . . 95 ALA HB1 . 17226 1
764 . 1 1 95 95 ALA HB2 H 1 0.767 0.03 . 1 . . . . 95 ALA HB1 . 17226 1
765 . 1 1 95 95 ALA HB3 H 1 0.767 0.03 . 1 . . . . 95 ALA HB1 . 17226 1
766 . 1 1 95 95 ALA C C 13 179.460 0.30 . 1 . . . . 95 ALA C . 17226 1
767 . 1 1 95 95 ALA CA C 13 54.883 0.30 . 1 . . . . 95 ALA CA . 17226 1
768 . 1 1 95 95 ALA CB C 13 16.576 0.30 . 1 . . . . 95 ALA CB . 17226 1
769 . 1 1 95 95 ALA N N 15 121.677 0.3 . 1 . . . . 95 ALA N . 17226 1
770 . 1 1 96 96 GLY H H 1 7.541 0.03 . 1 . . . . 96 GLY HN . 17226 1
771 . 1 1 96 96 GLY HA2 H 1 3.643 0.03 . 2 . . . . 96 GLY HA1 . 17226 1
772 . 1 1 96 96 GLY HA3 H 1 3.506 0.03 . 2 . . . . 96 GLY HA2 . 17226 1
773 . 1 1 96 96 GLY C C 13 175.639 0.30 . 1 . . . . 96 GLY C . 17226 1
774 . 1 1 96 96 GLY CA C 13 46.960 0.30 . 1 . . . . 96 GLY CA . 17226 1
775 . 1 1 96 96 GLY N N 15 105.795 0.3 . 1 . . . . 96 GLY N . 17226 1
776 . 1 1 97 97 HIS H H 1 7.732 0.03 . 1 . . . . 97 HIS HN . 17226 1
777 . 1 1 97 97 HIS HB2 H 1 3.117 0.03 . 2 . . . . 97 HIS HB1 . 17226 1
778 . 1 1 97 97 HIS C C 13 178.760 0.30 . 1 . . . . 97 HIS C . 17226 1
779 . 1 1 97 97 HIS CA C 13 59.827 0.30 . 1 . . . . 97 HIS CA . 17226 1
780 . 1 1 97 97 HIS CB C 13 31.178 0.30 . 1 . . . . 97 HIS CB . 17226 1
781 . 1 1 97 97 HIS N N 15 121.193 0.3 . 1 . . . . 97 HIS N . 17226 1
782 . 1 1 98 98 LEU H H 1 8.526 0.03 . 1 . . . . 98 LEU HN . 17226 1
783 . 1 1 98 98 LEU HA H 1 4.064 0.03 . 1 . . . . 98 LEU HA . 17226 1
784 . 1 1 98 98 LEU HD11 H 1 0.155 0.03 . 2 . . . . 98 LEU HD11 . 17226 1
785 . 1 1 98 98 LEU HD12 H 1 0.155 0.03 . 2 . . . . 98 LEU HD11 . 17226 1
786 . 1 1 98 98 LEU HD13 H 1 0.155 0.03 . 2 . . . . 98 LEU HD11 . 17226 1
787 . 1 1 98 98 LEU HG H 1 0.315 0.03 . 1 . . . . 98 LEU HG . 17226 1
788 . 1 1 98 98 LEU C C 13 178.220 0.30 . 1 . . . . 98 LEU C . 17226 1
789 . 1 1 98 98 LEU CA C 13 58.110 0.30 . 1 . . . . 98 LEU CA . 17226 1
790 . 1 1 98 98 LEU CB C 13 40.750 0.30 . 1 . . . . 98 LEU CB . 17226 1
791 . 1 1 98 98 LEU CD1 C 13 21.195 0.30 . 1 . . . . 98 LEU CD1 . 17226 1
792 . 1 1 98 98 LEU CG C 13 25.546 0.30 . 1 . . . . 98 LEU CG . 17226 1
793 . 1 1 98 98 LEU N N 15 121.074 0.3 . 1 . . . . 98 LEU N . 17226 1
794 . 1 1 99 99 ALA H H 1 8.233 0.03 . 1 . . . . 99 ALA HN . 17226 1
795 . 1 1 99 99 ALA HA H 1 3.879 0.03 . 1 . . . . 99 ALA HA . 17226 1
796 . 1 1 99 99 ALA HB1 H 1 1.488 0.03 . 1 . . . . 99 ALA HB1 . 17226 1
797 . 1 1 99 99 ALA HB2 H 1 1.488 0.03 . 1 . . . . 99 ALA HB1 . 17226 1
798 . 1 1 99 99 ALA HB3 H 1 1.488 0.03 . 1 . . . . 99 ALA HB1 . 17226 1
799 . 1 1 99 99 ALA C C 13 180.490 0.30 . 1 . . . . 99 ALA C . 17226 1
800 . 1 1 99 99 ALA CA C 13 56.069 0.30 . 1 . . . . 99 ALA CA . 17226 1
801 . 1 1 99 99 ALA CB C 13 17.723 0.30 . 1 . . . . 99 ALA CB . 17226 1
802 . 1 1 99 99 ALA N N 15 121.689 0.3 . 1 . . . . 99 ALA N . 17226 1
803 . 1 1 100 100 ASP H H 1 8.590 0.03 . 1 . . . . 100 ASP HN . 17226 1
804 . 1 1 100 100 ASP HA H 1 4.379 0.03 . 1 . . . . 100 ASP HA . 17226 1
805 . 1 1 100 100 ASP HB2 H 1 3.105 0.03 . 2 . . . . 100 ASP HB1 . 17226 1
806 . 1 1 100 100 ASP HB3 H 1 2.735 0.03 . 2 . . . . 100 ASP HB2 . 17226 1
807 . 1 1 100 100 ASP C C 13 179.401 0.30 . 1 . . . . 100 ASP C . 17226 1
808 . 1 1 100 100 ASP CA C 13 57.506 0.30 . 1 . . . . 100 ASP CA . 17226 1
809 . 1 1 100 100 ASP CB C 13 40.294 0.30 . 1 . . . . 100 ASP CB . 17226 1
810 . 1 1 100 100 ASP N N 15 120.247 0.3 . 1 . . . . 100 ASP N . 17226 1
811 . 1 1 101 101 ALA H H 1 8.784 0.03 . 1 . . . . 101 ALA HN . 17226 1
812 . 1 1 101 101 ALA HA H 1 4.448 0.03 . 1 . . . . 101 ALA HA . 17226 1
813 . 1 1 101 101 ALA HB1 H 1 1.852 0.03 . 1 . . . . 101 ALA HB1 . 17226 1
814 . 1 1 101 101 ALA HB2 H 1 1.852 0.03 . 1 . . . . 101 ALA HB1 . 17226 1
815 . 1 1 101 101 ALA HB3 H 1 1.852 0.03 . 1 . . . . 101 ALA HB1 . 17226 1
816 . 1 1 101 101 ALA C C 13 180.947 0.30 . 1 . . . . 101 ALA C . 17226 1
817 . 1 1 101 101 ALA CA C 13 55.190 0.30 . 1 . . . . 101 ALA CA . 17226 1
818 . 1 1 101 101 ALA CB C 13 18.696 0.30 . 1 . . . . 101 ALA CB . 17226 1
819 . 1 1 101 101 ALA N N 15 125.997 0.3 . 1 . . . . 101 ALA N . 17226 1
820 . 1 1 102 102 LEU H H 1 8.786 0.03 . 1 . . . . 102 LEU HN . 17226 1
821 . 1 1 102 102 LEU HA H 1 3.950 0.03 . 1 . . . . 102 LEU HA . 17226 1
822 . 1 1 102 102 LEU HB2 H 1 2.141 0.03 . 2 . . . . 102 LEU HB1 . 17226 1
823 . 1 1 102 102 LEU HB3 H 1 1.172 0.03 . 2 . . . . 102 LEU HB2 . 17226 1
824 . 1 1 102 102 LEU HG H 1 0.802 0.03 . 1 . . . . 102 LEU HG . 17226 1
825 . 1 1 102 102 LEU C C 13 178.418 0.30 . 1 . . . . 102 LEU C . 17226 1
826 . 1 1 102 102 LEU CA C 13 58.434 0.30 . 1 . . . . 102 LEU CA . 17226 1
827 . 1 1 102 102 LEU CB C 13 42.063 0.30 . 1 . . . . 102 LEU CB . 17226 1
828 . 1 1 102 102 LEU CG C 13 26.890 0.30 . 1 . . . . 102 LEU CG . 17226 1
829 . 1 1 102 102 LEU N N 15 120.750 0.3 . 1 . . . . 102 LEU N . 17226 1
830 . 1 1 103 103 THR H H 1 8.627 0.03 . 1 . . . . 103 THR HN . 17226 1
831 . 1 1 103 103 THR HA H 1 3.940 0.03 . 1 . . . . 103 THR HA . 17226 1
832 . 1 1 103 103 THR HB H 1 4.400 0.03 . 1 . . . . 103 THR HB . 17226 1
833 . 1 1 103 103 THR C C 13 178.768 0.30 . 1 . . . . 103 THR C . 17226 1
834 . 1 1 103 103 THR CA C 13 67.090 0.30 . 1 . . . . 103 THR CA . 17226 1
835 . 1 1 103 103 THR CB C 13 68.548 0.30 . 1 . . . . 103 THR CB . 17226 1
836 . 1 1 103 103 THR CG2 C 13 21.230 0.30 . 1 . . . . 103 THR CG2 . 17226 1
837 . 1 1 103 103 THR N N 15 118.365 0.3 . 1 . . . . 103 THR N . 17226 1
838 . 1 1 104 104 ALA H H 1 8.369 0.03 . 1 . . . . 104 ALA HN . 17226 1
839 . 1 1 104 104 ALA HA H 1 4.187 0.03 . 1 . . . . 104 ALA HA . 17226 1
840 . 1 1 104 104 ALA HB1 H 1 1.597 0.03 . 1 . . . . 104 ALA HB1 . 17226 1
841 . 1 1 104 104 ALA HB2 H 1 1.597 0.03 . 1 . . . . 104 ALA HB1 . 17226 1
842 . 1 1 104 104 ALA HB3 H 1 1.597 0.03 . 1 . . . . 104 ALA HB1 . 17226 1
843 . 1 1 104 104 ALA C C 13 178.416 0.30 . 1 . . . . 104 ALA C . 17226 1
844 . 1 1 104 104 ALA CA C 13 54.915 0.30 . 1 . . . . 104 ALA CA . 17226 1
845 . 1 1 104 104 ALA CB C 13 17.981 0.30 . 1 . . . . 104 ALA CB . 17226 1
846 . 1 1 104 104 ALA N N 15 126.264 0.3 . 1 . . . . 104 ALA N . 17226 1
847 . 1 1 105 105 ALA H H 1 7.514 0.03 . 1 . . . . 105 ALA HN . 17226 1
848 . 1 1 105 105 ALA HA H 1 4.447 0.03 . 1 . . . . 105 ALA HA . 17226 1
849 . 1 1 105 105 ALA HB1 H 1 1.570 0.03 . 1 . . . . 105 ALA HB1 . 17226 1
850 . 1 1 105 105 ALA HB2 H 1 1.570 0.03 . 1 . . . . 105 ALA HB1 . 17226 1
851 . 1 1 105 105 ALA HB3 H 1 1.570 0.03 . 1 . . . . 105 ALA HB1 . 17226 1
852 . 1 1 105 105 ALA C C 13 177.484 0.30 . 1 . . . . 105 ALA C . 17226 1
853 . 1 1 105 105 ALA CA C 13 52.097 0.30 . 1 . . . . 105 ALA CA . 17226 1
854 . 1 1 105 105 ALA CB C 13 18.934 0.30 . 1 . . . . 105 ALA CB . 17226 1
855 . 1 1 105 105 ALA N N 15 118.412 0.3 . 1 . . . . 105 ALA N . 17226 1
856 . 1 1 106 106 GLY H H 1 7.956 0.03 . 1 . . . . 106 GLY HN . 17226 1
857 . 1 1 106 106 GLY HA2 H 1 4.170 0.03 . 2 . . . . 106 GLY HA1 . 17226 1
858 . 1 1 106 106 GLY C C 13 174.800 0.30 . 1 . . . . 106 GLY C . 17226 1
859 . 1 1 106 106 GLY CA C 13 45.459 0.30 . 1 . . . . 106 GLY CA . 17226 1
860 . 1 1 106 106 GLY N N 15 106.590 0.3 . 1 . . . . 106 GLY N . 17226 1
861 . 1 1 107 107 VAL H H 1 7.760 0.03 . 1 . . . . 107 VAL HN . 17226 1
862 . 1 1 107 107 VAL CA C 13 61.020 0.30 . 1 . . . . 107 VAL CA . 17226 1
863 . 1 1 107 107 VAL N N 15 124.203 0.3 . 1 . . . . 107 VAL N . 17226 1
864 . 1 1 108 108 PRO HA H 1 4.479 0.03 . 1 . . . . 108 PRO HA . 17226 1
865 . 1 1 108 108 PRO HB2 H 1 2.522 0.03 . 2 . . . . 108 PRO HB1 . 17226 1
866 . 1 1 108 108 PRO HB3 H 1 2.089 0.03 . 2 . . . . 108 PRO HB2 . 17226 1
867 . 1 1 108 108 PRO HG2 H 1 0.917 0.03 . 2 . . . . 108 PRO HG1 . 17226 1
868 . 1 1 108 108 PRO C C 13 178.420 0.30 . 1 . . . . 108 PRO C . 17226 1
869 . 1 1 108 108 PRO CA C 13 63.065 0.30 . 1 . . . . 108 PRO CA . 17226 1
870 . 1 1 108 108 PRO CB C 13 32.990 0.30 . 1 . . . . 108 PRO CB . 17226 1
871 . 1 1 108 108 PRO CG C 13 28.109 0.30 . 1 . . . . 108 PRO CG . 17226 1
872 . 1 1 109 109 SER H H 1 8.900 0.03 . 1 . . . . 109 SER HN . 17226 1
873 . 1 1 109 109 SER HA H 1 3.949 0.03 . 1 . . . . 109 SER HA . 17226 1
874 . 1 1 109 109 SER C C 13 176.608 0.30 . 1 . . . . 109 SER C . 17226 1
875 . 1 1 109 109 SER CA C 13 62.590 0.30 . 1 . . . . 109 SER CA . 17226 1
876 . 1 1 109 109 SER N N 15 119.450 0.3 . 1 . . . . 109 SER N . 17226 1
877 . 1 1 110 110 GLU H H 1 9.609 0.03 . 1 . . . . 110 GLU HN . 17226 1
878 . 1 1 110 110 GLU HA H 1 4.148 0.03 . 1 . . . . 110 GLU HA . 17226 1
879 . 1 1 110 110 GLU C C 13 178.766 0.30 . 1 . . . . 110 GLU C . 17226 1
880 . 1 1 110 110 GLU CA C 13 59.860 0.30 . 1 . . . . 110 GLU CA . 17226 1
881 . 1 1 110 110 GLU CB C 13 28.510 0.30 . 1 . . . . 110 GLU CB . 17226 1
882 . 1 1 110 110 GLU N N 15 120.439 0.3 . 1 . . . . 110 GLU N . 17226 1
883 . 1 1 111 111 THR H H 1 7.312 0.03 . 1 . . . . 111 THR HN . 17226 1
884 . 1 1 111 111 THR HA H 1 4.192 0.03 . 1 . . . . 111 THR HA . 17226 1
885 . 1 1 111 111 THR HB H 1 4.107 0.03 . 1 . . . . 111 THR HB . 17226 1
886 . 1 1 111 111 THR HG21 H 1 1.124 0.03 . 1 . . . . 111 THR HG1 . 17226 1
887 . 1 1 111 111 THR HG22 H 1 1.124 0.03 . 1 . . . . 111 THR HG1 . 17226 1
888 . 1 1 111 111 THR HG23 H 1 1.124 0.03 . 1 . . . . 111 THR HG1 . 17226 1
889 . 1 1 111 111 THR C C 13 176.055 0.30 . 1 . . . . 111 THR C . 17226 1
890 . 1 1 111 111 THR CA C 13 65.210 0.30 . 1 . . . . 111 THR CA . 17226 1
891 . 1 1 111 111 THR CB C 13 67.870 0.30 . 1 . . . . 111 THR CB . 17226 1
892 . 1 1 111 111 THR CG2 C 13 23.630 0.30 . 1 . . . . 111 THR CG2 . 17226 1
893 . 1 1 111 111 THR N N 15 118.255 0.3 . 1 . . . . 111 THR N . 17226 1
894 . 1 1 112 112 ILE H H 1 8.160 0.03 . 1 . . . . 112 ILE HN . 17226 1
895 . 1 1 112 112 ILE HA H 1 3.359 0.03 . 1 . . . . 112 ILE HA . 17226 1
896 . 1 1 112 112 ILE HB H 1 2.094 0.03 . 1 . . . . 112 ILE HB . 17226 1
897 . 1 1 112 112 ILE HD11 H 1 0.822 0.03 . 1 . . . . 112 ILE HD11 . 17226 1
898 . 1 1 112 112 ILE HD12 H 1 0.822 0.03 . 1 . . . . 112 ILE HD11 . 17226 1
899 . 1 1 112 112 ILE HD13 H 1 0.822 0.03 . 1 . . . . 112 ILE HD11 . 17226 1
900 . 1 1 112 112 ILE C C 13 177.589 0.30 . 1 . . . . 112 ILE C . 17226 1
901 . 1 1 112 112 ILE CA C 13 67.670 0.30 . 1 . . . . 112 ILE CA . 17226 1
902 . 1 1 112 112 ILE CB C 13 36.890 0.30 . 1 . . . . 112 ILE CB . 17226 1
903 . 1 1 112 112 ILE CD1 C 13 14.473 0.30 . 1 . . . . 112 ILE CD1 . 17226 1
904 . 1 1 112 112 ILE CG1 C 13 29.667 0.30 . 1 . . . . 112 ILE CG1 . 17226 1
905 . 1 1 112 112 ILE CG2 C 13 16.153 0.30 . 1 . . . . 112 ILE CG2 . 17226 1
906 . 1 1 112 112 ILE N N 15 124.744 0.3 . 1 . . . . 112 ILE N . 17226 1
907 . 1 1 113 113 THR H H 1 8.210 0.03 . 1 . . . . 113 THR HN . 17226 1
908 . 1 1 113 113 THR HA H 1 3.729 0.03 . 1 . . . . 113 THR HA . 17226 1
909 . 1 1 113 113 THR C C 13 176.984 0.30 . 1 . . . . 113 THR C . 17226 1
910 . 1 1 113 113 THR CA C 13 67.095 0.30 . 1 . . . . 113 THR CA . 17226 1
911 . 1 1 113 113 THR CB C 13 68.719 0.30 . 1 . . . . 113 THR CB . 17226 1
912 . 1 1 113 113 THR CG2 C 13 22.192 0.30 . 1 . . . . 113 THR CG2 . 17226 1
913 . 1 1 113 113 THR N N 15 115.615 0.3 . 1 . . . . 113 THR N . 17226 1
914 . 1 1 114 114 GLU H H 1 7.313 0.03 . 1 . . . . 114 GLU HN . 17226 1
915 . 1 1 114 114 GLU HA H 1 4.018 0.03 . 1 . . . . 114 GLU HA . 17226 1
916 . 1 1 114 114 GLU HB2 H 1 2.290 0.03 . 2 . . . . 114 GLU HB1 . 17226 1
917 . 1 1 114 114 GLU HB3 H 1 2.100 0.03 . 2 . . . . 114 GLU HB2 . 17226 1
918 . 1 1 114 114 GLU HG2 H 1 2.161 0.03 . 2 . . . . 114 GLU HG2 . 17226 1
919 . 1 1 114 114 GLU C C 13 179.560 0.30 . 1 . . . . 114 GLU C . 17226 1
920 . 1 1 114 114 GLU CA C 13 59.880 0.30 . 1 . . . . 114 GLU CA . 17226 1
921 . 1 1 114 114 GLU CB C 13 29.840 0.30 . 1 . . . . 114 GLU CB . 17226 1
922 . 1 1 114 114 GLU CG C 13 36.660 0.30 . 1 . . . . 114 GLU CG . 17226 1
923 . 1 1 114 114 GLU N N 15 121.667 0.3 . 1 . . . . 114 GLU N . 17226 1
924 . 1 1 115 115 ILE H H 1 8.416 0.03 . 1 . . . . 115 ILE HN . 17226 1
925 . 1 1 115 115 ILE HA H 1 3.401 0.03 . 1 . . . . 115 ILE HA . 17226 1
926 . 1 1 115 115 ILE HB H 1 1.952 0.03 . 1 . . . . 115 ILE HB . 17226 1
927 . 1 1 115 115 ILE C C 13 177.870 0.30 . 1 . . . . 115 ILE C . 17226 1
928 . 1 1 115 115 ILE CA C 13 66.330 0.30 . 1 . . . . 115 ILE CA . 17226 1
929 . 1 1 115 115 ILE CB C 13 37.620 0.30 . 1 . . . . 115 ILE CB . 17226 1
930 . 1 1 115 115 ILE CD1 C 13 14.854 0.30 . 1 . . . . 115 ILE CD1 . 17226 1
931 . 1 1 115 115 ILE CG1 C 13 30.686 0.30 . 1 . . . . 115 ILE CG1 . 17226 1
932 . 1 1 115 115 ILE CG2 C 13 16.413 0.30 . 1 . . . . 115 ILE CG2 . 17226 1
933 . 1 1 115 115 ILE N N 15 121.426 0.3 . 1 . . . . 115 ILE N . 17226 1
934 . 1 1 116 116 LEU H H 1 8.763 0.03 . 1 . . . . 116 LEU HN . 17226 1
935 . 1 1 116 116 LEU HA H 1 3.874 0.03 . 1 . . . . 116 LEU HA . 17226 1
936 . 1 1 116 116 LEU HB2 H 1 1.792 0.03 . 2 . . . . 116 LEU HB1 . 17226 1
937 . 1 1 116 116 LEU HB3 H 1 1.388 0.03 . 2 . . . . 116 LEU HB2 . 17226 1
938 . 1 1 116 116 LEU C C 13 179.623 0.30 . 1 . . . . 116 LEU C . 17226 1
939 . 1 1 116 116 LEU CA C 13 57.567 0.30 . 1 . . . . 116 LEU CA . 17226 1
940 . 1 1 116 116 LEU CB C 13 39.930 0.30 . 1 . . . . 116 LEU CB . 17226 1
941 . 1 1 116 116 LEU N N 15 119.760 0.3 . 1 . . . . 116 LEU N . 17226 1
942 . 1 1 117 117 GLY H H 1 7.860 0.03 . 1 . . . . 117 GLY HN . 17226 1
943 . 1 1 117 117 GLY HA2 H 1 3.910 0.03 . 2 . . . . 117 GLY HA1 . 17226 1
944 . 1 1 117 117 GLY HA3 H 1 3.820 0.03 . 2 . . . . 117 GLY HA2 . 17226 1
945 . 1 1 117 117 GLY C C 13 175.851 0.30 . 1 . . . . 117 GLY C . 17226 1
946 . 1 1 117 117 GLY CA C 13 46.533 0.30 . 1 . . . . 117 GLY CA . 17226 1
947 . 1 1 117 117 GLY N N 15 106.767 0.3 . 1 . . . . 117 GLY N . 17226 1
948 . 1 1 118 118 VAL H H 1 7.559 0.03 . 1 . . . . 118 VAL HN . 17226 1
949 . 1 1 118 118 VAL HA H 1 3.809 0.03 . 1 . . . . 118 VAL HA . 17226 1
950 . 1 1 118 118 VAL HB H 1 2.293 0.03 . 1 . . . . 118 VAL HB . 17226 1
951 . 1 1 118 118 VAL HG11 H 1 0.973 0.03 . 2 . . . . 118 VAL HG11 . 17226 1
952 . 1 1 118 118 VAL HG12 H 1 0.973 0.03 . 2 . . . . 118 VAL HG11 . 17226 1
953 . 1 1 118 118 VAL HG13 H 1 0.973 0.03 . 2 . . . . 118 VAL HG11 . 17226 1
954 . 1 1 118 118 VAL HG21 H 1 0.787 0.03 . 2 . . . . 118 VAL HG21 . 17226 1
955 . 1 1 118 118 VAL HG22 H 1 0.787 0.03 . 2 . . . . 118 VAL HG21 . 17226 1
956 . 1 1 118 118 VAL HG23 H 1 0.787 0.03 . 2 . . . . 118 VAL HG21 . 17226 1
957 . 1 1 118 118 VAL C C 13 177.330 0.30 . 1 . . . . 118 VAL C . 17226 1
958 . 1 1 118 118 VAL CA C 13 65.094 0.30 . 1 . . . . 118 VAL CA . 17226 1
959 . 1 1 118 118 VAL CB C 13 31.560 0.30 . 1 . . . . 118 VAL CB . 17226 1
960 . 1 1 118 118 VAL N N 15 121.296 0.3 . 1 . . . . 118 VAL N . 17226 1
961 . 1 1 119 119 ILE H H 1 7.302 0.03 . 1 . . . . 119 ILE HN . 17226 1
962 . 1 1 119 119 ILE HA H 1 4.103 0.03 . 1 . . . . 119 ILE HA . 17226 1
963 . 1 1 119 119 ILE HB H 1 1.809 0.03 . 1 . . . . 119 ILE HB . 17226 1
964 . 1 1 119 119 ILE HG12 H 1 1.184 0.03 . 1 . . . . 119 ILE HG12 . 17226 1
965 . 1 1 119 119 ILE C C 13 176.690 0.30 . 1 . . . . 119 ILE C . 17226 1
966 . 1 1 119 119 ILE CA C 13 60.977 0.30 . 1 . . . . 119 ILE CA . 17226 1
967 . 1 1 119 119 ILE CB C 13 38.185 0.30 . 1 . . . . 119 ILE CB . 17226 1
968 . 1 1 119 119 ILE CG1 C 13 27.049 0.30 . 1 . . . . 119 ILE CG1 . 17226 1
969 . 1 1 119 119 ILE CG2 C 13 18.204 0.30 . 1 . . . . 119 ILE CG2 . 17226 1
970 . 1 1 119 119 ILE N N 15 112.657 0.3 . 1 . . . . 119 ILE N . 17226 1
971 . 1 1 120 120 ALA H H 1 7.921 0.03 . 1 . . . . 120 ALA HN . 17226 1
972 . 1 1 120 120 ALA HB1 H 1 1.474 0.03 . 1 . . . . 120 ALA HB1 . 17226 1
973 . 1 1 120 120 ALA HB2 H 1 1.474 0.03 . 1 . . . . 120 ALA HB1 . 17226 1
974 . 1 1 120 120 ALA HB3 H 1 1.474 0.03 . 1 . . . . 120 ALA HB1 . 17226 1
975 . 1 1 120 120 ALA CA C 13 57.014 0.30 . 1 . . . . 120 ALA CA . 17226 1
976 . 1 1 120 120 ALA CB C 13 15.865 0.30 . 1 . . . . 120 ALA CB . 17226 1
977 . 1 1 120 120 ALA N N 15 124.164 0.3 . 1 . . . . 120 ALA N . 17226 1
978 . 1 1 121 121 PRO HA H 1 4.393 0.03 . 1 . . . . 121 PRO HA . 17226 1
979 . 1 1 121 121 PRO HB2 H 1 2.433 0.03 . 2 . . . . 121 PRO HB1 . 17226 1
980 . 1 1 121 121 PRO HD2 H 1 3.621 0.03 . 2 . . . . 121 PRO HD1 . 17226 1
981 . 1 1 121 121 PRO C C 13 177.950 0.30 . 1 . . . . 121 PRO C . 17226 1
982 . 1 1 121 121 PRO CA C 13 65.160 0.30 . 1 . . . . 121 PRO CA . 17226 1
983 . 1 1 121 121 PRO CB C 13 31.520 0.30 . 1 . . . . 121 PRO CB . 17226 1
984 . 1 1 121 121 PRO CD C 13 51.554 0.30 . 1 . . . . 121 PRO CD . 17226 1
985 . 1 1 121 121 PRO CG C 13 28.038 0.30 . 1 . . . . 121 PRO CG . 17226 1
986 . 1 1 122 122 LEU H H 1 7.851 0.03 . 1 . . . . 122 LEU HN . 17226 1
987 . 1 1 122 122 LEU HA H 1 4.428 0.03 . 1 . . . . 122 LEU HA . 17226 1
988 . 1 1 122 122 LEU HB2 H 1 2.013 0.03 . 2 . . . . 122 LEU HB1 . 17226 1
989 . 1 1 122 122 LEU HB3 H 1 1.449 0.03 . 2 . . . . 122 LEU HB2 . 17226 1
990 . 1 1 122 122 LEU HD11 H 1 1.006 0.03 . 2 . . . . 122 LEU HD11 . 17226 1
991 . 1 1 122 122 LEU HD12 H 1 1.006 0.03 . 2 . . . . 122 LEU HD11 . 17226 1
992 . 1 1 122 122 LEU HD13 H 1 1.006 0.03 . 2 . . . . 122 LEU HD11 . 17226 1
993 . 1 1 122 122 LEU HD21 H 1 0.817 0.03 . 2 . . . . 122 LEU HD21 . 17226 1
994 . 1 1 122 122 LEU HD22 H 1 0.817 0.03 . 2 . . . . 122 LEU HD21 . 17226 1
995 . 1 1 122 122 LEU HD23 H 1 0.817 0.03 . 2 . . . . 122 LEU HD21 . 17226 1
996 . 1 1 122 122 LEU HG H 1 1.847 0.03 . 1 . . . . 122 LEU HG . 17226 1
997 . 1 1 122 122 LEU C C 13 177.950 0.30 . 1 . . . . 122 LEU C . 17226 1
998 . 1 1 122 122 LEU CA C 13 55.805 0.30 . 1 . . . . 122 LEU CA . 17226 1
999 . 1 1 122 122 LEU CB C 13 41.220 0.30 . 1 . . . . 122 LEU CB . 17226 1
1000 . 1 1 122 122 LEU CD1 C 13 26.926 0.30 . 1 . . . . 122 LEU CD1 . 17226 1
1001 . 1 1 122 122 LEU CG C 13 23.071 0.30 . 1 . . . . 122 LEU CG . 17226 1
1002 . 1 1 122 122 LEU N N 15 115.300 0.3 . 1 . . . . 122 LEU N . 17226 1
1003 . 1 1 123 123 ALA H H 1 7.330 0.03 . 1 . . . . 123 ALA HN . 17226 1
1004 . 1 1 123 123 ALA HA H 1 2.701 0.03 . 1 . . . . 123 ALA HA . 17226 1
1005 . 1 1 123 123 ALA HB1 H 1 0.278 0.03 . 1 . . . . 123 ALA HB1 . 17226 1
1006 . 1 1 123 123 ALA HB2 H 1 0.278 0.03 . 1 . . . . 123 ALA HB1 . 17226 1
1007 . 1 1 123 123 ALA HB3 H 1 0.278 0.03 . 1 . . . . 123 ALA HB1 . 17226 1
1008 . 1 1 123 123 ALA C C 13 179.760 0.30 . 1 . . . . 123 ALA C . 17226 1
1009 . 1 1 123 123 ALA CA C 13 56.130 0.30 . 1 . . . . 123 ALA CA . 17226 1
1010 . 1 1 123 123 ALA CB C 13 17.006 0.30 . 1 . . . . 123 ALA CB . 17226 1
1011 . 1 1 123 123 ALA N N 15 121.382 0.3 . 1 . . . . 123 ALA N . 17226 1
1012 . 1 1 124 124 VAL H H 1 7.266 0.03 . 1 . . . . 124 VAL HN . 17226 1
1013 . 1 1 124 124 VAL HA H 1 3.803 0.03 . 1 . . . . 124 VAL HA . 17226 1
1014 . 1 1 124 124 VAL HB H 1 2.205 0.03 . 1 . . . . 124 VAL HB . 17226 1
1015 . 1 1 124 124 VAL C C 13 176.785 0.30 . 1 . . . . 124 VAL C . 17226 1
1016 . 1 1 124 124 VAL CA C 13 65.150 0.30 . 1 . . . . 124 VAL CA . 17226 1
1017 . 1 1 124 124 VAL CB C 13 31.710 0.30 . 1 . . . . 124 VAL CB . 17226 1
1018 . 1 1 124 124 VAL CG1 C 13 20.869 0.30 . 1 . . . . 124 VAL CG1 . 17226 1
1019 . 1 1 124 124 VAL CG2 C 13 21.394 0.30 . 1 . . . . 124 VAL CG2 . 17226 1
1020 . 1 1 124 124 VAL N N 15 115.484 0.3 . 1 . . . . 124 VAL N . 17226 1
1021 . 1 1 125 125 ASP H H 1 7.685 0.03 . 1 . . . . 125 ASP HN . 17226 1
1022 . 1 1 125 125 ASP HA H 1 5.259 0.03 . 1 . . . . 125 ASP HA . 17226 1
1023 . 1 1 125 125 ASP HB2 H 1 3.390 0.03 . 2 . . . . 125 ASP HB1 . 17226 1
1024 . 1 1 125 125 ASP C C 13 178.720 0.30 . 1 . . . . 125 ASP C . 17226 1
1025 . 1 1 125 125 ASP CA C 13 57.308 0.30 . 1 . . . . 125 ASP CA . 17226 1
1026 . 1 1 125 125 ASP CB C 13 42.980 0.30 . 1 . . . . 125 ASP CB . 17226 1
1027 . 1 1 125 125 ASP N N 15 120.184 0.3 . 1 . . . . 125 ASP N . 17226 1
1028 . 1 1 126 126 VAL H H 1 8.725 0.03 . 1 . . . . 126 VAL HN . 17226 1
1029 . 1 1 126 126 VAL HA H 1 6.739 0.03 . 1 . . . . 126 VAL HA . 17226 1
1030 . 1 1 126 126 VAL HB H 1 2.400 0.03 . 1 . . . . 126 VAL HB . 17226 1
1031 . 1 1 126 126 VAL C C 13 176.140 0.30 . 1 . . . . 126 VAL C . 17226 1
1032 . 1 1 126 126 VAL CA C 13 67.360 0.30 . 1 . . . . 126 VAL CA . 17226 1
1033 . 1 1 126 126 VAL CB C 13 33.515 0.30 . 1 . . . . 126 VAL CB . 17226 1
1034 . 1 1 126 126 VAL N N 15 117.460 0.3 . 1 . . . . 126 VAL N . 17226 1
1035 . 1 1 127 127 THR H H 1 7.826 0.03 . 1 . . . . 127 THR HN . 17226 1
1036 . 1 1 127 127 THR HA H 1 4.868 0.03 . 1 . . . . 127 THR HA . 17226 1
1037 . 1 1 127 127 THR HB H 1 4.431 0.03 . 1 . . . . 127 THR HB . 17226 1
1038 . 1 1 127 127 THR HG21 H 1 0.830 0.03 . 1 . . . . 127 THR HG21 . 17226 1
1039 . 1 1 127 127 THR HG22 H 1 0.830 0.03 . 1 . . . . 127 THR HG21 . 17226 1
1040 . 1 1 127 127 THR HG23 H 1 0.830 0.03 . 1 . . . . 127 THR HG21 . 17226 1
1041 . 1 1 127 127 THR C C 13 175.430 0.30 . 1 . . . . 127 THR C . 17226 1
1042 . 1 1 127 127 THR CA C 13 61.100 0.30 . 1 . . . . 127 THR CA . 17226 1
1043 . 1 1 127 127 THR CB C 13 70.860 0.30 . 1 . . . . 127 THR CB . 17226 1
1044 . 1 1 127 127 THR CG2 C 13 21.519 0.30 . 1 . . . . 127 THR CG2 . 17226 1
1045 . 1 1 127 127 THR N N 15 104.670 0.3 . 1 . . . . 127 THR N . 17226 1
1046 . 1 1 128 128 SER H H 1 8.370 0.03 . 1 . . . . 128 SER HN . 17226 1
1047 . 1 1 128 128 SER HA H 1 4.855 0.03 . 1 . . . . 128 SER HA . 17226 1
1048 . 1 1 128 128 SER HB2 H 1 4.519 0.03 . 2 . . . . 128 SER HB1 . 17226 1
1049 . 1 1 128 128 SER C C 13 175.644 0.30 . 1 . . . . 128 SER C . 17226 1
1050 . 1 1 128 128 SER CA C 13 59.690 0.30 . 1 . . . . 128 SER CA . 17226 1
1051 . 1 1 128 128 SER CB C 13 64.578 0.30 . 1 . . . . 128 SER CB . 17226 1
1052 . 1 1 128 128 SER N N 15 116.260 0.3 . 1 . . . . 128 SER N . 17226 1
1053 . 1 1 129 129 GLY H H 1 8.880 0.03 . 1 . . . . 129 GLY HN . 17226 1
1054 . 1 1 129 129 GLY HA2 H 1 4.383 0.03 . 2 . . . . 129 GLY HA1 . 17226 1
1055 . 1 1 129 129 GLY HA3 H 1 4.224 0.03 . 2 . . . . 129 GLY HA2 . 17226 1
1056 . 1 1 129 129 GLY C C 13 174.250 0.30 . 1 . . . . 129 GLY C . 17226 1
1057 . 1 1 129 129 GLY CA C 13 45.514 0.30 . 1 . . . . 129 GLY CA . 17226 1
1058 . 1 1 129 129 GLY N N 15 111.260 0.3 . 1 . . . . 129 GLY N . 17226 1
1059 . 1 1 130 130 GLU H H 1 8.577 0.03 . 1 . . . . 130 GLU HN . 17226 1
1060 . 1 1 130 130 GLU HA H 1 4.495 0.03 . 1 . . . . 130 GLU HA . 17226 1
1061 . 1 1 130 130 GLU HB2 H 1 2.218 0.03 . 2 . . . . 130 GLU HB1 . 17226 1
1062 . 1 1 130 130 GLU HB3 H 1 2.101 0.03 . 2 . . . . 130 GLU HB2 . 17226 1
1063 . 1 1 130 130 GLU HG2 H 1 2.416 0.03 . 2 . . . . 130 GLU HG1 . 17226 1
1064 . 1 1 130 130 GLU HG3 H 1 2.405 0.03 . 2 . . . . 130 GLU HG2 . 17226 1
1065 . 1 1 130 130 GLU C C 13 176.715 0.30 . 1 . . . . 130 GLU C . 17226 1
1066 . 1 1 130 130 GLU CA C 13 56.737 0.30 . 1 . . . . 130 GLU CA . 17226 1
1067 . 1 1 130 130 GLU CB C 13 30.670 0.30 . 1 . . . . 130 GLU CB . 17226 1
1068 . 1 1 130 130 GLU CG C 13 36.396 0.30 . 1 . . . . 130 GLU CG . 17226 1
1069 . 1 1 130 130 GLU N N 15 120.864 0.3 . 1 . . . . 130 GLU N . 17226 1
1070 . 1 1 131 131 SER H H 1 8.653 0.03 . 1 . . . . 131 SER HN . 17226 1
1071 . 1 1 131 131 SER HA H 1 4.656 0.03 . 1 . . . . 131 SER HA . 17226 1
1072 . 1 1 131 131 SER HB2 H 1 3.993 0.03 . 2 . . . . 131 SER HB1 . 17226 1
1073 . 1 1 131 131 SER C C 13 174.898 0.30 . 1 . . . . 131 SER C . 17226 1
1074 . 1 1 131 131 SER CA C 13 58.390 0.30 . 1 . . . . 131 SER CA . 17226 1
1075 . 1 1 131 131 SER CB C 13 63.990 0.30 . 1 . . . . 131 SER CB . 17226 1
1076 . 1 1 131 131 SER N N 15 117.170 0.3 . 1 . . . . 131 SER N . 17226 1
1077 . 1 1 132 132 THR H H 1 8.399 0.03 . 1 . . . . 132 THR HN . 17226 1
1078 . 1 1 132 132 THR HA H 1 4.514 0.03 . 1 . . . . 132 THR HA . 17226 1
1079 . 1 1 132 132 THR HB H 1 4.349 0.03 . 1 . . . . 132 THR HB . 17226 1
1080 . 1 1 132 132 THR HG21 H 1 1.295 0.03 . 1 . . . . 132 THR HG21 . 17226 1
1081 . 1 1 132 132 THR HG22 H 1 1.295 0.03 . 1 . . . . 132 THR HG21 . 17226 1
1082 . 1 1 132 132 THR HG23 H 1 1.295 0.03 . 1 . . . . 132 THR HG21 . 17226 1
1083 . 1 1 132 132 THR C C 13 174.682 0.30 . 1 . . . . 132 THR C . 17226 1
1084 . 1 1 132 132 THR CA C 13 61.870 0.30 . 1 . . . . 132 THR CA . 17226 1
1085 . 1 1 132 132 THR CB C 13 69.785 0.30 . 1 . . . . 132 THR CB . 17226 1
1086 . 1 1 132 132 THR CG2 C 13 21.783 0.30 . 1 . . . . 132 THR CG2 . 17226 1
1087 . 1 1 132 132 THR N N 15 116.246 0.3 . 1 . . . . 132 THR N . 17226 1
1088 . 1 1 133 133 THR H H 1 8.250 0.03 . 1 . . . . 133 THR HN . 17226 1
1089 . 1 1 133 133 THR HA H 1 4.395 0.03 . 1 . . . . 133 THR HA . 17226 1
1090 . 1 1 133 133 THR HB H 1 4.225 0.03 . 1 . . . . 133 THR HB . 17226 1
1091 . 1 1 133 133 THR HG21 H 1 1.257 0.03 . 1 . . . . 133 THR HG21 . 17226 1
1092 . 1 1 133 133 THR HG22 H 1 1.257 0.03 . 1 . . . . 133 THR HG21 . 17226 1
1093 . 1 1 133 133 THR HG23 H 1 1.257 0.03 . 1 . . . . 133 THR HG21 . 17226 1
1094 . 1 1 133 133 THR C C 13 173.865 0.30 . 1 . . . . 133 THR C . 17226 1
1095 . 1 1 133 133 THR CA C 13 61.703 0.30 . 1 . . . . 133 THR CA . 17226 1
1096 . 1 1 133 133 THR CB C 13 69.903 0.30 . 1 . . . . 133 THR CB . 17226 1
1097 . 1 1 133 133 THR CG2 C 13 21.861 0.30 . 1 . . . . 133 THR CG2 . 17226 1
1098 . 1 1 133 133 THR N N 15 116.960 0.3 . 1 . . . . 133 THR N . 17226 1
1099 . 1 1 134 134 ALA H H 1 8.386 0.03 . 1 . . . . 134 ALA HN . 17226 1
1100 . 1 1 134 134 ALA HA H 1 4.653 0.03 . 1 . . . . 134 ALA HA . 17226 1
1101 . 1 1 134 134 ALA HB1 H 1 1.415 0.03 . 1 . . . . 134 ALA HB1 . 17226 1
1102 . 1 1 134 134 ALA HB2 H 1 1.415 0.03 . 1 . . . . 134 ALA HB1 . 17226 1
1103 . 1 1 134 134 ALA HB3 H 1 1.415 0.03 . 1 . . . . 134 ALA HB1 . 17226 1
1104 . 1 1 134 134 ALA CA C 13 50.580 0.30 . 1 . . . . 134 ALA CA . 17226 1
1105 . 1 1 134 134 ALA CB C 13 18.300 0.30 . 1 . . . . 134 ALA CB . 17226 1
1106 . 1 1 134 134 ALA N N 15 128.617 0.3 . 1 . . . . 134 ALA N . 17226 1
1107 . 1 1 135 135 PRO HA H 1 4.499 0.03 . 1 . . . . 135 PRO HA . 17226 1
1108 . 1 1 135 135 PRO HB2 H 1 2.299 0.03 . 2 . . . . 135 PRO HB1 . 17226 1
1109 . 1 1 135 135 PRO HB3 H 1 2.053 0.03 . 2 . . . . 135 PRO HB2 . 17226 1
1110 . 1 1 135 135 PRO HD2 H 1 3.837 0.03 . 2 . . . . 135 PRO HD1 . 17226 1
1111 . 1 1 135 135 PRO HD3 H 1 3.708 0.03 . 2 . . . . 135 PRO HD2 . 17226 1
1112 . 1 1 135 135 PRO HG2 H 1 1.976 0.03 . 2 . . . . 135 PRO HG1 . 17226 1
1113 . 1 1 135 135 PRO HG3 H 1 1.983 0.03 . 2 . . . . 135 PRO HG2 . 17226 1
1114 . 1 1 135 135 PRO C C 13 176.150 0.30 . 1 . . . . 135 PRO C . 17226 1
1115 . 1 1 135 135 PRO CA C 13 63.260 0.30 . 1 . . . . 135 PRO CA . 17226 1
1116 . 1 1 135 135 PRO CB C 13 31.900 0.30 . 1 . . . . 135 PRO CB . 17226 1
1117 . 1 1 135 135 PRO CD C 13 50.599 0.30 . 1 . . . . 135 PRO CD . 17226 1
1118 . 1 1 135 135 PRO CG C 13 27.371 0.30 . 1 . . . . 135 PRO CG . 17226 1
1119 . 1 1 136 136 VAL H H 1 7.751 0.03 . 1 . . . . 136 VAL HN . 17226 1
1120 . 1 1 136 136 VAL HA H 1 4.034 0.03 . 1 . . . . 136 VAL HA . 17226 1
1121 . 1 1 136 136 VAL HB H 1 2.096 0.03 . 1 . . . . 136 VAL HB . 17226 1
1122 . 1 1 136 136 VAL CA C 13 63.480 0.30 . 1 . . . . 136 VAL CA . 17226 1
1123 . 1 1 136 136 VAL CB C 13 33.298 0.30 . 1 . . . . 136 VAL CB . 17226 1
1124 . 1 1 136 136 VAL N N 15 124.071 0.3 . 1 . . . . 136 VAL N . 17226 1
stop_
save_