###################################
# 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 10186
_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 10186 1
2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10186 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 8 8 THR CA C 13 61.919 0.300 . 1 . . . . 8 THR CA . 10186 1
2 . 1 1 8 8 THR HA H 1 4.367 0.030 . 1 . . . . 8 THR HA . 10186 1
3 . 1 1 8 8 THR CB C 13 69.796 0.300 . 1 . . . . 8 THR CB . 10186 1
4 . 1 1 8 8 THR HB H 1 4.301 0.030 . 1 . . . . 8 THR HB . 10186 1
5 . 1 1 8 8 THR CG2 C 13 21.528 0.300 . 1 . . . . 8 THR CG2 . 10186 1
6 . 1 1 8 8 THR HG21 H 1 1.200 0.030 . 1 . . . . 8 THR HG2 . 10186 1
7 . 1 1 8 8 THR HG22 H 1 1.200 0.030 . 1 . . . . 8 THR HG2 . 10186 1
8 . 1 1 8 8 THR HG23 H 1 1.200 0.030 . 1 . . . . 8 THR HG2 . 10186 1
9 . 1 1 8 8 THR C C 13 175.193 0.300 . 1 . . . . 8 THR C . 10186 1
10 . 1 1 9 9 GLY N N 15 111.079 0.300 . 1 . . . . 9 GLY N . 10186 1
11 . 1 1 9 9 GLY H H 1 8.450 0.030 . 1 . . . . 9 GLY H . 10186 1
12 . 1 1 9 9 GLY CA C 13 45.243 0.300 . 1 . . . . 9 GLY CA . 10186 1
13 . 1 1 9 9 GLY HA2 H 1 3.956 0.030 . 1 . . . . 9 GLY HA2 . 10186 1
14 . 1 1 9 9 GLY HA3 H 1 3.956 0.030 . 1 . . . . 9 GLY HA3 . 10186 1
15 . 1 1 9 9 GLY C C 13 173.979 0.300 . 1 . . . . 9 GLY C . 10186 1
16 . 1 1 10 10 GLU N N 15 120.501 0.300 . 1 . . . . 10 GLU N . 10186 1
17 . 1 1 10 10 GLU H H 1 8.192 0.030 . 1 . . . . 10 GLU H . 10186 1
18 . 1 1 10 10 GLU CA C 13 56.560 0.300 . 1 . . . . 10 GLU CA . 10186 1
19 . 1 1 10 10 GLU HA H 1 4.198 0.030 . 1 . . . . 10 GLU HA . 10186 1
20 . 1 1 10 10 GLU CB C 13 30.474 0.300 . 1 . . . . 10 GLU CB . 10186 1
21 . 1 1 10 10 GLU HB2 H 1 1.884 0.030 . 2 . . . . 10 GLU HB2 . 10186 1
22 . 1 1 10 10 GLU HB3 H 1 1.968 0.030 . 2 . . . . 10 GLU HB3 . 10186 1
23 . 1 1 10 10 GLU CG C 13 36.242 0.300 . 1 . . . . 10 GLU CG . 10186 1
24 . 1 1 10 10 GLU HG2 H 1 2.220 0.030 . 1 . . . . 10 GLU HG2 . 10186 1
25 . 1 1 10 10 GLU HG3 H 1 2.220 0.030 . 1 . . . . 10 GLU HG3 . 10186 1
26 . 1 1 10 10 GLU C C 13 176.188 0.300 . 1 . . . . 10 GLU C . 10186 1
27 . 1 1 11 11 LYS N N 15 122.926 0.300 . 1 . . . . 11 LYS N . 10186 1
28 . 1 1 11 11 LYS H H 1 8.346 0.030 . 1 . . . . 11 LYS H . 10186 1
29 . 1 1 11 11 LYS CA C 13 54.399 0.300 . 1 . . . . 11 LYS CA . 10186 1
30 . 1 1 11 11 LYS HA H 1 4.447 0.030 . 1 . . . . 11 LYS HA . 10186 1
31 . 1 1 11 11 LYS CB C 13 32.473 0.300 . 1 . . . . 11 LYS CB . 10186 1
32 . 1 1 11 11 LYS HB2 H 1 1.488 0.030 . 1 . . . . 11 LYS HB2 . 10186 1
33 . 1 1 11 11 LYS HB3 H 1 1.488 0.030 . 1 . . . . 11 LYS HB3 . 10186 1
34 . 1 1 11 11 LYS CG C 13 25.201 0.300 . 1 . . . . 11 LYS CG . 10186 1
35 . 1 1 11 11 LYS HG2 H 1 1.242 0.030 . 2 . . . . 11 LYS HG2 . 10186 1
36 . 1 1 11 11 LYS HG3 H 1 1.343 0.030 . 2 . . . . 11 LYS HG3 . 10186 1
37 . 1 1 11 11 LYS CD C 13 29.380 0.300 . 1 . . . . 11 LYS CD . 10186 1
38 . 1 1 11 11 LYS HD2 H 1 1.515 0.030 . 2 . . . . 11 LYS HD2 . 10186 1
39 . 1 1 11 11 LYS HD3 H 1 1.429 0.030 . 2 . . . . 11 LYS HD3 . 10186 1
40 . 1 1 11 11 LYS CE C 13 42.318 0.300 . 1 . . . . 11 LYS CE . 10186 1
41 . 1 1 11 11 LYS HE2 H 1 2.935 0.030 . 1 . . . . 11 LYS HE2 . 10186 1
42 . 1 1 11 11 LYS HE3 H 1 2.935 0.030 . 1 . . . . 11 LYS HE3 . 10186 1
43 . 1 1 11 11 LYS C C 13 174.709 0.300 . 1 . . . . 11 LYS C . 10186 1
44 . 1 1 12 12 PRO CA C 13 64.071 0.300 . 1 . . . . 12 PRO CA . 10186 1
45 . 1 1 12 12 PRO HA H 1 4.194 0.030 . 1 . . . . 12 PRO HA . 10186 1
46 . 1 1 12 12 PRO CB C 13 32.233 0.300 . 1 . . . . 12 PRO CB . 10186 1
47 . 1 1 12 12 PRO HB2 H 1 1.992 0.030 . 2 . . . . 12 PRO HB2 . 10186 1
48 . 1 1 12 12 PRO HB3 H 1 1.132 0.030 . 2 . . . . 12 PRO HB3 . 10186 1
49 . 1 1 12 12 PRO CG C 13 27.025 0.300 . 1 . . . . 12 PRO CG . 10186 1
50 . 1 1 12 12 PRO HG2 H 1 1.704 0.030 . 2 . . . . 12 PRO HG2 . 10186 1
51 . 1 1 12 12 PRO HG3 H 1 1.860 0.030 . 2 . . . . 12 PRO HG3 . 10186 1
52 . 1 1 12 12 PRO CD C 13 50.623 0.300 . 1 . . . . 12 PRO CD . 10186 1
53 . 1 1 12 12 PRO HD2 H 1 3.656 0.030 . 2 . . . . 12 PRO HD2 . 10186 1
54 . 1 1 12 12 PRO HD3 H 1 3.740 0.030 . 2 . . . . 12 PRO HD3 . 10186 1
55 . 1 1 12 12 PRO C C 13 176.563 0.300 . 1 . . . . 12 PRO C . 10186 1
56 . 1 1 13 13 PHE N N 15 117.437 0.300 . 1 . . . . 13 PHE N . 10186 1
57 . 1 1 13 13 PHE H H 1 7.906 0.030 . 1 . . . . 13 PHE H . 10186 1
58 . 1 1 13 13 PHE CA C 13 57.216 0.300 . 1 . . . . 13 PHE CA . 10186 1
59 . 1 1 13 13 PHE HA H 1 4.733 0.030 . 1 . . . . 13 PHE HA . 10186 1
60 . 1 1 13 13 PHE CB C 13 38.760 0.300 . 1 . . . . 13 PHE CB . 10186 1
61 . 1 1 13 13 PHE HB2 H 1 2.917 0.030 . 2 . . . . 13 PHE HB2 . 10186 1
62 . 1 1 13 13 PHE HB3 H 1 3.018 0.030 . 2 . . . . 13 PHE HB3 . 10186 1
63 . 1 1 13 13 PHE CD1 C 13 131.626 0.300 . 1 . . . . 13 PHE CD1 . 10186 1
64 . 1 1 13 13 PHE HD1 H 1 7.113 0.030 . 1 . . . . 13 PHE HD1 . 10186 1
65 . 1 1 13 13 PHE CD2 C 13 131.626 0.300 . 1 . . . . 13 PHE CD2 . 10186 1
66 . 1 1 13 13 PHE HD2 H 1 7.113 0.030 . 1 . . . . 13 PHE HD2 . 10186 1
67 . 1 1 13 13 PHE CE1 C 13 131.606 0.300 . 1 . . . . 13 PHE CE1 . 10186 1
68 . 1 1 13 13 PHE HE1 H 1 7.397 0.030 . 1 . . . . 13 PHE HE1 . 10186 1
69 . 1 1 13 13 PHE CE2 C 13 131.606 0.300 . 1 . . . . 13 PHE CE2 . 10186 1
70 . 1 1 13 13 PHE HE2 H 1 7.397 0.030 . 1 . . . . 13 PHE HE2 . 10186 1
71 . 1 1 13 13 PHE CZ C 13 130.235 0.300 . 1 . . . . 13 PHE CZ . 10186 1
72 . 1 1 13 13 PHE HZ H 1 7.382 0.030 . 1 . . . . 13 PHE HZ . 10186 1
73 . 1 1 13 13 PHE C C 13 174.019 0.300 . 1 . . . . 13 PHE C . 10186 1
74 . 1 1 14 14 LYS N N 15 125.906 0.300 . 1 . . . . 14 LYS N . 10186 1
75 . 1 1 14 14 LYS H H 1 8.558 0.030 . 1 . . . . 14 LYS H . 10186 1
76 . 1 1 14 14 LYS CA C 13 55.253 0.300 . 1 . . . . 14 LYS CA . 10186 1
77 . 1 1 14 14 LYS HA H 1 4.753 0.030 . 1 . . . . 14 LYS HA . 10186 1
78 . 1 1 14 14 LYS CB C 13 35.471 0.300 . 1 . . . . 14 LYS CB . 10186 1
79 . 1 1 14 14 LYS HB2 H 1 1.580 0.030 . 2 . . . . 14 LYS HB2 . 10186 1
80 . 1 1 14 14 LYS HB3 H 1 1.708 0.030 . 2 . . . . 14 LYS HB3 . 10186 1
81 . 1 1 14 14 LYS CG C 13 24.698 0.300 . 1 . . . . 14 LYS CG . 10186 1
82 . 1 1 14 14 LYS HG2 H 1 1.153 0.030 . 2 . . . . 14 LYS HG2 . 10186 1
83 . 1 1 14 14 LYS HG3 H 1 1.205 0.030 . 2 . . . . 14 LYS HG3 . 10186 1
84 . 1 1 14 14 LYS CD C 13 29.530 0.300 . 1 . . . . 14 LYS CD . 10186 1
85 . 1 1 14 14 LYS HD2 H 1 1.604 0.030 . 1 . . . . 14 LYS HD2 . 10186 1
86 . 1 1 14 14 LYS HD3 H 1 1.604 0.030 . 1 . . . . 14 LYS HD3 . 10186 1
87 . 1 1 14 14 LYS CE C 13 42.063 0.300 . 1 . . . . 14 LYS CE . 10186 1
88 . 1 1 14 14 LYS HE2 H 1 2.961 0.030 . 1 . . . . 14 LYS HE2 . 10186 1
89 . 1 1 14 14 LYS HE3 H 1 2.961 0.030 . 1 . . . . 14 LYS HE3 . 10186 1
90 . 1 1 14 14 LYS C C 13 175.156 0.300 . 1 . . . . 14 LYS C . 10186 1
91 . 1 1 15 15 CYS N N 15 128.017 0.300 . 1 . . . . 15 CYS N . 10186 1
92 . 1 1 15 15 CYS H H 1 9.322 0.030 . 1 . . . . 15 CYS H . 10186 1
93 . 1 1 15 15 CYS CA C 13 59.976 0.300 . 1 . . . . 15 CYS CA . 10186 1
94 . 1 1 15 15 CYS HA H 1 4.451 0.030 . 1 . . . . 15 CYS HA . 10186 1
95 . 1 1 15 15 CYS CB C 13 29.411 0.300 . 1 . . . . 15 CYS CB . 10186 1
96 . 1 1 15 15 CYS HB2 H 1 3.442 0.030 . 2 . . . . 15 CYS HB2 . 10186 1
97 . 1 1 15 15 CYS HB3 H 1 2.908 0.030 . 2 . . . . 15 CYS HB3 . 10186 1
98 . 1 1 15 15 CYS C C 13 177.343 0.300 . 1 . . . . 15 CYS C . 10186 1
99 . 1 1 16 16 GLY N N 15 120.643 0.300 . 1 . . . . 16 GLY N . 10186 1
100 . 1 1 16 16 GLY H H 1 9.425 0.030 . 1 . . . . 16 GLY H . 10186 1
101 . 1 1 16 16 GLY CA C 13 46.692 0.300 . 1 . . . . 16 GLY CA . 10186 1
102 . 1 1 16 16 GLY HA2 H 1 3.969 0.030 . 2 . . . . 16 GLY HA2 . 10186 1
103 . 1 1 16 16 GLY HA3 H 1 4.034 0.030 . 2 . . . . 16 GLY HA3 . 10186 1
104 . 1 1 16 16 GLY C C 13 174.008 0.300 . 1 . . . . 16 GLY C . 10186 1
105 . 1 1 17 17 GLU N N 15 121.284 0.300 . 1 . . . . 17 GLU N . 10186 1
106 . 1 1 17 17 GLU H H 1 8.683 0.030 . 1 . . . . 17 GLU H . 10186 1
107 . 1 1 17 17 GLU CA C 13 57.922 0.300 . 1 . . . . 17 GLU CA . 10186 1
108 . 1 1 17 17 GLU HA H 1 4.295 0.030 . 1 . . . . 17 GLU HA . 10186 1
109 . 1 1 17 17 GLU CB C 13 29.778 0.300 . 1 . . . . 17 GLU CB . 10186 1
110 . 1 1 17 17 GLU HB2 H 1 1.344 0.030 . 1 . . . . 17 GLU HB2 . 10186 1
111 . 1 1 17 17 GLU HB3 H 1 1.344 0.030 . 1 . . . . 17 GLU HB3 . 10186 1
112 . 1 1 17 17 GLU CG C 13 35.803 0.300 . 1 . . . . 17 GLU CG . 10186 1
113 . 1 1 17 17 GLU HG2 H 1 1.783 0.030 . 2 . . . . 17 GLU HG2 . 10186 1
114 . 1 1 17 17 GLU HG3 H 1 1.885 0.030 . 2 . . . . 17 GLU HG3 . 10186 1
115 . 1 1 17 17 GLU C C 13 177.066 0.300 . 1 . . . . 17 GLU C . 10186 1
116 . 1 1 18 18 CYS N N 15 115.033 0.300 . 1 . . . . 18 CYS N . 10186 1
117 . 1 1 18 18 CYS H H 1 7.942 0.030 . 1 . . . . 18 CYS H . 10186 1
118 . 1 1 18 18 CYS CA C 13 58.453 0.300 . 1 . . . . 18 CYS CA . 10186 1
119 . 1 1 18 18 CYS HA H 1 5.187 0.030 . 1 . . . . 18 CYS HA . 10186 1
120 . 1 1 18 18 CYS CB C 13 32.524 0.300 . 1 . . . . 18 CYS CB . 10186 1
121 . 1 1 18 18 CYS HB2 H 1 3.438 0.030 . 2 . . . . 18 CYS HB2 . 10186 1
122 . 1 1 18 18 CYS HB3 H 1 2.886 0.030 . 2 . . . . 18 CYS HB3 . 10186 1
123 . 1 1 18 18 CYS C C 13 176.135 0.300 . 1 . . . . 18 CYS C . 10186 1
124 . 1 1 19 19 GLY N N 15 112.484 0.300 . 1 . . . . 19 GLY N . 10186 1
125 . 1 1 19 19 GLY H H 1 8.139 0.030 . 1 . . . . 19 GLY H . 10186 1
126 . 1 1 19 19 GLY CA C 13 46.297 0.300 . 1 . . . . 19 GLY CA . 10186 1
127 . 1 1 19 19 GLY HA2 H 1 4.269 0.030 . 2 . . . . 19 GLY HA2 . 10186 1
128 . 1 1 19 19 GLY HA3 H 1 3.800 0.030 . 2 . . . . 19 GLY HA3 . 10186 1
129 . 1 1 19 19 GLY C C 13 174.065 0.300 . 1 . . . . 19 GLY C . 10186 1
130 . 1 1 20 20 LYS N N 15 123.711 0.300 . 1 . . . . 20 LYS N . 10186 1
131 . 1 1 20 20 LYS H H 1 8.048 0.030 . 1 . . . . 20 LYS H . 10186 1
132 . 1 1 20 20 LYS CA C 13 58.446 0.300 . 1 . . . . 20 LYS CA . 10186 1
133 . 1 1 20 20 LYS HA H 1 4.045 0.030 . 1 . . . . 20 LYS HA . 10186 1
134 . 1 1 20 20 LYS CB C 13 33.391 0.300 . 1 . . . . 20 LYS CB . 10186 1
135 . 1 1 20 20 LYS HB2 H 1 1.293 0.030 . 2 . . . . 20 LYS HB2 . 10186 1
136 . 1 1 20 20 LYS HB3 H 1 1.345 0.030 . 2 . . . . 20 LYS HB3 . 10186 1
137 . 1 1 20 20 LYS CG C 13 26.539 0.300 . 1 . . . . 20 LYS CG . 10186 1
138 . 1 1 20 20 LYS HG2 H 1 1.294 0.030 . 2 . . . . 20 LYS HG2 . 10186 1
139 . 1 1 20 20 LYS HG3 H 1 1.526 0.030 . 2 . . . . 20 LYS HG3 . 10186 1
140 . 1 1 20 20 LYS CD C 13 29.043 0.300 . 1 . . . . 20 LYS CD . 10186 1
141 . 1 1 20 20 LYS HD2 H 1 1.499 0.030 . 2 . . . . 20 LYS HD2 . 10186 1
142 . 1 1 20 20 LYS HD3 H 1 1.544 0.030 . 2 . . . . 20 LYS HD3 . 10186 1
143 . 1 1 20 20 LYS CE C 13 42.322 0.300 . 1 . . . . 20 LYS CE . 10186 1
144 . 1 1 20 20 LYS HE2 H 1 2.932 0.030 . 1 . . . . 20 LYS HE2 . 10186 1
145 . 1 1 20 20 LYS HE3 H 1 2.932 0.030 . 1 . . . . 20 LYS HE3 . 10186 1
146 . 1 1 20 20 LYS C C 13 174.750 0.300 . 1 . . . . 20 LYS C . 10186 1
147 . 1 1 21 21 SER N N 15 114.286 0.300 . 1 . . . . 21 SER N . 10186 1
148 . 1 1 21 21 SER H H 1 7.863 0.030 . 1 . . . . 21 SER H . 10186 1
149 . 1 1 21 21 SER CA C 13 56.933 0.300 . 1 . . . . 21 SER CA . 10186 1
150 . 1 1 21 21 SER HA H 1 5.398 0.030 . 1 . . . . 21 SER HA . 10186 1
151 . 1 1 21 21 SER CB C 13 66.461 0.300 . 1 . . . . 21 SER CB . 10186 1
152 . 1 1 21 21 SER HB2 H 1 3.595 0.030 . 1 . . . . 21 SER HB2 . 10186 1
153 . 1 1 21 21 SER HB3 H 1 3.595 0.030 . 1 . . . . 21 SER HB3 . 10186 1
154 . 1 1 21 21 SER C C 13 172.635 0.300 . 1 . . . . 21 SER C . 10186 1
155 . 1 1 22 22 TYR N N 15 117.528 0.300 . 1 . . . . 22 TYR N . 10186 1
156 . 1 1 22 22 TYR H H 1 8.774 0.030 . 1 . . . . 22 TYR H . 10186 1
157 . 1 1 22 22 TYR CA C 13 58.061 0.300 . 1 . . . . 22 TYR CA . 10186 1
158 . 1 1 22 22 TYR HA H 1 4.750 0.030 . 1 . . . . 22 TYR HA . 10186 1
159 . 1 1 22 22 TYR CB C 13 44.125 0.300 . 1 . . . . 22 TYR CB . 10186 1
160 . 1 1 22 22 TYR HB2 H 1 3.588 0.030 . 2 . . . . 22 TYR HB2 . 10186 1
161 . 1 1 22 22 TYR HB3 H 1 2.642 0.030 . 2 . . . . 22 TYR HB3 . 10186 1
162 . 1 1 22 22 TYR CD1 C 13 133.345 0.300 . 1 . . . . 22 TYR CD1 . 10186 1
163 . 1 1 22 22 TYR HD1 H 1 7.103 0.030 . 1 . . . . 22 TYR HD1 . 10186 1
164 . 1 1 22 22 TYR CD2 C 13 133.345 0.300 . 1 . . . . 22 TYR CD2 . 10186 1
165 . 1 1 22 22 TYR HD2 H 1 7.103 0.030 . 1 . . . . 22 TYR HD2 . 10186 1
166 . 1 1 22 22 TYR CE1 C 13 117.557 0.300 . 1 . . . . 22 TYR CE1 . 10186 1
167 . 1 1 22 22 TYR HE1 H 1 6.345 0.030 . 1 . . . . 22 TYR HE1 . 10186 1
168 . 1 1 22 22 TYR CE2 C 13 117.557 0.300 . 1 . . . . 22 TYR CE2 . 10186 1
169 . 1 1 22 22 TYR HE2 H 1 6.345 0.030 . 1 . . . . 22 TYR HE2 . 10186 1
170 . 1 1 22 22 TYR C C 13 174.955 0.300 . 1 . . . . 22 TYR C . 10186 1
171 . 1 1 23 23 ASN N N 15 118.657 0.300 . 1 . . . . 23 ASN N . 10186 1
172 . 1 1 23 23 ASN H H 1 9.444 0.030 . 1 . . . . 23 ASN H . 10186 1
173 . 1 1 23 23 ASN CA C 13 54.765 0.300 . 1 . . . . 23 ASN CA . 10186 1
174 . 1 1 23 23 ASN HA H 1 5.029 0.030 . 1 . . . . 23 ASN HA . 10186 1
175 . 1 1 23 23 ASN CB C 13 40.282 0.300 . 1 . . . . 23 ASN CB . 10186 1
176 . 1 1 23 23 ASN HB2 H 1 3.003 0.030 . 2 . . . . 23 ASN HB2 . 10186 1
177 . 1 1 23 23 ASN HB3 H 1 3.089 0.030 . 2 . . . . 23 ASN HB3 . 10186 1
178 . 1 1 23 23 ASN ND2 N 15 112.369 0.300 . 1 . . . . 23 ASN ND2 . 10186 1
179 . 1 1 23 23 ASN HD21 H 1 7.828 0.030 . 2 . . . . 23 ASN HD21 . 10186 1
180 . 1 1 23 23 ASN HD22 H 1 7.096 0.030 . 2 . . . . 23 ASN HD22 . 10186 1
181 . 1 1 23 23 ASN C C 13 175.004 0.300 . 1 . . . . 23 ASN C . 10186 1
182 . 1 1 24 24 GLN N N 15 114.619 0.300 . 1 . . . . 24 GLN N . 10186 1
183 . 1 1 24 24 GLN H H 1 7.579 0.030 . 1 . . . . 24 GLN H . 10186 1
184 . 1 1 24 24 GLN CA C 13 54.151 0.300 . 1 . . . . 24 GLN CA . 10186 1
185 . 1 1 24 24 GLN HA H 1 4.692 0.030 . 1 . . . . 24 GLN HA . 10186 1
186 . 1 1 24 24 GLN CB C 13 31.829 0.300 . 1 . . . . 24 GLN CB . 10186 1
187 . 1 1 24 24 GLN HB2 H 1 1.940 0.030 . 2 . . . . 24 GLN HB2 . 10186 1
188 . 1 1 24 24 GLN HB3 H 1 1.233 0.030 . 2 . . . . 24 GLN HB3 . 10186 1
189 . 1 1 24 24 GLN CG C 13 33.617 0.300 . 1 . . . . 24 GLN CG . 10186 1
190 . 1 1 24 24 GLN HG2 H 1 2.262 0.030 . 2 . . . . 24 GLN HG2 . 10186 1
191 . 1 1 24 24 GLN HG3 H 1 2.329 0.030 . 2 . . . . 24 GLN HG3 . 10186 1
192 . 1 1 24 24 GLN NE2 N 15 111.933 0.300 . 1 . . . . 24 GLN NE2 . 10186 1
193 . 1 1 24 24 GLN HE21 H 1 6.863 0.030 . 2 . . . . 24 GLN HE21 . 10186 1
194 . 1 1 24 24 GLN HE22 H 1 7.510 0.030 . 2 . . . . 24 GLN HE22 . 10186 1
195 . 1 1 24 24 GLN C C 13 175.731 0.300 . 1 . . . . 24 GLN C . 10186 1
196 . 1 1 25 25 ARG N N 15 127.274 0.300 . 1 . . . . 25 ARG N . 10186 1
197 . 1 1 25 25 ARG H H 1 8.350 0.030 . 1 . . . . 25 ARG H . 10186 1
198 . 1 1 25 25 ARG CA C 13 59.687 0.300 . 1 . . . . 25 ARG CA . 10186 1
199 . 1 1 25 25 ARG HA H 1 2.879 0.030 . 1 . . . . 25 ARG HA . 10186 1
200 . 1 1 25 25 ARG CB C 13 29.082 0.300 . 1 . . . . 25 ARG CB . 10186 1
201 . 1 1 25 25 ARG HB2 H 1 0.965 0.030 . 2 . . . . 25 ARG HB2 . 10186 1
202 . 1 1 25 25 ARG HB3 H 1 1.381 0.030 . 2 . . . . 25 ARG HB3 . 10186 1
203 . 1 1 25 25 ARG CG C 13 27.235 0.300 . 1 . . . . 25 ARG CG . 10186 1
204 . 1 1 25 25 ARG HG2 H 1 1.197 0.030 . 2 . . . . 25 ARG HG2 . 10186 1
205 . 1 1 25 25 ARG HG3 H 1 1.315 0.030 . 2 . . . . 25 ARG HG3 . 10186 1
206 . 1 1 25 25 ARG CD C 13 42.931 0.300 . 1 . . . . 25 ARG CD . 10186 1
207 . 1 1 25 25 ARG HD2 H 1 3.005 0.030 . 2 . . . . 25 ARG HD2 . 10186 1
208 . 1 1 25 25 ARG HD3 H 1 3.081 0.030 . 2 . . . . 25 ARG HD3 . 10186 1
209 . 1 1 25 25 ARG C C 13 178.363 0.300 . 1 . . . . 25 ARG C . 10186 1
210 . 1 1 26 26 VAL N N 15 115.093 0.300 . 1 . . . . 26 VAL N . 10186 1
211 . 1 1 26 26 VAL H H 1 8.274 0.030 . 1 . . . . 26 VAL H . 10186 1
212 . 1 1 26 26 VAL CA C 13 64.611 0.300 . 1 . . . . 26 VAL CA . 10186 1
213 . 1 1 26 26 VAL HA H 1 3.908 0.030 . 1 . . . . 26 VAL HA . 10186 1
214 . 1 1 26 26 VAL CB C 13 31.070 0.300 . 1 . . . . 26 VAL CB . 10186 1
215 . 1 1 26 26 VAL HB H 1 1.979 0.030 . 1 . . . . 26 VAL HB . 10186 1
216 . 1 1 26 26 VAL CG1 C 13 20.955 0.300 . 2 . . . . 26 VAL CG1 . 10186 1
217 . 1 1 26 26 VAL HG11 H 1 0.849 0.030 . 1 . . . . 26 VAL HG1 . 10186 1
218 . 1 1 26 26 VAL HG12 H 1 0.849 0.030 . 1 . . . . 26 VAL HG1 . 10186 1
219 . 1 1 26 26 VAL HG13 H 1 0.849 0.030 . 1 . . . . 26 VAL HG1 . 10186 1
220 . 1 1 26 26 VAL CG2 C 13 20.021 0.300 . 2 . . . . 26 VAL CG2 . 10186 1
221 . 1 1 26 26 VAL HG21 H 1 0.687 0.030 . 1 . . . . 26 VAL HG2 . 10186 1
222 . 1 1 26 26 VAL HG22 H 1 0.687 0.030 . 1 . . . . 26 VAL HG2 . 10186 1
223 . 1 1 26 26 VAL HG23 H 1 0.687 0.030 . 1 . . . . 26 VAL HG2 . 10186 1
224 . 1 1 26 26 VAL C C 13 176.893 0.300 . 1 . . . . 26 VAL C . 10186 1
225 . 1 1 27 27 HIS N N 15 119.161 0.300 . 1 . . . . 27 HIS N . 10186 1
226 . 1 1 27 27 HIS H H 1 6.525 0.030 . 1 . . . . 27 HIS H . 10186 1
227 . 1 1 27 27 HIS CA C 13 57.177 0.300 . 1 . . . . 27 HIS CA . 10186 1
228 . 1 1 27 27 HIS HA H 1 4.387 0.030 . 1 . . . . 27 HIS HA . 10186 1
229 . 1 1 27 27 HIS CB C 13 31.423 0.300 . 1 . . . . 27 HIS CB . 10186 1
230 . 1 1 27 27 HIS HB2 H 1 3.167 0.030 . 2 . . . . 27 HIS HB2 . 10186 1
231 . 1 1 27 27 HIS HB3 H 1 2.991 0.030 . 2 . . . . 27 HIS HB3 . 10186 1
232 . 1 1 27 27 HIS CD2 C 13 116.677 0.300 . 1 . . . . 27 HIS CD2 . 10186 1
233 . 1 1 27 27 HIS HD2 H 1 6.922 0.030 . 1 . . . . 27 HIS HD2 . 10186 1
234 . 1 1 27 27 HIS CE1 C 13 138.975 0.300 . 1 . . . . 27 HIS CE1 . 10186 1
235 . 1 1 27 27 HIS HE1 H 1 7.782 0.030 . 1 . . . . 27 HIS HE1 . 10186 1
236 . 1 1 27 27 HIS C C 13 178.508 0.300 . 1 . . . . 27 HIS C . 10186 1
237 . 1 1 28 28 LEU N N 15 121.662 0.300 . 1 . . . . 28 LEU N . 10186 1
238 . 1 1 28 28 LEU H H 1 7.064 0.030 . 1 . . . . 28 LEU H . 10186 1
239 . 1 1 28 28 LEU CA C 13 58.041 0.300 . 1 . . . . 28 LEU CA . 10186 1
240 . 1 1 28 28 LEU HA H 1 3.807 0.030 . 1 . . . . 28 LEU HA . 10186 1
241 . 1 1 28 28 LEU CB C 13 40.232 0.300 . 1 . . . . 28 LEU CB . 10186 1
242 . 1 1 28 28 LEU HB2 H 1 2.158 0.030 . 2 . . . . 28 LEU HB2 . 10186 1
243 . 1 1 28 28 LEU HB3 H 1 1.394 0.030 . 2 . . . . 28 LEU HB3 . 10186 1
244 . 1 1 28 28 LEU CG C 13 27.544 0.300 . 1 . . . . 28 LEU CG . 10186 1
245 . 1 1 28 28 LEU HG H 1 1.596 0.030 . 1 . . . . 28 LEU HG . 10186 1
246 . 1 1 28 28 LEU CD1 C 13 26.478 0.300 . 2 . . . . 28 LEU CD1 . 10186 1
247 . 1 1 28 28 LEU HD11 H 1 1.031 0.030 . 1 . . . . 28 LEU HD1 . 10186 1
248 . 1 1 28 28 LEU HD12 H 1 1.031 0.030 . 1 . . . . 28 LEU HD1 . 10186 1
249 . 1 1 28 28 LEU HD13 H 1 1.031 0.030 . 1 . . . . 28 LEU HD1 . 10186 1
250 . 1 1 28 28 LEU CD2 C 13 22.740 0.300 . 2 . . . . 28 LEU CD2 . 10186 1
251 . 1 1 28 28 LEU HD21 H 1 1.132 0.030 . 1 . . . . 28 LEU HD2 . 10186 1
252 . 1 1 28 28 LEU HD22 H 1 1.132 0.030 . 1 . . . . 28 LEU HD2 . 10186 1
253 . 1 1 28 28 LEU HD23 H 1 1.132 0.030 . 1 . . . . 28 LEU HD2 . 10186 1
254 . 1 1 28 28 LEU C C 13 177.776 0.300 . 1 . . . . 28 LEU C . 10186 1
255 . 1 1 29 29 THR N N 15 116.331 0.300 . 1 . . . . 29 THR N . 10186 1
256 . 1 1 29 29 THR H H 1 8.606 0.030 . 1 . . . . 29 THR H . 10186 1
257 . 1 1 29 29 THR CA C 13 66.300 0.300 . 1 . . . . 29 THR CA . 10186 1
258 . 1 1 29 29 THR HA H 1 4.009 0.030 . 1 . . . . 29 THR HA . 10186 1
259 . 1 1 29 29 THR CB C 13 68.317 0.300 . 1 . . . . 29 THR CB . 10186 1
260 . 1 1 29 29 THR HB H 1 4.152 0.030 . 1 . . . . 29 THR HB . 10186 1
261 . 1 1 29 29 THR CG2 C 13 22.220 0.300 . 1 . . . . 29 THR CG2 . 10186 1
262 . 1 1 29 29 THR HG21 H 1 1.199 0.030 . 1 . . . . 29 THR HG2 . 10186 1
263 . 1 1 29 29 THR HG22 H 1 1.199 0.030 . 1 . . . . 29 THR HG2 . 10186 1
264 . 1 1 29 29 THR HG23 H 1 1.199 0.030 . 1 . . . . 29 THR HG2 . 10186 1
265 . 1 1 29 29 THR C C 13 177.336 0.300 . 1 . . . . 29 THR C . 10186 1
266 . 1 1 30 30 GLN N N 15 119.465 0.300 . 1 . . . . 30 GLN N . 10186 1
267 . 1 1 30 30 GLN H H 1 7.838 0.030 . 1 . . . . 30 GLN H . 10186 1
268 . 1 1 30 30 GLN CA C 13 58.851 0.300 . 1 . . . . 30 GLN CA . 10186 1
269 . 1 1 30 30 GLN HA H 1 3.969 0.030 . 1 . . . . 30 GLN HA . 10186 1
270 . 1 1 30 30 GLN CB C 13 28.349 0.300 . 1 . . . . 30 GLN CB . 10186 1
271 . 1 1 30 30 GLN HB2 H 1 2.028 0.030 . 2 . . . . 30 GLN HB2 . 10186 1
272 . 1 1 30 30 GLN HB3 H 1 2.113 0.030 . 2 . . . . 30 GLN HB3 . 10186 1
273 . 1 1 30 30 GLN CG C 13 33.877 0.300 . 1 . . . . 30 GLN CG . 10186 1
274 . 1 1 30 30 GLN HG2 H 1 2.388 0.030 . 2 . . . . 30 GLN HG2 . 10186 1
275 . 1 1 30 30 GLN HG3 H 1 2.535 0.030 . 2 . . . . 30 GLN HG3 . 10186 1
276 . 1 1 30 30 GLN NE2 N 15 111.292 0.300 . 1 . . . . 30 GLN NE2 . 10186 1
277 . 1 1 30 30 GLN HE21 H 1 7.396 0.030 . 2 . . . . 30 GLN HE21 . 10186 1
278 . 1 1 30 30 GLN HE22 H 1 6.851 0.030 . 2 . . . . 30 GLN HE22 . 10186 1
279 . 1 1 30 30 GLN C C 13 178.722 0.300 . 1 . . . . 30 GLN C . 10186 1
280 . 1 1 31 31 HIS N N 15 119.993 0.300 . 1 . . . . 31 HIS N . 10186 1
281 . 1 1 31 31 HIS H H 1 7.664 0.030 . 1 . . . . 31 HIS H . 10186 1
282 . 1 1 31 31 HIS CA C 13 59.107 0.300 . 1 . . . . 31 HIS CA . 10186 1
283 . 1 1 31 31 HIS HA H 1 4.287 0.030 . 1 . . . . 31 HIS HA . 10186 1
284 . 1 1 31 31 HIS CB C 13 28.026 0.300 . 1 . . . . 31 HIS CB . 10186 1
285 . 1 1 31 31 HIS HB2 H 1 3.404 0.030 . 2 . . . . 31 HIS HB2 . 10186 1
286 . 1 1 31 31 HIS HB3 H 1 3.148 0.030 . 2 . . . . 31 HIS HB3 . 10186 1
287 . 1 1 31 31 HIS CD2 C 13 126.074 0.300 . 1 . . . . 31 HIS CD2 . 10186 1
288 . 1 1 31 31 HIS HD2 H 1 6.914 0.030 . 1 . . . . 31 HIS HD2 . 10186 1
289 . 1 1 31 31 HIS CE1 C 13 139.639 0.300 . 1 . . . . 31 HIS CE1 . 10186 1
290 . 1 1 31 31 HIS HE1 H 1 7.909 0.030 . 1 . . . . 31 HIS HE1 . 10186 1
291 . 1 1 31 31 HIS C C 13 176.251 0.300 . 1 . . . . 31 HIS C . 10186 1
292 . 1 1 32 32 GLN N N 15 115.117 0.300 . 1 . . . . 32 GLN N . 10186 1
293 . 1 1 32 32 GLN H H 1 8.424 0.030 . 1 . . . . 32 GLN H . 10186 1
294 . 1 1 32 32 GLN CA C 13 59.472 0.300 . 1 . . . . 32 GLN CA . 10186 1
295 . 1 1 32 32 GLN HA H 1 3.613 0.030 . 1 . . . . 32 GLN HA . 10186 1
296 . 1 1 32 32 GLN CB C 13 28.286 0.300 . 1 . . . . 32 GLN CB . 10186 1
297 . 1 1 32 32 GLN HB2 H 1 2.237 0.030 . 2 . . . . 32 GLN HB2 . 10186 1
298 . 1 1 32 32 GLN HB3 H 1 2.336 0.030 . 2 . . . . 32 GLN HB3 . 10186 1
299 . 1 1 32 32 GLN CG C 13 35.790 0.300 . 1 . . . . 32 GLN CG . 10186 1
300 . 1 1 32 32 GLN HG2 H 1 2.831 0.030 . 2 . . . . 32 GLN HG2 . 10186 1
301 . 1 1 32 32 GLN HG3 H 1 2.902 0.030 . 2 . . . . 32 GLN HG3 . 10186 1
302 . 1 1 32 32 GLN NE2 N 15 112.865 0.300 . 1 . . . . 32 GLN NE2 . 10186 1
303 . 1 1 32 32 GLN HE21 H 1 7.090 0.030 . 2 . . . . 32 GLN HE21 . 10186 1
304 . 1 1 32 32 GLN HE22 H 1 7.714 0.030 . 2 . . . . 32 GLN HE22 . 10186 1
305 . 1 1 32 32 GLN C C 13 177.186 0.300 . 1 . . . . 32 GLN C . 10186 1
306 . 1 1 33 33 ARG N N 15 117.852 0.300 . 1 . . . . 33 ARG N . 10186 1
307 . 1 1 33 33 ARG H H 1 7.105 0.030 . 1 . . . . 33 ARG H . 10186 1
308 . 1 1 33 33 ARG CA C 13 58.492 0.300 . 1 . . . . 33 ARG CA . 10186 1
309 . 1 1 33 33 ARG HA H 1 4.149 0.030 . 1 . . . . 33 ARG HA . 10186 1
310 . 1 1 33 33 ARG CB C 13 30.080 0.300 . 1 . . . . 33 ARG CB . 10186 1
311 . 1 1 33 33 ARG HB2 H 1 1.790 0.030 . 2 . . . . 33 ARG HB2 . 10186 1
312 . 1 1 33 33 ARG HB3 H 1 1.898 0.030 . 2 . . . . 33 ARG HB3 . 10186 1
313 . 1 1 33 33 ARG CG C 13 27.494 0.300 . 1 . . . . 33 ARG CG . 10186 1
314 . 1 1 33 33 ARG HG2 H 1 1.687 0.030 . 2 . . . . 33 ARG HG2 . 10186 1
315 . 1 1 33 33 ARG HG3 H 1 1.843 0.030 . 2 . . . . 33 ARG HG3 . 10186 1
316 . 1 1 33 33 ARG CD C 13 43.488 0.300 . 1 . . . . 33 ARG CD . 10186 1
317 . 1 1 33 33 ARG HD2 H 1 3.213 0.030 . 1 . . . . 33 ARG HD2 . 10186 1
318 . 1 1 33 33 ARG HD3 H 1 3.213 0.030 . 1 . . . . 33 ARG HD3 . 10186 1
319 . 1 1 33 33 ARG C C 13 178.535 0.300 . 1 . . . . 33 ARG C . 10186 1
320 . 1 1 34 34 VAL N N 15 115.844 0.300 . 1 . . . . 34 VAL N . 10186 1
321 . 1 1 34 34 VAL H H 1 7.971 0.030 . 1 . . . . 34 VAL H . 10186 1
322 . 1 1 34 34 VAL CA C 13 63.982 0.300 . 1 . . . . 34 VAL CA . 10186 1
323 . 1 1 34 34 VAL HA H 1 3.936 0.030 . 1 . . . . 34 VAL HA . 10186 1
324 . 1 1 34 34 VAL CB C 13 31.159 0.300 . 1 . . . . 34 VAL CB . 10186 1
325 . 1 1 34 34 VAL HB H 1 1.946 0.030 . 1 . . . . 34 VAL HB . 10186 1
326 . 1 1 34 34 VAL CG1 C 13 19.531 0.300 . 2 . . . . 34 VAL CG1 . 10186 1
327 . 1 1 34 34 VAL HG11 H 1 0.509 0.030 . 1 . . . . 34 VAL HG1 . 10186 1
328 . 1 1 34 34 VAL HG12 H 1 0.509 0.030 . 1 . . . . 34 VAL HG1 . 10186 1
329 . 1 1 34 34 VAL HG13 H 1 0.509 0.030 . 1 . . . . 34 VAL HG1 . 10186 1
330 . 1 1 34 34 VAL CG2 C 13 19.819 0.300 . 2 . . . . 34 VAL CG2 . 10186 1
331 . 1 1 34 34 VAL HG21 H 1 0.658 0.030 . 1 . . . . 34 VAL HG2 . 10186 1
332 . 1 1 34 34 VAL HG22 H 1 0.658 0.030 . 1 . . . . 34 VAL HG2 . 10186 1
333 . 1 1 34 34 VAL HG23 H 1 0.658 0.030 . 1 . . . . 34 VAL HG2 . 10186 1
334 . 1 1 34 34 VAL C C 13 177.254 0.300 . 1 . . . . 34 VAL C . 10186 1
335 . 1 1 35 35 HIS N N 15 117.345 0.300 . 1 . . . . 35 HIS N . 10186 1
336 . 1 1 35 35 HIS H H 1 7.225 0.030 . 1 . . . . 35 HIS H . 10186 1
337 . 1 1 35 35 HIS CA C 13 55.058 0.300 . 1 . . . . 35 HIS CA . 10186 1
338 . 1 1 35 35 HIS HA H 1 4.895 0.030 . 1 . . . . 35 HIS HA . 10186 1
339 . 1 1 35 35 HIS CB C 13 28.620 0.300 . 1 . . . . 35 HIS CB . 10186 1
340 . 1 1 35 35 HIS HB2 H 1 3.387 0.030 . 2 . . . . 35 HIS HB2 . 10186 1
341 . 1 1 35 35 HIS HB3 H 1 3.218 0.030 . 2 . . . . 35 HIS HB3 . 10186 1
342 . 1 1 35 35 HIS CD2 C 13 127.505 0.300 . 1 . . . . 35 HIS CD2 . 10186 1
343 . 1 1 35 35 HIS HD2 H 1 6.721 0.030 . 1 . . . . 35 HIS HD2 . 10186 1
344 . 1 1 35 35 HIS CE1 C 13 139.962 0.300 . 1 . . . . 35 HIS CE1 . 10186 1
345 . 1 1 35 35 HIS HE1 H 1 8.042 0.030 . 1 . . . . 35 HIS HE1 . 10186 1
346 . 1 1 35 35 HIS C C 13 175.716 0.300 . 1 . . . . 35 HIS C . 10186 1
347 . 1 1 36 36 THR N N 15 111.842 0.300 . 1 . . . . 36 THR N . 10186 1
348 . 1 1 36 36 THR H H 1 7.775 0.030 . 1 . . . . 36 THR H . 10186 1
349 . 1 1 36 36 THR CA C 13 62.514 0.300 . 1 . . . . 36 THR CA . 10186 1
350 . 1 1 36 36 THR HA H 1 4.374 0.030 . 1 . . . . 36 THR HA . 10186 1
351 . 1 1 36 36 THR CB C 13 69.853 0.300 . 1 . . . . 36 THR CB . 10186 1
352 . 1 1 36 36 THR HB H 1 4.339 0.030 . 1 . . . . 36 THR HB . 10186 1
353 . 1 1 36 36 THR CG2 C 13 21.597 0.300 . 1 . . . . 36 THR CG2 . 10186 1
354 . 1 1 36 36 THR HG21 H 1 1.252 0.030 . 1 . . . . 36 THR HG2 . 10186 1
355 . 1 1 36 36 THR HG22 H 1 1.252 0.030 . 1 . . . . 36 THR HG2 . 10186 1
356 . 1 1 36 36 THR HG23 H 1 1.252 0.030 . 1 . . . . 36 THR HG2 . 10186 1
357 . 1 1 36 36 THR C C 13 175.509 0.300 . 1 . . . . 36 THR C . 10186 1
358 . 1 1 37 37 GLY N N 15 110.650 0.300 . 1 . . . . 37 GLY N . 10186 1
359 . 1 1 37 37 GLY H H 1 8.235 0.030 . 1 . . . . 37 GLY H . 10186 1
360 . 1 1 37 37 GLY CA C 13 45.420 0.300 . 1 . . . . 37 GLY CA . 10186 1
361 . 1 1 37 37 GLY HA2 H 1 3.960 0.030 . 2 . . . . 37 GLY HA2 . 10186 1
362 . 1 1 37 37 GLY HA3 H 1 4.040 0.030 . 2 . . . . 37 GLY HA3 . 10186 1
363 . 1 1 37 37 GLY C C 13 173.979 0.300 . 1 . . . . 37 GLY C . 10186 1
364 . 1 1 38 38 GLU N N 15 120.601 0.300 . 1 . . . . 38 GLU N . 10186 1
365 . 1 1 38 38 GLU H H 1 8.101 0.030 . 1 . . . . 38 GLU H . 10186 1
366 . 1 1 38 38 GLU CA C 13 56.476 0.300 . 1 . . . . 38 GLU CA . 10186 1
367 . 1 1 38 38 GLU HA H 1 4.255 0.030 . 1 . . . . 38 GLU HA . 10186 1
368 . 1 1 38 38 GLU CB C 13 30.561 0.300 . 1 . . . . 38 GLU CB . 10186 1
369 . 1 1 38 38 GLU HB2 H 1 1.916 0.030 . 2 . . . . 38 GLU HB2 . 10186 1
370 . 1 1 38 38 GLU HB3 H 1 2.002 0.030 . 2 . . . . 38 GLU HB3 . 10186 1
371 . 1 1 38 38 GLU CG C 13 36.279 0.300 . 1 . . . . 38 GLU CG . 10186 1
372 . 1 1 38 38 GLU HG2 H 1 2.279 0.030 . 2 . . . . 38 GLU HG2 . 10186 1
373 . 1 1 38 38 GLU HG3 H 1 2.225 0.030 . 2 . . . . 38 GLU HG3 . 10186 1
374 . 1 1 38 38 GLU C C 13 176.212 0.300 . 1 . . . . 38 GLU C . 10186 1
375 . 1 1 39 39 LYS N N 15 123.814 0.300 . 1 . . . . 39 LYS N . 10186 1
376 . 1 1 39 39 LYS H H 1 8.413 0.030 . 1 . . . . 39 LYS H . 10186 1
377 . 1 1 39 39 LYS CA C 13 54.245 0.300 . 1 . . . . 39 LYS CA . 10186 1
378 . 1 1 39 39 LYS HA H 1 4.618 0.030 . 1 . . . . 39 LYS HA . 10186 1
379 . 1 1 39 39 LYS CB C 13 32.519 0.300 . 1 . . . . 39 LYS CB . 10186 1
380 . 1 1 39 39 LYS HB2 H 1 1.827 0.030 . 2 . . . . 39 LYS HB2 . 10186 1
381 . 1 1 39 39 LYS HB3 H 1 1.738 0.030 . 2 . . . . 39 LYS HB3 . 10186 1
382 . 1 1 39 39 LYS CG C 13 24.515 0.300 . 1 . . . . 39 LYS CG . 10186 1
383 . 1 1 39 39 LYS HG2 H 1 1.480 0.030 . 1 . . . . 39 LYS HG2 . 10186 1
384 . 1 1 39 39 LYS HG3 H 1 1.480 0.030 . 1 . . . . 39 LYS HG3 . 10186 1
385 . 1 1 39 39 LYS CD C 13 29.151 0.300 . 1 . . . . 39 LYS CD . 10186 1
386 . 1 1 39 39 LYS HD2 H 1 1.699 0.030 . 1 . . . . 39 LYS HD2 . 10186 1
387 . 1 1 39 39 LYS HD3 H 1 1.699 0.030 . 1 . . . . 39 LYS HD3 . 10186 1
388 . 1 1 39 39 LYS CE C 13 42.211 0.300 . 1 . . . . 39 LYS CE . 10186 1
389 . 1 1 39 39 LYS HE2 H 1 3.013 0.030 . 1 . . . . 39 LYS HE2 . 10186 1
390 . 1 1 39 39 LYS HE3 H 1 3.013 0.030 . 1 . . . . 39 LYS HE3 . 10186 1
391 . 1 1 39 39 LYS C C 13 174.467 0.300 . 1 . . . . 39 LYS C . 10186 1
392 . 1 1 40 40 PRO CA C 13 63.219 0.300 . 1 . . . . 40 PRO CA . 10186 1
393 . 1 1 40 40 PRO HA H 1 4.467 0.030 . 1 . . . . 40 PRO HA . 10186 1
394 . 1 1 40 40 PRO CB C 13 32.203 0.300 . 1 . . . . 40 PRO CB . 10186 1
395 . 1 1 40 40 PRO HB2 H 1 2.309 0.030 . 2 . . . . 40 PRO HB2 . 10186 1
396 . 1 1 40 40 PRO HB3 H 1 1.949 0.030 . 2 . . . . 40 PRO HB3 . 10186 1
397 . 1 1 40 40 PRO CG C 13 27.411 0.300 . 1 . . . . 40 PRO CG . 10186 1
398 . 1 1 40 40 PRO HG2 H 1 2.028 0.030 . 1 . . . . 40 PRO HG2 . 10186 1
399 . 1 1 40 40 PRO HG3 H 1 2.028 0.030 . 1 . . . . 40 PRO HG3 . 10186 1
400 . 1 1 40 40 PRO CD C 13 50.682 0.300 . 1 . . . . 40 PRO CD . 10186 1
401 . 1 1 40 40 PRO HD2 H 1 3.655 0.030 . 2 . . . . 40 PRO HD2 . 10186 1
402 . 1 1 40 40 PRO HD3 H 1 3.828 0.030 . 2 . . . . 40 PRO HD3 . 10186 1
403 . 1 1 40 40 PRO C C 13 173.930 0.300 . 1 . . . . 40 PRO C . 10186 1
404 . 1 1 41 41 SER N N 15 116.519 0.300 . 1 . . . . 41 SER N . 10186 1
405 . 1 1 41 41 SER H H 1 8.488 0.030 . 1 . . . . 41 SER H . 10186 1
406 . 1 1 41 41 SER C C 13 178.949 0.300 . 1 . . . . 41 SER C . 10186 1
407 . 1 1 42 42 GLY CA C 13 44.689 0.300 . 1 . . . . 42 GLY CA . 10186 1
408 . 1 1 42 42 GLY HA2 H 1 4.119 0.030 . 2 . . . . 42 GLY HA2 . 10186 1
409 . 1 1 42 42 GLY HA3 H 1 4.173 0.030 . 2 . . . . 42 GLY HA3 . 10186 1
410 . 1 1 43 43 PRO CA C 13 63.267 0.300 . 1 . . . . 43 PRO CA . 10186 1
411 . 1 1 43 43 PRO HA H 1 4.485 0.030 . 1 . . . . 43 PRO HA . 10186 1
412 . 1 1 43 43 PRO CB C 13 32.227 0.300 . 1 . . . . 43 PRO CB . 10186 1
413 . 1 1 43 43 PRO HB2 H 1 2.303 0.030 . 2 . . . . 43 PRO HB2 . 10186 1
414 . 1 1 43 43 PRO HB3 H 1 1.968 0.030 . 2 . . . . 43 PRO HB3 . 10186 1
415 . 1 1 43 43 PRO CG C 13 27.179 0.300 . 1 . . . . 43 PRO CG . 10186 1
416 . 1 1 43 43 PRO HG2 H 1 2.026 0.030 . 1 . . . . 43 PRO HG2 . 10186 1
417 . 1 1 43 43 PRO HG3 H 1 2.026 0.030 . 1 . . . . 43 PRO HG3 . 10186 1
418 . 1 1 43 43 PRO CD C 13 49.806 0.300 . 1 . . . . 43 PRO CD . 10186 1
419 . 1 1 43 43 PRO HD2 H 1 3.636 0.030 . 1 . . . . 43 PRO HD2 . 10186 1
420 . 1 1 43 43 PRO HD3 H 1 3.636 0.030 . 1 . . . . 43 PRO HD3 . 10186 1
421 . 1 1 45 45 SER CA C 13 58.370 0.300 . 1 . . . . 45 SER CA . 10186 1
422 . 1 1 45 45 SER HA H 1 4.495 0.030 . 1 . . . . 45 SER HA . 10186 1
423 . 1 1 45 45 SER CB C 13 64.018 0.300 . 1 . . . . 45 SER CB . 10186 1
424 . 1 1 45 45 SER HB2 H 1 3.879 0.030 . 2 . . . . 45 SER HB2 . 10186 1
425 . 1 1 45 45 SER C C 13 173.890 0.300 . 1 . . . . 45 SER C . 10186 1
426 . 1 1 46 46 GLY N N 15 116.869 0.300 . 1 . . . . 46 GLY N . 10186 1
427 . 1 1 46 46 GLY H H 1 8.053 0.030 . 1 . . . . 46 GLY H . 10186 1
428 . 1 1 46 46 GLY CA C 13 46.243 0.300 . 1 . . . . 46 GLY CA . 10186 1
429 . 1 1 46 46 GLY HA2 H 1 3.806 0.030 . 2 . . . . 46 GLY HA2 . 10186 1
430 . 1 1 46 46 GLY HA3 H 1 3.764 0.030 . 2 . . . . 46 GLY HA3 . 10186 1
431 . 1 1 46 46 GLY C C 13 178.949 0.300 . 1 . . . . 46 GLY C . 10186 1
stop_
save_