###################################
# 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_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 34507
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 $chem_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 1H-1H-NOESY . . . 34507 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_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 SER HA H 1 4.400 . . . . . . . A 26 SER HA . 34507 1
2 . 1 . 1 1 1 SER HB2 H 1 3.963 . . . . . . . A 26 SER HB2 . 34507 1
3 . 1 . 1 1 1 SER HB3 H 1 3.834 . . . . . . . A 26 SER HB3 . 34507 1
4 . 1 . 1 1 1 SER HG H 1 7.789 . . . . . . . A 26 SER HG . 34507 1
5 . 1 . 1 1 1 SER CA C 13 58.000 . . . . . . . A 26 SER CA . 34507 1
6 . 1 . 1 1 1 SER CB C 13 63.139 . . . . . . . A 26 SER CB . 34507 1
7 . 1 . 1 2 2 ASN HA H 1 4.790 . . . . . . . A 27 ASN HA . 34507 1
8 . 1 . 1 2 2 ASN HB2 H 1 2.916 . . . . . . . A 27 ASN HB2 . 34507 1
9 . 1 . 1 2 2 ASN HB3 H 1 2.916 . . . . . . . A 27 ASN HB3 . 34507 1
10 . 1 . 1 2 2 ASN CB C 13 37.156 . . . . . . . A 27 ASN CB . 34507 1
11 . 1 . 1 3 3 LYS H H 1 8.044 . . . . . . . A 28 LYS H . 34507 1
12 . 1 . 1 3 3 LYS HA H 1 4.116 . . . . . . . A 28 LYS HA . 34507 1
13 . 1 . 1 3 3 LYS CA C 13 58.153 . . . . . . . A 28 LYS CA . 34507 1
14 . 1 . 1 4 4 GLY H H 1 8.241 . . . . . . . A 29 GLY H . 34507 1
15 . 1 . 1 4 4 GLY HA2 H 1 3.852 . . . . . . . A 29 GLY HA2 . 34507 1
16 . 1 . 1 4 4 GLY HA3 H 1 3.852 . . . . . . . A 29 GLY HA3 . 34507 1
17 . 1 . 1 4 4 GLY CA C 13 45.819 . . . . . . . A 29 GLY CA . 34507 1
18 . 1 . 1 5 5 ALA H H 1 7.652 . . . . . . . A 30 ALA H . 34507 1
19 . 1 . 1 5 5 ALA HA H 1 4.228 . . . . . . . A 30 ALA HA . 34507 1
20 . 1 . 1 5 5 ALA HB1 H 1 1.498 . . . . . . . A 30 ALA HB1 . 34507 1
21 . 1 . 1 5 5 ALA HB2 H 1 1.498 . . . . . . . A 30 ALA HB2 . 34507 1
22 . 1 . 1 5 5 ALA HB3 H 1 1.498 . . . . . . . A 30 ALA HB3 . 34507 1
23 . 1 . 1 5 5 ALA CA C 13 53.678 . . . . . . . A 30 ALA CA . 34507 1
24 . 1 . 1 5 5 ALA CB C 13 17.258 . . . . . . . A 30 ALA CB . 34507 1
25 . 1 . 1 6 6 ILE H H 1 7.500 . . . . . . . A 31 ILE H . 34507 1
26 . 1 . 1 6 6 ILE HA H 1 3.946 . . . . . . . A 31 ILE HA . 34507 1
27 . 1 . 1 6 6 ILE HB H 1 2.030 . . . . . . . A 31 ILE HB . 34507 1
28 . 1 . 1 6 6 ILE HG12 H 1 1.303 . . . . . . . A 31 ILE HG12 . 34507 1
29 . 1 . 1 6 6 ILE HG13 H 1 1.646 . . . . . . . A 31 ILE HG13 . 34507 1
30 . 1 . 1 6 6 ILE HG21 H 1 0.995 . . . . . . . A 31 ILE HG21 . 34507 1
31 . 1 . 1 6 6 ILE HG22 H 1 0.995 . . . . . . . A 31 ILE HG22 . 34507 1
32 . 1 . 1 6 6 ILE HG23 H 1 0.995 . . . . . . . A 31 ILE HG23 . 34507 1
33 . 1 . 1 6 6 ILE HD11 H 1 0.901 . . . . . . . A 31 ILE HD11 . 34507 1
34 . 1 . 1 6 6 ILE HD12 H 1 0.901 . . . . . . . A 31 ILE HD12 . 34507 1
35 . 1 . 1 6 6 ILE HD13 H 1 0.901 . . . . . . . A 31 ILE HD13 . 34507 1
36 . 1 . 1 6 6 ILE CA C 13 63.024 . . . . . . . A 31 ILE CA . 34507 1
37 . 1 . 1 6 6 ILE CB C 13 37.358 . . . . . . . A 31 ILE CB . 34507 1
38 . 1 . 1 6 6 ILE CG1 C 13 27.631 . . . . . . . A 31 ILE CG1 . 34507 1
39 . 1 . 1 6 6 ILE CG2 C 13 16.198 . . . . . . . A 31 ILE CG2 . 34507 1
40 . 1 . 1 6 6 ILE CD1 C 13 11.224 . . . . . . . A 31 ILE CD1 . 34507 1
41 . 1 . 1 7 7 ILE H H 1 7.844 . . . . . . . A 32 ILE H . 34507 1
42 . 1 . 1 7 7 ILE HA H 1 3.841 . . . . . . . A 32 ILE HA . 34507 1
43 . 1 . 1 7 7 ILE HB H 1 1.930 . . . . . . . A 32 ILE HB . 34507 1
44 . 1 . 1 7 7 ILE HG12 H 1 1.264 . . . . . . . A 32 ILE HG12 . 34507 1
45 . 1 . 1 7 7 ILE HG13 H 1 1.690 . . . . . . . A 32 ILE HG13 . 34507 1
46 . 1 . 1 7 7 ILE HG21 H 1 0.945 . . . . . . . A 32 ILE HG21 . 34507 1
47 . 1 . 1 7 7 ILE HG22 H 1 0.945 . . . . . . . A 32 ILE HG22 . 34507 1
48 . 1 . 1 7 7 ILE HG23 H 1 0.945 . . . . . . . A 32 ILE HG23 . 34507 1
49 . 1 . 1 7 7 ILE HD11 H 1 0.884 . . . . . . . A 32 ILE HD11 . 34507 1
50 . 1 . 1 7 7 ILE HD12 H 1 0.884 . . . . . . . A 32 ILE HD12 . 34507 1
51 . 1 . 1 7 7 ILE HD13 H 1 0.884 . . . . . . . A 32 ILE HD13 . 34507 1
52 . 1 . 1 7 7 ILE CA C 13 63.981 . . . . . . . A 32 ILE CA . 34507 1
53 . 1 . 1 7 7 ILE CB C 13 37.016 . . . . . . . A 32 ILE CB . 34507 1
54 . 1 . 1 7 7 ILE CG1 C 13 27.926 . . . . . . . A 32 ILE CG1 . 34507 1
55 . 1 . 1 7 7 ILE CG2 C 13 15.861 . . . . . . . A 32 ILE CG2 . 34507 1
56 . 1 . 1 7 7 ILE CD1 C 13 11.178 . . . . . . . A 32 ILE CD1 . 34507 1
57 . 1 . 1 8 8 GLY H H 1 7.897 . . . . . . . A 33 GLY H . 34507 1
58 . 1 . 1 8 8 GLY HA2 H 1 3.823 . . . . . . . A 33 GLY HA2 . 34507 1
59 . 1 . 1 8 8 GLY HA3 H 1 3.823 . . . . . . . A 33 GLY HA3 . 34507 1
60 . 1 . 1 8 8 GLY CA C 13 46.295 . . . . . . . A 33 GLY CA . 34507 1
61 . 1 . 1 9 9 LEU H H 1 7.773 . . . . . . . A 34 LEU H . 34507 1
62 . 1 . 1 9 9 LEU HA H 1 4.266 . . . . . . . A 34 LEU HA . 34507 1
63 . 1 . 1 9 9 LEU HB2 H 1 1.887 . . . . . . . A 34 LEU HB2 . 34507 1
64 . 1 . 1 9 9 LEU HB3 H 1 1.812 . . . . . . . A 34 LEU HB3 . 34507 1
65 . 1 . 1 9 9 LEU HG H 1 1.786 . . . . . . . A 34 LEU HG . 34507 1
66 . 1 . 1 9 9 LEU HD11 H 1 0.952 . . . . . . . A 34 LEU HD11 . 34507 1
67 . 1 . 1 9 9 LEU HD12 H 1 0.952 . . . . . . . A 34 LEU HD12 . 34507 1
68 . 1 . 1 9 9 LEU HD13 H 1 0.952 . . . . . . . A 34 LEU HD13 . 34507 1
69 . 1 . 1 9 9 LEU HD21 H 1 0.924 . . . . . . . A 34 LEU HD21 . 34507 1
70 . 1 . 1 9 9 LEU HD22 H 1 0.924 . . . . . . . A 34 LEU HD22 . 34507 1
71 . 1 . 1 9 9 LEU HD23 H 1 0.924 . . . . . . . A 34 LEU HD23 . 34507 1
72 . 1 . 1 9 9 LEU CA C 13 57.116 . . . . . . . A 34 LEU CA . 34507 1
73 . 1 . 1 9 9 LEU CB C 13 41.367 . . . . . . . A 34 LEU CB . 34507 1
74 . 1 . 1 9 9 LEU CG C 13 26.221 . . . . . . . A 34 LEU CG . 34507 1
75 . 1 . 1 9 9 LEU CD1 C 13 23.036 . . . . . . . A 34 LEU CD1 . 34507 1
76 . 1 . 1 9 9 LEU CD2 C 13 22.605 . . . . . . . A 34 LEU CD2 . 34507 1
77 . 1 . 1 10 10 MET H H 1 8.121 . . . . . . . A 35 MET H . 34507 1
78 . 1 . 1 10 10 MET HA H 1 4.246 . . . . . . . A 35 MET HA . 34507 1
79 . 1 . 1 10 10 MET HB2 H 1 2.331 . . . . . . . A 35 MET HB2 . 34507 1
80 . 1 . 1 10 10 MET HB3 H 1 2.172 . . . . . . . A 35 MET HB3 . 34507 1
81 . 1 . 1 10 10 MET HG2 H 1 2.767 . . . . . . . A 35 MET HG2 . 34507 1
82 . 1 . 1 10 10 MET HG3 H 1 2.605 . . . . . . . A 35 MET HG3 . 34507 1
83 . 1 . 1 10 10 MET CA C 13 58.022 . . . . . . . A 35 MET CA . 34507 1
84 . 1 . 1 10 10 MET CB C 13 31.576 . . . . . . . A 35 MET CB . 34507 1
85 . 1 . 1 10 10 MET CG C 13 31.538 . . . . . . . A 35 MET CG . 34507 1
86 . 1 . 1 11 11 VAL H H 1 8.454 . . . . . . . A 36 VAL H . 34507 1
87 . 1 . 1 11 11 VAL HA H 1 3.715 . . . . . . . A 36 VAL HA . 34507 1
88 . 1 . 1 11 11 VAL HB H 1 2.144 . . . . . . . A 36 VAL HB . 34507 1
89 . 1 . 1 11 11 VAL HG11 H 1 1.082 . . . . . . . A 36 VAL HG11 . 34507 1
90 . 1 . 1 11 11 VAL HG12 H 1 1.082 . . . . . . . A 36 VAL HG12 . 34507 1
91 . 1 . 1 11 11 VAL HG13 H 1 1.082 . . . . . . . A 36 VAL HG13 . 34507 1
92 . 1 . 1 11 11 VAL HG21 H 1 0.957 . . . . . . . A 36 VAL HG21 . 34507 1
93 . 1 . 1 11 11 VAL HG22 H 1 0.957 . . . . . . . A 36 VAL HG22 . 34507 1
94 . 1 . 1 11 11 VAL HG23 H 1 0.957 . . . . . . . A 36 VAL HG23 . 34507 1
95 . 1 . 1 11 11 VAL CA C 13 65.828 . . . . . . . A 36 VAL CA . 34507 1
96 . 1 . 1 11 11 VAL CB C 13 31.111 . . . . . . . A 36 VAL CB . 34507 1
97 . 1 . 1 11 11 VAL CG1 C 13 20.967 . . . . . . . A 36 VAL CG1 . 34507 1
98 . 1 . 1 11 11 VAL CG2 C 13 19.763 . . . . . . . A 36 VAL CG2 . 34507 1
99 . 1 . 1 12 12 GLY H H 1 7.864 . . . . . . . A 37 GLY H . 34507 1
100 . 1 . 1 12 12 GLY HA2 H 1 3.892 . . . . . . . A 37 GLY HA2 . 34507 1
101 . 1 . 1 12 12 GLY HA3 H 1 3.808 . . . . . . . A 37 GLY HA3 . 34507 1
102 . 1 . 1 12 12 GLY CA C 13 46.528 . . . . . . . A 37 GLY CA . 34507 1
103 . 1 . 1 13 13 LEU H H 1 7.941 . . . . . . . A 38 LEU H . 34507 1
104 . 1 . 1 13 13 LEU HA H 1 4.217 . . . . . . . A 38 LEU HA . 34507 1
105 . 1 . 1 13 13 LEU HB2 H 1 2.016 . . . . . . . A 38 LEU HB2 . 34507 1
106 . 1 . 1 13 13 LEU HB3 H 1 1.636 . . . . . . . A 38 LEU HB3 . 34507 1
107 . 1 . 1 13 13 LEU HG H 1 1.929 . . . . . . . A 38 LEU HG . 34507 1
108 . 1 . 1 13 13 LEU HD11 H 1 0.906 . . . . . . . A 38 LEU HD11 . 34507 1
109 . 1 . 1 13 13 LEU HD12 H 1 0.906 . . . . . . . A 38 LEU HD12 . 34507 1
110 . 1 . 1 13 13 LEU HD13 H 1 0.906 . . . . . . . A 38 LEU HD13 . 34507 1
111 . 1 . 1 13 13 LEU HD21 H 1 0.952 . . . . . . . A 38 LEU HD21 . 34507 1
112 . 1 . 1 13 13 LEU HD22 H 1 0.952 . . . . . . . A 38 LEU HD22 . 34507 1
113 . 1 . 1 13 13 LEU HD23 H 1 0.952 . . . . . . . A 38 LEU HD23 . 34507 1
114 . 1 . 1 13 13 LEU CA C 13 57.417 . . . . . . . A 38 LEU CA . 34507 1
115 . 1 . 1 13 13 LEU CB C 13 41.085 . . . . . . . A 38 LEU CB . 34507 1
116 . 1 . 1 13 13 LEU CG C 13 26.005 . . . . . . . A 38 LEU CG . 34507 1
117 . 1 . 1 13 13 LEU CD1 C 13 21.695 . . . . . . . A 38 LEU CD1 . 34507 1
118 . 1 . 1 13 13 LEU CD2 C 13 23.657 . . . . . . . A 38 LEU CD2 . 34507 1
119 . 1 . 1 14 14 VAL H H 1 7.865 . . . . . . . A 39 VAL H . 34507 1
120 . 1 . 1 14 14 VAL HA H 1 3.747 . . . . . . . A 39 VAL HA . 34507 1
121 . 1 . 1 14 14 VAL HB H 1 2.378 . . . . . . . A 39 VAL HB . 34507 1
122 . 1 . 1 14 14 VAL HG11 H 1 1.113 . . . . . . . A 39 VAL HG11 . 34507 1
123 . 1 . 1 14 14 VAL HG12 H 1 1.113 . . . . . . . A 39 VAL HG12 . 34507 1
124 . 1 . 1 14 14 VAL HG13 H 1 1.113 . . . . . . . A 39 VAL HG13 . 34507 1
125 . 1 . 1 14 14 VAL HG21 H 1 0.981 . . . . . . . A 39 VAL HG21 . 34507 1
126 . 1 . 1 14 14 VAL HG22 H 1 0.981 . . . . . . . A 39 VAL HG22 . 34507 1
127 . 1 . 1 14 14 VAL HG23 H 1 0.981 . . . . . . . A 39 VAL HG23 . 34507 1
128 . 1 . 1 14 14 VAL CA C 13 65.798 . . . . . . . A 39 VAL CA . 34507 1
129 . 1 . 1 14 14 VAL CB C 13 30.912 . . . . . . . A 39 VAL CB . 34507 1
130 . 1 . 1 14 14 VAL CG1 C 13 21.352 . . . . . . . A 39 VAL CG1 . 34507 1
131 . 1 . 1 14 14 VAL CG2 C 13 19.885 . . . . . . . A 39 VAL CG2 . 34507 1
132 . 1 . 1 15 15 VAL H H 1 8.390 . . . . . . . A 40 VAL H . 34507 1
133 . 1 . 1 15 15 VAL HA H 1 3.605 . . . . . . . A 40 VAL HA . 34507 1
134 . 1 . 1 15 15 VAL HB H 1 2.342 . . . . . . . A 40 VAL HB . 34507 1
135 . 1 . 1 15 15 VAL HG11 H 1 0.947 . . . . . . . A 40 VAL HG11 . 34507 1
136 . 1 . 1 15 15 VAL HG12 H 1 0.947 . . . . . . . A 40 VAL HG12 . 34507 1
137 . 1 . 1 15 15 VAL HG13 H 1 0.947 . . . . . . . A 40 VAL HG13 . 34507 1
138 . 1 . 1 15 15 VAL HG21 H 1 1.090 . . . . . . . A 40 VAL HG21 . 34507 1
139 . 1 . 1 15 15 VAL HG22 H 1 1.090 . . . . . . . A 40 VAL HG22 . 34507 1
140 . 1 . 1 15 15 VAL HG23 H 1 1.090 . . . . . . . A 40 VAL HG23 . 34507 1
141 . 1 . 1 15 15 VAL CA C 13 67.085 . . . . . . . A 40 VAL CA . 34507 1
142 . 1 . 1 15 15 VAL CB C 13 30.862 . . . . . . . A 40 VAL CB . 34507 1
143 . 1 . 1 15 15 VAL CG1 C 13 19.565 . . . . . . . A 40 VAL CG1 . 34507 1
144 . 1 . 1 15 15 VAL CG2 C 13 21.337 . . . . . . . A 40 VAL CG2 . 34507 1
145 . 1 . 1 16 16 ILE H H 1 8.208 . . . . . . . A 41 ILE H . 34507 1
146 . 1 . 1 16 16 ILE HA H 1 3.739 . . . . . . . A 41 ILE HA . 34507 1
147 . 1 . 1 16 16 ILE HB H 1 1.978 . . . . . . . A 41 ILE HB . 34507 1
148 . 1 . 1 16 16 ILE HG12 H 1 1.236 . . . . . . . A 41 ILE HG12 . 34507 1
149 . 1 . 1 16 16 ILE HG13 H 1 1.789 . . . . . . . A 41 ILE HG13 . 34507 1
150 . 1 . 1 16 16 ILE HG21 H 1 0.980 . . . . . . . A 41 ILE HG21 . 34507 1
151 . 1 . 1 16 16 ILE HG22 H 1 0.980 . . . . . . . A 41 ILE HG22 . 34507 1
152 . 1 . 1 16 16 ILE HG23 H 1 0.980 . . . . . . . A 41 ILE HG23 . 34507 1
153 . 1 . 1 16 16 ILE HD11 H 1 0.871 . . . . . . . A 41 ILE HD11 . 34507 1
154 . 1 . 1 16 16 ILE HD12 H 1 0.871 . . . . . . . A 41 ILE HD12 . 34507 1
155 . 1 . 1 16 16 ILE HD13 H 1 0.871 . . . . . . . A 41 ILE HD13 . 34507 1
156 . 1 . 1 16 16 ILE CA C 13 64.510 . . . . . . . A 41 ILE CA . 34507 1
157 . 1 . 1 16 16 ILE CB C 13 37.054 . . . . . . . A 41 ILE CB . 34507 1
158 . 1 . 1 16 16 ILE CG1 C 13 28.263 . . . . . . . A 41 ILE CG1 . 34507 1
159 . 1 . 1 16 16 ILE CG2 C 13 16.072 . . . . . . . A 41 ILE CG2 . 34507 1
160 . 1 . 1 16 16 ILE CD1 C 13 11.153 . . . . . . . A 41 ILE CD1 . 34507 1
161 . 1 . 1 17 17 ALA H H 1 8.241 . . . . . . . A 42 ALA H . 34507 1
162 . 1 . 1 17 17 ALA HA H 1 4.046 . . . . . . . A 42 ALA HA . 34507 1
163 . 1 . 1 17 17 ALA HB1 H 1 1.547 . . . . . . . A 42 ALA HB1 . 34507 1
164 . 1 . 1 17 17 ALA HB2 H 1 1.547 . . . . . . . A 42 ALA HB2 . 34507 1
165 . 1 . 1 17 17 ALA HB3 H 1 1.547 . . . . . . . A 42 ALA HB3 . 34507 1
166 . 1 . 1 17 17 ALA CA C 13 54.938 . . . . . . . A 42 ALA CA . 34507 1
167 . 1 . 1 17 17 ALA CB C 13 16.948 . . . . . . . A 42 ALA CB . 34507 1
168 . 1 . 1 18 18 THR H H 1 7.996 . . . . . . . A 43 THR H . 34507 1
169 . 1 . 1 18 18 THR HA H 1 3.896 . . . . . . . A 43 THR HA . 34507 1
170 . 1 . 1 18 18 THR HB H 1 4.584 . . . . . . . A 43 THR HB . 34507 1
171 . 1 . 1 18 18 THR HG1 H 1 5.644 . . . . . . . A 43 THR HG1 . 34507 1
172 . 1 . 1 18 18 THR HG21 H 1 1.281 . . . . . . . A 43 THR HG21 . 34507 1
173 . 1 . 1 18 18 THR HG22 H 1 1.281 . . . . . . . A 43 THR HG22 . 34507 1
174 . 1 . 1 18 18 THR HG23 H 1 1.281 . . . . . . . A 43 THR HG23 . 34507 1
175 . 1 . 1 18 18 THR CA C 13 66.765 . . . . . . . A 43 THR CA . 34507 1
176 . 1 . 1 18 18 THR CB C 13 68.303 . . . . . . . A 43 THR CB . 34507 1
177 . 1 . 1 18 18 THR CG2 C 13 19.481 . . . . . . . A 43 THR CG2 . 34507 1
178 . 1 . 1 19 19 VAL H H 1 8.337 . . . . . . . A 44 VAL H . 34507 1
179 . 1 . 1 19 19 VAL HA H 1 3.637 . . . . . . . A 44 VAL HA . 34507 1
180 . 1 . 1 19 19 VAL HB H 1 2.362 . . . . . . . A 44 VAL HB . 34507 1
181 . 1 . 1 19 19 VAL HG11 H 1 1.094 . . . . . . . A 44 VAL HG11 . 34507 1
182 . 1 . 1 19 19 VAL HG12 H 1 1.094 . . . . . . . A 44 VAL HG12 . 34507 1
183 . 1 . 1 19 19 VAL HG13 H 1 1.094 . . . . . . . A 44 VAL HG13 . 34507 1
184 . 1 . 1 19 19 VAL HG21 H 1 0.937 . . . . . . . A 44 VAL HG21 . 34507 1
185 . 1 . 1 19 19 VAL HG22 H 1 0.937 . . . . . . . A 44 VAL HG22 . 34507 1
186 . 1 . 1 19 19 VAL HG23 H 1 0.937 . . . . . . . A 44 VAL HG23 . 34507 1
187 . 1 . 1 19 19 VAL CA C 13 67.378 . . . . . . . A 44 VAL CA . 34507 1
188 . 1 . 1 19 19 VAL CB C 13 30.862 . . . . . . . A 44 VAL CB . 34507 1
189 . 1 . 1 19 19 VAL CG1 C 13 21.337 . . . . . . . A 44 VAL CG1 . 34507 1
190 . 1 . 1 19 19 VAL CG2 C 13 19.835 . . . . . . . A 44 VAL CG2 . 34507 1
191 . 1 . 1 20 20 ILE H H 1 8.532 . . . . . . . A 45 ILE H . 34507 1
192 . 1 . 1 20 20 ILE HA H 1 3.637 . . . . . . . A 45 ILE HA . 34507 1
193 . 1 . 1 20 20 ILE HB H 1 2.116 . . . . . . . A 45 ILE HB . 34507 1
194 . 1 . 1 20 20 ILE HG12 H 1 1.099 . . . . . . . A 45 ILE HG12 . 34507 1
195 . 1 . 1 20 20 ILE HG13 H 1 1.907 . . . . . . . A 45 ILE HG13 . 34507 1
196 . 1 . 1 20 20 ILE HG21 H 1 0.922 . . . . . . . A 45 ILE HG21 . 34507 1
197 . 1 . 1 20 20 ILE HG22 H 1 0.922 . . . . . . . A 45 ILE HG22 . 34507 1
198 . 1 . 1 20 20 ILE HG23 H 1 0.922 . . . . . . . A 45 ILE HG23 . 34507 1
199 . 1 . 1 20 20 ILE HD11 H 1 0.850 . . . . . . . A 45 ILE HD11 . 34507 1
200 . 1 . 1 20 20 ILE HD12 H 1 0.850 . . . . . . . A 45 ILE HD12 . 34507 1
201 . 1 . 1 20 20 ILE HD13 H 1 0.850 . . . . . . . A 45 ILE HD13 . 34507 1
202 . 1 . 1 20 20 ILE CA C 13 65.767 . . . . . . . A 45 ILE CA . 34507 1
203 . 1 . 1 20 20 ILE CB C 13 36.871 . . . . . . . A 45 ILE CB . 34507 1
204 . 1 . 1 20 20 ILE CG1 C 13 28.236 . . . . . . . A 45 ILE CG1 . 34507 1
205 . 1 . 1 20 20 ILE CG2 C 13 15.495 . . . . . . . A 45 ILE CG2 . 34507 1
206 . 1 . 1 20 20 ILE CD1 C 13 11.547 . . . . . . . A 45 ILE CD1 . 34507 1
207 . 1 . 1 21 21 VAL H H 1 8.220 . . . . . . . A 46 VAL H . 34507 1
208 . 1 . 1 21 21 VAL HA H 1 3.640 . . . . . . . A 46 VAL HA . 34507 1
209 . 1 . 1 21 21 VAL HB H 1 2.284 . . . . . . . A 46 VAL HB . 34507 1
210 . 1 . 1 21 21 VAL HG11 H 1 1.139 . . . . . . . A 46 VAL HG11 . 34507 1
211 . 1 . 1 21 21 VAL HG12 H 1 1.139 . . . . . . . A 46 VAL HG12 . 34507 1
212 . 1 . 1 21 21 VAL HG13 H 1 1.139 . . . . . . . A 46 VAL HG13 . 34507 1
213 . 1 . 1 21 21 VAL HG21 H 1 0.978 . . . . . . . A 46 VAL HG21 . 34507 1
214 . 1 . 1 21 21 VAL HG22 H 1 0.978 . . . . . . . A 46 VAL HG22 . 34507 1
215 . 1 . 1 21 21 VAL HG23 H 1 0.978 . . . . . . . A 46 VAL HG23 . 34507 1
216 . 1 . 1 21 21 VAL CA C 13 66.486 . . . . . . . A 46 VAL CA . 34507 1
217 . 1 . 1 21 21 VAL CB C 13 30.838 . . . . . . . A 46 VAL CB . 34507 1
218 . 1 . 1 21 21 VAL CG1 C 13 21.858 . . . . . . . A 46 VAL CG1 . 34507 1
219 . 1 . 1 21 21 VAL CG2 C 13 19.885 . . . . . . . A 46 VAL CG2 . 34507 1
220 . 1 . 1 22 22 ILE H H 1 8.576 . . . . . . . A 47 ILE H . 34507 1
221 . 1 . 1 22 22 ILE HA H 1 3.699 . . . . . . . A 47 ILE HA . 34507 1
222 . 1 . 1 22 22 ILE HB H 1 1.983 . . . . . . . A 47 ILE HB . 34507 1
223 . 1 . 1 22 22 ILE HG12 H 1 1.238 . . . . . . . A 47 ILE HG12 . 34507 1
224 . 1 . 1 22 22 ILE HG13 H 1 1.857 . . . . . . . A 47 ILE HG13 . 34507 1
225 . 1 . 1 22 22 ILE HG21 H 1 0.957 . . . . . . . A 47 ILE HG21 . 34507 1
226 . 1 . 1 22 22 ILE HG22 H 1 0.957 . . . . . . . A 47 ILE HG22 . 34507 1
227 . 1 . 1 22 22 ILE HG23 H 1 0.957 . . . . . . . A 47 ILE HG23 . 34507 1
228 . 1 . 1 22 22 ILE HD11 H 1 0.848 . . . . . . . A 47 ILE HD11 . 34507 1
229 . 1 . 1 22 22 ILE HD12 H 1 0.848 . . . . . . . A 47 ILE HD12 . 34507 1
230 . 1 . 1 22 22 ILE HD13 H 1 0.848 . . . . . . . A 47 ILE HD13 . 34507 1
231 . 1 . 1 22 22 ILE CA C 13 64.797 . . . . . . . A 47 ILE CA . 34507 1
232 . 1 . 1 22 22 ILE CB C 13 37.054 . . . . . . . A 47 ILE CB . 34507 1
233 . 1 . 1 22 22 ILE CG1 C 13 28.222 . . . . . . . A 47 ILE CG1 . 34507 1
234 . 1 . 1 22 22 ILE CG2 C 13 16.099 . . . . . . . A 47 ILE CG2 . 34507 1
235 . 1 . 1 22 22 ILE CD1 C 13 11.729 . . . . . . . A 47 ILE CD1 . 34507 1
236 . 1 . 1 23 23 THR H H 1 8.185 . . . . . . . A 48 THR H . 34507 1
237 . 1 . 1 23 23 THR HA H 1 3.845 . . . . . . . A 48 THR HA . 34507 1
238 . 1 . 1 23 23 THR HB H 1 4.551 . . . . . . . A 48 THR HB . 34507 1
239 . 1 . 1 23 23 THR HG1 H 1 5.674 . . . . . . . A 48 THR HG1 . 34507 1
240 . 1 . 1 23 23 THR HG21 H 1 1.244 . . . . . . . A 48 THR HG21 . 34507 1
241 . 1 . 1 23 23 THR HG22 H 1 1.244 . . . . . . . A 48 THR HG22 . 34507 1
242 . 1 . 1 23 23 THR HG23 H 1 1.244 . . . . . . . A 48 THR HG23 . 34507 1
243 . 1 . 1 23 23 THR CA C 13 67.273 . . . . . . . A 48 THR CA . 34507 1
244 . 1 . 1 23 23 THR CB C 13 68.019 . . . . . . . A 48 THR CB . 34507 1
245 . 1 . 1 23 23 THR CG2 C 13 19.364 . . . . . . . A 48 THR CG2 . 34507 1
246 . 1 . 1 24 24 LEU H H 1 8.499 . . . . . . . A 49 LEU H . 34507 1
247 . 1 . 1 24 24 LEU HA H 1 4.111 . . . . . . . A 49 LEU HA . 34507 1
248 . 1 . 1 24 24 LEU HB2 H 1 2.124 . . . . . . . A 49 LEU HB2 . 34507 1
249 . 1 . 1 24 24 LEU HB3 H 1 1.521 . . . . . . . A 49 LEU HB3 . 34507 1
250 . 1 . 1 24 24 LEU HG H 1 1.979 . . . . . . . A 49 LEU HG . 34507 1
251 . 1 . 1 24 24 LEU HD11 H 1 0.896 . . . . . . . A 49 LEU HD11 . 34507 1
252 . 1 . 1 24 24 LEU HD12 H 1 0.896 . . . . . . . A 49 LEU HD12 . 34507 1
253 . 1 . 1 24 24 LEU HD13 H 1 0.896 . . . . . . . A 49 LEU HD13 . 34507 1
254 . 1 . 1 24 24 LEU HD21 H 1 0.874 . . . . . . . A 49 LEU HD21 . 34507 1
255 . 1 . 1 24 24 LEU HD22 H 1 0.874 . . . . . . . A 49 LEU HD22 . 34507 1
256 . 1 . 1 24 24 LEU HD23 H 1 0.874 . . . . . . . A 49 LEU HD23 . 34507 1
257 . 1 . 1 24 24 LEU CA C 13 57.949 . . . . . . . A 49 LEU CA . 34507 1
258 . 1 . 1 24 24 LEU CB C 13 41.023 . . . . . . . A 49 LEU CB . 34507 1
259 . 1 . 1 24 24 LEU CG C 13 25.933 . . . . . . . A 49 LEU CG . 34507 1
260 . 1 . 1 24 24 LEU CD1 C 13 23.912 . . . . . . . A 49 LEU CD1 . 34507 1
261 . 1 . 1 24 24 LEU CD2 C 13 21.513 . . . . . . . A 49 LEU CD2 . 34507 1
262 . 1 . 1 25 25 VAL H H 1 8.629 . . . . . . . A 50 VAL H . 34507 1
263 . 1 . 1 25 25 VAL HA H 1 3.610 . . . . . . . A 50 VAL HA . 34507 1
264 . 1 . 1 25 25 VAL HB H 1 2.341 . . . . . . . A 50 VAL HB . 34507 1
265 . 1 . 1 25 25 VAL HG11 H 1 1.107 . . . . . . . A 50 VAL HG11 . 34507 1
266 . 1 . 1 25 25 VAL HG12 H 1 1.107 . . . . . . . A 50 VAL HG12 . 34507 1
267 . 1 . 1 25 25 VAL HG13 H 1 1.107 . . . . . . . A 50 VAL HG13 . 34507 1
268 . 1 . 1 25 25 VAL HG21 H 1 0.947 . . . . . . . A 50 VAL HG21 . 34507 1
269 . 1 . 1 25 25 VAL HG22 H 1 0.947 . . . . . . . A 50 VAL HG22 . 34507 1
270 . 1 . 1 25 25 VAL HG23 H 1 0.947 . . . . . . . A 50 VAL HG23 . 34507 1
271 . 1 . 1 25 25 VAL CA C 13 66.563 . . . . . . . A 50 VAL CA . 34507 1
272 . 1 . 1 25 25 VAL CB C 13 30.862 . . . . . . . A 50 VAL CB . 34507 1
273 . 1 . 1 25 25 VAL CG1 C 13 21.635 . . . . . . . A 50 VAL CG1 . 34507 1
274 . 1 . 1 25 25 VAL CG2 C 13 20.007 . . . . . . . A 50 VAL CG2 . 34507 1
275 . 1 . 1 26 26 MET H H 1 8.561 . . . . . . . A 51 MET H . 34507 1
276 . 1 . 1 26 26 MET HA H 1 4.204 . . . . . . . A 51 MET HA . 34507 1
277 . 1 . 1 26 26 MET HB2 H 1 2.434 . . . . . . . A 51 MET HB2 . 34507 1
278 . 1 . 1 26 26 MET HB3 H 1 2.109 . . . . . . . A 51 MET HB3 . 34507 1
279 . 1 . 1 26 26 MET HG2 H 1 2.805 . . . . . . . A 51 MET HG2 . 34507 1
280 . 1 . 1 26 26 MET HG3 H 1 2.671 . . . . . . . A 51 MET HG3 . 34507 1
281 . 1 . 1 26 26 MET HE1 H 1 2.071 . . . . . . . A 51 MET HE1 . 34507 1
282 . 1 . 1 26 26 MET HE2 H 1 2.071 . . . . . . . A 51 MET HE2 . 34507 1
283 . 1 . 1 26 26 MET HE3 H 1 2.071 . . . . . . . A 51 MET HE3 . 34507 1
284 . 1 . 1 26 26 MET CA C 13 58.038 . . . . . . . A 51 MET CA . 34507 1
285 . 1 . 1 26 26 MET CB C 13 31.000 . . . . . . . A 51 MET CB . 34507 1
286 . 1 . 1 26 26 MET CG C 13 31.937 . . . . . . . A 51 MET CG . 34507 1
287 . 1 . 1 26 26 MET CE C 13 15.459 . . . . . . . A 51 MET CE . 34507 1
288 . 1 . 1 27 27 LEU H H 1 8.543 . . . . . . . A 52 LEU H . 34507 1
289 . 1 . 1 27 27 LEU HA H 1 4.140 . . . . . . . A 52 LEU HA . 34507 1
290 . 1 . 1 27 27 LEU HB2 H 1 2.010 . . . . . . . A 52 LEU HB2 . 34507 1
291 . 1 . 1 27 27 LEU HB3 H 1 1.567 . . . . . . . A 52 LEU HB3 . 34507 1
292 . 1 . 1 27 27 LEU HG H 1 1.927 . . . . . . . A 52 LEU HG . 34507 1
293 . 1 . 1 27 27 LEU HD11 H 1 0.908 . . . . . . . A 52 LEU HD11 . 34507 1
294 . 1 . 1 27 27 LEU HD12 H 1 0.908 . . . . . . . A 52 LEU HD12 . 34507 1
295 . 1 . 1 27 27 LEU HD13 H 1 0.908 . . . . . . . A 52 LEU HD13 . 34507 1
296 . 1 . 1 27 27 LEU HD21 H 1 0.888 . . . . . . . A 52 LEU HD21 . 34507 1
297 . 1 . 1 27 27 LEU HD22 H 1 0.888 . . . . . . . A 52 LEU HD22 . 34507 1
298 . 1 . 1 27 27 LEU HD23 H 1 0.888 . . . . . . . A 52 LEU HD23 . 34507 1
299 . 1 . 1 27 27 LEU CA C 13 57.176 . . . . . . . A 52 LEU CA . 34507 1
300 . 1 . 1 27 27 LEU CB C 13 41.354 . . . . . . . A 52 LEU CB . 34507 1
301 . 1 . 1 27 27 LEU CG C 13 26.005 . . . . . . . A 52 LEU CG . 34507 1
302 . 1 . 1 27 27 LEU CD1 C 13 23.875 . . . . . . . A 52 LEU CD1 . 34507 1
303 . 1 . 1 27 27 LEU CD2 C 13 21.616 . . . . . . . A 52 LEU CD2 . 34507 1
304 . 1 . 1 28 28 LYS H H 1 8.202 . . . . . . . A 53 LYS H . 34507 1
305 . 1 . 1 28 28 LYS HA H 1 4.125 . . . . . . . A 53 LYS HA . 34507 1
306 . 1 . 1 28 28 LYS CA C 13 57.654 . . . . . . . A 53 LYS CA . 34507 1
307 . 1 . 1 29 29 LYS H H 1 8.246 . . . . . . . A 54 LYS H . 34507 1
308 . 1 . 1 29 29 LYS HA H 1 4.182 . . . . . . . A 54 LYS HA . 34507 1
309 . 1 . 1 29 29 LYS CA C 13 57.250 . . . . . . . A 54 LYS CA . 34507 1
310 . 1 . 1 30 30 LYS H H 1 8.006 . . . . . . . A 55 LYS H . 34507 1
311 . 1 . 1 30 30 LYS HA H 1 4.223 . . . . . . . A 55 LYS HA . 34507 1
312 . 1 . 1 30 30 LYS HB2 H 1 1.948 . . . . . . . A 55 LYS HB2 . 34507 1
313 . 1 . 1 30 30 LYS HG2 H 1 1.716 . . . . . . . A 55 LYS HG2 . 34507 1
314 . 1 . 1 30 30 LYS CA C 13 56.195 . . . . . . . A 55 LYS CA . 34507 1
315 . 1 . 1 30 30 LYS CB C 13 32.024 . . . . . . . A 55 LYS CB . 34507 1
316 . 1 . 1 30 30 LYS CG C 13 28.232 . . . . . . . A 55 LYS CG . 34507 1
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