###################################
# 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 34258
_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 $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 '3D 1H-13C NOESY aliphatic' . . . 34258 1
2 '3D 1H-15N NOESY' . . . 34258 1
3 '2D 1H-1H NOESY' . . . 34258 1
4 '2D 13C F2-filtered NOESY' . . . 34258 1
5 '2D 1H-13C HSQC aliphatic' . . . 34258 1
6 '2D 1H-13C HSQC aromatic' . . . 34258 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.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 H H 1 8.252 0.000 . 1 . . . . B 414 GLY H1 . 34258 1
2 . 1 1 1 1 GLY HA2 H 1 3.984 0.001 . 2 . . . . B 414 GLY HA2 . 34258 1
3 . 1 1 1 1 GLY HA3 H 1 3.937 0.001 . 2 . . . . B 414 GLY HA3 . 34258 1
4 . 1 1 1 1 GLY CA C 13 43.427 0.003 . 1 . . . . B 414 GLY CA . 34258 1
5 . 1 1 1 1 GLY N N 15 107.987 0.000 . 1 . . . . B 414 GLY N . 34258 1
6 . 1 1 2 2 PRO HA H 1 4.454 0.001 . 1 . . . . B 415 PRO HA . 34258 1
7 . 1 1 2 2 PRO HB2 H 1 2.276 0.000 . 2 . . . . B 415 PRO HB2 . 34258 1
8 . 1 1 2 2 PRO HB3 H 1 2.276 0.000 . 2 . . . . B 415 PRO HB3 . 34258 1
9 . 1 1 2 2 PRO HG2 H 1 1.981 0.002 . 2 . . . . B 415 PRO HG2 . 34258 1
10 . 1 1 2 2 PRO HG3 H 1 1.948 0.002 . 2 . . . . B 415 PRO HG3 . 34258 1
11 . 1 1 2 2 PRO HD2 H 1 3.546 0.004 . 2 . . . . B 415 PRO HD2 . 34258 1
12 . 1 1 2 2 PRO HD3 H 1 3.514 0.003 . 2 . . . . B 415 PRO HD3 . 34258 1
13 . 1 1 2 2 PRO CA C 13 63.064 0.139 . 1 . . . . B 415 PRO CA . 34258 1
14 . 1 1 2 2 PRO CB C 13 32.404 0.000 . 1 . . . . B 415 PRO CB . 34258 1
15 . 1 1 2 2 PRO CG C 13 26.943 0.000 . 1 . . . . B 415 PRO CG . 34258 1
16 . 1 1 2 2 PRO CD C 13 49.656 0.020 . 1 . . . . B 415 PRO CD . 34258 1
17 . 1 1 3 3 LEU H H 1 8.410 0.004 . 1 . . . . B 416 LEU H . 34258 1
18 . 1 1 3 3 LEU HA H 1 4.343 0.002 . 1 . . . . B 416 LEU HA . 34258 1
19 . 1 1 3 3 LEU HB2 H 1 1.618 0.000 . 2 . . . . B 416 LEU HB2 . 34258 1
20 . 1 1 3 3 LEU HB3 H 1 1.538 0.001 . 2 . . . . B 416 LEU HB3 . 34258 1
21 . 1 1 3 3 LEU HG H 1 1.590 0.001 . 1 . . . . B 416 LEU HG . 34258 1
22 . 1 1 3 3 LEU HD11 H 1 0.876 0.000 . 2 . . . . B 416 LEU HD11 . 34258 1
23 . 1 1 3 3 LEU HD12 H 1 0.876 0.000 . 2 . . . . B 416 LEU HD12 . 34258 1
24 . 1 1 3 3 LEU HD13 H 1 0.876 0.000 . 2 . . . . B 416 LEU HD13 . 34258 1
25 . 1 1 3 3 LEU HD21 H 1 0.851 0.008 . 2 . . . . B 416 LEU HD21 . 34258 1
26 . 1 1 3 3 LEU HD22 H 1 0.851 0.008 . 2 . . . . B 416 LEU HD22 . 34258 1
27 . 1 1 3 3 LEU HD23 H 1 0.851 0.008 . 2 . . . . B 416 LEU HD23 . 34258 1
28 . 1 1 3 3 LEU CA C 13 55.209 0.017 . 1 . . . . B 416 LEU CA . 34258 1
29 . 1 1 3 3 LEU CB C 13 42.534 0.070 . 1 . . . . B 416 LEU CB . 34258 1
30 . 1 1 3 3 LEU CG C 13 27.145 0.082 . 1 . . . . B 416 LEU CG . 34258 1
31 . 1 1 3 3 LEU CD1 C 13 25.107 0.010 . 2 . . . . B 416 LEU CD1 . 34258 1
32 . 1 1 3 3 LEU CD2 C 13 23.633 0.003 . 2 . . . . B 416 LEU CD2 . 34258 1
33 . 1 1 3 3 LEU N N 15 121.829 0.006 . 1 . . . . B 416 LEU N . 34258 1
34 . 1 1 4 4 GLY H H 1 8.388 0.002 . 1 . . . . B 417 GLY H . 34258 1
35 . 1 1 4 4 GLY HA2 H 1 3.966 0.002 . 2 . . . . B 417 GLY HA2 . 34258 1
36 . 1 1 4 4 GLY HA3 H 1 3.966 0.002 . 2 . . . . B 417 GLY HA3 . 34258 1
37 . 1 1 4 4 GLY CA C 13 45.230 0.000 . 1 . . . . B 417 GLY CA . 34258 1
38 . 1 1 4 4 GLY N N 15 109.939 0.001 . 1 . . . . B 417 GLY N . 34258 1
39 . 1 1 5 5 SER H H 1 8.311 0.000 . 1 . . . . B 418 SER H . 34258 1
40 . 1 1 5 5 SER HA H 1 4.378 0.001 . 1 . . . . B 418 SER HA . 34258 1
41 . 1 1 5 5 SER HB2 H 1 3.899 0.003 . 2 . . . . B 418 SER HB2 . 34258 1
42 . 1 1 5 5 SER HB3 H 1 3.845 0.002 . 2 . . . . B 418 SER HB3 . 34258 1
43 . 1 1 5 5 SER CA C 13 58.889 0.005 . 1 . . . . B 418 SER CA . 34258 1
44 . 1 1 5 5 SER CB C 13 63.775 0.027 . 1 . . . . B 418 SER CB . 34258 1
45 . 1 1 5 5 SER N N 15 115.903 0.013 . 1 . . . . B 418 SER N . 34258 1
46 . 1 1 6 6 GLY H H 1 8.498 0.002 . 1 . . . . B 419 GLY H . 34258 1
47 . 1 1 6 6 GLY HA2 H 1 3.957 0.001 . 2 . . . . B 419 GLY HA2 . 34258 1
48 . 1 1 6 6 GLY HA3 H 1 3.957 0.001 . 2 . . . . B 419 GLY HA3 . 34258 1
49 . 1 1 6 6 GLY CA C 13 45.514 0.000 . 1 . . . . B 419 GLY CA . 34258 1
50 . 1 1 6 6 GLY N N 15 110.841 0.005 . 1 . . . . B 419 GLY N . 34258 1
51 . 1 1 7 7 GLN H H 1 8.087 0.001 . 1 . . . . B 420 GLN H . 34258 1
52 . 1 1 7 7 GLN HA H 1 4.347 0.003 . 1 . . . . B 420 GLN HA . 34258 1
53 . 1 1 7 7 GLN HB2 H 1 2.109 0.001 . 2 . . . . B 420 GLN HB2 . 34258 1
54 . 1 1 7 7 GLN HB3 H 1 1.938 0.002 . 2 . . . . B 420 GLN HB3 . 34258 1
55 . 1 1 7 7 GLN HG2 H 1 2.288 0.002 . 2 . . . . B 420 GLN HG2 . 34258 1
56 . 1 1 7 7 GLN HG3 H 1 2.288 0.002 . 2 . . . . B 420 GLN HG3 . 34258 1
57 . 1 1 7 7 GLN HE21 H 1 7.487 0.010 . 2 . . . . B 420 GLN HE21 . 34258 1
58 . 1 1 7 7 GLN HE22 H 1 6.835 0.001 . 2 . . . . B 420 GLN HE22 . 34258 1
59 . 1 1 7 7 GLN CA C 13 55.635 0.031 . 1 . . . . B 420 GLN CA . 34258 1
60 . 1 1 7 7 GLN CB C 13 29.869 0.070 . 1 . . . . B 420 GLN CB . 34258 1
61 . 1 1 7 7 GLN CG C 13 33.837 0.080 . 1 . . . . B 420 GLN CG . 34258 1
62 . 1 1 7 7 GLN N N 15 119.264 0.007 . 1 . . . . B 420 GLN N . 34258 1
63 . 1 1 7 7 GLN NE2 N 15 112.333 0.011 . 1 . . . . B 420 GLN NE2 . 34258 1
64 . 1 1 8 8 GLN H H 1 8.250 0.002 . 1 . . . . B 421 GLN H . 34258 1
65 . 1 1 8 8 GLN HA H 1 4.316 0.002 . 1 . . . . B 421 GLN HA . 34258 1
66 . 1 1 8 8 GLN HB2 H 1 2.021 0.002 . 2 . . . . B 421 GLN HB2 . 34258 1
67 . 1 1 8 8 GLN HB3 H 1 1.974 0.004 . 2 . . . . B 421 GLN HB3 . 34258 1
68 . 1 1 8 8 GLN HG2 H 1 2.381 0.002 . 2 . . . . B 421 GLN HG2 . 34258 1
69 . 1 1 8 8 GLN HG3 H 1 2.329 0.007 . 2 . . . . B 421 GLN HG3 . 34258 1
70 . 1 1 8 8 GLN HE21 H 1 7.511 0.001 . 2 . . . . B 421 GLN HE21 . 34258 1
71 . 1 1 8 8 GLN HE22 H 1 6.764 0.000 . 2 . . . . B 421 GLN HE22 . 34258 1
72 . 1 1 8 8 GLN CA C 13 56.038 0.005 . 1 . . . . B 421 GLN CA . 34258 1
73 . 1 1 8 8 GLN CB C 13 29.930 0.067 . 1 . . . . B 421 GLN CB . 34258 1
74 . 1 1 8 8 GLN CG C 13 33.835 0.083 . 1 . . . . B 421 GLN CG . 34258 1
75 . 1 1 8 8 GLN N N 15 121.714 0.002 . 1 . . . . B 421 GLN N . 34258 1
76 . 1 1 8 8 GLN NE2 N 15 111.523 0.008 . 1 . . . . B 421 GLN NE2 . 34258 1
77 . 1 1 9 9 ARG H H 1 8.633 0.002 . 1 . . . . B 422 ARG H . 34258 1
78 . 1 1 9 9 ARG HA H 1 4.495 0.064 . 1 . . . . B 422 ARG HA . 34258 1
79 . 1 1 9 9 ARG HB2 H 1 1.824 0.006 . 2 . . . . B 422 ARG HB2 . 34258 1
80 . 1 1 9 9 ARG HB3 H 1 1.682 0.004 . 2 . . . . B 422 ARG HB3 . 34258 1
81 . 1 1 9 9 ARG HG2 H 1 1.520 0.003 . 2 . . . . B 422 ARG HG2 . 34258 1
82 . 1 1 9 9 ARG HG3 H 1 1.486 0.001 . 2 . . . . B 422 ARG HG3 . 34258 1
83 . 1 1 9 9 ARG HD2 H 1 2.942 0.002 . 2 . . . . B 422 ARG HD2 . 34258 1
84 . 1 1 9 9 ARG HD3 H 1 2.503 0.003 . 2 . . . . B 422 ARG HD3 . 34258 1
85 . 1 1 9 9 ARG CA C 13 55.236 0.607 . 1 . . . . B 422 ARG CA . 34258 1
86 . 1 1 9 9 ARG CB C 13 32.940 0.037 . 1 . . . . B 422 ARG CB . 34258 1
87 . 1 1 9 9 ARG CG C 13 26.848 0.062 . 1 . . . . B 422 ARG CG . 34258 1
88 . 1 1 9 9 ARG CD C 13 43.644 0.054 . 1 . . . . B 422 ARG CD . 34258 1
89 . 1 1 9 9 ARG N N 15 123.434 0.005 . 1 . . . . B 422 ARG N . 34258 1
90 . 1 1 10 10 ALA H H 1 8.526 0.001 . 1 . . . . B 423 ALA H . 34258 1
91 . 1 1 10 10 ALA HA H 1 4.138 0.001 . 1 . . . . B 423 ALA HA . 34258 1
92 . 1 1 10 10 ALA HB1 H 1 1.359 0.001 . 1 . . . . B 423 ALA HB1 . 34258 1
93 . 1 1 10 10 ALA HB2 H 1 1.359 0.001 . 1 . . . . B 423 ALA HB2 . 34258 1
94 . 1 1 10 10 ALA HB3 H 1 1.359 0.001 . 1 . . . . B 423 ALA HB3 . 34258 1
95 . 1 1 10 10 ALA CA C 13 53.808 0.026 . 1 . . . . B 423 ALA CA . 34258 1
96 . 1 1 10 10 ALA CB C 13 18.067 0.017 . 1 . . . . B 423 ALA CB . 34258 1
97 . 1 1 10 10 ALA N N 15 125.627 0.005 . 1 . . . . B 423 ALA N . 34258 1
98 . 1 1 11 11 GLY H H 1 8.621 0.001 . 1 . . . . B 424 GLY H . 34258 1
99 . 1 1 11 11 GLY HA2 H 1 4.243 0.005 . 2 . . . . B 424 GLY HA2 . 34258 1
100 . 1 1 11 11 GLY HA3 H 1 3.802 0.002 . 2 . . . . B 424 GLY HA3 . 34258 1
101 . 1 1 11 11 GLY CA C 13 44.966 0.012 . 1 . . . . B 424 GLY CA . 34258 1
102 . 1 1 11 11 GLY N N 15 109.766 0.008 . 1 . . . . B 424 GLY N . 34258 1
103 . 1 1 12 12 ASP H H 1 7.819 0.002 . 1 . . . . B 425 ASP H . 34258 1
104 . 1 1 12 12 ASP HA H 1 4.773 0.001 . 1 . . . . B 425 ASP HA . 34258 1
105 . 1 1 12 12 ASP HB2 H 1 2.685 0.002 . 2 . . . . B 425 ASP HB2 . 34258 1
106 . 1 1 12 12 ASP HB3 H 1 2.629 0.001 . 2 . . . . B 425 ASP HB3 . 34258 1
107 . 1 1 12 12 ASP CA C 13 55.940 0.009 . 1 . . . . B 425 ASP CA . 34258 1
108 . 1 1 12 12 ASP CB C 13 40.527 0.026 . 1 . . . . B 425 ASP CB . 34258 1
109 . 1 1 12 12 ASP N N 15 123.548 0.012 . 1 . . . . B 425 ASP N . 34258 1
110 . 1 1 13 13 TRP H H 1 8.821 0.007 . 1 . . . . B 426 TRP H . 34258 1
111 . 1 1 13 13 TRP HA H 1 5.112 0.001 . 1 . . . . B 426 TRP HA . 34258 1
112 . 1 1 13 13 TRP HB2 H 1 3.183 0.001 . 1 . . . . B 426 TRP HB2 . 34258 1
113 . 1 1 13 13 TRP HB3 H 1 3.018 0.002 . 1 . . . . B 426 TRP HB3 . 34258 1
114 . 1 1 13 13 TRP HD1 H 1 7.218 0.000 . 1 . . . . B 426 TRP HD1 . 34258 1
115 . 1 1 13 13 TRP HE1 H 1 9.671 0.001 . 1 . . . . B 426 TRP HE1 . 34258 1
116 . 1 1 13 13 TRP HE3 H 1 7.350 0.000 . 3 . . . . B 426 TRP HE3 . 34258 1
117 . 1 1 13 13 TRP HZ2 H 1 6.499 0.001 . 3 . . . . B 426 TRP HZ2 . 34258 1
118 . 1 1 13 13 TRP HZ3 H 1 6.947 0.000 . 1 . . . . B 426 TRP HZ3 . 34258 1
119 . 1 1 13 13 TRP HH2 H 1 6.953 0.000 . 1 . . . . B 426 TRP HH2 . 34258 1
120 . 1 1 13 13 TRP CA C 13 53.499 0.007 . 1 . . . . B 426 TRP CA . 34258 1
121 . 1 1 13 13 TRP CB C 13 31.248 0.007 . 1 . . . . B 426 TRP CB . 34258 1
122 . 1 1 13 13 TRP CD1 C 13 128.270 0.000 . 1 . . . . B 426 TRP CD1 . 34258 1
123 . 1 1 13 13 TRP CE3 C 13 120.822 0.000 . 3 . . . . B 426 TRP CE3 . 34258 1
124 . 1 1 13 13 TRP CZ2 C 13 113.607 0.000 . 3 . . . . B 426 TRP CZ2 . 34258 1
125 . 1 1 13 13 TRP CZ3 C 13 120.729 0.000 . 1 . . . . B 426 TRP CZ3 . 34258 1
126 . 1 1 13 13 TRP CH2 C 13 123.941 0.000 . 1 . . . . B 426 TRP CH2 . 34258 1
127 . 1 1 13 13 TRP N N 15 119.258 0.011 . 1 . . . . B 426 TRP N . 34258 1
128 . 1 1 13 13 TRP NE1 N 15 130.405 0.015 . 1 . . . . B 426 TRP NE1 . 34258 1
129 . 1 1 14 14 LYS H H 1 8.831 0.000 . 1 . . . . B 427 LYS H . 34258 1
130 . 1 1 14 14 LYS HA H 1 4.430 0.002 . 1 . . . . B 427 LYS HA . 34258 1
131 . 1 1 14 14 LYS HB2 H 1 1.555 0.004 . 2 . . . . B 427 LYS HB2 . 34258 1
132 . 1 1 14 14 LYS HB3 H 1 1.725 0.002 . 2 . . . . B 427 LYS HB3 . 34258 1
133 . 1 1 14 14 LYS HG2 H 1 1.349 0.009 . 2 . . . . B 427 LYS HG2 . 34258 1
134 . 1 1 14 14 LYS HG3 H 1 1.164 0.001 . 2 . . . . B 427 LYS HG3 . 34258 1
135 . 1 1 14 14 LYS HD2 H 1 1.593 0.001 . 2 . . . . B 427 LYS HD2 . 34258 1
136 . 1 1 14 14 LYS HD3 H 1 1.593 0.001 . 2 . . . . B 427 LYS HD3 . 34258 1
137 . 1 1 14 14 LYS HE2 H 1 2.911 0.001 . 2 . . . . B 427 LYS HE2 . 34258 1
138 . 1 1 14 14 LYS HE3 H 1 2.911 0.001 . 2 . . . . B 427 LYS HE3 . 34258 1
139 . 1 1 14 14 LYS CA C 13 55.460 0.000 . 1 . . . . B 427 LYS CA . 34258 1
140 . 1 1 14 14 LYS CB C 13 33.285 0.016 . 1 . . . . B 427 LYS CB . 34258 1
141 . 1 1 14 14 LYS CG C 13 23.999 0.027 . 1 . . . . B 427 LYS CG . 34258 1
142 . 1 1 14 14 LYS CD C 13 29.241 0.005 . 1 . . . . B 427 LYS CD . 34258 1
143 . 1 1 14 14 LYS CE C 13 41.855 0.139 . 1 . . . . B 427 LYS CE . 34258 1
144 . 1 1 14 14 LYS N N 15 126.429 0.003 . 1 . . . . B 427 LYS N . 34258 1
145 . 1 1 15 15 CYS H H 1 8.881 0.001 . 1 . . . . B 428 CYS H . 34258 1
146 . 1 1 15 15 CYS HA H 1 4.575 0.005 . 1 . . . . B 428 CYS HA . 34258 1
147 . 1 1 15 15 CYS HB2 H 1 2.820 0.001 . 2 . . . . B 428 CYS HB2 . 34258 1
148 . 1 1 15 15 CYS HB3 H 1 2.776 0.001 . 2 . . . . B 428 CYS HB3 . 34258 1
149 . 1 1 15 15 CYS CA C 13 57.643 0.023 . 1 . . . . B 428 CYS CA . 34258 1
150 . 1 1 15 15 CYS CB C 13 32.135 0.004 . 1 . . . . B 428 CYS CB . 34258 1
151 . 1 1 15 15 CYS N N 15 132.034 0.007 . 1 . . . . B 428 CYS N . 34258 1
152 . 1 1 16 16 PRO HA H 1 4.570 0.006 . 1 . . . . B 429 PRO HA . 34258 1
153 . 1 1 16 16 PRO HB2 H 1 2.155 0.000 . 2 . . . . B 429 PRO HB2 . 34258 1
154 . 1 1 16 16 PRO HB3 H 1 2.216 0.000 . 2 . . . . B 429 PRO HB3 . 34258 1
155 . 1 1 16 16 PRO HG2 H 1 1.956 0.006 . 2 . . . . B 429 PRO HG2 . 34258 1
156 . 1 1 16 16 PRO HG3 H 1 2.106 0.001 . 2 . . . . B 429 PRO HG3 . 34258 1
157 . 1 1 16 16 PRO HD2 H 1 4.681 0.003 . 2 . . . . B 429 PRO HD2 . 34258 1
158 . 1 1 16 16 PRO HD3 H 1 3.870 0.001 . 2 . . . . B 429 PRO HD3 . 34258 1
159 . 1 1 16 16 PRO CA C 13 63.254 0.037 . 1 . . . . B 429 PRO CA . 34258 1
160 . 1 1 16 16 PRO CB C 13 32.094 0.014 . 1 . . . . B 429 PRO CB . 34258 1
161 . 1 1 16 16 PRO CG C 13 26.385 0.044 . 1 . . . . B 429 PRO CG . 34258 1
162 . 1 1 16 16 PRO CD C 13 51.688 0.019 . 1 . . . . B 429 PRO CD . 34258 1
163 . 1 1 17 17 ASN H H 1 9.267 0.001 . 1 . . . . B 430 ASN H . 34258 1
164 . 1 1 17 17 ASN HA H 1 4.883 0.002 . 1 . . . . B 430 ASN HA . 34258 1
165 . 1 1 17 17 ASN HB2 H 1 3.921 0.001 . 2 . . . . B 430 ASN HB2 . 34258 1
166 . 1 1 17 17 ASN HB3 H 1 2.785 0.003 . 2 . . . . B 430 ASN HB3 . 34258 1
167 . 1 1 17 17 ASN HD21 H 1 7.977 0.002 . 2 . . . . B 430 ASN HD21 . 34258 1
168 . 1 1 17 17 ASN HD22 H 1 6.844 0.003 . 2 . . . . B 430 ASN HD22 . 34258 1
169 . 1 1 17 17 ASN CA C 13 50.959 0.019 . 1 . . . . B 430 ASN CA . 34258 1
170 . 1 1 17 17 ASN CB C 13 38.881 0.008 . 1 . . . . B 430 ASN CB . 34258 1
171 . 1 1 17 17 ASN N N 15 126.554 0.003 . 1 . . . . B 430 ASN N . 34258 1
172 . 1 1 17 17 ASN ND2 N 15 113.133 0.001 . 1 . . . . B 430 ASN ND2 . 34258 1
173 . 1 1 18 18 PRO HA H 1 4.423 0.003 . 1 . . . . B 431 PRO HA . 34258 1
174 . 1 1 18 18 PRO HB2 H 1 1.993 0.003 . 2 . . . . B 431 PRO HB2 . 34258 1
175 . 1 1 18 18 PRO HB3 H 1 2.358 0.001 . 2 . . . . B 431 PRO HB3 . 34258 1
176 . 1 1 18 18 PRO HG2 H 1 1.992 0.000 . 2 . . . . B 431 PRO HG2 . 34258 1
177 . 1 1 18 18 PRO HG3 H 1 2.074 0.004 . 2 . . . . B 431 PRO HG3 . 34258 1
178 . 1 1 18 18 PRO HD2 H 1 4.037 0.001 . 2 . . . . B 431 PRO HD2 . 34258 1
179 . 1 1 18 18 PRO HD3 H 1 4.220 0.000 . 2 . . . . B 431 PRO HD3 . 34258 1
180 . 1 1 18 18 PRO CA C 13 64.512 0.017 . 1 . . . . B 431 PRO CA . 34258 1
181 . 1 1 18 18 PRO CB C 13 32.442 0.020 . 1 . . . . B 431 PRO CB . 34258 1
182 . 1 1 18 18 PRO CG C 13 27.043 0.044 . 1 . . . . B 431 PRO CG . 34258 1
183 . 1 1 18 18 PRO CD C 13 51.460 0.006 . 1 . . . . B 431 PRO CD . 34258 1
184 . 1 1 19 19 THR H H 1 7.430 0.008 . 1 . . . . B 432 THR H . 34258 1
185 . 1 1 19 19 THR HA H 1 4.297 0.003 . 1 . . . . B 432 THR HA . 34258 1
186 . 1 1 19 19 THR HB H 1 4.363 0.001 . 1 . . . . B 432 THR HB . 34258 1
187 . 1 1 19 19 THR HG21 H 1 1.147 0.000 . 1 . . . . B 432 THR HG21 . 34258 1
188 . 1 1 19 19 THR HG22 H 1 1.147 0.000 . 1 . . . . B 432 THR HG22 . 34258 1
189 . 1 1 19 19 THR HG23 H 1 1.147 0.000 . 1 . . . . B 432 THR HG23 . 34258 1
190 . 1 1 19 19 THR CA C 13 61.639 0.001 . 1 . . . . B 432 THR CA . 34258 1
191 . 1 1 19 19 THR CB C 13 68.742 0.063 . 1 . . . . B 432 THR CB . 34258 1
192 . 1 1 19 19 THR CG2 C 13 21.760 0.000 . 1 . . . . B 432 THR CG2 . 34258 1
193 . 1 1 19 19 THR N N 15 107.075 0.010 . 1 . . . . B 432 THR N . 34258 1
194 . 1 1 20 20 CYS H H 1 7.992 0.004 . 1 . . . . B 433 CYS H . 34258 1
195 . 1 1 20 20 CYS HA H 1 4.320 0.002 . 1 . . . . B 433 CYS HA . 34258 1
196 . 1 1 20 20 CYS HB2 H 1 2.540 0.001 . 2 . . . . B 433 CYS HB2 . 34258 1
197 . 1 1 20 20 CYS HB3 H 1 3.109 0.001 . 2 . . . . B 433 CYS HB3 . 34258 1
198 . 1 1 20 20 CYS CA C 13 60.097 0.039 . 1 . . . . B 433 CYS CA . 34258 1
199 . 1 1 20 20 CYS CB C 13 32.292 0.058 . 1 . . . . B 433 CYS CB . 34258 1
200 . 1 1 20 20 CYS N N 15 125.510 0.002 . 1 . . . . B 433 CYS N . 34258 1
201 . 1 1 21 21 GLU H H 1 7.668 0.002 . 1 . . . . B 434 GLU H . 34258 1
202 . 1 1 21 21 GLU HA H 1 4.117 0.003 . 1 . . . . B 434 GLU HA . 34258 1
203 . 1 1 21 21 GLU HB2 H 1 2.101 0.002 . 2 . . . . B 434 GLU HB2 . 34258 1
204 . 1 1 21 21 GLU HB3 H 1 2.041 0.000 . 2 . . . . B 434 GLU HB3 . 34258 1
205 . 1 1 21 21 GLU HG2 H 1 2.008 0.000 . 2 . . . . B 434 GLU HG2 . 34258 1
206 . 1 1 21 21 GLU HG3 H 1 2.175 0.000 . 2 . . . . B 434 GLU HG3 . 34258 1
207 . 1 1 21 21 GLU CA C 13 57.887 0.013 . 1 . . . . B 434 GLU CA . 34258 1
208 . 1 1 21 21 GLU CB C 13 27.958 0.123 . 1 . . . . B 434 GLU CB . 34258 1
209 . 1 1 21 21 GLU CG C 13 37.351 0.022 . 1 . . . . B 434 GLU CG . 34258 1
210 . 1 1 21 21 GLU N N 15 109.352 0.036 . 1 . . . . B 434 GLU N . 34258 1
211 . 1 1 22 22 ASN H H 1 8.486 0.002 . 1 . . . . B 435 ASN H . 34258 1
212 . 1 1 22 22 ASN HA H 1 4.196 0.001 . 1 . . . . B 435 ASN HA . 34258 1
213 . 1 1 22 22 ASN HB2 H 1 2.739 0.004 . 2 . . . . B 435 ASN HB2 . 34258 1
214 . 1 1 22 22 ASN HB3 H 1 2.532 0.001 . 2 . . . . B 435 ASN HB3 . 34258 1
215 . 1 1 22 22 ASN HD21 H 1 6.639 0.001 . 2 . . . . B 435 ASN HD21 . 34258 1
216 . 1 1 22 22 ASN HD22 H 1 6.639 0.001 . 2 . . . . B 435 ASN HD22 . 34258 1
217 . 1 1 22 22 ASN CA C 13 54.819 0.011 . 1 . . . . B 435 ASN CA . 34258 1
218 . 1 1 22 22 ASN CB C 13 40.864 0.020 . 1 . . . . B 435 ASN CB . 34258 1
219 . 1 1 22 22 ASN N N 15 119.518 0.004 . 1 . . . . B 435 ASN N . 34258 1
220 . 1 1 22 22 ASN ND2 N 15 113.998 0.033 . 1 . . . . B 435 ASN ND2 . 34258 1
221 . 1 1 23 23 MET H H 1 8.163 0.004 . 1 . . . . B 436 MET H . 34258 1
222 . 1 1 23 23 MET HA H 1 4.710 0.002 . 1 . . . . B 436 MET HA . 34258 1
223 . 1 1 23 23 MET HB2 H 1 1.896 0.002 . 2 . . . . B 436 MET HB2 . 34258 1
224 . 1 1 23 23 MET HB3 H 1 1.896 0.002 . 2 . . . . B 436 MET HB3 . 34258 1
225 . 1 1 23 23 MET HG2 H 1 2.495 0.004 . 2 . . . . B 436 MET HG2 . 34258 1
226 . 1 1 23 23 MET HG3 H 1 2.354 0.003 . 2 . . . . B 436 MET HG3 . 34258 1
227 . 1 1 23 23 MET HE1 H 1 1.886 0.007 . 1 . . . . B 436 MET HE1 . 34258 1
228 . 1 1 23 23 MET HE2 H 1 1.886 0.007 . 1 . . . . B 436 MET HE2 . 34258 1
229 . 1 1 23 23 MET HE3 H 1 1.886 0.007 . 1 . . . . B 436 MET HE3 . 34258 1
230 . 1 1 23 23 MET CA C 13 52.941 0.012 . 1 . . . . B 436 MET CA . 34258 1
231 . 1 1 23 23 MET CB C 13 29.749 0.047 . 1 . . . . B 436 MET CB . 34258 1
232 . 1 1 23 23 MET CG C 13 31.598 0.036 . 1 . . . . B 436 MET CG . 34258 1
233 . 1 1 23 23 MET CE C 13 15.477 0.000 . 1 . . . . B 436 MET CE . 34258 1
234 . 1 1 23 23 MET N N 15 122.925 0.006 . 1 . . . . B 436 MET N . 34258 1
235 . 1 1 24 24 ASN H H 1 9.048 0.002 . 1 . . . . B 437 ASN H . 34258 1
236 . 1 1 24 24 ASN HA H 1 4.543 0.006 . 1 . . . . B 437 ASN HA . 34258 1
237 . 1 1 24 24 ASN HB2 H 1 0.387 0.002 . 2 . . . . B 437 ASN HB2 . 34258 1
238 . 1 1 24 24 ASN HB3 H 1 1.262 0.001 . 2 . . . . B 437 ASN HB3 . 34258 1
239 . 1 1 24 24 ASN HD21 H 1 4.303 0.001 . 2 . . . . B 437 ASN HD21 . 34258 1
240 . 1 1 24 24 ASN HD22 H 1 6.897 0.002 . 2 . . . . B 437 ASN HD22 . 34258 1
241 . 1 1 24 24 ASN CA C 13 53.704 0.050 . 1 . . . . B 437 ASN CA . 34258 1
242 . 1 1 24 24 ASN CB C 13 41.499 0.023 . 1 . . . . B 437 ASN CB . 34258 1
243 . 1 1 24 24 ASN N N 15 126.935 0.024 . 1 . . . . B 437 ASN N . 34258 1
244 . 1 1 24 24 ASN ND2 N 15 113.310 0.007 . 1 . . . . B 437 ASN ND2 . 34258 1
245 . 1 1 25 25 PHE H H 1 7.612 0.003 . 1 . . . . B 438 PHE H . 34258 1
246 . 1 1 25 25 PHE HA H 1 4.466 0.005 . 1 . . . . B 438 PHE HA . 34258 1
247 . 1 1 25 25 PHE HB2 H 1 2.529 0.004 . 2 . . . . B 438 PHE HB2 . 34258 1
248 . 1 1 25 25 PHE HB3 H 1 1.537 0.002 . 2 . . . . B 438 PHE HB3 . 34258 1
249 . 1 1 25 25 PHE HD1 H 1 6.394 0.003 . 3 . . . . B 438 PHE HD1 . 34258 1
250 . 1 1 25 25 PHE HD2 H 1 6.394 0.003 . 3 . . . . B 438 PHE HD2 . 34258 1
251 . 1 1 25 25 PHE HE1 H 1 6.603 0.006 . 3 . . . . B 438 PHE HE1 . 34258 1
252 . 1 1 25 25 PHE HE2 H 1 6.603 0.006 . 3 . . . . B 438 PHE HE2 . 34258 1
253 . 1 1 25 25 PHE HZ H 1 6.374 0.000 . 1 . . . . B 438 PHE HZ . 34258 1
254 . 1 1 25 25 PHE CA C 13 53.679 0.025 . 1 . . . . B 438 PHE CA . 34258 1
255 . 1 1 25 25 PHE CB C 13 35.640 0.077 . 1 . . . . B 438 PHE CB . 34258 1
256 . 1 1 25 25 PHE CD1 C 13 128.034 0.000 . 3 . . . . B 438 PHE CD1 . 34258 1
257 . 1 1 25 25 PHE CE1 C 13 129.762 0.000 . 3 . . . . B 438 PHE CE1 . 34258 1
258 . 1 1 25 25 PHE N N 15 119.476 0.017 . 1 . . . . B 438 PHE N . 34258 1
259 . 1 1 26 26 SER H H 1 8.475 0.003 . 1 . . . . B 439 SER H . 34258 1
260 . 1 1 26 26 SER HA H 1 4.250 0.002 . 1 . . . . B 439 SER HA . 34258 1
261 . 1 1 26 26 SER HB2 H 1 4.145 0.001 . 2 . . . . B 439 SER HB2 . 34258 1
262 . 1 1 26 26 SER HB3 H 1 3.890 0.002 . 2 . . . . B 439 SER HB3 . 34258 1
263 . 1 1 26 26 SER CA C 13 61.284 0.004 . 1 . . . . B 439 SER CA . 34258 1
264 . 1 1 26 26 SER CB C 13 63.915 0.006 . 1 . . . . B 439 SER CB . 34258 1
265 . 1 1 26 26 SER N N 15 116.410 0.005 . 1 . . . . B 439 SER N . 34258 1
266 . 1 1 27 27 TRP H H 1 6.772 0.001 . 1 . . . . B 440 TRP H . 34258 1
267 . 1 1 27 27 TRP HA H 1 4.615 0.002 . 1 . . . . B 440 TRP HA . 34258 1
268 . 1 1 27 27 TRP HB2 H 1 3.690 0.003 . 2 . . . . B 440 TRP HB2 . 34258 1
269 . 1 1 27 27 TRP HB3 H 1 3.175 0.002 . 2 . . . . B 440 TRP HB3 . 34258 1
270 . 1 1 27 27 TRP HD1 H 1 7.505 0.004 . 1 . . . . B 440 TRP HD1 . 34258 1
271 . 1 1 27 27 TRP HE1 H 1 10.315 0.002 . 1 . . . . B 440 TRP HE1 . 34258 1
272 . 1 1 27 27 TRP HE3 H 1 7.331 0.001 . 3 . . . . B 440 TRP HE3 . 34258 1
273 . 1 1 27 27 TRP HZ2 H 1 7.444 0.000 . 3 . . . . B 440 TRP HZ2 . 34258 1
274 . 1 1 27 27 TRP HZ3 H 1 7.126 0.000 . 1 . . . . B 440 TRP HZ3 . 34258 1
275 . 1 1 27 27 TRP HH2 H 1 7.207 0.000 . 1 . . . . B 440 TRP HH2 . 34258 1
276 . 1 1 27 27 TRP CA C 13 54.231 0.010 . 1 . . . . B 440 TRP CA . 34258 1
277 . 1 1 27 27 TRP CB C 13 28.859 0.029 . 1 . . . . B 440 TRP CB . 34258 1
278 . 1 1 27 27 TRP CD1 C 13 128.672 0.000 . 1 . . . . B 440 TRP CD1 . 34258 1
279 . 1 1 27 27 TRP CE3 C 13 121.454 0.000 . 3 . . . . B 440 TRP CE3 . 34258 1
280 . 1 1 27 27 TRP CZ2 C 13 114.569 0.000 . 3 . . . . B 440 TRP CZ2 . 34258 1
281 . 1 1 27 27 TRP CZ3 C 13 122.661 0.000 . 1 . . . . B 440 TRP CZ3 . 34258 1
282 . 1 1 27 27 TRP CH2 C 13 125.398 0.000 . 1 . . . . B 440 TRP CH2 . 34258 1
283 . 1 1 27 27 TRP N N 15 116.053 0.009 . 1 . . . . B 440 TRP N . 34258 1
284 . 1 1 27 27 TRP NE1 N 15 131.637 0.013 . 1 . . . . B 440 TRP NE1 . 34258 1
285 . 1 1 28 28 ARG H H 1 7.933 0.001 . 1 . . . . B 441 ARG H . 34258 1
286 . 1 1 28 28 ARG HA H 1 4.319 0.001 . 1 . . . . B 441 ARG HA . 34258 1
287 . 1 1 28 28 ARG HB2 H 1 1.790 0.002 . 2 . . . . B 441 ARG HB2 . 34258 1
288 . 1 1 28 28 ARG HB3 H 1 1.923 0.002 . 2 . . . . B 441 ARG HB3 . 34258 1
289 . 1 1 28 28 ARG HG2 H 1 1.094 0.004 . 2 . . . . B 441 ARG HG2 . 34258 1
290 . 1 1 28 28 ARG HG3 H 1 0.531 0.002 . 2 . . . . B 441 ARG HG3 . 34258 1
291 . 1 1 28 28 ARG HD2 H 1 3.010 0.003 . 2 . . . . B 441 ARG HD2 . 34258 1
292 . 1 1 28 28 ARG HD3 H 1 2.906 0.003 . 2 . . . . B 441 ARG HD3 . 34258 1
293 . 1 1 28 28 ARG HE H 1 7.562 0.001 . 1 . . . . B 441 ARG HE . 34258 1
294 . 1 1 28 28 ARG CA C 13 58.040 0.046 . 1 . . . . B 441 ARG CA . 34258 1
295 . 1 1 28 28 ARG CB C 13 30.007 0.036 . 1 . . . . B 441 ARG CB . 34258 1
296 . 1 1 28 28 ARG CG C 13 28.305 0.036 . 1 . . . . B 441 ARG CG . 34258 1
297 . 1 1 28 28 ARG CD C 13 42.713 0.038 . 1 . . . . B 441 ARG CD . 34258 1
298 . 1 1 28 28 ARG N N 15 122.094 0.003 . 1 . . . . B 441 ARG N . 34258 1
299 . 1 1 28 28 ARG NE N 15 82.696 0.009 . 1 . . . . B 441 ARG NE . 34258 1
300 . 1 1 29 29 ASN H H 1 9.185 0.003 . 1 . . . . B 442 ASN H . 34258 1
301 . 1 1 29 29 ASN HA H 1 4.816 0.004 . 1 . . . . B 442 ASN HA . 34258 1
302 . 1 1 29 29 ASN HB2 H 1 2.907 0.004 . 2 . . . . B 442 ASN HB2 . 34258 1
303 . 1 1 29 29 ASN HB3 H 1 2.811 0.002 . 2 . . . . B 442 ASN HB3 . 34258 1
304 . 1 1 29 29 ASN HD21 H 1 7.629 0.004 . 2 . . . . B 442 ASN HD21 . 34258 1
305 . 1 1 29 29 ASN HD22 H 1 6.910 0.002 . 2 . . . . B 442 ASN HD22 . 34258 1
306 . 1 1 29 29 ASN CA C 13 53.354 0.015 . 1 . . . . B 442 ASN CA . 34258 1
307 . 1 1 29 29 ASN CB C 13 39.379 0.072 . 1 . . . . B 442 ASN CB . 34258 1
308 . 1 1 29 29 ASN N N 15 119.651 0.012 . 1 . . . . B 442 ASN N . 34258 1
309 . 1 1 29 29 ASN ND2 N 15 112.947 0.003 . 1 . . . . B 442 ASN ND2 . 34258 1
310 . 1 1 30 30 GLU H H 1 7.659 0.002 . 1 . . . . B 443 GLU H . 34258 1
311 . 1 1 30 30 GLU HA H 1 5.126 0.002 . 1 . . . . B 443 GLU HA . 34258 1
312 . 1 1 30 30 GLU HB2 H 1 1.910 0.001 . 2 . . . . B 443 GLU HB2 . 34258 1
313 . 1 1 30 30 GLU HB3 H 1 1.704 0.001 . 2 . . . . B 443 GLU HB3 . 34258 1
314 . 1 1 30 30 GLU HG2 H 1 1.963 0.000 . 2 . . . . B 443 GLU HG2 . 34258 1
315 . 1 1 30 30 GLU HG3 H 1 2.118 0.001 . 2 . . . . B 443 GLU HG3 . 34258 1
316 . 1 1 30 30 GLU CA C 13 53.816 0.011 . 1 . . . . B 443 GLU CA . 34258 1
317 . 1 1 30 30 GLU CB C 13 32.410 0.033 . 1 . . . . B 443 GLU CB . 34258 1
318 . 1 1 30 30 GLU CG C 13 34.906 0.027 . 1 . . . . B 443 GLU CG . 34258 1
319 . 1 1 30 30 GLU N N 15 117.743 0.004 . 1 . . . . B 443 GLU N . 34258 1
320 . 1 1 31 31 CYS H H 1 9.780 0.001 . 1 . . . . B 444 CYS H . 34258 1
321 . 1 1 31 31 CYS HA H 1 3.823 0.001 . 1 . . . . B 444 CYS HA . 34258 1
322 . 1 1 31 31 CYS HB2 H 1 3.109 0.001 . 2 . . . . B 444 CYS HB2 . 34258 1
323 . 1 1 31 31 CYS HB3 H 1 3.282 0.001 . 2 . . . . B 444 CYS HB3 . 34258 1
324 . 1 1 31 31 CYS CA C 13 58.842 0.008 . 1 . . . . B 444 CYS CA . 34258 1
325 . 1 1 31 31 CYS CB C 13 30.532 0.017 . 1 . . . . B 444 CYS CB . 34258 1
326 . 1 1 31 31 CYS N N 15 125.704 0.002 . 1 . . . . B 444 CYS N . 34258 1
327 . 1 1 32 32 ASN H H 1 8.440 0.002 . 1 . . . . B 445 ASN H . 34258 1
328 . 1 1 32 32 ASN HA H 1 4.363 0.002 . 1 . . . . B 445 ASN HA . 34258 1
329 . 1 1 32 32 ASN HB2 H 1 2.324 0.002 . 2 . . . . B 445 ASN HB2 . 34258 1
330 . 1 1 32 32 ASN HB3 H 1 2.117 0.001 . 2 . . . . B 445 ASN HB3 . 34258 1
331 . 1 1 32 32 ASN HD21 H 1 7.183 0.001 . 2 . . . . B 445 ASN HD21 . 34258 1
332 . 1 1 32 32 ASN HD22 H 1 6.401 0.002 . 2 . . . . B 445 ASN HD22 . 34258 1
333 . 1 1 32 32 ASN CA C 13 54.860 0.010 . 1 . . . . B 445 ASN CA . 34258 1
334 . 1 1 32 32 ASN CB C 13 39.161 0.019 . 1 . . . . B 445 ASN CB . 34258 1
335 . 1 1 32 32 ASN N N 15 126.894 0.003 . 1 . . . . B 445 ASN N . 34258 1
336 . 1 1 32 32 ASN ND2 N 15 112.191 0.003 . 1 . . . . B 445 ASN ND2 . 34258 1
337 . 1 1 33 33 GLN H H 1 9.047 0.002 . 1 . . . . B 446 GLN H . 34258 1
338 . 1 1 33 33 GLN HA H 1 4.294 0.008 . 1 . . . . B 446 GLN HA . 34258 1
339 . 1 1 33 33 GLN HB2 H 1 1.726 0.001 . 2 . . . . B 446 GLN HB2 . 34258 1
340 . 1 1 33 33 GLN HB3 H 1 1.905 0.001 . 2 . . . . B 446 GLN HB3 . 34258 1
341 . 1 1 33 33 GLN HG2 H 1 1.986 0.008 . 2 . . . . B 446 GLN HG2 . 34258 1
342 . 1 1 33 33 GLN HG3 H 1 1.893 0.004 . 2 . . . . B 446 GLN HG3 . 34258 1
343 . 1 1 33 33 GLN HE21 H 1 6.521 0.002 . 2 . . . . B 446 GLN HE21 . 34258 1
344 . 1 1 33 33 GLN HE22 H 1 6.763 0.004 . 2 . . . . B 446 GLN HE22 . 34258 1
345 . 1 1 33 33 GLN CA C 13 56.806 0.010 . 1 . . . . B 446 GLN CA . 34258 1
346 . 1 1 33 33 GLN CB C 13 30.728 0.030 . 1 . . . . B 446 GLN CB . 34258 1
347 . 1 1 33 33 GLN CG C 13 33.083 0.052 . 1 . . . . B 446 GLN CG . 34258 1
348 . 1 1 33 33 GLN N N 15 116.896 0.025 . 1 . . . . B 446 GLN N . 34258 1
349 . 1 1 33 33 GLN NE2 N 15 110.334 0.047 . 1 . . . . B 446 GLN NE2 . 34258 1
350 . 1 1 34 34 CYS H H 1 8.098 0.001 . 1 . . . . B 447 CYS H . 34258 1
351 . 1 1 34 34 CYS HA H 1 4.889 0.002 . 1 . . . . B 447 CYS HA . 34258 1
352 . 1 1 34 34 CYS HB2 H 1 3.112 0.000 . 2 . . . . B 447 CYS HB2 . 34258 1
353 . 1 1 34 34 CYS HB3 H 1 2.609 0.001 . 2 . . . . B 447 CYS HB3 . 34258 1
354 . 1 1 34 34 CYS CA C 13 59.063 0.012 . 1 . . . . B 447 CYS CA . 34258 1
355 . 1 1 34 34 CYS CB C 13 31.581 0.006 . 1 . . . . B 447 CYS CB . 34258 1
356 . 1 1 34 34 CYS N N 15 118.672 0.005 . 1 . . . . B 447 CYS N . 34258 1
357 . 1 1 35 35 LYS H H 1 7.509 0.002 . 1 . . . . B 448 LYS H . 34258 1
358 . 1 1 35 35 LYS HA H 1 4.057 0.003 . 1 . . . . B 448 LYS HA . 34258 1
359 . 1 1 35 35 LYS HB2 H 1 2.104 0.001 . 2 . . . . B 448 LYS HB2 . 34258 1
360 . 1 1 35 35 LYS HB3 H 1 2.013 0.036 . 2 . . . . B 448 LYS HB3 . 34258 1
361 . 1 1 35 35 LYS HG2 H 1 1.285 0.001 . 2 . . . . B 448 LYS HG2 . 34258 1
362 . 1 1 35 35 LYS HG3 H 1 1.221 0.001 . 2 . . . . B 448 LYS HG3 . 34258 1
363 . 1 1 35 35 LYS HD2 H 1 1.606 0.003 . 2 . . . . B 448 LYS HD2 . 34258 1
364 . 1 1 35 35 LYS HD3 H 1 1.526 0.004 . 2 . . . . B 448 LYS HD3 . 34258 1
365 . 1 1 35 35 LYS HE2 H 1 2.879 0.000 . 2 . . . . B 448 LYS HE2 . 34258 1
366 . 1 1 35 35 LYS HE3 H 1 2.879 0.000 . 2 . . . . B 448 LYS HE3 . 34258 1
367 . 1 1 35 35 LYS CA C 13 58.490 0.012 . 1 . . . . B 448 LYS CA . 34258 1
368 . 1 1 35 35 LYS CB C 13 29.522 0.043 . 1 . . . . B 448 LYS CB . 34258 1
369 . 1 1 35 35 LYS CG C 13 25.248 0.042 . 1 . . . . B 448 LYS CG . 34258 1
370 . 1 1 35 35 LYS CD C 13 28.568 0.050 . 1 . . . . B 448 LYS CD . 34258 1
371 . 1 1 35 35 LYS CE C 13 42.248 0.006 . 1 . . . . B 448 LYS CE . 34258 1
372 . 1 1 35 35 LYS N N 15 116.426 0.002 . 1 . . . . B 448 LYS N . 34258 1
373 . 1 1 36 36 ALA H H 1 8.889 0.001 . 1 . . . . B 449 ALA H . 34258 1
374 . 1 1 36 36 ALA HA H 1 4.485 0.002 . 1 . . . . B 449 ALA HA . 34258 1
375 . 1 1 36 36 ALA HB1 H 1 1.526 0.001 . 1 . . . . B 449 ALA HB1 . 34258 1
376 . 1 1 36 36 ALA HB2 H 1 1.526 0.001 . 1 . . . . B 449 ALA HB2 . 34258 1
377 . 1 1 36 36 ALA HB3 H 1 1.526 0.001 . 1 . . . . B 449 ALA HB3 . 34258 1
378 . 1 1 36 36 ALA CA C 13 51.861 0.013 . 1 . . . . B 449 ALA CA . 34258 1
379 . 1 1 36 36 ALA CB C 13 18.483 0.037 . 1 . . . . B 449 ALA CB . 34258 1
380 . 1 1 36 36 ALA N N 15 127.281 0.003 . 1 . . . . B 449 ALA N . 34258 1
381 . 1 1 37 37 PRO HA H 1 4.491 0.002 . 1 . . . . B 450 PRO HA . 34258 1
382 . 1 1 37 37 PRO HB2 H 1 1.752 0.002 . 2 . . . . B 450 PRO HB2 . 34258 1
383 . 1 1 37 37 PRO HB3 H 1 2.310 0.001 . 2 . . . . B 450 PRO HB3 . 34258 1
384 . 1 1 37 37 PRO HG2 H 1 2.030 0.001 . 2 . . . . B 450 PRO HG2 . 34258 1
385 . 1 1 37 37 PRO HG3 H 1 2.030 0.001 . 2 . . . . B 450 PRO HG3 . 34258 1
386 . 1 1 37 37 PRO HD2 H 1 3.616 0.001 . 2 . . . . B 450 PRO HD2 . 34258 1
387 . 1 1 37 37 PRO HD3 H 1 3.905 0.001 . 2 . . . . B 450 PRO HD3 . 34258 1
388 . 1 1 37 37 PRO CA C 13 62.365 0.007 . 1 . . . . B 450 PRO CA . 34258 1
389 . 1 1 37 37 PRO CB C 13 32.016 0.007 . 1 . . . . B 450 PRO CB . 34258 1
390 . 1 1 37 37 PRO CG C 13 27.311 0.033 . 1 . . . . B 450 PRO CG . 34258 1
391 . 1 1 37 37 PRO CD C 13 50.317 0.017 . 1 . . . . B 450 PRO CD . 34258 1
392 . 1 1 38 38 LYS H H 1 7.175 0.000 . 1 . . . . B 451 LYS H . 34258 1
393 . 1 1 38 38 LYS HA H 1 2.837 0.001 . 1 . . . . B 451 LYS HA . 34258 1
394 . 1 1 38 38 LYS HB2 H 1 1.022 0.001 . 2 . . . . B 451 LYS HB2 . 34258 1
395 . 1 1 38 38 LYS HB3 H 1 0.512 0.002 . 2 . . . . B 451 LYS HB3 . 34258 1
396 . 1 1 38 38 LYS HG2 H 1 -0.854 0.001 . 1 . . . . B 451 LYS HG2 . 34258 1
397 . 1 1 38 38 LYS HG3 H 1 0.681 0.001 . 2 . . . . B 451 LYS HG3 . 34258 1
398 . 1 1 38 38 LYS HD2 H 1 1.045 0.001 . 2 . . . . B 451 LYS HD2 . 34258 1
399 . 1 1 38 38 LYS HD3 H 1 1.045 0.001 . 2 . . . . B 451 LYS HD3 . 34258 1
400 . 1 1 38 38 LYS HE2 H 1 2.388 0.000 . 2 . . . . B 451 LYS HE2 . 34258 1
401 . 1 1 38 38 LYS HE3 H 1 2.388 0.000 . 2 . . . . B 451 LYS HE3 . 34258 1
402 . 1 1 38 38 LYS CA C 13 54.207 0.013 . 1 . . . . B 451 LYS CA . 34258 1
403 . 1 1 38 38 LYS CB C 13 33.357 0.012 . 1 . . . . B 451 LYS CB . 34258 1
404 . 1 1 38 38 LYS CG C 13 23.092 0.013 . 1 . . . . B 451 LYS CG . 34258 1
405 . 1 1 38 38 LYS CD C 13 29.243 0.000 . 1 . . . . B 451 LYS CD . 34258 1
406 . 1 1 38 38 LYS CE C 13 41.900 0.000 . 1 . . . . B 451 LYS CE . 34258 1
407 . 1 1 38 38 LYS N N 15 122.761 0.002 . 1 . . . . B 451 LYS N . 34258 1
408 . 1 1 39 39 PRO HA H 1 4.276 0.003 . 1 . . . . B 452 PRO HA . 34258 1
409 . 1 1 39 39 PRO HB2 H 1 2.218 0.001 . 2 . . . . B 452 PRO HB2 . 34258 1
410 . 1 1 39 39 PRO HB3 H 1 1.875 0.001 . 2 . . . . B 452 PRO HB3 . 34258 1
411 . 1 1 39 39 PRO HG2 H 1 1.900 0.000 . 2 . . . . B 452 PRO HG2 . 34258 1
412 . 1 1 39 39 PRO HG3 H 1 2.057 0.000 . 2 . . . . B 452 PRO HG3 . 34258 1
413 . 1 1 39 39 PRO HD2 H 1 3.032 0.001 . 2 . . . . B 452 PRO HD2 . 34258 1
414 . 1 1 39 39 PRO HD3 H 1 3.618 0.001 . 2 . . . . B 452 PRO HD3 . 34258 1
415 . 1 1 39 39 PRO CA C 13 62.885 0.003 . 1 . . . . B 452 PRO CA . 34258 1
416 . 1 1 39 39 PRO CB C 13 32.167 0.056 . 1 . . . . B 452 PRO CB . 34258 1
417 . 1 1 39 39 PRO CG C 13 27.102 0.057 . 1 . . . . B 452 PRO CG . 34258 1
418 . 1 1 39 39 PRO CD C 13 51.367 0.027 . 1 . . . . B 452 PRO CD . 34258 1
419 . 1 1 40 40 ASP H H 1 8.261 0.003 . 1 . . . . B 453 ASP H . 34258 1
420 . 1 1 40 40 ASP HA H 1 4.443 0.003 . 1 . . . . B 453 ASP HA . 34258 1
421 . 1 1 40 40 ASP HB2 H 1 2.590 0.002 . 2 . . . . B 453 ASP HB2 . 34258 1
422 . 1 1 40 40 ASP HB3 H 1 2.520 0.003 . 2 . . . . B 453 ASP HB3 . 34258 1
423 . 1 1 40 40 ASP CA C 13 54.300 0.015 . 1 . . . . B 453 ASP CA . 34258 1
424 . 1 1 40 40 ASP CB C 13 41.159 0.031 . 1 . . . . B 453 ASP CB . 34258 1
425 . 1 1 40 40 ASP N N 15 121.548 0.000 . 1 . . . . B 453 ASP N . 34258 1
426 . 1 1 41 41 GLY H H 1 7.718 0.002 . 1 . . . . B 454 GLY H . 34258 1
427 . 1 1 41 41 GLY HA2 H 1 3.684 0.001 . 2 . . . . B 454 GLY HA2 . 34258 1
428 . 1 1 41 41 GLY HA3 H 1 3.684 0.001 . 2 . . . . B 454 GLY HA3 . 34258 1
429 . 1 1 41 41 GLY CA C 13 46.211 0.001 . 1 . . . . B 454 GLY CA . 34258 1
430 . 1 1 41 41 GLY N N 15 114.897 0.000 . 1 . . . . B 454 GLY N . 34258 1
stop_
save_
###################################
# 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_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 34258
_Assigned_chem_shift_list.ID 2
_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 '3D 1H-13C NOESY aliphatic' . . . 34258 2
2 '3D 1H-15N NOESY' . . . 34258 2
3 '2D 1H-1H NOESY' . . . 34258 2
4 '2D 13C F2-filtered NOESY' . . . 34258 2
5 '2D 1H-13C HSQC aliphatic' . . . 34258 2
6 '2D 1H-13C HSQC aromatic' . . . 34258 2
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.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 . 2 2 1 1 U H1' H 1 5.771 0.001 . 1 . . . . A 1 U H1' . 34258 2
2 . 2 2 1 1 U H2' H 1 4.384 0.000 . 1 . . . . A 1 U H2' . 34258 2
3 . 2 2 1 1 U H3' H 1 4.624 0.001 . 1 . . . . A 1 U H3' . 34258 2
4 . 2 2 1 1 U H4' H 1 4.217 0.002 . 1 . . . . A 1 U H4' . 34258 2
5 . 2 2 1 1 U H5 H 1 5.438 0.002 . 1 . . . . A 1 U H5 . 34258 2
6 . 2 2 1 1 U H5' H 1 3.714 0.001 . 2 . . . . A 1 U H5' . 34258 2
7 . 2 2 1 1 U H5'' H 1 3.714 0.001 . 2 . . . . A 1 U H5'' . 34258 2
8 . 2 2 1 1 U H6 H 1 7.383 0.002 . 1 . . . . A 1 U H6 . 34258 2
9 . 2 2 1 1 U C1' C 13 90.888 0.000 . 1 . . . . A 1 U C1' . 34258 2
10 . 2 2 1 1 U C2' C 13 74.925 0.000 . 1 . . . . A 1 U C2' . 34258 2
11 . 2 2 1 1 U C3' C 13 77.437 0.000 . 1 . . . . A 1 U C3' . 34258 2
12 . 2 2 1 1 U C4' C 13 86.956 0.000 . 1 . . . . A 1 U C4' . 34258 2
13 . 2 2 1 1 U C5 C 13 104.911 0.000 . 1 . . . . A 1 U C5 . 34258 2
14 . 2 2 1 1 U C5' C 13 63.572 0.000 . 1 . . . . A 1 U C5' . 34258 2
15 . 2 2 1 1 U C6 C 13 143.505 0.000 . 1 . . . . A 1 U C6 . 34258 2
16 . 2 2 2 2 G H1' H 1 5.623 0.002 . 1 . . . . A 2 G H1' . 34258 2
17 . 2 2 2 2 G H2' H 1 4.399 0.006 . 1 . . . . A 2 G H2' . 34258 2
18 . 2 2 2 2 G H3' H 1 4.867 0.002 . 1 . . . . A 2 G H3' . 34258 2
19 . 2 2 2 2 G H4' H 1 4.369 0.003 . 1 . . . . A 2 G H4' . 34258 2
20 . 2 2 2 2 G H5' H 1 4.291 0.006 . 2 . . . . A 2 G H5' . 34258 2
21 . 2 2 2 2 G H5'' H 1 4.190 0.006 . 2 . . . . A 2 G H5'' . 34258 2
22 . 2 2 2 2 G H8 H 1 8.028 0.003 . 1 . . . . A 2 G H8 . 34258 2
23 . 2 2 2 2 G C1' C 13 91.676 0.000 . 1 . . . . A 2 G C1' . 34258 2
24 . 2 2 2 2 G C2' C 13 75.989 0.000 . 1 . . . . A 2 G C2' . 34258 2
25 . 2 2 2 2 G C3' C 13 74.513 0.000 . 1 . . . . A 2 G C3' . 34258 2
26 . 2 2 2 2 G C4' C 13 83.185 0.000 . 1 . . . . A 2 G C4' . 34258 2
27 . 2 2 2 2 G C5' C 13 68.050 0.000 . 1 . . . . A 2 G C5' . 34258 2
28 . 2 2 2 2 G C8 C 13 139.043 0.000 . 1 . . . . A 2 G C8 . 34258 2
29 . 2 2 3 3 G H1' H 1 5.500 0.003 . 1 . . . . A 3 G H1' . 34258 2
30 . 2 2 3 3 G H2' H 1 4.890 0.008 . 1 . . . . A 3 G H2' . 34258 2
31 . 2 2 3 3 G H3' H 1 4.840 0.006 . 1 . . . . A 3 G H3' . 34258 2
32 . 2 2 3 3 G H4' H 1 4.509 0.001 . 1 . . . . A 3 G H4' . 34258 2
33 . 2 2 3 3 G H5' H 1 4.291 0.006 . 2 . . . . A 3 G H5' . 34258 2
34 . 2 2 3 3 G H5'' H 1 4.190 0.006 . 2 . . . . A 3 G H5'' . 34258 2
35 . 2 2 3 3 G H8 H 1 8.050 0.002 . 1 . . . . A 3 G H8 . 34258 2
36 . 2 2 3 3 G C1' C 13 86.716 0.000 . 1 . . . . A 3 G C1' . 34258 2
37 . 2 2 3 3 G C2' C 13 74.204 0.000 . 1 . . . . A 3 G C2' . 34258 2
38 . 2 2 3 3 G C3' C 13 78.027 0.000 . 1 . . . . A 3 G C3' . 34258 2
39 . 2 2 3 3 G C4' C 13 86.009 0.000 . 1 . . . . A 3 G C4' . 34258 2
40 . 2 2 3 3 G C5' C 13 67.790 0.000 . 1 . . . . A 3 G C5' . 34258 2
41 . 2 2 3 3 G C8 C 13 137.889 0.000 . 1 . . . . A 3 G C8 . 34258 2
42 . 2 2 4 4 U H1' H 1 5.927 0.002 . 1 . . . . A 4 U H1' . 34258 2
43 . 2 2 4 4 U H2' H 1 4.174 0.001 . 1 . . . . A 4 U H2' . 34258 2
44 . 2 2 4 4 U H3' H 1 4.546 0.002 . 1 . . . . A 4 U H3' . 34258 2
45 . 2 2 4 4 U H4' H 1 4.267 0.003 . 1 . . . . A 4 U H4' . 34258 2
46 . 2 2 4 4 U H5 H 1 5.035 0.012 . 1 . . . . A 4 U H5 . 34258 2
47 . 2 2 4 4 U H5' H 1 4.102 0.000 . 2 . . . . A 4 U H5' . 34258 2
48 . 2 2 4 4 U H5'' H 1 4.152 0.000 . 2 . . . . A 4 U H5'' . 34258 2
49 . 2 2 4 4 U H6 H 1 7.566 0.001 . 1 . . . . A 4 U H6 . 34258 2
50 . 2 2 4 4 U C1' C 13 89.641 0.000 . 1 . . . . A 4 U C1' . 34258 2
51 . 2 2 4 4 U C2' C 13 75.206 0.000 . 1 . . . . A 4 U C2' . 34258 2
52 . 2 2 4 4 U C3' C 13 75.785 0.000 . 1 . . . . A 4 U C3' . 34258 2
53 . 2 2 4 4 U C4' C 13 85.074 0.000 . 1 . . . . A 4 U C4' . 34258 2
54 . 2 2 4 4 U C5 C 13 104.759 0.000 . 1 . . . . A 4 U C5 . 34258 2
55 . 2 2 4 4 U C5' C 13 68.253 0.009 . 1 . . . . A 4 U C5' . 34258 2
56 . 2 2 4 4 U C6 C 13 143.849 0.000 . 1 . . . . A 4 U C6 . 34258 2
57 . 2 2 5 5 G H1' H 1 5.869 0.003 . 1 . . . . A 5 G H1' . 34258 2
58 . 2 2 5 5 G H2' H 1 4.757 0.001 . 1 . . . . A 5 G H2' . 34258 2
59 . 2 2 5 5 G H3' H 1 4.470 0.002 . 1 . . . . A 5 G H3' . 34258 2
60 . 2 2 5 5 G H4' H 1 4.295 0.001 . 1 . . . . A 5 G H4' . 34258 2
61 . 2 2 5 5 G H5' H 1 4.123 0.000 . 2 . . . . A 5 G H5' . 34258 2
62 . 2 2 5 5 G H5'' H 1 4.123 0.000 . 2 . . . . A 5 G H5'' . 34258 2
63 . 2 2 5 5 G H8 H 1 7.992 0.004 . 1 . . . . A 5 G H8 . 34258 2
64 . 2 2 5 5 G C1' C 13 90.045 0.000 . 1 . . . . A 5 G C1' . 34258 2
65 . 2 2 5 5 G C2' C 13 76.055 0.000 . 1 . . . . A 5 G C2' . 34258 2
66 . 2 2 5 5 G C3' C 13 73.014 0.000 . 1 . . . . A 5 G C3' . 34258 2
67 . 2 2 5 5 G C4' C 13 86.297 0.000 . 1 . . . . A 5 G C4' . 34258 2
68 . 2 2 5 5 G C5' C 13 67.382 0.009 . 1 . . . . A 5 G C5' . 34258 2
69 . 2 2 5 5 G C8 C 13 140.300 0.000 . 1 . . . . A 5 G C8 . 34258 2
stop_
save_