###################################
# 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 30213
_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 '2D 1H-1H TOCSY' . . . 30213 1
2 '2D 1H-1H NOESY' . . . 30213 1
3 '2D 1H-15N HSQC' . . . 30213 1
4 '2D 1H-13C HSQC' . . . 30213 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 GLY HA2 H 1 4.110 . . . . . . . A 1 GLY HA2 . 30213 1
2 . 1 . 1 1 1 GLY HA3 H 1 3.957 . . . . . . . A 1 GLY HA3 . 30213 1
3 . 1 . 1 1 1 GLY CA C 13 43.414 . . . . . . . A 1 GLY CA . 30213 1
4 . 1 . 1 2 2 VAL H H 1 8.136 . . . . . . . A 2 VAL H . 30213 1
5 . 1 . 1 2 2 VAL HA H 1 3.860 . . . . . . . A 2 VAL HA . 30213 1
6 . 1 . 1 2 2 VAL HB H 1 2.112 . . . . . . . A 2 VAL HB . 30213 1
7 . 1 . 1 2 2 VAL HG11 H 1 1.116 . . . . . . . A 2 VAL HG11 . 30213 1
8 . 1 . 1 2 2 VAL HG12 H 1 1.116 . . . . . . . A 2 VAL HG12 . 30213 1
9 . 1 . 1 2 2 VAL HG13 H 1 1.116 . . . . . . . A 2 VAL HG13 . 30213 1
10 . 1 . 1 2 2 VAL HG21 H 1 1.036 . . . . . . . A 2 VAL HG21 . 30213 1
11 . 1 . 1 2 2 VAL HG22 H 1 1.036 . . . . . . . A 2 VAL HG22 . 30213 1
12 . 1 . 1 2 2 VAL HG23 H 1 1.036 . . . . . . . A 2 VAL HG23 . 30213 1
13 . 1 . 1 2 2 VAL CA C 13 66.317 . . . . . . . A 2 VAL CA . 30213 1
14 . 1 . 1 2 2 VAL CB C 13 32.563 . . . . . . . A 2 VAL CB . 30213 1
15 . 1 . 1 2 2 VAL CG1 C 13 21.121 . . . . . . . A 2 VAL CG1 . 30213 1
16 . 1 . 1 2 2 VAL CG2 C 13 20.041 . . . . . . . A 2 VAL CG2 . 30213 1
17 . 1 . 1 3 3 VAL H H 1 8.138 . . . . . . . A 3 VAL H . 30213 1
18 . 1 . 1 3 3 VAL HA H 1 3.787 . . . . . . . A 3 VAL HA . 30213 1
19 . 1 . 1 3 3 VAL HB H 1 2.110 . . . . . . . A 3 VAL HB . 30213 1
20 . 1 . 1 3 3 VAL HG11 H 1 1.078 . . . . . . . A 3 VAL HG11 . 30213 1
21 . 1 . 1 3 3 VAL HG12 H 1 1.078 . . . . . . . A 3 VAL HG12 . 30213 1
22 . 1 . 1 3 3 VAL HG13 H 1 1.078 . . . . . . . A 3 VAL HG13 . 30213 1
23 . 1 . 1 3 3 VAL HG21 H 1 0.996 . . . . . . . A 3 VAL HG21 . 30213 1
24 . 1 . 1 3 3 VAL HG22 H 1 0.996 . . . . . . . A 3 VAL HG22 . 30213 1
25 . 1 . 1 3 3 VAL HG23 H 1 0.996 . . . . . . . A 3 VAL HG23 . 30213 1
26 . 1 . 1 3 3 VAL CA C 13 66.067 . . . . . . . A 3 VAL CA . 30213 1
27 . 1 . 1 3 3 VAL CB C 13 32.029 . . . . . . . A 3 VAL CB . 30213 1
28 . 1 . 1 3 3 VAL CG1 C 13 21.852 . . . . . . . A 3 VAL CG1 . 30213 1
29 . 1 . 1 3 3 VAL CG2 C 13 20.702 . . . . . . . A 3 VAL CG2 . 30213 1
30 . 1 . 1 3 3 VAL N N 15 117.918 . . . . . . . A 3 VAL N . 30213 1
31 . 1 . 1 4 4 ASP H H 1 7.424 . . . . . . . A 4 ASP H . 30213 1
32 . 1 . 1 4 4 ASP HA H 1 4.391 . . . . . . . A 4 ASP HA . 30213 1
33 . 1 . 1 4 4 ASP HB2 H 1 2.845 . . . . . . . A 4 ASP HB2 . 30213 1
34 . 1 . 1 4 4 ASP HB3 H 1 2.754 . . . . . . . A 4 ASP HB3 . 30213 1
35 . 1 . 1 4 4 ASP CA C 13 57.323 . . . . . . . A 4 ASP CA . 30213 1
36 . 1 . 1 4 4 ASP CB C 13 41.028 . . . . . . . A 4 ASP CB . 30213 1
37 . 1 . 1 4 4 ASP N N 15 114.356 . . . . . . . A 4 ASP N . 30213 1
38 . 1 . 1 5 5 ILE H H 1 7.614 . . . . . . . A 5 ILE H . 30213 1
39 . 1 . 1 5 5 ILE HA H 1 3.863 . . . . . . . A 5 ILE HA . 30213 1
40 . 1 . 1 5 5 ILE HB H 1 2.173 . . . . . . . A 5 ILE HB . 30213 1
41 . 1 . 1 5 5 ILE HG12 H 1 1.733 . . . . . . . A 5 ILE HG12 . 30213 1
42 . 1 . 1 5 5 ILE HG13 H 1 1.247 . . . . . . . A 5 ILE HG13 . 30213 1
43 . 1 . 1 5 5 ILE HG21 H 1 0.977 . . . . . . . A 5 ILE HG21 . 30213 1
44 . 1 . 1 5 5 ILE HG22 H 1 0.977 . . . . . . . A 5 ILE HG22 . 30213 1
45 . 1 . 1 5 5 ILE HG23 H 1 0.977 . . . . . . . A 5 ILE HG23 . 30213 1
46 . 1 . 1 5 5 ILE HD11 H 1 0.910 . . . . . . . A 5 ILE HD11 . 30213 1
47 . 1 . 1 5 5 ILE HD12 H 1 0.910 . . . . . . . A 5 ILE HD12 . 30213 1
48 . 1 . 1 5 5 ILE HD13 H 1 0.910 . . . . . . . A 5 ILE HD13 . 30213 1
49 . 1 . 1 5 5 ILE CA C 13 64.384 . . . . . . . A 5 ILE CA . 30213 1
50 . 1 . 1 5 5 ILE CB C 13 37.867 . . . . . . . A 5 ILE CB . 30213 1
51 . 1 . 1 5 5 ILE CG1 C 13 28.121 . . . . . . . A 5 ILE CG1 . 30213 1
52 . 1 . 1 5 5 ILE CG2 C 13 16.331 . . . . . . . A 5 ILE CG2 . 30213 1
53 . 1 . 1 5 5 ILE CD1 C 13 12.386 . . . . . . . A 5 ILE CD1 . 30213 1
54 . 1 . 1 5 5 ILE N N 15 120.520 . . . . . . . A 5 ILE N . 30213 1
55 . 1 . 1 6 6 LEU H H 1 8.106 . . . . . . . A 6 LEU H . 30213 1
56 . 1 . 1 6 6 LEU HA H 1 4.151 . . . . . . . A 6 LEU HA . 30213 1
57 . 1 . 1 6 6 LEU HB2 H 1 1.946 . . . . . . . A 6 LEU HB2 . 30213 1
58 . 1 . 1 6 6 LEU HB3 H 1 1.596 . . . . . . . A 6 LEU HB3 . 30213 1
59 . 1 . 1 6 6 LEU HG H 1 1.892 . . . . . . . A 6 LEU HG . 30213 1
60 . 1 . 1 6 6 LEU HD11 H 1 0.923 . . . . . . . A 6 LEU HD11 . 30213 1
61 . 1 . 1 6 6 LEU HD12 H 1 0.923 . . . . . . . A 6 LEU HD12 . 30213 1
62 . 1 . 1 6 6 LEU HD13 H 1 0.923 . . . . . . . A 6 LEU HD13 . 30213 1
63 . 1 . 1 6 6 LEU HD21 H 1 0.890 . . . . . . . A 6 LEU HD21 . 30213 1
64 . 1 . 1 6 6 LEU HD22 H 1 0.890 . . . . . . . A 6 LEU HD22 . 30213 1
65 . 1 . 1 6 6 LEU HD23 H 1 0.890 . . . . . . . A 6 LEU HD23 . 30213 1
66 . 1 . 1 6 6 LEU CA C 13 58.052 . . . . . . . A 6 LEU CA . 30213 1
67 . 1 . 1 6 6 LEU CB C 13 41.532 . . . . . . . A 6 LEU CB . 30213 1
68 . 1 . 1 6 6 LEU CG C 13 26.720 . . . . . . . A 6 LEU CG . 30213 1
69 . 1 . 1 6 6 LEU CD1 C 13 22.765 . . . . . . . A 6 LEU CD1 . 30213 1
70 . 1 . 1 6 6 LEU CD2 C 13 21.916 . . . . . . . A 6 LEU CD2 . 30213 1
71 . 1 . 1 6 6 LEU N N 15 120.404 . . . . . . . A 6 LEU N . 30213 1
72 . 1 . 1 7 7 LYS H H 1 8.437 . . . . . . . A 7 LYS H . 30213 1
73 . 1 . 1 7 7 LYS HA H 1 4.085 . . . . . . . A 7 LYS HA . 30213 1
74 . 1 . 1 7 7 LYS HB2 H 1 1.979 . . . . . . . A 7 LYS HB2 . 30213 1
75 . 1 . 1 7 7 LYS HB3 H 1 1.928 . . . . . . . A 7 LYS HB3 . 30213 1
76 . 1 . 1 7 7 LYS HG2 H 1 1.767 . . . . . . . A 7 LYS HG2 . 30213 1
77 . 1 . 1 7 7 LYS HG3 H 1 1.478 . . . . . . . A 7 LYS HG3 . 30213 1
78 . 1 . 1 7 7 LYS HD2 H 1 1.753 . . . . . . . A 7 LYS HD2 . 30213 1
79 . 1 . 1 7 7 LYS HE2 H 1 3.040 . . . . . . . A 7 LYS HE2 . 30213 1
80 . 1 . 1 7 7 LYS HE3 H 1 2.968 . . . . . . . A 7 LYS HE3 . 30213 1
81 . 1 . 1 7 7 LYS CA C 13 59.600 . . . . . . . A 7 LYS CA . 30213 1
82 . 1 . 1 7 7 LYS CB C 13 32.686 . . . . . . . A 7 LYS CB . 30213 1
83 . 1 . 1 7 7 LYS CG C 13 25.517 . . . . . . . A 7 LYS CG . 30213 1
84 . 1 . 1 7 7 LYS CD C 13 29.357 . . . . . . . A 7 LYS CD . 30213 1
85 . 1 . 1 7 7 LYS CE C 13 42.049 . . . . . . . A 7 LYS CE . 30213 1
86 . 1 . 1 7 7 LYS N N 15 117.855 . . . . . . . A 7 LYS N . 30213 1
87 . 1 . 1 8 8 GLY H H 1 7.999 . . . . . . . A 8 GLY H . 30213 1
88 . 1 . 1 8 8 GLY HA2 H 1 3.941 . . . . . . . A 8 GLY HA2 . 30213 1
89 . 1 . 1 8 8 GLY HA3 H 1 3.868 . . . . . . . A 8 GLY HA3 . 30213 1
90 . 1 . 1 8 8 GLY CA C 13 46.812 . . . . . . . A 8 GLY CA . 30213 1
91 . 1 . 1 8 8 GLY N N 15 106.100 . . . . . . . A 8 GLY N . 30213 1
92 . 1 . 1 9 9 ALA H H 1 8.352 . . . . . . . A 9 ALA H . 30213 1
93 . 1 . 1 9 9 ALA HA H 1 4.336 . . . . . . . A 9 ALA HA . 30213 1
94 . 1 . 1 9 9 ALA HB1 H 1 1.568 . . . . . . . A 9 ALA HB1 . 30213 1
95 . 1 . 1 9 9 ALA HB2 H 1 1.568 . . . . . . . A 9 ALA HB2 . 30213 1
96 . 1 . 1 9 9 ALA HB3 H 1 1.568 . . . . . . . A 9 ALA HB3 . 30213 1
97 . 1 . 1 9 9 ALA CA C 13 54.783 . . . . . . . A 9 ALA CA . 30213 1
98 . 1 . 1 9 9 ALA CB C 13 17.874 . . . . . . . A 9 ALA CB . 30213 1
99 . 1 . 1 9 9 ALA N N 15 125.131 . . . . . . . A 9 ALA N . 30213 1
100 . 1 . 1 10 10 ALA H H 1 8.208 . . . . . . . A 10 ALA H . 30213 1
101 . 1 . 1 10 10 ALA HA H 1 4.127 . . . . . . . A 10 ALA HA . 30213 1
102 . 1 . 1 10 10 ALA HB1 H 1 1.568 . . . . . . . A 10 ALA HB1 . 30213 1
103 . 1 . 1 10 10 ALA HB2 H 1 1.568 . . . . . . . A 10 ALA HB2 . 30213 1
104 . 1 . 1 10 10 ALA HB3 H 1 1.568 . . . . . . . A 10 ALA HB3 . 30213 1
105 . 1 . 1 10 10 ALA CA C 13 55.171 . . . . . . . A 10 ALA CA . 30213 1
106 . 1 . 1 10 10 ALA CB C 13 17.629 . . . . . . . A 10 ALA CB . 30213 1
107 . 1 . 1 10 10 ALA N N 15 119.854 . . . . . . . A 10 ALA N . 30213 1
108 . 1 . 1 11 11 LYS H H 1 7.900 . . . . . . . A 11 LYS H . 30213 1
109 . 1 . 1 11 11 LYS HA H 1 4.127 . . . . . . . A 11 LYS HA . 30213 1
110 . 1 . 1 11 11 LYS HB2 H 1 2.022 . . . . . . . A 11 LYS HB2 . 30213 1
111 . 1 . 1 11 11 LYS HB3 H 1 1.918 . . . . . . . A 11 LYS HB3 . 30213 1
112 . 1 . 1 11 11 LYS HG2 H 1 1.569 . . . . . . . A 11 LYS HG2 . 30213 1
113 . 1 . 1 11 11 LYS HD2 H 1 1.757 . . . . . . . A 11 LYS HD2 . 30213 1
114 . 1 . 1 11 11 LYS HD3 H 1 1.682 . . . . . . . A 11 LYS HD3 . 30213 1
115 . 1 . 1 11 11 LYS HE2 H 1 3.044 . . . . . . . A 11 LYS HE2 . 30213 1
116 . 1 . 1 11 11 LYS HE3 H 1 2.956 . . . . . . . A 11 LYS HE3 . 30213 1
117 . 1 . 1 11 11 LYS CA C 13 59.192 . . . . . . . A 11 LYS CA . 30213 1
118 . 1 . 1 11 11 LYS CB C 13 32.170 . . . . . . . A 11 LYS CB . 30213 1
119 . 1 . 1 11 11 LYS CG C 13 24.718 . . . . . . . A 11 LYS CG . 30213 1
120 . 1 . 1 11 11 LYS CD C 13 28.762 . . . . . . . A 11 LYS CD . 30213 1
121 . 1 . 1 11 11 LYS CE C 13 42.173 . . . . . . . A 11 LYS CE . 30213 1
122 . 1 . 1 11 11 LYS N N 15 117.074 . . . . . . . A 11 LYS N . 30213 1
123 . 1 . 1 12 12 ASP H H 1 8.052 . . . . . . . A 12 ASP H . 30213 1
124 . 1 . 1 12 12 ASP HA H 1 4.639 . . . . . . . A 12 ASP HA . 30213 1
125 . 1 . 1 12 12 ASP HB2 H 1 2.934 . . . . . . . A 12 ASP HB2 . 30213 1
126 . 1 . 1 12 12 ASP HB3 H 1 2.841 . . . . . . . A 12 ASP HB3 . 30213 1
127 . 1 . 1 12 12 ASP CA C 13 56.915 . . . . . . . A 12 ASP CA . 30213 1
128 . 1 . 1 12 12 ASP CB C 13 40.750 . . . . . . . A 12 ASP CB . 30213 1
129 . 1 . 1 12 12 ASP N N 15 121.195 . . . . . . . A 12 ASP N . 30213 1
130 . 1 . 1 13 13 ILE H H 1 8.511 . . . . . . . A 13 ILE H . 30213 1
131 . 1 . 1 13 13 ILE HA H 1 3.826 . . . . . . . A 13 ILE HA . 30213 1
132 . 1 . 1 13 13 ILE HB H 1 1.992 . . . . . . . A 13 ILE HB . 30213 1
133 . 1 . 1 13 13 ILE HG12 H 1 1.843 . . . . . . . A 13 ILE HG12 . 30213 1
134 . 1 . 1 13 13 ILE HG13 H 1 1.165 . . . . . . . A 13 ILE HG13 . 30213 1
135 . 1 . 1 13 13 ILE HG21 H 1 1.001 . . . . . . . A 13 ILE HG21 . 30213 1
136 . 1 . 1 13 13 ILE HG22 H 1 1.001 . . . . . . . A 13 ILE HG22 . 30213 1
137 . 1 . 1 13 13 ILE HG23 H 1 1.001 . . . . . . . A 13 ILE HG23 . 30213 1
138 . 1 . 1 13 13 ILE HD11 H 1 0.894 . . . . . . . A 13 ILE HD11 . 30213 1
139 . 1 . 1 13 13 ILE HD12 H 1 0.894 . . . . . . . A 13 ILE HD12 . 30213 1
140 . 1 . 1 13 13 ILE HD13 H 1 0.894 . . . . . . . A 13 ILE HD13 . 30213 1
141 . 1 . 1 13 13 ILE CA C 13 65.463 . . . . . . . A 13 ILE CA . 30213 1
142 . 1 . 1 13 13 ILE CB C 13 38.309 . . . . . . . A 13 ILE CB . 30213 1
143 . 1 . 1 13 13 ILE CG1 C 13 28.923 . . . . . . . A 13 ILE CG1 . 30213 1
144 . 1 . 1 13 13 ILE CG2 C 13 16.449 . . . . . . . A 13 ILE CG2 . 30213 1
145 . 1 . 1 13 13 ILE CD1 C 13 12.320 . . . . . . . A 13 ILE CD1 . 30213 1
146 . 1 . 1 13 13 ILE N N 15 122.797 . . . . . . . A 13 ILE N . 30213 1
147 . 1 . 1 14 14 ALA H H 1 8.421 . . . . . . . A 14 ALA H . 30213 1
148 . 1 . 1 14 14 ALA HA H 1 4.127 . . . . . . . A 14 ALA HA . 30213 1
149 . 1 . 1 14 14 ALA HB1 H 1 1.570 . . . . . . . A 14 ALA HB1 . 30213 1
150 . 1 . 1 14 14 ALA HB2 H 1 1.570 . . . . . . . A 14 ALA HB2 . 30213 1
151 . 1 . 1 14 14 ALA HB3 H 1 1.570 . . . . . . . A 14 ALA HB3 . 30213 1
152 . 1 . 1 14 14 ALA CA C 13 55.631 . . . . . . . A 14 ALA CA . 30213 1
153 . 1 . 1 14 14 ALA CB C 13 17.643 . . . . . . . A 14 ALA CB . 30213 1
154 . 1 . 1 14 14 ALA N N 15 122.025 . . . . . . . A 14 ALA N . 30213 1
155 . 1 . 1 15 15 GLY H H 1 8.291 . . . . . . . A 15 GLY H . 30213 1
156 . 1 . 1 15 15 GLY HA2 H 1 3.983 . . . . . . . A 15 GLY HA2 . 30213 1
157 . 1 . 1 15 15 GLY HA3 H 1 3.911 . . . . . . . A 15 GLY HA3 . 30213 1
158 . 1 . 1 15 15 GLY CA C 13 46.838 . . . . . . . A 15 GLY CA . 30213 1
159 . 1 . 1 15 15 GLY N N 15 103.974 . . . . . . . A 15 GLY N . 30213 1
160 . 1 . 1 16 16 HIS H H 1 8.180 . . . . . . . A 16 HIS H . 30213 1
161 . 1 . 1 16 16 HIS HA H 1 4.430 . . . . . . . A 16 HIS HA . 30213 1
162 . 1 . 1 16 16 HIS HB2 H 1 3.373 . . . . . . . A 16 HIS HB2 . 30213 1
163 . 1 . 1 16 16 HIS HD2 H 1 7.113 . . . . . . . A 16 HIS HD2 . 30213 1
164 . 1 . 1 16 16 HIS CA C 13 59.856 . . . . . . . A 16 HIS CA . 30213 1
165 . 1 . 1 16 16 HIS CB C 13 28.985 . . . . . . . A 16 HIS CB . 30213 1
166 . 1 . 1 16 16 HIS N N 15 121.600 . . . . . . . A 16 HIS N . 30213 1
167 . 1 . 1 17 17 LEU H H 1 8.665 . . . . . . . A 17 LEU H . 30213 1
168 . 1 . 1 17 17 LEU HA H 1 4.127 . . . . . . . A 17 LEU HA . 30213 1
169 . 1 . 1 17 17 LEU HB2 H 1 1.908 . . . . . . . A 17 LEU HB2 . 30213 1
170 . 1 . 1 17 17 LEU HB3 H 1 1.697 . . . . . . . A 17 LEU HB3 . 30213 1
171 . 1 . 1 17 17 LEU HG H 1 1.862 . . . . . . . A 17 LEU HG . 30213 1
172 . 1 . 1 17 17 LEU HD11 H 1 0.952 . . . . . . . A 17 LEU HD11 . 30213 1
173 . 1 . 1 17 17 LEU HD12 H 1 0.952 . . . . . . . A 17 LEU HD12 . 30213 1
174 . 1 . 1 17 17 LEU HD13 H 1 0.952 . . . . . . . A 17 LEU HD13 . 30213 1
175 . 1 . 1 17 17 LEU HD21 H 1 0.929 . . . . . . . A 17 LEU HD21 . 30213 1
176 . 1 . 1 17 17 LEU HD22 H 1 0.929 . . . . . . . A 17 LEU HD22 . 30213 1
177 . 1 . 1 17 17 LEU HD23 H 1 0.929 . . . . . . . A 17 LEU HD23 . 30213 1
178 . 1 . 1 17 17 LEU CA C 13 58.365 . . . . . . . A 17 LEU CA . 30213 1
179 . 1 . 1 17 17 LEU CB C 13 41.607 . . . . . . . A 17 LEU CB . 30213 1
180 . 1 . 1 17 17 LEU CG C 13 26.825 . . . . . . . A 17 LEU CG . 30213 1
181 . 1 . 1 17 17 LEU CD1 C 13 24.003 . . . . . . . A 17 LEU CD1 . 30213 1
182 . 1 . 1 17 17 LEU CD2 C 13 24.636 . . . . . . . A 17 LEU CD2 . 30213 1
183 . 1 . 1 17 17 LEU N N 15 121.652 . . . . . . . A 17 LEU N . 30213 1
184 . 1 . 1 18 18 ALA H H 1 8.576 . . . . . . . A 18 ALA H . 30213 1
185 . 1 . 1 18 18 ALA HA H 1 4.076 . . . . . . . A 18 ALA HA . 30213 1
186 . 1 . 1 18 18 ALA HB1 H 1 1.553 . . . . . . . A 18 ALA HB1 . 30213 1
187 . 1 . 1 18 18 ALA HB2 H 1 1.553 . . . . . . . A 18 ALA HB2 . 30213 1
188 . 1 . 1 18 18 ALA HB3 H 1 1.553 . . . . . . . A 18 ALA HB3 . 30213 1
189 . 1 . 1 18 18 ALA CA C 13 55.444 . . . . . . . A 18 ALA CA . 30213 1
190 . 1 . 1 18 18 ALA CB C 13 17.531 . . . . . . . A 18 ALA CB . 30213 1
191 . 1 . 1 18 18 ALA N N 15 120.492 . . . . . . . A 18 ALA N . 30213 1
192 . 1 . 1 19 19 SER H H 1 7.892 . . . . . . . A 19 SER H . 30213 1
193 . 1 . 1 19 19 SER HA H 1 4.199 . . . . . . . A 19 SER HA . 30213 1
194 . 1 . 1 19 19 SER HB2 H 1 4.076 . . . . . . . A 19 SER HB2 . 30213 1
195 . 1 . 1 19 19 SER HB3 H 1 4.031 . . . . . . . A 19 SER HB3 . 30213 1
196 . 1 . 1 19 19 SER CA C 13 61.741 . . . . . . . A 19 SER CA . 30213 1
197 . 1 . 1 19 19 SER CB C 13 62.966 . . . . . . . A 19 SER CB . 30213 1
198 . 1 . 1 19 19 SER N N 15 111.526 . . . . . . . A 19 SER N . 30213 1
199 . 1 . 1 20 20 LYS H H 1 7.842 . . . . . . . A 20 LYS H . 30213 1
200 . 1 . 1 20 20 LYS HA H 1 4.192 . . . . . . . A 20 LYS HA . 30213 1
201 . 1 . 1 20 20 LYS HB2 H 1 2.104 . . . . . . . A 20 LYS HB2 . 30213 1
202 . 1 . 1 20 20 LYS HB3 H 1 2.006 . . . . . . . A 20 LYS HB3 . 30213 1
203 . 1 . 1 20 20 LYS HG2 H 1 1.606 . . . . . . . A 20 LYS HG2 . 30213 1
204 . 1 . 1 20 20 LYS HG3 H 1 1.491 . . . . . . . A 20 LYS HG3 . 30213 1
205 . 1 . 1 20 20 LYS HD2 H 1 1.706 . . . . . . . A 20 LYS HD2 . 30213 1
206 . 1 . 1 20 20 LYS HD3 H 1 1.616 . . . . . . . A 20 LYS HD3 . 30213 1
207 . 1 . 1 20 20 LYS HE2 H 1 2.967 . . . . . . . A 20 LYS HE2 . 30213 1
208 . 1 . 1 20 20 LYS HE3 H 1 2.868 . . . . . . . A 20 LYS HE3 . 30213 1
209 . 1 . 1 20 20 LYS CA C 13 59.060 . . . . . . . A 20 LYS CA . 30213 1
210 . 1 . 1 20 20 LYS CB C 13 32.501 . . . . . . . A 20 LYS CB . 30213 1
211 . 1 . 1 20 20 LYS CG C 13 24.762 . . . . . . . A 20 LYS CG . 30213 1
212 . 1 . 1 20 20 LYS CD C 13 28.967 . . . . . . . A 20 LYS CD . 30213 1
213 . 1 . 1 20 20 LYS N N 15 122.371 . . . . . . . A 20 LYS N . 30213 1
214 . 1 . 1 21 21 VAL H H 1 8.177 . . . . . . . A 21 VAL H . 30213 1
215 . 1 . 1 21 21 VAL HA H 1 3.740 . . . . . . . A 21 VAL HA . 30213 1
216 . 1 . 1 21 21 VAL HB H 1 2.236 . . . . . . . A 21 VAL HB . 30213 1
217 . 1 . 1 21 21 VAL HG11 H 1 1.079 . . . . . . . A 21 VAL HG11 . 30213 1
218 . 1 . 1 21 21 VAL HG12 H 1 1.079 . . . . . . . A 21 VAL HG12 . 30213 1
219 . 1 . 1 21 21 VAL HG13 H 1 1.079 . . . . . . . A 21 VAL HG13 . 30213 1
220 . 1 . 1 21 21 VAL HG21 H 1 0.983 . . . . . . . A 21 VAL HG21 . 30213 1
221 . 1 . 1 21 21 VAL HG22 H 1 0.983 . . . . . . . A 21 VAL HG22 . 30213 1
222 . 1 . 1 21 21 VAL HG23 H 1 0.983 . . . . . . . A 21 VAL HG23 . 30213 1
223 . 1 . 1 21 21 VAL CA C 13 66.365 . . . . . . . A 21 VAL CA . 30213 1
224 . 1 . 1 21 21 VAL CB C 13 32.102 . . . . . . . A 21 VAL CB . 30213 1
225 . 1 . 1 21 21 VAL CG1 C 13 21.673 . . . . . . . A 21 VAL CG1 . 30213 1
226 . 1 . 1 21 21 VAL CG2 C 13 20.657 . . . . . . . A 21 VAL CG2 . 30213 1
227 . 1 . 1 21 21 VAL N N 15 119.526 . . . . . . . A 21 VAL N . 30213 1
228 . 1 . 1 22 22 MET H H 1 8.460 . . . . . . . A 22 MET H . 30213 1
229 . 1 . 1 22 22 MET HA H 1 4.262 . . . . . . . A 22 MET HA . 30213 1
230 . 1 . 1 22 22 MET HB2 H 1 2.222 . . . . . . . A 22 MET HB2 . 30213 1
231 . 1 . 1 22 22 MET HB3 H 1 2.131 . . . . . . . A 22 MET HB3 . 30213 1
232 . 1 . 1 22 22 MET HG2 H 1 2.763 . . . . . . . A 22 MET HG2 . 30213 1
233 . 1 . 1 22 22 MET HG3 H 1 2.626 . . . . . . . A 22 MET HG3 . 30213 1
234 . 1 . 1 22 22 MET CA C 13 58.119 . . . . . . . A 22 MET CA . 30213 1
235 . 1 . 1 22 22 MET CB C 13 32.052 . . . . . . . A 22 MET CB . 30213 1
236 . 1 . 1 22 22 MET CG C 13 32.271 . . . . . . . A 22 MET CG . 30213 1
237 . 1 . 1 22 22 MET N N 15 117.466 . . . . . . . A 22 MET N . 30213 1
238 . 1 . 1 23 23 ASN H H 1 7.970 . . . . . . . A 23 ASN H . 30213 1
239 . 1 . 1 23 23 ASN HA H 1 4.583 . . . . . . . A 23 ASN HA . 30213 1
240 . 1 . 1 23 23 ASN HB2 H 1 2.964 . . . . . . . A 23 ASN HB2 . 30213 1
241 . 1 . 1 23 23 ASN HB3 H 1 2.865 . . . . . . . A 23 ASN HB3 . 30213 1
242 . 1 . 1 23 23 ASN HD21 H 1 7.651 . . . . . . . A 23 ASN HD21 . 30213 1
243 . 1 . 1 23 23 ASN HD22 H 1 6.730 . . . . . . . A 23 ASN HD22 . 30213 1
244 . 1 . 1 23 23 ASN CA C 13 55.430 . . . . . . . A 23 ASN CA . 30213 1
245 . 1 . 1 23 23 ASN CB C 13 39.086 . . . . . . . A 23 ASN CB . 30213 1
246 . 1 . 1 23 23 ASN N N 15 116.363 . . . . . . . A 23 ASN N . 30213 1
247 . 1 . 1 23 23 ASN ND2 N 15 111.555 . . . . . . . A 23 ASN ND2 . 30213 1
248 . 1 . 1 24 24 LYS H H 1 7.958 . . . . . . . A 24 LYS H . 30213 1
249 . 1 . 1 24 24 LYS HA H 1 4.280 . . . . . . . A 24 LYS HA . 30213 1
250 . 1 . 1 24 24 LYS HB2 H 1 2.020 . . . . . . . A 24 LYS HB2 . 30213 1
251 . 1 . 1 24 24 LYS HB3 H 1 1.915 . . . . . . . A 24 LYS HB3 . 30213 1
252 . 1 . 1 24 24 LYS HG2 H 1 1.745 . . . . . . . A 24 LYS HG2 . 30213 1
253 . 1 . 1 24 24 LYS HG3 H 1 1.683 . . . . . . . A 24 LYS HG3 . 30213 1
254 . 1 . 1 24 24 LYS HD2 H 1 1.731 . . . . . . . A 24 LYS HD2 . 30213 1
255 . 1 . 1 24 24 LYS CA C 13 57.628 . . . . . . . A 24 LYS CA . 30213 1
256 . 1 . 1 24 24 LYS CB C 13 32.645 . . . . . . . A 24 LYS CB . 30213 1
257 . 1 . 1 24 24 LYS CG C 13 24.789 . . . . . . . A 24 LYS CG . 30213 1
258 . 1 . 1 24 24 LYS CD C 13 29.742 . . . . . . . A 24 LYS CD . 30213 1
259 . 1 . 1 24 24 LYS N N 15 119.461 . . . . . . . A 24 LYS N . 30213 1
260 . 1 . 1 25 25 LEU H H 1 8.066 . . . . . . . A 25 LEU H . 30213 1
261 . 1 . 1 25 25 LEU HA H 1 4.278 . . . . . . . A 25 LEU HA . 30213 1
262 . 1 . 1 25 25 LEU HB2 H 1 1.836 . . . . . . . A 25 LEU HB2 . 30213 1
263 . 1 . 1 25 25 LEU HB3 H 1 1.624 . . . . . . . A 25 LEU HB3 . 30213 1
264 . 1 . 1 25 25 LEU HD11 H 1 0.935 . . . . . . . A 25 LEU HD11 . 30213 1
265 . 1 . 1 25 25 LEU HD12 H 1 0.935 . . . . . . . A 25 LEU HD12 . 30213 1
266 . 1 . 1 25 25 LEU HD13 H 1 0.935 . . . . . . . A 25 LEU HD13 . 30213 1
267 . 1 . 1 25 25 LEU HD21 H 1 0.894 . . . . . . . A 25 LEU HD21 . 30213 1
268 . 1 . 1 25 25 LEU HD22 H 1 0.894 . . . . . . . A 25 LEU HD22 . 30213 1
269 . 1 . 1 25 25 LEU HD23 H 1 0.894 . . . . . . . A 25 LEU HD23 . 30213 1
270 . 1 . 1 25 25 LEU CA C 13 55.804 . . . . . . . A 25 LEU CA . 30213 1
271 . 1 . 1 25 25 LEU CB C 13 42.552 . . . . . . . A 25 LEU CB . 30213 1
272 . 1 . 1 25 25 LEU CD1 C 13 24.642 . . . . . . . A 25 LEU CD1 . 30213 1
273 . 1 . 1 25 25 LEU CD2 C 13 21.804 . . . . . . . A 25 LEU CD2 . 30213 1
274 . 1 . 1 25 25 LEU N N 15 119.553 . . . . . . . A 25 LEU N . 30213 1
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