###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 17558
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 17558 1
3 '3D HNCO' . . . 17558 1
5 '3D HNCACB' . . . 17558 1
9 '3D HCCH-COSY' . . . 17558 1
10 '3D 1H-15N NOESY' . . . 17558 1
12 '3D CBCA(CO)NH' . . . 17558 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 LYS HA H 1 4.639 0.02 . 1 . . . A 1 LYS HA . 17558 1
2 . 1 1 1 1 LYS HE2 H 1 2.900 0.02 . 2 . . . A 1 LYS HE2 . 17558 1
3 . 1 1 1 1 LYS CE C 13 42.047 0.20 . 1 . . . A 1 LYS CE . 17558 1
4 . 1 1 2 2 HIS HA H 1 4.313 0.02 . 1 . . . A 2 HIS HA . 17558 1
5 . 1 1 2 2 HIS HB2 H 1 3.154 0.02 . 2 . . . A 2 HIS HB2 . 17558 1
6 . 1 1 2 2 HIS HD2 H 1 6.889 0.02 . 1 . . . A 2 HIS HD2 . 17558 1
7 . 1 1 2 2 HIS HE1 H 1 7.802 0.02 . 1 . . . A 2 HIS HE1 . 17558 1
8 . 1 1 2 2 HIS C C 13 177.032 0.2 . 1 . . . A 2 HIS C . 17558 1
9 . 1 1 2 2 HIS CA C 13 59.353 0.2 . 1 . . . A 2 HIS CA . 17558 1
10 . 1 1 2 2 HIS CB C 13 30.556 0.2 . 1 . . . A 2 HIS CB . 17558 1
11 . 1 1 2 2 HIS CD2 C 13 119.910 0.2 . 1 . . . A 2 HIS CD2 . 17558 1
12 . 1 1 2 2 HIS CE1 C 13 138.800 0.2 . 1 . . . A 2 HIS CE1 . 17558 1
13 . 1 1 3 3 MET H H 1 8.055 0.02 . 1 . . . A 3 MET H . 17558 1
14 . 1 1 3 3 MET HA H 1 4.116 0.02 . 1 . . . A 3 MET HA . 17558 1
15 . 1 1 3 3 MET HB2 H 1 2.300 0.02 . 2 . . . A 3 MET HB2 . 17558 1
16 . 1 1 3 3 MET HE1 H 1 1.839 0.02 . 1 . . . A 3 MET HE1 . 17558 1
17 . 1 1 3 3 MET HE2 H 1 1.839 0.02 . 1 . . . A 3 MET HE2 . 17558 1
18 . 1 1 3 3 MET HE3 H 1 1.839 0.02 . 1 . . . A 3 MET HE3 . 17558 1
19 . 1 1 3 3 MET C C 13 177.497 0.2 . 1 . . . A 3 MET C . 17558 1
20 . 1 1 3 3 MET CA C 13 59.361 0.2 . 1 . . . A 3 MET CA . 17558 1
21 . 1 1 3 3 MET CB C 13 33.826 0.2 . 1 . . . A 3 MET CB . 17558 1
22 . 1 1 3 3 MET CE C 13 17.148 0.2 . 1 . . . A 3 MET CE . 17558 1
23 . 1 1 3 3 MET N N 15 118.797 0.2 . 1 . . . A 3 MET N . 17558 1
24 . 1 1 4 4 ALA H H 1 8.279 0.02 . 1 . . . A 4 ALA H . 17558 1
25 . 1 1 4 4 ALA HA H 1 3.965 0.02 . 1 . . . A 4 ALA HA . 17558 1
26 . 1 1 4 4 ALA HB1 H 1 1.410 0.02 . 1 . . . A 4 ALA HB1 . 17558 1
27 . 1 1 4 4 ALA HB2 H 1 1.410 0.02 . 1 . . . A 4 ALA HB2 . 17558 1
28 . 1 1 4 4 ALA HB3 H 1 1.410 0.02 . 1 . . . A 4 ALA HB3 . 17558 1
29 . 1 1 4 4 ALA C C 13 178.892 0.2 . 1 . . . A 4 ALA C . 17558 1
30 . 1 1 4 4 ALA CA C 13 56.051 0.2 . 1 . . . A 4 ALA CA . 17558 1
31 . 1 1 4 4 ALA CB C 13 18.804 0.2 . 1 . . . A 4 ALA CB . 17558 1
32 . 1 1 4 4 ALA N N 15 120.454 0.2 . 1 . . . A 4 ALA N . 17558 1
33 . 1 1 5 5 GLY H H 1 8.478 0.02 . 1 . . . A 5 GLY H . 17558 1
34 . 1 1 5 5 GLY HA2 H 1 3.621 0.02 . 2 . . . A 5 GLY HA2 . 17558 1
35 . 1 1 5 5 GLY HA3 H 1 3.858 0.02 . 2 . . . A 5 GLY HA3 . 17558 1
36 . 1 1 5 5 GLY C C 13 174.212 0.2 . 1 . . . A 5 GLY C . 17558 1
37 . 1 1 5 5 GLY CA C 13 47.970 0.2 . 1 . . . A 5 GLY CA . 17558 1
38 . 1 1 5 5 GLY N N 15 104.385 0.2 . 1 . . . A 5 GLY N . 17558 1
39 . 1 1 6 6 ALA H H 1 8.005 0.02 . 1 . . . A 6 ALA H . 17558 1
40 . 1 1 6 6 ALA HA H 1 4.245 0.02 . 1 . . . A 6 ALA HA . 17558 1
41 . 1 1 6 6 ALA HB1 H 1 1.355 0.02 . 1 . . . A 6 ALA HB1 . 17558 1
42 . 1 1 6 6 ALA HB2 H 1 1.355 0.02 . 1 . . . A 6 ALA HB2 . 17558 1
43 . 1 1 6 6 ALA HB3 H 1 1.355 0.02 . 1 . . . A 6 ALA HB3 . 17558 1
44 . 1 1 6 6 ALA C C 13 179.297 0.2 . 1 . . . A 6 ALA C . 17558 1
45 . 1 1 6 6 ALA CA C 13 56.301 0.2 . 1 . . . A 6 ALA CA . 17558 1
46 . 1 1 6 6 ALA CB C 13 19.467 0.2 . 1 . . . A 6 ALA CB . 17558 1
47 . 1 1 6 6 ALA N N 15 123.200 0.2 . 1 . . . A 6 ALA N . 17558 1
48 . 1 1 7 7 ALA H H 1 8.315 0.02 . 1 . . . A 7 ALA H . 17558 1
49 . 1 1 7 7 ALA HA H 1 3.863 0.02 . 1 . . . A 7 ALA HA . 17558 1
50 . 1 1 7 7 ALA HB1 H 1 1.400 0.02 . 1 . . . A 7 ALA HB1 . 17558 1
51 . 1 1 7 7 ALA HB2 H 1 1.400 0.02 . 1 . . . A 7 ALA HB2 . 17558 1
52 . 1 1 7 7 ALA HB3 H 1 1.400 0.02 . 1 . . . A 7 ALA HB3 . 17558 1
53 . 1 1 7 7 ALA C C 13 178.133 0.2 . 1 . . . A 7 ALA C . 17558 1
54 . 1 1 7 7 ALA CA C 13 55.720 0.2 . 1 . . . A 7 ALA CA . 17558 1
55 . 1 1 7 7 ALA CB C 13 18.785 0.2 . 1 . . . A 7 ALA CB . 17558 1
56 . 1 1 7 7 ALA N N 15 119.489 0.2 . 1 . . . A 7 ALA N . 17558 1
57 . 1 1 8 8 ALA H H 1 8.294 0.02 . 1 . . . A 8 ALA H . 17558 1
58 . 1 1 8 8 ALA HA H 1 3.988 0.02 . 1 . . . A 8 ALA HA . 17558 1
59 . 1 1 8 8 ALA HB1 H 1 1.605 0.02 . 1 . . . A 8 ALA HB1 . 17558 1
60 . 1 1 8 8 ALA HB2 H 1 1.605 0.02 . 1 . . . A 8 ALA HB2 . 17558 1
61 . 1 1 8 8 ALA HB3 H 1 1.605 0.02 . 1 . . . A 8 ALA HB3 . 17558 1
62 . 1 1 8 8 ALA C C 13 178.857 0.2 . 1 . . . A 8 ALA C . 17558 1
63 . 1 1 8 8 ALA CA C 13 56.089 0.2 . 1 . . . A 8 ALA CA . 17558 1
64 . 1 1 8 8 ALA CB C 13 18.637 0.2 . 1 . . . A 8 ALA CB . 17558 1
65 . 1 1 8 8 ALA N N 15 118.612 0.2 . 1 . . . A 8 ALA N . 17558 1
66 . 1 1 9 9 ALA H H 1 8.029 0.02 . 1 . . . A 9 ALA H . 17558 1
67 . 1 1 9 9 ALA HA H 1 3.861 0.02 . 1 . . . A 9 ALA HA . 17558 1
68 . 1 1 9 9 ALA HB1 H 1 1.376 0.02 . 1 . . . A 9 ALA HB1 . 17558 1
69 . 1 1 9 9 ALA HB2 H 1 1.376 0.02 . 1 . . . A 9 ALA HB2 . 17558 1
70 . 1 1 9 9 ALA HB3 H 1 1.376 0.02 . 1 . . . A 9 ALA HB3 . 17558 1
71 . 1 1 9 9 ALA C C 13 179.548 0.2 . 1 . . . A 9 ALA C . 17558 1
72 . 1 1 9 9 ALA CA C 13 55.890 0.2 . 1 . . . A 9 ALA CA . 17558 1
73 . 1 1 9 9 ALA CB C 13 18.986 0.2 . 1 . . . A 9 ALA CB . 17558 1
74 . 1 1 9 9 ALA N N 15 118.968 0.2 . 1 . . . A 9 ALA N . 17558 1
75 . 1 1 10 10 GLY H H 1 8.386 0.02 . 1 . . . A 10 GLY H . 17558 1
76 . 1 1 10 10 GLY HA2 H 1 3.495 0.02 . 2 . . . A 10 GLY HA2 . 17558 1
77 . 1 1 10 10 GLY HA3 H 1 4.313 0.02 . 2 . . . A 10 GLY HA3 . 17558 1
78 . 1 1 10 10 GLY C C 13 175.031 0.2 . 1 . . . A 10 GLY C . 17558 1
79 . 1 1 10 10 GLY CA C 13 47.696 0.2 . 1 . . . A 10 GLY CA . 17558 1
80 . 1 1 10 10 GLY N N 15 103.412 0.2 . 1 . . . A 10 GLY N . 17558 1
81 . 1 1 11 11 ALA H H 1 8.392 0.02 . 1 . . . A 11 ALA H . 17558 1
82 . 1 1 11 11 ALA HA H 1 4.159 0.02 . 1 . . . A 11 ALA HA . 17558 1
83 . 1 1 11 11 ALA HB1 H 1 1.282 0.02 . 1 . . . A 11 ALA HB1 . 17558 1
84 . 1 1 11 11 ALA HB2 H 1 1.282 0.02 . 1 . . . A 11 ALA HB2 . 17558 1
85 . 1 1 11 11 ALA HB3 H 1 1.282 0.02 . 1 . . . A 11 ALA HB3 . 17558 1
86 . 1 1 11 11 ALA C C 13 179.909 0.2 . 1 . . . A 11 ALA C . 17558 1
87 . 1 1 11 11 ALA CA C 13 55.624 0.2 . 1 . . . A 11 ALA CA . 17558 1
88 . 1 1 11 11 ALA CB C 13 18.158 0.2 . 1 . . . A 11 ALA CB . 17558 1
89 . 1 1 11 11 ALA N N 15 123.234 0.2 . 1 . . . A 11 ALA N . 17558 1
90 . 1 1 12 12 VAL H H 1 7.932 0.02 . 1 . . . A 12 VAL H . 17558 1
91 . 1 1 12 12 VAL HA H 1 3.539 0.02 . 1 . . . A 12 VAL HA . 17558 1
92 . 1 1 12 12 VAL HB H 1 2.147 0.02 . 1 . . . A 12 VAL HB . 17558 1
93 . 1 1 12 12 VAL HG11 H 1 0.970 0.02 . 2 . . . A 12 VAL HG11 . 17558 1
94 . 1 1 12 12 VAL HG12 H 1 0.970 0.02 . 2 . . . A 12 VAL HG12 . 17558 1
95 . 1 1 12 12 VAL HG13 H 1 0.970 0.02 . 2 . . . A 12 VAL HG13 . 17558 1
96 . 1 1 12 12 VAL HG21 H 1 0.792 0.02 . 2 . . . A 12 VAL HG21 . 17558 1
97 . 1 1 12 12 VAL HG22 H 1 0.792 0.02 . 2 . . . A 12 VAL HG22 . 17558 1
98 . 1 1 12 12 VAL HG23 H 1 0.792 0.02 . 2 . . . A 12 VAL HG23 . 17558 1
99 . 1 1 12 12 VAL C C 13 176.877 0.2 . 1 . . . A 12 VAL C . 17558 1
100 . 1 1 12 12 VAL CA C 13 67.683 0.2 . 1 . . . A 12 VAL CA . 17558 1
101 . 1 1 12 12 VAL CB C 13 32.070 0.2 . 1 . . . A 12 VAL CB . 17558 1
102 . 1 1 12 12 VAL CG1 C 13 22.881 0.2 . 2 . . . A 12 VAL CG1 . 17558 1
103 . 1 1 12 12 VAL CG2 C 13 21.318 0.2 . 2 . . . A 12 VAL CG2 . 17558 1
104 . 1 1 12 12 VAL N N 15 117.423 0.2 . 1 . . . A 12 VAL N . 17558 1
105 . 1 1 13 13 VAL H H 1 7.679 0.02 . 1 . . . A 13 VAL H . 17558 1
106 . 1 1 13 13 VAL HA H 1 3.499 0.02 . 1 . . . A 13 VAL HA . 17558 1
107 . 1 1 13 13 VAL HB H 1 2.003 0.02 . 1 . . . A 13 VAL HB . 17558 1
108 . 1 1 13 13 VAL HG11 H 1 0.973 0.02 . 2 . . . A 13 VAL HG11 . 17558 1
109 . 1 1 13 13 VAL HG12 H 1 0.973 0.02 . 2 . . . A 13 VAL HG12 . 17558 1
110 . 1 1 13 13 VAL HG13 H 1 0.973 0.02 . 2 . . . A 13 VAL HG13 . 17558 1
111 . 1 1 13 13 VAL HG21 H 1 0.834 0.02 . 2 . . . A 13 VAL HG21 . 17558 1
112 . 1 1 13 13 VAL HG22 H 1 0.834 0.02 . 2 . . . A 13 VAL HG22 . 17558 1
113 . 1 1 13 13 VAL HG23 H 1 0.834 0.02 . 2 . . . A 13 VAL HG23 . 17558 1
114 . 1 1 13 13 VAL C C 13 177.998 0.2 . 1 . . . A 13 VAL C . 17558 1
115 . 1 1 13 13 VAL CA C 13 67.952 0.2 . 1 . . . A 13 VAL CA . 17558 1
116 . 1 1 13 13 VAL CB C 13 32.216 0.2 . 1 . . . A 13 VAL CB . 17558 1
117 . 1 1 13 13 VAL CG1 C 13 22.685 0.2 . 2 . . . A 13 VAL CG1 . 17558 1
118 . 1 1 13 13 VAL CG2 C 13 21.318 0.2 . 2 . . . A 13 VAL CG2 . 17558 1
119 . 1 1 13 13 VAL N N 15 117.519 0.2 . 1 . . . A 13 VAL N . 17558 1
120 . 1 1 14 14 GLY H H 1 9.134 0.02 . 1 . . . A 14 GLY H . 17558 1
121 . 1 1 14 14 GLY HA2 H 1 3.611 0.02 . 2 . . . A 14 GLY HA2 . 17558 1
122 . 1 1 14 14 GLY HA3 H 1 3.999 0.02 . 2 . . . A 14 GLY HA3 . 17558 1
123 . 1 1 14 14 GLY C C 13 175.640 0.2 . 1 . . . A 14 GLY C . 17558 1
124 . 1 1 14 14 GLY CA C 13 47.493 0.2 . 1 . . . A 14 GLY CA . 17558 1
125 . 1 1 14 14 GLY N N 15 105.995 0.2 . 1 . . . A 14 GLY N . 17558 1
126 . 1 1 15 15 GLY H H 1 8.635 0.02 . 1 . . . A 15 GLY H . 17558 1
127 . 1 1 15 15 GLY HA2 H 1 3.465 0.02 . 2 . . . A 15 GLY HA2 . 17558 1
128 . 1 1 15 15 GLY HA3 H 1 4.029 0.02 . 2 . . . A 15 GLY HA3 . 17558 1
129 . 1 1 15 15 GLY C C 13 175.562 0.2 . 1 . . . A 15 GLY C . 17558 1
130 . 1 1 15 15 GLY CA C 13 47.876 0.2 . 1 . . . A 15 GLY CA . 17558 1
131 . 1 1 15 15 GLY N N 15 111.347 0.2 . 1 . . . A 15 GLY N . 17558 1
132 . 1 1 16 16 LEU H H 1 8.137 0.02 . 1 . . . A 16 LEU H . 17558 1
133 . 1 1 16 16 LEU HA H 1 4.096 0.02 . 1 . . . A 16 LEU HA . 17558 1
134 . 1 1 16 16 LEU HB2 H 1 1.587 0.02 . 2 . . . A 16 LEU HB2 . 17558 1
135 . 1 1 16 16 LEU HB3 H 1 1.844 0.02 . 2 . . . A 16 LEU HB3 . 17558 1
136 . 1 1 16 16 LEU HG H 1 1.817 0.02 . 1 . . . A 16 LEU HG . 17558 1
137 . 1 1 16 16 LEU HD11 H 1 0.815 0.02 . 2 . . . A 16 LEU HD11 . 17558 1
138 . 1 1 16 16 LEU HD12 H 1 0.815 0.02 . 2 . . . A 16 LEU HD12 . 17558 1
139 . 1 1 16 16 LEU HD13 H 1 0.815 0.02 . 2 . . . A 16 LEU HD13 . 17558 1
140 . 1 1 16 16 LEU HD21 H 1 0.858 0.02 . 2 . . . A 16 LEU HD21 . 17558 1
141 . 1 1 16 16 LEU HD22 H 1 0.858 0.02 . 2 . . . A 16 LEU HD22 . 17558 1
142 . 1 1 16 16 LEU HD23 H 1 0.858 0.02 . 2 . . . A 16 LEU HD23 . 17558 1
143 . 1 1 16 16 LEU C C 13 179.090 0.2 . 1 . . . A 16 LEU C . 17558 1
144 . 1 1 16 16 LEU CA C 13 58.910 0.2 . 1 . . . A 16 LEU CA . 17558 1
145 . 1 1 16 16 LEU CB C 13 42.543 0.2 . 1 . . . A 16 LEU CB . 17558 1
146 . 1 1 16 16 LEU CG C 13 27.019 0.2 . 1 . . . A 16 LEU CG . 17558 1
147 . 1 1 16 16 LEU CD1 C 13 24.373 0.2 . 2 . . . A 16 LEU CD1 . 17558 1
148 . 1 1 16 16 LEU CD2 C 13 24.987 0.2 . 2 . . . A 16 LEU CD2 . 17558 1
149 . 1 1 16 16 LEU N N 15 121.900 0.2 . 1 . . . A 16 LEU N . 17558 1
150 . 1 1 17 17 GLY H H 1 8.412 0.02 . 1 . . . A 17 GLY H . 17558 1
151 . 1 1 17 17 GLY HA2 H 1 3.548 0.02 . 2 . . . A 17 GLY HA2 . 17558 1
152 . 1 1 17 17 GLY HA3 H 1 3.730 0.02 . 2 . . . A 17 GLY HA3 . 17558 1
153 . 1 1 17 17 GLY C C 13 175.280 0.2 . 1 . . . A 17 GLY C . 17558 1
154 . 1 1 17 17 GLY CA C 13 48.659 0.2 . 1 . . . A 17 GLY CA . 17558 1
155 . 1 1 17 17 GLY N N 15 105.660 0.2 . 1 . . . A 17 GLY N . 17558 1
156 . 1 1 18 18 GLY H H 1 9.719 0.02 . 1 . . . A 18 GLY H . 17558 1
157 . 1 1 18 18 GLY HA2 H 1 3.788 0.02 . 2 . . . A 18 GLY HA2 . 17558 1
158 . 1 1 18 18 GLY HA3 H 1 4.409 0.02 . 2 . . . A 18 GLY HA3 . 17558 1
159 . 1 1 18 18 GLY C C 13 175.418 0.2 . 1 . . . A 18 GLY C . 17558 1
160 . 1 1 18 18 GLY CA C 13 48.225 0.2 . 1 . . . A 18 GLY CA . 17558 1
161 . 1 1 18 18 GLY N N 15 109.701 0.2 . 1 . . . A 18 GLY N . 17558 1
162 . 1 1 19 19 TYR H H 1 8.690 0.02 . 1 . . . A 19 TYR H . 17558 1
163 . 1 1 19 19 TYR HA H 1 4.093 0.02 . 1 . . . A 19 TYR HA . 17558 1
164 . 1 1 19 19 TYR HB2 H 1 3.000 0.02 . 2 . . . A 19 TYR HB2 . 17558 1
165 . 1 1 19 19 TYR HB3 H 1 3.148 0.02 . 2 . . . A 19 TYR HB3 . 17558 1
166 . 1 1 19 19 TYR HD2 H 1 7.084 0.02 . 2 . . . A 19 TYR HD2 . 17558 1
167 . 1 1 19 19 TYR HE2 H 1 6.790 0.02 . 2 . . . A 19 TYR HE2 . 17558 1
168 . 1 1 19 19 TYR C C 13 179.066 0.2 . 1 . . . A 19 TYR C . 17558 1
169 . 1 1 19 19 TYR CA C 13 62.680 0.2 . 1 . . . A 19 TYR CA . 17558 1
170 . 1 1 19 19 TYR CB C 13 39.781 0.2 . 1 . . . A 19 TYR CB . 17558 1
171 . 1 1 19 19 TYR CD2 C 13 132.523 0.2 . 2 . . . A 19 TYR CD2 . 17558 1
172 . 1 1 19 19 TYR CE2 C 13 117.902 0.2 . 2 . . . A 19 TYR CE2 . 17558 1
173 . 1 1 19 19 TYR N N 15 123.066 0.2 . 1 . . . A 19 TYR N . 17558 1
174 . 1 1 20 20 MET H H 1 8.367 0.02 . 1 . . . A 20 MET H . 17558 1
175 . 1 1 20 20 MET HA H 1 3.980 0.02 . 1 . . . A 20 MET HA . 17558 1
176 . 1 1 20 20 MET HB2 H 1 2.050 0.02 . 2 . . . A 20 MET HB2 . 17558 1
177 . 1 1 20 20 MET HB3 H 1 2.376 0.02 . 2 . . . A 20 MET HB3 . 17558 1
178 . 1 1 20 20 MET HE1 H 1 2.073 0.02 . 1 . . . A 20 MET HE1 . 17558 1
179 . 1 1 20 20 MET HE2 H 1 2.073 0.02 . 1 . . . A 20 MET HE2 . 17558 1
180 . 1 1 20 20 MET HE3 H 1 2.073 0.02 . 1 . . . A 20 MET HE3 . 17558 1
181 . 1 1 20 20 MET C C 13 178.549 0.2 . 1 . . . A 20 MET C . 17558 1
182 . 1 1 20 20 MET CA C 13 59.630 0.2 . 1 . . . A 20 MET CA . 17558 1
183 . 1 1 20 20 MET CB C 13 32.807 0.2 . 1 . . . A 20 MET CB . 17558 1
184 . 1 1 20 20 MET CE C 13 17.433 0.2 . 1 . . . A 20 MET CE . 17558 1
185 . 1 1 20 20 MET N N 15 119.540 0.2 . 1 . . . A 20 MET N . 17558 1
186 . 1 1 21 21 LEU H H 1 8.329 0.02 . 1 . . . A 21 LEU H . 17558 1
187 . 1 1 21 21 LEU HA H 1 4.111 0.02 . 1 . . . A 21 LEU HA . 17558 1
188 . 1 1 21 21 LEU HB2 H 1 1.850 0.02 . 2 . . . A 21 LEU HB2 . 17558 1
189 . 1 1 21 21 LEU HB3 H 1 1.881 0.02 . 2 . . . A 21 LEU HB3 . 17558 1
190 . 1 1 21 21 LEU HG H 1 1.560 0.02 . 1 . . . A 21 LEU HG . 17558 1
191 . 1 1 21 21 LEU HD11 H 1 0.942 0.02 . 2 . . . A 21 LEU HD11 . 17558 1
192 . 1 1 21 21 LEU HD12 H 1 0.942 0.02 . 2 . . . A 21 LEU HD12 . 17558 1
193 . 1 1 21 21 LEU HD13 H 1 0.942 0.02 . 2 . . . A 21 LEU HD13 . 17558 1
194 . 1 1 21 21 LEU HD21 H 1 0.923 0.02 . 2 . . . A 21 LEU HD21 . 17558 1
195 . 1 1 21 21 LEU HD22 H 1 0.923 0.02 . 2 . . . A 21 LEU HD22 . 17558 1
196 . 1 1 21 21 LEU HD23 H 1 0.923 0.02 . 2 . . . A 21 LEU HD23 . 17558 1
197 . 1 1 21 21 LEU C C 13 178.592 0.2 . 1 . . . A 21 LEU C . 17558 1
198 . 1 1 21 21 LEU CA C 13 58.791 0.2 . 1 . . . A 21 LEU CA . 17558 1
199 . 1 1 21 21 LEU CB C 13 43.000 0.2 . 1 . . . A 21 LEU CB . 17558 1
200 . 1 1 21 21 LEU CG C 13 27.400 0.2 . 1 . . . A 21 LEU CG . 17558 1
201 . 1 1 21 21 LEU CD1 C 13 24.696 0.2 . 2 . . . A 21 LEU CD1 . 17558 1
202 . 1 1 21 21 LEU CD2 C 13 25.266 0.2 . 2 . . . A 21 LEU CD2 . 17558 1
203 . 1 1 21 21 LEU N N 15 119.740 0.2 . 1 . . . A 21 LEU N . 17558 1
204 . 1 1 22 22 GLY H H 1 9.027 0.02 . 1 . . . A 22 GLY H . 17558 1
205 . 1 1 22 22 GLY HA2 H 1 3.270 0.02 . 2 . . . A 22 GLY HA2 . 17558 1
206 . 1 1 22 22 GLY C C 13 174.857 0.2 . 1 . . . A 22 GLY C . 17558 1
207 . 1 1 22 22 GLY CA C 13 47.693 0.2 . 1 . . . A 22 GLY CA . 17558 1
208 . 1 1 22 22 GLY N N 15 106.769 0.2 . 1 . . . A 22 GLY N . 17558 1
209 . 1 1 23 23 SER H H 1 7.893 0.02 . 1 . . . A 23 SER H . 17558 1
210 . 1 1 23 23 SER HA H 1 3.975 0.02 . 1 . . . A 23 SER HA . 17558 1
211 . 1 1 23 23 SER HB2 H 1 3.422 0.02 . 2 . . . A 23 SER HB2 . 17558 1
212 . 1 1 23 23 SER HB3 H 1 3.666 0.02 . 2 . . . A 23 SER HB3 . 17558 1
213 . 1 1 23 23 SER C C 13 175.751 0.2 . 1 . . . A 23 SER C . 17558 1
214 . 1 1 23 23 SER CA C 13 60.879 0.2 . 1 . . . A 23 SER CA . 17558 1
215 . 1 1 23 23 SER CB C 13 63.977 0.2 . 1 . . . A 23 SER CB . 17558 1
216 . 1 1 23 23 SER N N 15 114.334 0.2 . 1 . . . A 23 SER N . 17558 1
217 . 1 1 24 24 ALA H H 1 7.579 0.02 . 1 . . . A 24 ALA H . 17558 1
218 . 1 1 24 24 ALA HA H 1 4.175 0.02 . 1 . . . A 24 ALA HA . 17558 1
219 . 1 1 24 24 ALA HB1 H 1 1.480 0.02 . 1 . . . A 24 ALA HB1 . 17558 1
220 . 1 1 24 24 ALA HB2 H 1 1.480 0.02 . 1 . . . A 24 ALA HB2 . 17558 1
221 . 1 1 24 24 ALA HB3 H 1 1.480 0.02 . 1 . . . A 24 ALA HB3 . 17558 1
222 . 1 1 24 24 ALA C C 13 178.717 0.2 . 1 . . . A 24 ALA C . 17558 1
223 . 1 1 24 24 ALA CA C 13 54.613 0.2 . 1 . . . A 24 ALA CA . 17558 1
224 . 1 1 24 24 ALA CB C 13 19.523 0.2 . 1 . . . A 24 ALA CB . 17558 1
225 . 1 1 24 24 ALA N N 15 123.192 0.2 . 1 . . . A 24 ALA N . 17558 1
226 . 1 1 25 25 MET H H 1 7.905 0.02 . 1 . . . A 25 MET H . 17558 1
227 . 1 1 25 25 MET HA H 1 4.418 0.02 . 1 . . . A 25 MET HA . 17558 1
228 . 1 1 25 25 MET HB2 H 1 2.181 0.02 . 2 . . . A 25 MET HB2 . 17558 1
229 . 1 1 25 25 MET HB3 H 1 2.724 0.02 . 2 . . . A 25 MET HB3 . 17558 1
230 . 1 1 25 25 MET HE1 H 1 2.169 0.02 . 1 . . . A 25 MET HE1 . 17558 1
231 . 1 1 25 25 MET HE2 H 1 2.169 0.02 . 1 . . . A 25 MET HE2 . 17558 1
232 . 1 1 25 25 MET HE3 H 1 2.169 0.02 . 1 . . . A 25 MET HE3 . 17558 1
233 . 1 1 25 25 MET C C 13 176.479 0.2 . 1 . . . A 25 MET C . 17558 1
234 . 1 1 25 25 MET CA C 13 56.754 0.2 . 1 . . . A 25 MET CA . 17558 1
235 . 1 1 25 25 MET CB C 13 28.852 0.2 . 1 . . . A 25 MET CB . 17558 1
236 . 1 1 25 25 MET CE C 13 17.539 0.2 . 1 . . . A 25 MET CE . 17558 1
237 . 1 1 25 25 MET N N 15 115.187 0.2 . 1 . . . A 25 MET N . 17558 1
238 . 1 1 26 26 SER H H 1 7.710 0.02 . 1 . . . A 26 SER H . 17558 1
239 . 1 1 26 26 SER HA H 1 4.419 0.02 . 1 . . . A 26 SER HA . 17558 1
240 . 1 1 26 26 SER HB2 H 1 3.839 0.02 . 2 . . . A 26 SER HB2 . 17558 1
241 . 1 1 26 26 SER C C 13 173.350 0.2 . 1 . . . A 26 SER C . 17558 1
242 . 1 1 26 26 SER CA C 13 59.343 0.2 . 1 . . . A 26 SER CA . 17558 1
243 . 1 1 26 26 SER CB C 13 62.573 0.2 . 1 . . . A 26 SER CB . 17558 1
244 . 1 1 26 26 SER N N 15 124.236 0.2 . 1 . . . A 26 SER N . 17558 1
245 . 1 1 27 27 ARG H H 1 7.592 0.02 . 1 . . . A 27 ARG H . 17558 1
246 . 1 1 27 27 ARG HA H 1 4.020 0.02 . 1 . . . A 27 ARG HA . 17558 1
247 . 1 1 27 27 ARG HB2 H 1 1.700 0.02 . 2 . . . A 27 ARG HB2 . 17558 1
248 . 1 1 27 27 ARG HB3 H 1 1.825 0.02 . 2 . . . A 27 ARG HB3 . 17558 1
249 . 1 1 27 27 ARG HG2 H 1 1.560 0.02 . 2 . . . A 27 ARG HG2 . 17558 1
250 . 1 1 27 27 ARG HG3 H 1 1.636 0.02 . 2 . . . A 27 ARG HG3 . 17558 1
251 . 1 1 27 27 ARG HD2 H 1 3.150 0.02 . 2 . . . A 27 ARG HD2 . 17558 1
252 . 1 1 27 27 ARG CA C 13 58.570 0.2 . 1 . . . A 27 ARG CA . 17558 1
253 . 1 1 27 27 ARG CB C 13 32.108 0.2 . 1 . . . A 27 ARG CB . 17558 1
254 . 1 1 27 27 ARG CG C 13 29.400 0.2 . 1 . . . A 27 ARG CG . 17558 1
255 . 1 1 27 27 ARG CD C 13 43.587 0.2 . 1 . . . A 27 ARG CD . 17558 1
256 . 1 1 27 27 ARG N N 15 127.023 0.2 . 1 . . . A 27 ARG N . 17558 1
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