###################################
# 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_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 10167
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10167 1
2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10167 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 9 9 GLY CA C 13 45.191 0.300 . 1 . . . . 9 GLY CA . 10167 1
2 . 1 1 9 9 GLY HA2 H 1 3.910 0.030 . 1 . . . . 9 GLY HA2 . 10167 1
3 . 1 1 9 9 GLY HA3 H 1 3.910 0.030 . 1 . . . . 9 GLY HA3 . 10167 1
4 . 1 1 9 9 GLY C C 13 174.087 0.300 . 1 . . . . 9 GLY C . 10167 1
5 . 1 1 10 10 GLU N N 15 120.188 0.300 . 1 . . . . 10 GLU N . 10167 1
6 . 1 1 10 10 GLU H H 1 8.196 0.030 . 1 . . . . 10 GLU H . 10167 1
7 . 1 1 10 10 GLU CA C 13 56.995 0.300 . 1 . . . . 10 GLU CA . 10167 1
8 . 1 1 10 10 GLU HA H 1 4.167 0.030 . 1 . . . . 10 GLU HA . 10167 1
9 . 1 1 10 10 GLU CB C 13 30.393 0.300 . 1 . . . . 10 GLU CB . 10167 1
10 . 1 1 10 10 GLU HB2 H 1 1.916 0.030 . 2 . . . . 10 GLU HB2 . 10167 1
11 . 1 1 10 10 GLU HB3 H 1 1.979 0.030 . 2 . . . . 10 GLU HB3 . 10167 1
12 . 1 1 10 10 GLU CG C 13 36.287 0.300 . 1 . . . . 10 GLU CG . 10167 1
13 . 1 1 10 10 GLU HG2 H 1 2.211 0.030 . 2 . . . . 10 GLU HG2 . 10167 1
14 . 1 1 10 10 GLU HG3 H 1 2.260 0.030 . 2 . . . . 10 GLU HG3 . 10167 1
15 . 1 1 10 10 GLU C C 13 176.271 0.300 . 1 . . . . 10 GLU C . 10167 1
16 . 1 1 11 11 LYS N N 15 120.905 0.300 . 1 . . . . 11 LYS N . 10167 1
17 . 1 1 11 11 LYS H H 1 8.243 0.030 . 1 . . . . 11 LYS H . 10167 1
18 . 1 1 11 11 LYS CA C 13 53.823 0.300 . 1 . . . . 11 LYS CA . 10167 1
19 . 1 1 11 11 LYS HA H 1 4.538 0.030 . 1 . . . . 11 LYS HA . 10167 1
20 . 1 1 11 11 LYS CB C 13 33.303 0.300 . 1 . . . . 11 LYS CB . 10167 1
21 . 1 1 11 11 LYS HB2 H 1 1.572 0.030 . 2 . . . . 11 LYS HB2 . 10167 1
22 . 1 1 11 11 LYS HB3 H 1 1.390 0.030 . 2 . . . . 11 LYS HB3 . 10167 1
23 . 1 1 11 11 LYS CG C 13 25.165 0.300 . 1 . . . . 11 LYS CG . 10167 1
24 . 1 1 11 11 LYS HG2 H 1 1.333 0.030 . 2 . . . . 11 LYS HG2 . 10167 1
25 . 1 1 11 11 LYS HG3 H 1 1.083 0.030 . 2 . . . . 11 LYS HG3 . 10167 1
26 . 1 1 11 11 LYS CD C 13 29.720 0.300 . 1 . . . . 11 LYS CD . 10167 1
27 . 1 1 11 11 LYS HD2 H 1 1.490 0.030 . 1 . . . . 11 LYS HD2 . 10167 1
28 . 1 1 11 11 LYS HD3 H 1 1.490 0.030 . 1 . . . . 11 LYS HD3 . 10167 1
29 . 1 1 11 11 LYS CE C 13 42.228 0.300 . 1 . . . . 11 LYS CE . 10167 1
30 . 1 1 11 11 LYS HE2 H 1 2.889 0.030 . 1 . . . . 11 LYS HE2 . 10167 1
31 . 1 1 11 11 LYS HE3 H 1 2.889 0.030 . 1 . . . . 11 LYS HE3 . 10167 1
32 . 1 1 11 11 LYS C C 13 173.935 0.300 . 1 . . . . 11 LYS C . 10167 1
33 . 1 1 12 12 PRO CA C 13 63.584 0.300 . 1 . . . . 12 PRO CA . 10167 1
34 . 1 1 12 12 PRO HA H 1 4.263 0.030 . 1 . . . . 12 PRO HA . 10167 1
35 . 1 1 12 12 PRO CB C 13 32.345 0.300 . 1 . . . . 12 PRO CB . 10167 1
36 . 1 1 12 12 PRO HB2 H 1 1.186 0.030 . 2 . . . . 12 PRO HB2 . 10167 1
37 . 1 1 12 12 PRO HB3 H 1 1.978 0.030 . 2 . . . . 12 PRO HB3 . 10167 1
38 . 1 1 12 12 PRO CG C 13 26.551 0.300 . 1 . . . . 12 PRO CG . 10167 1
39 . 1 1 12 12 PRO HG2 H 1 1.543 0.030 . 2 . . . . 12 PRO HG2 . 10167 1
40 . 1 1 12 12 PRO HG3 H 1 1.774 0.030 . 2 . . . . 12 PRO HG3 . 10167 1
41 . 1 1 12 12 PRO CD C 13 50.268 0.300 . 1 . . . . 12 PRO CD . 10167 1
42 . 1 1 12 12 PRO HD2 H 1 3.643 0.030 . 2 . . . . 12 PRO HD2 . 10167 1
43 . 1 1 12 12 PRO HD3 H 1 3.719 0.030 . 2 . . . . 12 PRO HD3 . 10167 1
44 . 1 1 12 12 PRO C C 13 176.502 0.300 . 1 . . . . 12 PRO C . 10167 1
45 . 1 1 13 13 PHE N N 15 118.504 0.300 . 1 . . . . 13 PHE N . 10167 1
46 . 1 1 13 13 PHE H H 1 7.832 0.030 . 1 . . . . 13 PHE H . 10167 1
47 . 1 1 13 13 PHE CA C 13 57.518 0.300 . 1 . . . . 13 PHE CA . 10167 1
48 . 1 1 13 13 PHE HA H 1 4.678 0.030 . 1 . . . . 13 PHE HA . 10167 1
49 . 1 1 13 13 PHE CB C 13 39.051 0.300 . 1 . . . . 13 PHE CB . 10167 1
50 . 1 1 13 13 PHE HB2 H 1 2.903 0.030 . 2 . . . . 13 PHE HB2 . 10167 1
51 . 1 1 13 13 PHE HB3 H 1 3.075 0.030 . 2 . . . . 13 PHE HB3 . 10167 1
52 . 1 1 13 13 PHE CD1 C 13 132.047 0.300 . 1 . . . . 13 PHE CD1 . 10167 1
53 . 1 1 13 13 PHE HD1 H 1 7.116 0.030 . 1 . . . . 13 PHE HD1 . 10167 1
54 . 1 1 13 13 PHE CD2 C 13 132.047 0.300 . 1 . . . . 13 PHE CD2 . 10167 1
55 . 1 1 13 13 PHE HD2 H 1 7.116 0.030 . 1 . . . . 13 PHE HD2 . 10167 1
56 . 1 1 13 13 PHE CE1 C 13 131.737 0.300 . 1 . . . . 13 PHE CE1 . 10167 1
57 . 1 1 13 13 PHE HE1 H 1 7.426 0.030 . 1 . . . . 13 PHE HE1 . 10167 1
58 . 1 1 13 13 PHE CE2 C 13 131.737 0.300 . 1 . . . . 13 PHE CE2 . 10167 1
59 . 1 1 13 13 PHE HE2 H 1 7.426 0.030 . 1 . . . . 13 PHE HE2 . 10167 1
60 . 1 1 13 13 PHE CZ C 13 130.240 0.300 . 1 . . . . 13 PHE CZ . 10167 1
61 . 1 1 13 13 PHE HZ H 1 7.383 0.030 . 1 . . . . 13 PHE HZ . 10167 1
62 . 1 1 13 13 PHE C C 13 174.345 0.300 . 1 . . . . 13 PHE C . 10167 1
63 . 1 1 14 14 LYS N N 15 124.932 0.300 . 1 . . . . 14 LYS N . 10167 1
64 . 1 1 14 14 LYS H H 1 8.568 0.030 . 1 . . . . 14 LYS H . 10167 1
65 . 1 1 14 14 LYS CA C 13 55.189 0.300 . 1 . . . . 14 LYS CA . 10167 1
66 . 1 1 14 14 LYS HA H 1 4.997 0.030 . 1 . . . . 14 LYS HA . 10167 1
67 . 1 1 14 14 LYS CB C 13 35.460 0.300 . 1 . . . . 14 LYS CB . 10167 1
68 . 1 1 14 14 LYS HB2 H 1 1.609 0.030 . 2 . . . . 14 LYS HB2 . 10167 1
69 . 1 1 14 14 LYS HB3 H 1 1.648 0.030 . 2 . . . . 14 LYS HB3 . 10167 1
70 . 1 1 14 14 LYS CG C 13 24.961 0.300 . 1 . . . . 14 LYS CG . 10167 1
71 . 1 1 14 14 LYS HG2 H 1 1.178 0.030 . 2 . . . . 14 LYS HG2 . 10167 1
72 . 1 1 14 14 LYS HG3 H 1 1.224 0.030 . 2 . . . . 14 LYS HG3 . 10167 1
73 . 1 1 14 14 LYS CD C 13 29.424 0.300 . 1 . . . . 14 LYS CD . 10167 1
74 . 1 1 14 14 LYS HD2 H 1 1.602 0.030 . 1 . . . . 14 LYS HD2 . 10167 1
75 . 1 1 14 14 LYS HD3 H 1 1.602 0.030 . 1 . . . . 14 LYS HD3 . 10167 1
76 . 1 1 14 14 LYS CE C 13 42.057 0.300 . 1 . . . . 14 LYS CE . 10167 1
77 . 1 1 14 14 LYS HE2 H 1 2.946 0.030 . 1 . . . . 14 LYS HE2 . 10167 1
78 . 1 1 14 14 LYS HE3 H 1 2.946 0.030 . 1 . . . . 14 LYS HE3 . 10167 1
79 . 1 1 14 14 LYS C C 13 175.180 0.300 . 1 . . . . 14 LYS C . 10167 1
80 . 1 1 15 15 CYS N N 15 127.244 0.300 . 1 . . . . 15 CYS N . 10167 1
81 . 1 1 15 15 CYS H H 1 9.264 0.030 . 1 . . . . 15 CYS H . 10167 1
82 . 1 1 15 15 CYS CA C 13 59.641 0.300 . 1 . . . . 15 CYS CA . 10167 1
83 . 1 1 15 15 CYS HA H 1 4.567 0.030 . 1 . . . . 15 CYS HA . 10167 1
84 . 1 1 15 15 CYS CB C 13 29.799 0.300 . 1 . . . . 15 CYS CB . 10167 1
85 . 1 1 15 15 CYS HB2 H 1 2.868 0.030 . 2 . . . . 15 CYS HB2 . 10167 1
86 . 1 1 15 15 CYS HB3 H 1 3.383 0.030 . 2 . . . . 15 CYS HB3 . 10167 1
87 . 1 1 15 15 CYS C C 13 177.766 0.300 . 1 . . . . 15 CYS C . 10167 1
88 . 1 1 16 16 LYS N N 15 132.596 0.300 . 1 . . . . 16 LYS N . 10167 1
89 . 1 1 16 16 LYS H H 1 9.452 0.030 . 1 . . . . 16 LYS H . 10167 1
90 . 1 1 16 16 LYS CA C 13 58.651 0.300 . 1 . . . . 16 LYS CA . 10167 1
91 . 1 1 16 16 LYS HA H 1 4.142 0.030 . 1 . . . . 16 LYS HA . 10167 1
92 . 1 1 16 16 LYS CB C 13 32.384 0.300 . 1 . . . . 16 LYS CB . 10167 1
93 . 1 1 16 16 LYS HB2 H 1 1.953 0.030 . 1 . . . . 16 LYS HB2 . 10167 1
94 . 1 1 16 16 LYS HB3 H 1 1.953 0.030 . 1 . . . . 16 LYS HB3 . 10167 1
95 . 1 1 16 16 LYS CG C 13 24.946 0.300 . 1 . . . . 16 LYS CG . 10167 1
96 . 1 1 16 16 LYS HG2 H 1 1.556 0.030 . 1 . . . . 16 LYS HG2 . 10167 1
97 . 1 1 16 16 LYS HG3 H 1 1.556 0.030 . 1 . . . . 16 LYS HG3 . 10167 1
98 . 1 1 16 16 LYS CD C 13 29.236 0.300 . 1 . . . . 16 LYS CD . 10167 1
99 . 1 1 16 16 LYS HD2 H 1 1.739 0.030 . 1 . . . . 16 LYS HD2 . 10167 1
100 . 1 1 16 16 LYS HD3 H 1 1.739 0.030 . 1 . . . . 16 LYS HD3 . 10167 1
101 . 1 1 16 16 LYS CE C 13 42.163 0.300 . 1 . . . . 16 LYS CE . 10167 1
102 . 1 1 16 16 LYS HE2 H 1 3.057 0.030 . 1 . . . . 16 LYS HE2 . 10167 1
103 . 1 1 16 16 LYS HE3 H 1 3.057 0.030 . 1 . . . . 16 LYS HE3 . 10167 1
104 . 1 1 16 16 LYS C C 13 176.701 0.300 . 1 . . . . 16 LYS C . 10167 1
105 . 1 1 17 17 GLU N N 15 120.589 0.300 . 1 . . . . 17 GLU N . 10167 1
106 . 1 1 17 17 GLU H H 1 8.832 0.030 . 1 . . . . 17 GLU H . 10167 1
107 . 1 1 17 17 GLU CA C 13 57.941 0.300 . 1 . . . . 17 GLU CA . 10167 1
108 . 1 1 17 17 GLU HA H 1 4.228 0.030 . 1 . . . . 17 GLU HA . 10167 1
109 . 1 1 17 17 GLU CB C 13 29.158 0.300 . 1 . . . . 17 GLU CB . 10167 1
110 . 1 1 17 17 GLU HB2 H 1 1.214 0.030 . 2 . . . . 17 GLU HB2 . 10167 1
111 . 1 1 17 17 GLU HB3 H 1 1.355 0.030 . 2 . . . . 17 GLU HB3 . 10167 1
112 . 1 1 17 17 GLU CG C 13 35.203 0.300 . 1 . . . . 17 GLU CG . 10167 1
113 . 1 1 17 17 GLU HG2 H 1 1.812 0.030 . 2 . . . . 17 GLU HG2 . 10167 1
114 . 1 1 17 17 GLU HG3 H 1 1.843 0.030 . 2 . . . . 17 GLU HG3 . 10167 1
115 . 1 1 17 17 GLU C C 13 177.504 0.300 . 1 . . . . 17 GLU C . 10167 1
116 . 1 1 18 18 CYS N N 15 115.823 0.300 . 1 . . . . 18 CYS N . 10167 1
117 . 1 1 18 18 CYS H H 1 8.345 0.030 . 1 . . . . 18 CYS H . 10167 1
118 . 1 1 18 18 CYS CA C 13 58.442 0.300 . 1 . . . . 18 CYS CA . 10167 1
119 . 1 1 18 18 CYS HA H 1 5.196 0.030 . 1 . . . . 18 CYS HA . 10167 1
120 . 1 1 18 18 CYS CB C 13 32.566 0.300 . 1 . . . . 18 CYS CB . 10167 1
121 . 1 1 18 18 CYS HB2 H 1 2.841 0.030 . 2 . . . . 18 CYS HB2 . 10167 1
122 . 1 1 18 18 CYS HB3 H 1 3.450 0.030 . 2 . . . . 18 CYS HB3 . 10167 1
123 . 1 1 18 18 CYS C C 13 176.419 0.300 . 1 . . . . 18 CYS C . 10167 1
124 . 1 1 19 19 GLY N N 15 113.312 0.300 . 1 . . . . 19 GLY N . 10167 1
125 . 1 1 19 19 GLY H H 1 8.066 0.030 . 1 . . . . 19 GLY H . 10167 1
126 . 1 1 19 19 GLY CA C 13 46.235 0.300 . 1 . . . . 19 GLY CA . 10167 1
127 . 1 1 19 19 GLY HA2 H 1 3.778 0.030 . 2 . . . . 19 GLY HA2 . 10167 1
128 . 1 1 19 19 GLY HA3 H 1 4.257 0.030 . 2 . . . . 19 GLY HA3 . 10167 1
129 . 1 1 19 19 GLY C C 13 173.644 0.300 . 1 . . . . 19 GLY C . 10167 1
130 . 1 1 20 20 LYS N N 15 123.577 0.300 . 1 . . . . 20 LYS N . 10167 1
131 . 1 1 20 20 LYS H H 1 7.997 0.030 . 1 . . . . 20 LYS H . 10167 1
132 . 1 1 20 20 LYS CA C 13 58.469 0.300 . 1 . . . . 20 LYS CA . 10167 1
133 . 1 1 20 20 LYS HA H 1 3.908 0.030 . 1 . . . . 20 LYS HA . 10167 1
134 . 1 1 20 20 LYS CB C 13 33.466 0.300 . 1 . . . . 20 LYS CB . 10167 1
135 . 1 1 20 20 LYS HB2 H 1 1.175 0.030 . 2 . . . . 20 LYS HB2 . 10167 1
136 . 1 1 20 20 LYS HB3 H 1 1.434 0.030 . 2 . . . . 20 LYS HB3 . 10167 1
137 . 1 1 20 20 LYS CG C 13 26.219 0.300 . 1 . . . . 20 LYS CG . 10167 1
138 . 1 1 20 20 LYS HG2 H 1 1.369 0.030 . 2 . . . . 20 LYS HG2 . 10167 1
139 . 1 1 20 20 LYS HG3 H 1 1.038 0.030 . 2 . . . . 20 LYS HG3 . 10167 1
140 . 1 1 20 20 LYS CD C 13 29.330 0.300 . 1 . . . . 20 LYS CD . 10167 1
141 . 1 1 20 20 LYS HD2 H 1 1.443 0.030 . 2 . . . . 20 LYS HD2 . 10167 1
142 . 1 1 20 20 LYS HD3 H 1 1.514 0.030 . 2 . . . . 20 LYS HD3 . 10167 1
143 . 1 1 20 20 LYS CE C 13 42.154 0.300 . 1 . . . . 20 LYS CE . 10167 1
144 . 1 1 20 20 LYS HE2 H 1 2.894 0.030 . 1 . . . . 20 LYS HE2 . 10167 1
145 . 1 1 20 20 LYS HE3 H 1 2.894 0.030 . 1 . . . . 20 LYS HE3 . 10167 1
146 . 1 1 20 20 LYS C C 13 173.507 0.300 . 1 . . . . 20 LYS C . 10167 1
147 . 1 1 21 21 ALA N N 15 124.329 0.300 . 1 . . . . 21 ALA N . 10167 1
148 . 1 1 21 21 ALA H H 1 7.783 0.030 . 1 . . . . 21 ALA H . 10167 1
149 . 1 1 21 21 ALA CA C 13 50.334 0.300 . 1 . . . . 21 ALA CA . 10167 1
150 . 1 1 21 21 ALA HA H 1 5.185 0.030 . 1 . . . . 21 ALA HA . 10167 1
151 . 1 1 21 21 ALA CB C 13 22.524 0.300 . 1 . . . . 21 ALA CB . 10167 1
152 . 1 1 21 21 ALA HB1 H 1 1.233 0.030 . 1 . . . . 21 ALA HB . 10167 1
153 . 1 1 21 21 ALA HB2 H 1 1.233 0.030 . 1 . . . . 21 ALA HB . 10167 1
154 . 1 1 21 21 ALA HB3 H 1 1.233 0.030 . 1 . . . . 21 ALA HB . 10167 1
155 . 1 1 21 21 ALA C C 13 176.077 0.300 . 1 . . . . 21 ALA C . 10167 1
156 . 1 1 22 22 PHE N N 15 116.711 0.300 . 1 . . . . 22 PHE N . 10167 1
157 . 1 1 22 22 PHE H H 1 8.847 0.030 . 1 . . . . 22 PHE H . 10167 1
158 . 1 1 22 22 PHE CA C 13 57.330 0.300 . 1 . . . . 22 PHE CA . 10167 1
159 . 1 1 22 22 PHE HA H 1 4.775 0.030 . 1 . . . . 22 PHE HA . 10167 1
160 . 1 1 22 22 PHE CB C 13 43.939 0.300 . 1 . . . . 22 PHE CB . 10167 1
161 . 1 1 22 22 PHE HB2 H 1 2.764 0.030 . 2 . . . . 22 PHE HB2 . 10167 1
162 . 1 1 22 22 PHE HB3 H 1 3.573 0.030 . 2 . . . . 22 PHE HB3 . 10167 1
163 . 1 1 22 22 PHE CD1 C 13 132.516 0.300 . 1 . . . . 22 PHE CD1 . 10167 1
164 . 1 1 22 22 PHE HD1 H 1 7.305 0.030 . 1 . . . . 22 PHE HD1 . 10167 1
165 . 1 1 22 22 PHE CD2 C 13 132.516 0.300 . 1 . . . . 22 PHE CD2 . 10167 1
166 . 1 1 22 22 PHE HD2 H 1 7.305 0.030 . 1 . . . . 22 PHE HD2 . 10167 1
167 . 1 1 22 22 PHE CE1 C 13 130.711 0.300 . 1 . . . . 22 PHE CE1 . 10167 1
168 . 1 1 22 22 PHE HE1 H 1 6.858 0.030 . 1 . . . . 22 PHE HE1 . 10167 1
169 . 1 1 22 22 PHE CE2 C 13 130.711 0.300 . 1 . . . . 22 PHE CE2 . 10167 1
170 . 1 1 22 22 PHE HE2 H 1 6.858 0.030 . 1 . . . . 22 PHE HE2 . 10167 1
171 . 1 1 22 22 PHE CZ C 13 128.775 0.300 . 1 . . . . 22 PHE CZ . 10167 1
172 . 1 1 22 22 PHE HZ H 1 6.320 0.030 . 1 . . . . 22 PHE HZ . 10167 1
173 . 1 1 22 22 PHE C C 13 175.213 0.300 . 1 . . . . 22 PHE C . 10167 1
174 . 1 1 23 23 ARG N N 15 120.534 0.300 . 1 . . . . 23 ARG N . 10167 1
175 . 1 1 23 23 ARG H H 1 9.558 0.030 . 1 . . . . 23 ARG H . 10167 1
176 . 1 1 23 23 ARG CA C 13 58.450 0.300 . 1 . . . . 23 ARG CA . 10167 1
177 . 1 1 23 23 ARG HA H 1 4.579 0.030 . 1 . . . . 23 ARG HA . 10167 1
178 . 1 1 23 23 ARG CB C 13 31.693 0.300 . 1 . . . . 23 ARG CB . 10167 1
179 . 1 1 23 23 ARG HB2 H 1 2.078 0.030 . 2 . . . . 23 ARG HB2 . 10167 1
180 . 1 1 23 23 ARG HB3 H 1 2.186 0.030 . 2 . . . . 23 ARG HB3 . 10167 1
181 . 1 1 23 23 ARG CG C 13 28.551 0.300 . 1 . . . . 23 ARG CG . 10167 1
182 . 1 1 23 23 ARG HG2 H 1 1.886 0.030 . 2 . . . . 23 ARG HG2 . 10167 1
183 . 1 1 23 23 ARG HG3 H 1 1.917 0.030 . 2 . . . . 23 ARG HG3 . 10167 1
184 . 1 1 23 23 ARG CD C 13 43.374 0.300 . 1 . . . . 23 ARG CD . 10167 1
185 . 1 1 23 23 ARG HD2 H 1 3.370 0.030 . 1 . . . . 23 ARG HD2 . 10167 1
186 . 1 1 23 23 ARG HD3 H 1 3.370 0.030 . 1 . . . . 23 ARG HD3 . 10167 1
187 . 1 1 23 23 ARG C C 13 176.152 0.300 . 1 . . . . 23 ARG C . 10167 1
188 . 1 1 24 24 GLN N N 15 112.058 0.300 . 1 . . . . 24 GLN N . 10167 1
189 . 1 1 24 24 GLN H H 1 7.643 0.030 . 1 . . . . 24 GLN H . 10167 1
190 . 1 1 24 24 GLN CA C 13 53.900 0.300 . 1 . . . . 24 GLN CA . 10167 1
191 . 1 1 24 24 GLN HA H 1 4.749 0.030 . 1 . . . . 24 GLN HA . 10167 1
192 . 1 1 24 24 GLN CB C 13 32.181 0.300 . 1 . . . . 24 GLN CB . 10167 1
193 . 1 1 24 24 GLN HB2 H 1 1.960 0.030 . 2 . . . . 24 GLN HB2 . 10167 1
194 . 1 1 24 24 GLN HB3 H 1 1.214 0.030 . 2 . . . . 24 GLN HB3 . 10167 1
195 . 1 1 24 24 GLN CG C 13 33.910 0.300 . 1 . . . . 24 GLN CG . 10167 1
196 . 1 1 24 24 GLN HG2 H 1 2.225 0.030 . 2 . . . . 24 GLN HG2 . 10167 1
197 . 1 1 24 24 GLN HG3 H 1 2.335 0.030 . 2 . . . . 24 GLN HG3 . 10167 1
198 . 1 1 24 24 GLN NE2 N 15 111.282 0.300 . 1 . . . . 24 GLN NE2 . 10167 1
199 . 1 1 24 24 GLN HE21 H 1 6.870 0.030 . 2 . . . . 24 GLN HE21 . 10167 1
200 . 1 1 24 24 GLN HE22 H 1 7.523 0.030 . 2 . . . . 24 GLN HE22 . 10167 1
201 . 1 1 24 24 GLN C C 13 176.122 0.300 . 1 . . . . 24 GLN C . 10167 1
202 . 1 1 25 25 ASN CA C 13 56.267 0.300 . 1 . . . . 25 ASN CA . 10167 1
203 . 1 1 25 25 ASN HA H 1 3.435 0.030 . 1 . . . . 25 ASN HA . 10167 1
204 . 1 1 25 25 ASN CB C 13 37.777 0.300 . 1 . . . . 25 ASN CB . 10167 1
205 . 1 1 25 25 ASN HB2 H 1 1.935 0.030 . 2 . . . . 25 ASN HB2 . 10167 1
206 . 1 1 25 25 ASN HB3 H 1 2.219 0.030 . 2 . . . . 25 ASN HB3 . 10167 1
207 . 1 1 25 25 ASN ND2 N 15 112.400 0.300 . 1 . . . . 25 ASN ND2 . 10167 1
208 . 1 1 25 25 ASN HD21 H 1 7.251 0.030 . 2 . . . . 25 ASN HD21 . 10167 1
209 . 1 1 25 25 ASN HD22 H 1 6.714 0.030 . 2 . . . . 25 ASN HD22 . 10167 1
210 . 1 1 25 25 ASN C C 13 177.746 0.300 . 1 . . . . 25 ASN C . 10167 1
211 . 1 1 26 26 ILE N N 15 115.551 0.300 . 1 . . . . 26 ILE N . 10167 1
212 . 1 1 26 26 ILE H H 1 8.132 0.030 . 1 . . . . 26 ILE H . 10167 1
213 . 1 1 26 26 ILE CA C 13 63.728 0.300 . 1 . . . . 26 ILE CA . 10167 1
214 . 1 1 26 26 ILE HA H 1 3.895 0.030 . 1 . . . . 26 ILE HA . 10167 1
215 . 1 1 26 26 ILE CB C 13 37.791 0.300 . 1 . . . . 26 ILE CB . 10167 1
216 . 1 1 26 26 ILE HB H 1 1.697 0.030 . 1 . . . . 26 ILE HB . 10167 1
217 . 1 1 26 26 ILE CG1 C 13 27.460 0.300 . 1 . . . . 26 ILE CG1 . 10167 1
218 . 1 1 26 26 ILE HG12 H 1 1.010 0.030 . 2 . . . . 26 ILE HG12 . 10167 1
219 . 1 1 26 26 ILE HG13 H 1 1.140 0.030 . 2 . . . . 26 ILE HG13 . 10167 1
220 . 1 1 26 26 ILE CG2 C 13 17.562 0.300 . 1 . . . . 26 ILE CG2 . 10167 1
221 . 1 1 26 26 ILE HG21 H 1 0.708 0.030 . 1 . . . . 26 ILE HG2 . 10167 1
222 . 1 1 26 26 ILE HG22 H 1 0.708 0.030 . 1 . . . . 26 ILE HG2 . 10167 1
223 . 1 1 26 26 ILE HG23 H 1 0.708 0.030 . 1 . . . . 26 ILE HG2 . 10167 1
224 . 1 1 26 26 ILE CD1 C 13 13.876 0.300 . 1 . . . . 26 ILE CD1 . 10167 1
225 . 1 1 26 26 ILE HD11 H 1 0.778 0.030 . 1 . . . . 26 ILE HD1 . 10167 1
226 . 1 1 26 26 ILE HD12 H 1 0.778 0.030 . 1 . . . . 26 ILE HD1 . 10167 1
227 . 1 1 26 26 ILE HD13 H 1 0.778 0.030 . 1 . . . . 26 ILE HD1 . 10167 1
228 . 1 1 26 26 ILE C C 13 177.174 0.300 . 1 . . . . 26 ILE C . 10167 1
229 . 1 1 27 27 HIS N N 15 120.664 0.300 . 1 . . . . 27 HIS N . 10167 1
230 . 1 1 27 27 HIS H H 1 6.592 0.030 . 1 . . . . 27 HIS H . 10167 1
231 . 1 1 27 27 HIS CA C 13 56.928 0.300 . 1 . . . . 27 HIS CA . 10167 1
232 . 1 1 27 27 HIS HA H 1 4.515 0.030 . 1 . . . . 27 HIS HA . 10167 1
233 . 1 1 27 27 HIS CB C 13 31.690 0.300 . 1 . . . . 27 HIS CB . 10167 1
234 . 1 1 27 27 HIS HB2 H 1 3.195 0.030 . 2 . . . . 27 HIS HB2 . 10167 1
235 . 1 1 27 27 HIS HB3 H 1 3.281 0.030 . 2 . . . . 27 HIS HB3 . 10167 1
236 . 1 1 27 27 HIS CD2 C 13 117.136 0.300 . 1 . . . . 27 HIS CD2 . 10167 1
237 . 1 1 27 27 HIS HD2 H 1 7.027 0.030 . 1 . . . . 27 HIS HD2 . 10167 1
238 . 1 1 27 27 HIS CE1 C 13 138.878 0.300 . 1 . . . . 27 HIS CE1 . 10167 1
239 . 1 1 27 27 HIS HE1 H 1 7.770 0.030 . 1 . . . . 27 HIS HE1 . 10167 1
240 . 1 1 27 27 HIS C C 13 178.354 0.300 . 1 . . . . 27 HIS C . 10167 1
241 . 1 1 28 28 LEU N N 15 122.071 0.300 . 1 . . . . 28 LEU N . 10167 1
242 . 1 1 28 28 LEU H H 1 6.883 0.030 . 1 . . . . 28 LEU H . 10167 1
243 . 1 1 28 28 LEU CA C 13 57.620 0.300 . 1 . . . . 28 LEU CA . 10167 1
244 . 1 1 28 28 LEU HA H 1 3.326 0.030 . 1 . . . . 28 LEU HA . 10167 1
245 . 1 1 28 28 LEU CB C 13 40.160 0.300 . 1 . . . . 28 LEU CB . 10167 1
246 . 1 1 28 28 LEU HB2 H 1 2.008 0.030 . 2 . . . . 28 LEU HB2 . 10167 1
247 . 1 1 28 28 LEU HB3 H 1 1.273 0.030 . 2 . . . . 28 LEU HB3 . 10167 1
248 . 1 1 28 28 LEU CG C 13 27.633 0.300 . 1 . . . . 28 LEU CG . 10167 1
249 . 1 1 28 28 LEU HG H 1 1.630 0.030 . 1 . . . . 28 LEU HG . 10167 1
250 . 1 1 28 28 LEU CD1 C 13 26.527 0.300 . 2 . . . . 28 LEU CD1 . 10167 1
251 . 1 1 28 28 LEU HD11 H 1 1.088 0.030 . 1 . . . . 28 LEU HD1 . 10167 1
252 . 1 1 28 28 LEU HD12 H 1 1.088 0.030 . 1 . . . . 28 LEU HD1 . 10167 1
253 . 1 1 28 28 LEU HD13 H 1 1.088 0.030 . 1 . . . . 28 LEU HD1 . 10167 1
254 . 1 1 28 28 LEU CD2 C 13 22.549 0.300 . 2 . . . . 28 LEU CD2 . 10167 1
255 . 1 1 28 28 LEU HD21 H 1 1.071 0.030 . 1 . . . . 28 LEU HD2 . 10167 1
256 . 1 1 28 28 LEU HD22 H 1 1.071 0.030 . 1 . . . . 28 LEU HD2 . 10167 1
257 . 1 1 28 28 LEU HD23 H 1 1.071 0.030 . 1 . . . . 28 LEU HD2 . 10167 1
258 . 1 1 28 28 LEU C C 13 177.151 0.300 . 1 . . . . 28 LEU C . 10167 1
259 . 1 1 29 29 ALA N N 15 120.705 0.300 . 1 . . . . 29 ALA N . 10167 1
260 . 1 1 29 29 ALA H H 1 8.279 0.030 . 1 . . . . 29 ALA H . 10167 1
261 . 1 1 29 29 ALA CA C 13 55.529 0.300 . 1 . . . . 29 ALA CA . 10167 1
262 . 1 1 29 29 ALA HA H 1 3.938 0.030 . 1 . . . . 29 ALA HA . 10167 1
263 . 1 1 29 29 ALA CB C 13 17.758 0.300 . 1 . . . . 29 ALA CB . 10167 1
264 . 1 1 29 29 ALA HB1 H 1 1.369 0.030 . 1 . . . . 29 ALA HB . 10167 1
265 . 1 1 29 29 ALA HB2 H 1 1.369 0.030 . 1 . . . . 29 ALA HB . 10167 1
266 . 1 1 29 29 ALA HB3 H 1 1.369 0.030 . 1 . . . . 29 ALA HB . 10167 1
267 . 1 1 29 29 ALA C C 13 180.633 0.300 . 1 . . . . 29 ALA C . 10167 1
268 . 1 1 30 30 SER N N 15 111.186 0.300 . 1 . . . . 30 SER N . 10167 1
269 . 1 1 30 30 SER H H 1 7.532 0.030 . 1 . . . . 30 SER H . 10167 1
270 . 1 1 30 30 SER CA C 13 61.154 0.300 . 1 . . . . 30 SER CA . 10167 1
271 . 1 1 30 30 SER HA H 1 4.145 0.030 . 1 . . . . 30 SER HA . 10167 1
272 . 1 1 30 30 SER CB C 13 62.792 0.300 . 1 . . . . 30 SER CB . 10167 1
273 . 1 1 30 30 SER HB2 H 1 3.893 0.030 . 1 . . . . 30 SER HB2 . 10167 1
274 . 1 1 30 30 SER HB3 H 1 3.893 0.030 . 1 . . . . 30 SER HB3 . 10167 1
275 . 1 1 30 30 SER C C 13 176.819 0.300 . 1 . . . . 30 SER C . 10167 1
276 . 1 1 31 31 HIS N N 15 122.310 0.300 . 1 . . . . 31 HIS N . 10167 1
277 . 1 1 31 31 HIS H H 1 7.533 0.030 . 1 . . . . 31 HIS H . 10167 1
278 . 1 1 31 31 HIS CA C 13 59.375 0.300 . 1 . . . . 31 HIS CA . 10167 1
279 . 1 1 31 31 HIS HA H 1 4.196 0.030 . 1 . . . . 31 HIS HA . 10167 1
280 . 1 1 31 31 HIS CB C 13 28.704 0.300 . 1 . . . . 31 HIS CB . 10167 1
281 . 1 1 31 31 HIS HB2 H 1 2.923 0.030 . 2 . . . . 31 HIS HB2 . 10167 1
282 . 1 1 31 31 HIS HB3 H 1 3.270 0.030 . 2 . . . . 31 HIS HB3 . 10167 1
283 . 1 1 31 31 HIS CD2 C 13 127.266 0.300 . 1 . . . . 31 HIS CD2 . 10167 1
284 . 1 1 31 31 HIS HD2 H 1 7.042 0.030 . 1 . . . . 31 HIS HD2 . 10167 1
285 . 1 1 31 31 HIS CE1 C 13 139.599 0.300 . 1 . . . . 31 HIS CE1 . 10167 1
286 . 1 1 31 31 HIS HE1 H 1 8.016 0.030 . 1 . . . . 31 HIS HE1 . 10167 1
287 . 1 1 31 31 HIS C C 13 176.094 0.300 . 1 . . . . 31 HIS C . 10167 1
288 . 1 1 32 32 LEU N N 15 116.904 0.300 . 1 . . . . 32 LEU N . 10167 1
289 . 1 1 32 32 LEU H H 1 8.410 0.030 . 1 . . . . 32 LEU H . 10167 1
290 . 1 1 32 32 LEU CA C 13 58.179 0.300 . 1 . . . . 32 LEU CA . 10167 1
291 . 1 1 32 32 LEU HA H 1 3.831 0.030 . 1 . . . . 32 LEU HA . 10167 1
292 . 1 1 32 32 LEU CB C 13 42.008 0.300 . 1 . . . . 32 LEU CB . 10167 1
293 . 1 1 32 32 LEU HB2 H 1 1.602 0.030 . 2 . . . . 32 LEU HB2 . 10167 1
294 . 1 1 32 32 LEU HB3 H 1 1.900 0.030 . 2 . . . . 32 LEU HB3 . 10167 1
295 . 1 1 32 32 LEU CG C 13 27.055 0.300 . 1 . . . . 32 LEU CG . 10167 1
296 . 1 1 32 32 LEU HG H 1 2.070 0.030 . 1 . . . . 32 LEU HG . 10167 1
297 . 1 1 32 32 LEU CD1 C 13 25.578 0.300 . 2 . . . . 32 LEU CD1 . 10167 1
298 . 1 1 32 32 LEU HD11 H 1 1.026 0.030 . 1 . . . . 32 LEU HD1 . 10167 1
299 . 1 1 32 32 LEU HD12 H 1 1.026 0.030 . 1 . . . . 32 LEU HD1 . 10167 1
300 . 1 1 32 32 LEU HD13 H 1 1.026 0.030 . 1 . . . . 32 LEU HD1 . 10167 1
301 . 1 1 32 32 LEU CD2 C 13 24.861 0.300 . 2 . . . . 32 LEU CD2 . 10167 1
302 . 1 1 32 32 LEU HD21 H 1 1.294 0.030 . 1 . . . . 32 LEU HD2 . 10167 1
303 . 1 1 32 32 LEU HD22 H 1 1.294 0.030 . 1 . . . . 32 LEU HD2 . 10167 1
304 . 1 1 32 32 LEU HD23 H 1 1.294 0.030 . 1 . . . . 32 LEU HD2 . 10167 1
305 . 1 1 32 32 LEU C C 13 178.884 0.300 . 1 . . . . 32 LEU C . 10167 1
306 . 1 1 33 33 ARG N N 15 116.036 0.300 . 1 . . . . 33 ARG N . 10167 1
307 . 1 1 33 33 ARG H H 1 7.068 0.030 . 1 . . . . 33 ARG H . 10167 1
308 . 1 1 33 33 ARG CA C 13 58.384 0.300 . 1 . . . . 33 ARG CA . 10167 1
309 . 1 1 33 33 ARG HA H 1 4.131 0.030 . 1 . . . . 33 ARG HA . 10167 1
310 . 1 1 33 33 ARG CB C 13 29.968 0.300 . 1 . . . . 33 ARG CB . 10167 1
311 . 1 1 33 33 ARG HB2 H 1 1.823 0.030 . 2 . . . . 33 ARG HB2 . 10167 1
312 . 1 1 33 33 ARG HB3 H 1 1.887 0.030 . 2 . . . . 33 ARG HB3 . 10167 1
313 . 1 1 33 33 ARG CG C 13 27.621 0.300 . 1 . . . . 33 ARG CG . 10167 1
314 . 1 1 33 33 ARG HG2 H 1 1.826 0.030 . 2 . . . . 33 ARG HG2 . 10167 1
315 . 1 1 33 33 ARG HG3 H 1 1.650 0.030 . 2 . . . . 33 ARG HG3 . 10167 1
316 . 1 1 33 33 ARG CD C 13 43.391 0.300 . 1 . . . . 33 ARG CD . 10167 1
317 . 1 1 33 33 ARG HD2 H 1 3.214 0.030 . 1 . . . . 33 ARG HD2 . 10167 1
318 . 1 1 33 33 ARG HD3 H 1 3.214 0.030 . 1 . . . . 33 ARG HD3 . 10167 1
319 . 1 1 33 33 ARG C C 13 178.701 0.300 . 1 . . . . 33 ARG C . 10167 1
320 . 1 1 34 34 ILE N N 15 116.874 0.300 . 1 . . . . 34 ILE N . 10167 1
321 . 1 1 34 34 ILE H H 1 7.908 0.030 . 1 . . . . 34 ILE H . 10167 1
322 . 1 1 34 34 ILE CA C 13 63.093 0.300 . 1 . . . . 34 ILE CA . 10167 1
323 . 1 1 34 34 ILE HA H 1 3.976 0.030 . 1 . . . . 34 ILE HA . 10167 1
324 . 1 1 34 34 ILE CB C 13 37.654 0.300 . 1 . . . . 34 ILE CB . 10167 1
325 . 1 1 34 34 ILE HB H 1 1.685 0.030 . 1 . . . . 34 ILE HB . 10167 1
326 . 1 1 34 34 ILE CG1 C 13 26.825 0.300 . 1 . . . . 34 ILE CG1 . 10167 1
327 . 1 1 34 34 ILE HG12 H 1 0.790 0.030 . 2 . . . . 34 ILE HG12 . 10167 1
328 . 1 1 34 34 ILE HG13 H 1 0.966 0.030 . 2 . . . . 34 ILE HG13 . 10167 1
329 . 1 1 34 34 ILE CG2 C 13 16.561 0.300 . 1 . . . . 34 ILE CG2 . 10167 1
330 . 1 1 34 34 ILE HG21 H 1 0.587 0.030 . 1 . . . . 34 ILE HG2 . 10167 1
331 . 1 1 34 34 ILE HG22 H 1 0.587 0.030 . 1 . . . . 34 ILE HG2 . 10167 1
332 . 1 1 34 34 ILE HG23 H 1 0.587 0.030 . 1 . . . . 34 ILE HG2 . 10167 1
333 . 1 1 34 34 ILE CD1 C 13 14.284 0.300 . 1 . . . . 34 ILE CD1 . 10167 1
334 . 1 1 34 34 ILE HD11 H 1 0.693 0.030 . 1 . . . . 34 ILE HD1 . 10167 1
335 . 1 1 34 34 ILE HD12 H 1 0.693 0.030 . 1 . . . . 34 ILE HD1 . 10167 1
336 . 1 1 34 34 ILE HD13 H 1 0.693 0.030 . 1 . . . . 34 ILE HD1 . 10167 1
337 . 1 1 34 34 ILE C C 13 177.579 0.300 . 1 . . . . 34 ILE C . 10167 1
338 . 1 1 35 35 HIS N N 15 117.636 0.300 . 1 . . . . 35 HIS N . 10167 1
339 . 1 1 35 35 HIS H H 1 7.228 0.030 . 1 . . . . 35 HIS H . 10167 1
340 . 1 1 35 35 HIS CA C 13 55.502 0.300 . 1 . . . . 35 HIS CA . 10167 1
341 . 1 1 35 35 HIS HA H 1 4.849 0.030 . 1 . . . . 35 HIS HA . 10167 1
342 . 1 1 35 35 HIS CB C 13 28.632 0.300 . 1 . . . . 35 HIS CB . 10167 1
343 . 1 1 35 35 HIS HB2 H 1 3.184 0.030 . 2 . . . . 35 HIS HB2 . 10167 1
344 . 1 1 35 35 HIS HB3 H 1 3.362 0.030 . 2 . . . . 35 HIS HB3 . 10167 1
345 . 1 1 35 35 HIS CD2 C 13 127.602 0.300 . 1 . . . . 35 HIS CD2 . 10167 1
346 . 1 1 35 35 HIS HD2 H 1 6.740 0.030 . 1 . . . . 35 HIS HD2 . 10167 1
347 . 1 1 35 35 HIS CE1 C 13 140.063 0.300 . 1 . . . . 35 HIS CE1 . 10167 1
348 . 1 1 35 35 HIS HE1 H 1 8.044 0.030 . 1 . . . . 35 HIS HE1 . 10167 1
349 . 1 1 35 35 HIS C C 13 175.806 0.300 . 1 . . . . 35 HIS C . 10167 1
350 . 1 1 36 36 THR N N 15 111.751 0.300 . 1 . . . . 36 THR N . 10167 1
351 . 1 1 36 36 THR H H 1 7.810 0.030 . 1 . . . . 36 THR H . 10167 1
352 . 1 1 36 36 THR CA C 13 62.645 0.300 . 1 . . . . 36 THR CA . 10167 1
353 . 1 1 36 36 THR HA H 1 4.344 0.030 . 1 . . . . 36 THR HA . 10167 1
354 . 1 1 36 36 THR CB C 13 69.842 0.300 . 1 . . . . 36 THR CB . 10167 1
355 . 1 1 36 36 THR HB H 1 4.326 0.030 . 1 . . . . 36 THR HB . 10167 1
356 . 1 1 36 36 THR CG2 C 13 21.573 0.300 . 1 . . . . 36 THR CG2 . 10167 1
357 . 1 1 36 36 THR HG21 H 1 1.247 0.030 . 1 . . . . 36 THR HG2 . 10167 1
358 . 1 1 36 36 THR HG22 H 1 1.247 0.030 . 1 . . . . 36 THR HG2 . 10167 1
359 . 1 1 36 36 THR HG23 H 1 1.247 0.030 . 1 . . . . 36 THR HG2 . 10167 1
360 . 1 1 36 36 THR C C 13 175.493 0.300 . 1 . . . . 36 THR C . 10167 1
361 . 1 1 37 37 GLY N N 15 110.648 0.300 . 1 . . . . 37 GLY N . 10167 1
362 . 1 1 37 37 GLY H H 1 8.229 0.030 . 1 . . . . 37 GLY H . 10167 1
363 . 1 1 37 37 GLY CA C 13 45.270 0.300 . 1 . . . . 37 GLY CA . 10167 1
364 . 1 1 37 37 GLY HA2 H 1 4.029 0.030 . 2 . . . . 37 GLY HA2 . 10167 1
365 . 1 1 37 37 GLY HA3 H 1 3.944 0.030 . 2 . . . . 37 GLY HA3 . 10167 1
366 . 1 1 37 37 GLY C C 13 174.050 0.300 . 1 . . . . 37 GLY C . 10167 1
367 . 1 1 38 38 GLU N N 15 120.571 0.300 . 1 . . . . 38 GLU N . 10167 1
368 . 1 1 38 38 GLU H H 1 8.068 0.030 . 1 . . . . 38 GLU H . 10167 1
369 . 1 1 38 38 GLU CA C 13 56.459 0.300 . 1 . . . . 38 GLU CA . 10167 1
370 . 1 1 38 38 GLU HA H 1 4.245 0.030 . 1 . . . . 38 GLU HA . 10167 1
371 . 1 1 38 38 GLU CB C 13 30.556 0.300 . 1 . . . . 38 GLU CB . 10167 1
372 . 1 1 38 38 GLU HB2 H 1 1.904 0.030 . 2 . . . . 38 GLU HB2 . 10167 1
373 . 1 1 38 38 GLU HB3 H 1 1.991 0.030 . 2 . . . . 38 GLU HB3 . 10167 1
374 . 1 1 38 38 GLU CG C 13 36.294 0.300 . 1 . . . . 38 GLU CG . 10167 1
375 . 1 1 38 38 GLU HG2 H 1 2.269 0.030 . 2 . . . . 38 GLU HG2 . 10167 1
376 . 1 1 38 38 GLU HG3 H 1 2.209 0.030 . 2 . . . . 38 GLU HG3 . 10167 1
377 . 1 1 38 38 GLU C C 13 176.194 0.300 . 1 . . . . 38 GLU C . 10167 1
378 . 1 1 39 39 LYS N N 15 123.762 0.300 . 1 . . . . 39 LYS N . 10167 1
379 . 1 1 39 39 LYS H H 1 8.404 0.030 . 1 . . . . 39 LYS H . 10167 1
380 . 1 1 39 39 LYS CA C 13 54.107 0.300 . 1 . . . . 39 LYS CA . 10167 1
381 . 1 1 39 39 LYS HA H 1 4.607 0.030 . 1 . . . . 39 LYS HA . 10167 1
382 . 1 1 39 39 LYS CB C 13 32.501 0.300 . 1 . . . . 39 LYS CB . 10167 1
383 . 1 1 39 39 LYS HB2 H 1 1.818 0.030 . 2 . . . . 39 LYS HB2 . 10167 1
384 . 1 1 39 39 LYS HB3 H 1 1.727 0.030 . 2 . . . . 39 LYS HB3 . 10167 1
385 . 1 1 39 39 LYS CG C 13 24.503 0.300 . 1 . . . . 39 LYS CG . 10167 1
386 . 1 1 39 39 LYS HG2 H 1 1.472 0.030 . 1 . . . . 39 LYS HG2 . 10167 1
387 . 1 1 39 39 LYS HG3 H 1 1.472 0.030 . 1 . . . . 39 LYS HG3 . 10167 1
388 . 1 1 39 39 LYS CD C 13 29.144 0.300 . 1 . . . . 39 LYS CD . 10167 1
389 . 1 1 39 39 LYS HD2 H 1 1.689 0.030 . 1 . . . . 39 LYS HD2 . 10167 1
390 . 1 1 39 39 LYS HD3 H 1 1.689 0.030 . 1 . . . . 39 LYS HD3 . 10167 1
391 . 1 1 39 39 LYS CE C 13 42.192 0.300 . 1 . . . . 39 LYS CE . 10167 1
392 . 1 1 39 39 LYS HE2 H 1 2.966 0.030 . 1 . . . . 39 LYS HE2 . 10167 1
393 . 1 1 39 39 LYS HE3 H 1 2.966 0.030 . 1 . . . . 39 LYS HE3 . 10167 1
394 . 1 1 39 39 LYS C C 13 174.460 0.300 . 1 . . . . 39 LYS C . 10167 1
395 . 1 1 40 40 PRO CA C 13 63.205 0.300 . 1 . . . . 40 PRO CA . 10167 1
396 . 1 1 40 40 PRO HA H 1 4.462 0.030 . 1 . . . . 40 PRO HA . 10167 1
397 . 1 1 40 40 PRO CB C 13 32.180 0.300 . 1 . . . . 40 PRO CB . 10167 1
398 . 1 1 40 40 PRO HB2 H 1 1.938 0.030 . 2 . . . . 40 PRO HB2 . 10167 1
399 . 1 1 40 40 PRO HB3 H 1 2.307 0.030 . 2 . . . . 40 PRO HB3 . 10167 1
400 . 1 1 40 40 PRO CG C 13 27.285 0.300 . 1 . . . . 40 PRO CG . 10167 1
401 . 1 1 40 40 PRO HG2 H 1 2.012 0.030 . 1 . . . . 40 PRO HG2 . 10167 1
402 . 1 1 40 40 PRO HG3 H 1 2.012 0.030 . 1 . . . . 40 PRO HG3 . 10167 1
403 . 1 1 40 40 PRO CD C 13 50.675 0.300 . 1 . . . . 40 PRO CD . 10167 1
404 . 1 1 40 40 PRO HD2 H 1 3.645 0.030 . 2 . . . . 40 PRO HD2 . 10167 1
405 . 1 1 40 40 PRO HD3 H 1 3.816 0.030 . 2 . . . . 40 PRO HD3 . 10167 1
406 . 1 1 42 42 GLY CA C 13 44.664 0.300 . 1 . . . . 42 GLY CA . 10167 1
407 . 1 1 42 42 GLY HA2 H 1 4.110 0.030 . 2 . . . . 42 GLY HA2 . 10167 1
408 . 1 1 42 42 GLY HA3 H 1 4.157 0.030 . 2 . . . . 42 GLY HA3 . 10167 1
409 . 1 1 43 43 PRO CA C 13 63.253 0.300 . 1 . . . . 43 PRO CA . 10167 1
410 . 1 1 43 43 PRO HA H 1 4.472 0.030 . 1 . . . . 43 PRO HA . 10167 1
411 . 1 1 43 43 PRO CB C 13 32.202 0.300 . 1 . . . . 43 PRO CB . 10167 1
412 . 1 1 43 43 PRO HB2 H 1 2.292 0.030 . 2 . . . . 43 PRO HB2 . 10167 1
413 . 1 1 43 43 PRO HB3 H 1 1.952 0.030 . 2 . . . . 43 PRO HB3 . 10167 1
414 . 1 1 43 43 PRO CG C 13 27.271 0.300 . 1 . . . . 43 PRO CG . 10167 1
415 . 1 1 43 43 PRO HG2 H 1 2.023 0.030 . 1 . . . . 43 PRO HG2 . 10167 1
416 . 1 1 43 43 PRO HG3 H 1 2.023 0.030 . 1 . . . . 43 PRO HG3 . 10167 1
417 . 1 1 43 43 PRO CD C 13 49.807 0.300 . 1 . . . . 43 PRO CD . 10167 1
418 . 1 1 43 43 PRO HD2 H 1 3.626 0.030 . 1 . . . . 43 PRO HD2 . 10167 1
419 . 1 1 43 43 PRO HD3 H 1 3.626 0.030 . 1 . . . . 43 PRO HD3 . 10167 1
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