Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
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 34279
_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 '1D proton' . . . 34279 1
2 '2D DQF-COSY' . . . 34279 1
3 '2D 1H-1H TOCSY' . . . 34279 1
4 '2D 1H-1H NOESY' . . . 34279 1
5 '2D 1H-13C HSQC' . . . 34279 1
6 '2D 1H-15N HSQC' . . . 34279 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 LYS HA H 1 4.206 0.03 . 1 . . . . A 1 LYS HA . 34279 1
2 . 1 1 1 1 LYS HB2 H 1 1.735 0.03 . 1 . . . . A 1 LYS HB2 . 34279 1
3 . 1 1 1 1 LYS HB3 H 1 1.7 0.03 . 1 . . . . A 1 LYS HB3 . 34279 1
4 . 1 1 1 1 LYS HG2 H 1 1.426 0.03 . 1 . . . . A 1 LYS HG2 . 34279 1
5 . 1 1 1 1 LYS HG3 H 1 1.426 0.03 . 1 . . . . A 1 LYS HG3 . 34279 1
6 . 1 1 1 1 LYS HD2 H 1 1.661 0.03 . 1 . . . . A 1 LYS HD2 . 34279 1
7 . 1 1 1 1 LYS HD3 H 1 1.661 0.03 . 1 . . . . A 1 LYS HD3 . 34279 1
8 . 1 1 1 1 LYS HE2 H 1 2.965 0.03 . 1 . . . . A 1 LYS HE2 . 34279 1
9 . 1 1 1 1 LYS HE3 H 1 2.965 0.03 . 1 . . . . A 1 LYS HE3 . 34279 1
10 . 1 1 1 1 LYS HZ1 H 1 7.501 0.03 . 1 . . . . A 1 LYS HZ1 . 34279 1
11 . 1 1 1 1 LYS HZ2 H 1 7.501 0.03 . 1 . . . . A 1 LYS HZ2 . 34279 1
12 . 1 1 1 1 LYS HZ3 H 1 7.501 0.03 . 1 . . . . A 1 LYS HZ3 . 34279 1
13 . 1 1 1 1 LYS CG C 13 24.551 0.30 . 1 . . . . A 1 LYS CG . 34279 1
14 . 1 1 1 1 LYS CD C 13 29.014 0.30 . 1 . . . . A 1 LYS CD . 34279 1
15 . 1 1 1 1 LYS CE C 13 41.785 0.30 . 1 . . . . A 1 LYS CE . 34279 1
16 . 1 1 2 2 LYS H H 1 8.616 0.03 . 1 . . . . A 2 LYS H . 34279 1
17 . 1 1 2 2 LYS HA H 1 4.321 0.03 . 1 . . . . A 2 LYS HA . 34279 1
18 . 1 1 2 2 LYS HB2 H 1 1.78 0.03 . 1 . . . . A 2 LYS HB2 . 34279 1
19 . 1 1 2 2 LYS HB3 H 1 1.724 0.03 . 1 . . . . A 2 LYS HB3 . 34279 1
20 . 1 1 2 2 LYS HG2 H 1 1.415 0.03 . 1 . . . . A 2 LYS HG2 . 34279 1
21 . 1 1 2 2 LYS HG3 H 1 1.415 0.03 . 1 . . . . A 2 LYS HG3 . 34279 1
22 . 1 1 2 2 LYS HD2 H 1 1.66 0.03 . 1 . . . . A 2 LYS HD2 . 34279 1
23 . 1 1 2 2 LYS HD3 H 1 1.66 0.03 . 1 . . . . A 2 LYS HD3 . 34279 1
24 . 1 1 2 2 LYS HE2 H 1 2.973 0.03 . 1 . . . . A 2 LYS HE2 . 34279 1
25 . 1 1 2 2 LYS HE3 H 1 2.973 0.03 . 1 . . . . A 2 LYS HE3 . 34279 1
26 . 1 1 2 2 LYS CA C 13 56.285 0.30 . 1 . . . . A 2 LYS CA . 34279 1
27 . 1 1 2 2 LYS CB C 13 33.083 0.30 . 1 . . . . A 2 LYS CB . 34279 1
28 . 1 1 2 2 LYS CG C 13 24.609 0.30 . 1 . . . . A 2 LYS CG . 34279 1
29 . 1 1 2 2 LYS CD C 13 29.014 0.30 . 1 . . . . A 2 LYS CD . 34279 1
30 . 1 1 2 2 LYS CE C 13 41.785 0.30 . 1 . . . . A 2 LYS CE . 34279 1
31 . 1 1 3 3 LYS H H 1 8.402 0.03 . 1 . . . . A 3 LYS H . 34279 1
32 . 1 1 3 3 LYS HA H 1 4.252 0.03 . 1 . . . . A 3 LYS HA . 34279 1
33 . 1 1 3 3 LYS HB2 H 1 1.764 0.03 . 1 . . . . A 3 LYS HB2 . 34279 1
34 . 1 1 3 3 LYS HB3 H 1 1.729 0.03 . 1 . . . . A 3 LYS HB3 . 34279 1
35 . 1 1 3 3 LYS HG2 H 1 1.399 0.03 . 1 . . . . A 3 LYS HG2 . 34279 1
36 . 1 1 3 3 LYS HG3 H 1 1.399 0.03 . 1 . . . . A 3 LYS HG3 . 34279 1
37 . 1 1 3 3 LYS HD2 H 1 1.662 0.03 . 1 . . . . A 3 LYS HD2 . 34279 1
38 . 1 1 3 3 LYS HD3 H 1 1.662 0.03 . 1 . . . . A 3 LYS HD3 . 34279 1
39 . 1 1 3 3 LYS HE2 H 1 2.963 0.03 . 1 . . . . A 3 LYS HE2 . 34279 1
40 . 1 1 3 3 LYS HE3 H 1 2.963 0.03 . 1 . . . . A 3 LYS HE3 . 34279 1
41 . 1 1 3 3 LYS CA C 13 56.166 0.30 . 1 . . . . A 3 LYS CA . 34279 1
42 . 1 1 3 3 LYS CB C 13 33.123 0.30 . 1 . . . . A 3 LYS CB . 34279 1
43 . 1 1 3 3 LYS CG C 13 24.58 0.30 . 1 . . . . A 3 LYS CG . 34279 1
44 . 1 1 3 3 LYS CD C 13 29.014 0.30 . 1 . . . . A 3 LYS CD . 34279 1
45 . 1 1 3 3 LYS CE C 13 41.785 0.30 . 1 . . . . A 3 LYS CE . 34279 1
46 . 1 1 3 3 LYS N N 15 123.816 0.30 . 1 . . . . A 3 LYS N . 34279 1
47 . 1 1 4 4 LYS H H 1 8.328 0.03 . 1 . . . . A 4 LYS H . 34279 1
48 . 1 1 4 4 LYS HA H 1 4.258 0.03 . 1 . . . . A 4 LYS HA . 34279 1
49 . 1 1 4 4 LYS HB2 H 1 1.768 0.03 . 1 . . . . A 4 LYS HB2 . 34279 1
50 . 1 1 4 4 LYS HB3 H 1 1.72 0.03 . 1 . . . . A 4 LYS HB3 . 34279 1
51 . 1 1 4 4 LYS HG2 H 1 1.402 0.03 . 1 . . . . A 4 LYS HG2 . 34279 1
52 . 1 1 4 4 LYS HG3 H 1 1.434 0.03 . 1 . . . . A 4 LYS HG3 . 34279 1
53 . 1 1 4 4 LYS HD2 H 1 1.665 0.03 . 1 . . . . A 4 LYS HD2 . 34279 1
54 . 1 1 4 4 LYS HD3 H 1 1.665 0.03 . 1 . . . . A 4 LYS HD3 . 34279 1
55 . 1 1 4 4 LYS HE2 H 1 2.98 0.03 . 1 . . . . A 4 LYS HE2 . 34279 1
56 . 1 1 4 4 LYS HE3 H 1 2.98 0.03 . 1 . . . . A 4 LYS HE3 . 34279 1
57 . 1 1 4 4 LYS CA C 13 56.166 0.30 . 1 . . . . A 4 LYS CA . 34279 1
58 . 1 1 4 4 LYS CB C 13 33.187 0.30 . 1 . . . . A 4 LYS CB . 34279 1
59 . 1 1 4 4 LYS CG C 13 24.58 0.30 . 1 . . . . A 4 LYS CG . 34279 1
60 . 1 1 4 4 LYS CD C 13 29.014 0.30 . 1 . . . . A 4 LYS CD . 34279 1
61 . 1 1 4 4 LYS CE C 13 41.785 0.30 . 1 . . . . A 4 LYS CE . 34279 1
62 . 1 1 4 4 LYS N N 15 123.449 0.30 . 1 . . . . A 4 LYS N . 34279 1
63 . 1 1 5 5 GLN H H 1 8.346 0.03 . 1 . . . . A 5 GLN H . 34279 1
64 . 1 1 5 5 GLN HA H 1 4.389 0.03 . 1 . . . . A 5 GLN HA . 34279 1
65 . 1 1 5 5 GLN HB2 H 1 1.922 0.03 . 1 . . . . A 5 GLN HB2 . 34279 1
66 . 1 1 5 5 GLN HB3 H 1 2.019 0.03 . 1 . . . . A 5 GLN HB3 . 34279 1
67 . 1 1 5 5 GLN HG2 H 1 2.364 0.03 . 1 . . . . A 5 GLN HG2 . 34279 1
68 . 1 1 5 5 GLN HG3 H 1 2.329 0.03 . 1 . . . . A 5 GLN HG3 . 34279 1
69 . 1 1 5 5 GLN HE21 H 1 7.461 0.03 . 1 . . . . A 5 GLN HE21 . 34279 1
70 . 1 1 5 5 GLN HE22 H 1 6.748 0.03 . 1 . . . . A 5 GLN HE22 . 34279 1
71 . 1 1 5 5 GLN CA C 13 55.351 0.30 . 1 . . . . A 5 GLN CA . 34279 1
72 . 1 1 5 5 GLN CB C 13 30.482 0.30 . 1 . . . . A 5 GLN CB . 34279 1
73 . 1 1 5 5 GLN CG C 13 33.743 0.30 . 1 . . . . A 5 GLN CG . 34279 1
74 . 1 1 5 5 GLN N N 15 122.702 0.30 . 1 . . . . A 5 GLN N . 34279 1
75 . 1 1 5 5 GLN NE2 N 15 111.433 0.30 . 1 . . . . A 5 GLN NE2 . 34279 1
76 . 1 1 6 6 SER H H 1 8.514 0.03 . 1 . . . . A 6 SER H . 34279 1
77 . 1 1 6 6 SER HA H 1 4.489 0.03 . 1 . . . . A 6 SER HA . 34279 1
78 . 1 1 6 6 SER HB2 H 1 3.888 0.03 . 1 . . . . A 6 SER HB2 . 34279 1
79 . 1 1 6 6 SER HB3 H 1 3.829 0.03 . 1 . . . . A 6 SER HB3 . 34279 1
80 . 1 1 6 6 SER CB C 13 64.423 0.30 . 1 . . . . A 6 SER CB . 34279 1
81 . 1 1 6 6 SER N N 15 118.894 0.30 . 1 . . . . A 6 SER N . 34279 1
82 . 1 1 7 7 TRP H H 1 8.951 0.03 . 1 . . . . A 7 TRP H . 34279 1
83 . 1 1 7 7 TRP HA H 1 4.315 0.03 . 1 . . . . A 7 TRP HA . 34279 1
84 . 1 1 7 7 TRP HB2 H 1 3.357 0.03 . 1 . . . . A 7 TRP HB2 . 34279 1
85 . 1 1 7 7 TRP HB3 H 1 3.144 0.03 . 1 . . . . A 7 TRP HB3 . 34279 1
86 . 1 1 7 7 TRP HD1 H 1 7.476 0.03 . 1 . . . . A 7 TRP HD1 . 34279 1
87 . 1 1 7 7 TRP HE1 H 1 10.752 0.03 . 1 . . . . A 7 TRP HE1 . 34279 1
88 . 1 1 7 7 TRP HE3 H 1 7.113 0.03 . 1 . . . . A 7 TRP HE3 . 34279 1
89 . 1 1 7 7 TRP HZ2 H 1 7.469 0.03 . 1 . . . . A 7 TRP HZ2 . 34279 1
90 . 1 1 7 7 TRP HZ3 H 1 6.87 0.03 . 1 . . . . A 7 TRP HZ3 . 34279 1
91 . 1 1 7 7 TRP HH2 H 1 7.017 0.03 . 1 . . . . A 7 TRP HH2 . 34279 1
92 . 1 1 7 7 TRP CA C 13 60.113 0.30 . 1 . . . . A 7 TRP CA . 34279 1
93 . 1 1 7 7 TRP CB C 13 28.526 0.30 . 1 . . . . A 7 TRP CB . 34279 1
94 . 1 1 7 7 TRP CD1 C 13 127.734 0.30 . 1 . . . . A 7 TRP CD1 . 34279 1
95 . 1 1 7 7 TRP CE3 C 13 120.275 0.30 . 1 . . . . A 7 TRP CE3 . 34279 1
96 . 1 1 7 7 TRP CZ2 C 13 114.683 0.30 . 1 . . . . A 7 TRP CZ2 . 34279 1
97 . 1 1 7 7 TRP CZ3 C 13 120.931 0.30 . 1 . . . . A 7 TRP CZ3 . 34279 1
98 . 1 1 7 7 TRP CH2 C 13 123.576 0.30 . 1 . . . . A 7 TRP CH2 . 34279 1
99 . 1 1 7 7 TRP N N 15 123.378 0.30 . 1 . . . . A 7 TRP N . 34279 1
100 . 1 1 7 7 TRP NE1 N 15 130.931 0.30 . 1 . . . . A 7 TRP NE1 . 34279 1
101 . 1 1 8 8 TYR H H 1 6.816 0.03 . 1 . . . . A 8 TYR H . 34279 1
102 . 1 1 8 8 TYR HA H 1 3.958 0.03 . 1 . . . . A 8 TYR HA . 34279 1
103 . 1 1 8 8 TYR HB2 H 1 2.739 0.03 . 1 . . . . A 8 TYR HB2 . 34279 1
104 . 1 1 8 8 TYR HB3 H 1 2.297 0.03 . 1 . . . . A 8 TYR HB3 . 34279 1
105 . 1 1 8 8 TYR HD1 H 1 6.679 0.03 . 1 . . . . A 8 TYR HD1 . 34279 1
106 . 1 1 8 8 TYR HD2 H 1 6.679 0.03 . 1 . . . . A 8 TYR HD2 . 34279 1
107 . 1 1 8 8 TYR HE1 H 1 6.826 0.03 . 3 . . . . A 8 TYR HE1 . 34279 1
108 . 1 1 8 8 TYR HE2 H 1 6.826 0.03 . 3 . . . . A 8 TYR HE2 . 34279 1
109 . 1 1 8 8 TYR CA C 13 59.623 0.30 . 1 . . . . A 8 TYR CA . 34279 1
110 . 1 1 8 8 TYR CB C 13 37.348 0.30 . 1 . . . . A 8 TYR CB . 34279 1
111 . 1 1 8 8 TYR CD1 C 13 132.457 0.30 . 1 . . . . A 8 TYR CD1 . 34279 1
112 . 1 1 8 8 TYR CE1 C 13 118.472 0.30 . 1 . . . . A 8 TYR CE1 . 34279 1
113 . 1 1 8 8 TYR N N 15 115.931 0.30 . 1 . . . . A 8 TYR N . 34279 1
114 . 1 1 9 9 ALA H H 1 7.407 0.03 . 1 . . . . A 9 ALA H . 34279 1
115 . 1 1 9 9 ALA HA H 1 4 0.03 . 1 . . . . A 9 ALA HA . 34279 1
116 . 1 1 9 9 ALA HB1 H 1 1.419 0.03 . 1 . . . . A 9 ALA HB1 . 34279 1
117 . 1 1 9 9 ALA HB2 H 1 1.419 0.03 . 1 . . . . A 9 ALA HB2 . 34279 1
118 . 1 1 9 9 ALA HB3 H 1 1.419 0.03 . 1 . . . . A 9 ALA HB3 . 34279 1
119 . 1 1 9 9 ALA CA C 13 54.88 0.30 . 1 . . . . A 9 ALA CA . 34279 1
120 . 1 1 9 9 ALA CB C 13 18.222 0.30 . 1 . . . . A 9 ALA CB . 34279 1
121 . 1 1 9 9 ALA N N 15 123.05 0.30 . 1 . . . . A 9 ALA N . 34279 1
122 . 1 1 10 10 ALA H H 1 7.887 0.03 . 1 . . . . A 10 ALA H . 34279 1
123 . 1 1 10 10 ALA HA H 1 4.029 0.03 . 1 . . . . A 10 ALA HA . 34279 1
124 . 1 1 10 10 ALA HB1 H 1 1.403 0.03 . 1 . . . . A 10 ALA HB1 . 34279 1
125 . 1 1 10 10 ALA HB2 H 1 1.403 0.03 . 1 . . . . A 10 ALA HB2 . 34279 1
126 . 1 1 10 10 ALA HB3 H 1 1.403 0.03 . 1 . . . . A 10 ALA HB3 . 34279 1
127 . 1 1 10 10 ALA CA C 13 54.891 0.30 . 1 . . . . A 10 ALA CA . 34279 1
128 . 1 1 10 10 ALA CB C 13 18.137 0.30 . 1 . . . . A 10 ALA CB . 34279 1
129 . 1 1 10 10 ALA N N 15 120.043 0.30 . 1 . . . . A 10 ALA N . 34279 1
130 . 1 1 11 11 ALA H H 1 8.327 0.03 . 1 . . . . A 11 ALA H . 34279 1
131 . 1 1 11 11 ALA HA H 1 4.01 0.03 . 1 . . . . A 11 ALA HA . 34279 1
132 . 1 1 11 11 ALA HB1 H 1 1.288 0.03 . 1 . . . . A 11 ALA HB1 . 34279 1
133 . 1 1 11 11 ALA HB2 H 1 1.288 0.03 . 1 . . . . A 11 ALA HB2 . 34279 1
134 . 1 1 11 11 ALA HB3 H 1 1.288 0.03 . 1 . . . . A 11 ALA HB3 . 34279 1
135 . 1 1 11 11 ALA CA C 13 55.576 0.30 . 1 . . . . A 11 ALA CA . 34279 1
136 . 1 1 11 11 ALA CB C 13 17.93 0.30 . 1 . . . . A 11 ALA CB . 34279 1
137 . 1 1 11 11 ALA N N 15 120.872 0.30 . 1 . . . . A 11 ALA N . 34279 1
138 . 1 1 12 12 GLY H H 1 8.461 0.03 . 1 . . . . A 12 GLY H . 34279 1
139 . 1 1 12 12 GLY HA2 H 1 3.64 0.03 . 1 . . . . A 12 GLY HA2 . 34279 1
140 . 1 1 12 12 GLY HA3 H 1 3.731 0.03 . 1 . . . . A 12 GLY HA3 . 34279 1
141 . 1 1 12 12 GLY N N 15 104.961 0.30 . 1 . . . . A 12 GLY N . 34279 1
142 . 1 1 13 13 ASP H H 1 8.431 0.03 . 1 . . . . A 13 ASP H . 34279 1
143 . 1 1 13 13 ASP HA H 1 4.416 0.03 . 1 . . . . A 13 ASP HA . 34279 1
144 . 1 1 13 13 ASP HB2 H 1 2.978 0.03 . 2 . . . . A 13 ASP HB2 . 34279 1
145 . 1 1 13 13 ASP HB3 H 1 2.906 0.03 . 2 . . . . A 13 ASP HB3 . 34279 1
146 . 1 1 13 13 ASP CA C 13 55.37 0.30 . 1 . . . . A 13 ASP CA . 34279 1
147 . 1 1 13 13 ASP CB C 13 37.525 0.30 . 1 . . . . A 13 ASP CB . 34279 1
148 . 1 1 13 13 ASP N N 15 119.146 0.30 . 1 . . . . A 13 ASP N . 34279 1
149 . 1 1 14 14 ALA H H 1 7.918 0.03 . 1 . . . . A 14 ALA H . 34279 1
150 . 1 1 14 14 ALA HA H 1 4.202 0.03 . 1 . . . . A 14 ALA HA . 34279 1
151 . 1 1 14 14 ALA HB1 H 1 1.565 0.03 . 1 . . . . A 14 ALA HB1 . 34279 1
152 . 1 1 14 14 ALA HB2 H 1 1.565 0.03 . 1 . . . . A 14 ALA HB2 . 34279 1
153 . 1 1 14 14 ALA HB3 H 1 1.565 0.03 . 1 . . . . A 14 ALA HB3 . 34279 1
154 . 1 1 14 14 ALA CA C 13 54.911 0.30 . 1 . . . . A 14 ALA CA . 34279 1
155 . 1 1 14 14 ALA CB C 13 18.172 0.30 . 1 . . . . A 14 ALA CB . 34279 1
156 . 1 1 14 14 ALA N N 15 123.095 0.30 . 1 . . . . A 14 ALA N . 34279 1
157 . 1 1 15 15 ILE H H 1 8.218 0.03 . 1 . . . . A 15 ILE H . 34279 1
158 . 1 1 15 15 ILE HA H 1 3.732 0.03 . 1 . . . . A 15 ILE HA . 34279 1
159 . 1 1 15 15 ILE HB H 1 2.045 0.03 . 1 . . . . A 15 ILE HB . 34279 1
160 . 1 1 15 15 ILE HG12 H 1 1.905 0.03 . 1 . . . . A 15 ILE HG12 . 34279 1
161 . 1 1 15 15 ILE HG13 H 1 1.06 0.03 . 1 . . . . A 15 ILE HG13 . 34279 1
162 . 1 1 15 15 ILE HG21 H 1 0.949 0.03 . 1 . . . . A 15 ILE HG21 . 34279 1
163 . 1 1 15 15 ILE HG22 H 1 0.949 0.03 . 1 . . . . A 15 ILE HG22 . 34279 1
164 . 1 1 15 15 ILE HG23 H 1 0.949 0.03 . 1 . . . . A 15 ILE HG23 . 34279 1
165 . 1 1 15 15 ILE HD11 H 1 0.835 0.03 . 1 . . . . A 15 ILE HD11 . 34279 1
166 . 1 1 15 15 ILE HD12 H 1 0.835 0.03 . 1 . . . . A 15 ILE HD12 . 34279 1
167 . 1 1 15 15 ILE HD13 H 1 0.835 0.03 . 1 . . . . A 15 ILE HD13 . 34279 1
168 . 1 1 15 15 ILE CA C 13 65.489 0.30 . 1 . . . . A 15 ILE CA . 34279 1
169 . 1 1 15 15 ILE CB C 13 38.009 0.30 . 1 . . . . A 15 ILE CB . 34279 1
170 . 1 1 15 15 ILE CG1 C 13 29.397 0.30 . 1 . . . . A 15 ILE CG1 . 34279 1
171 . 1 1 15 15 ILE CG2 C 13 17.453 0.30 . 1 . . . . A 15 ILE CG2 . 34279 1
172 . 1 1 15 15 ILE CD1 C 13 13.464 0.30 . 1 . . . . A 15 ILE CD1 . 34279 1
173 . 1 1 15 15 ILE N N 15 118.736 0.30 . 1 . . . . A 15 ILE N . 34279 1
174 . 1 1 16 16 VAL H H 1 8.099 0.03 . 1 . . . . A 16 VAL H . 34279 1
175 . 1 1 16 16 VAL HA H 1 3.653 0.03 . 1 . . . . A 16 VAL HA . 34279 1
176 . 1 1 16 16 VAL HB H 1 2.193 0.03 . 1 . . . . A 16 VAL HB . 34279 1
177 . 1 1 16 16 VAL HG11 H 1 0.955 0.03 . 1 . . . . A 16 VAL HG11 . 34279 1
178 . 1 1 16 16 VAL HG12 H 1 0.955 0.03 . 1 . . . . A 16 VAL HG12 . 34279 1
179 . 1 1 16 16 VAL HG13 H 1 0.955 0.03 . 1 . . . . A 16 VAL HG13 . 34279 1
180 . 1 1 16 16 VAL HG21 H 1 1.095 0.03 . 1 . . . . A 16 VAL HG21 . 34279 1
181 . 1 1 16 16 VAL HG22 H 1 1.095 0.03 . 1 . . . . A 16 VAL HG22 . 34279 1
182 . 1 1 16 16 VAL HG23 H 1 1.095 0.03 . 1 . . . . A 16 VAL HG23 . 34279 1
183 . 1 1 16 16 VAL CA C 13 66.934 0.30 . 1 . . . . A 16 VAL CA . 34279 1
184 . 1 1 16 16 VAL CB C 13 31.454 0.30 . 1 . . . . A 16 VAL CB . 34279 1
185 . 1 1 16 16 VAL CG1 C 13 21.305 0.30 . 1 . . . . A 16 VAL CG1 . 34279 1
186 . 1 1 16 16 VAL CG2 C 13 23.328 0.30 . 1 . . . . A 16 VAL CG2 . 34279 1
187 . 1 1 16 16 VAL N N 15 119.179 0.30 . 1 . . . . A 16 VAL N . 34279 1
188 . 1 1 17 17 SER H H 1 8.134 0.03 . 1 . . . . A 17 SER H . 34279 1
189 . 1 1 17 17 SER HA H 1 4.212 0.03 . 1 . . . . A 17 SER HA . 34279 1
190 . 1 1 17 17 SER HB2 H 1 3.924 0.03 . 1 . . . . A 17 SER HB2 . 34279 1
191 . 1 1 17 17 SER HB3 H 1 3.983 0.03 . 1 . . . . A 17 SER HB3 . 34279 1
192 . 1 1 17 17 SER CA C 13 61.878 0.30 . 1 . . . . A 17 SER CA . 34279 1
193 . 1 1 17 17 SER CB C 13 62.722 0.30 . 1 . . . . A 17 SER CB . 34279 1
194 . 1 1 17 17 SER N N 15 114.444 0.30 . 1 . . . . A 17 SER N . 34279 1
195 . 1 1 18 18 PHE H H 1 8.297 0.03 . 1 . . . . A 18 PHE H . 34279 1
196 . 1 1 18 18 PHE HA H 1 4.419 0.03 . 1 . . . . A 18 PHE HA . 34279 1
197 . 1 1 18 18 PHE HB2 H 1 3.216 0.03 . 1 . . . . A 18 PHE HB2 . 34279 1
198 . 1 1 18 18 PHE HB3 H 1 3.295 0.03 . 1 . . . . A 18 PHE HB3 . 34279 1
199 . 1 1 18 18 PHE HD1 H 1 7.247 0.03 . 1 . . . . A 18 PHE HD1 . 34279 1
200 . 1 1 18 18 PHE HD2 H 1 7.247 0.03 . 1 . . . . A 18 PHE HD2 . 34279 1
201 . 1 1 18 18 PHE HE1 H 1 7.246 0.03 . 1 . . . . A 18 PHE HE1 . 34279 1
202 . 1 1 18 18 PHE HE2 H 1 7.246 0.03 . 1 . . . . A 18 PHE HE2 . 34279 1
203 . 1 1 18 18 PHE HZ H 1 7.18 0.03 . 1 . . . . A 18 PHE HZ . 34279 1
204 . 1 1 18 18 PHE CB C 13 39.366 0.30 . 1 . . . . A 18 PHE CB . 34279 1
205 . 1 1 18 18 PHE CD1 C 13 131.773 0.30 . 1 . . . . A 18 PHE CD1 . 34279 1
206 . 1 1 18 18 PHE CE1 C 13 130.876 0.30 . 1 . . . . A 18 PHE CE1 . 34279 1
207 . 1 1 18 18 PHE CZ C 13 129.466 0.30 . 1 . . . . A 18 PHE CZ . 34279 1
208 . 1 1 18 18 PHE N N 15 121.489 0.30 . 1 . . . . A 18 PHE N . 34279 1
209 . 1 1 19 19 GLY H H 1 8.828 0.03 . 1 . . . . A 19 GLY H . 34279 1
210 . 1 1 19 19 GLY HA2 H 1 3.729 0.03 . 1 . . . . A 19 GLY HA2 . 34279 1
211 . 1 1 19 19 GLY HA3 H 1 3.729 0.03 . 1 . . . . A 19 GLY HA3 . 34279 1
212 . 1 1 19 19 GLY CA C 13 47.153 0.30 . 1 . . . . A 19 GLY CA . 34279 1
213 . 1 1 19 19 GLY N N 15 106.874 0.30 . 1 . . . . A 19 GLY N . 34279 1
214 . 1 1 20 20 GLU H H 1 8.616 0.03 . 1 . . . . A 20 GLU H . 34279 1
215 . 1 1 20 20 GLU HA H 1 4.029 0.03 . 1 . . . . A 20 GLU HA . 34279 1
216 . 1 1 20 20 GLU HB2 H 1 2.22 0.03 . 1 . . . . A 20 GLU HB2 . 34279 1
217 . 1 1 20 20 GLU HB3 H 1 2.111 0.03 . 1 . . . . A 20 GLU HB3 . 34279 1
218 . 1 1 20 20 GLU HG2 H 1 2.476 0.03 . 1 . . . . A 20 GLU HG2 . 34279 1
219 . 1 1 20 20 GLU HG3 H 1 2.657 0.03 . 1 . . . . A 20 GLU HG3 . 34279 1
220 . 1 1 20 20 GLU CA C 13 58.93 0.30 . 1 . . . . A 20 GLU CA . 34279 1
221 . 1 1 20 20 GLU CB C 13 27.764 0.30 . 1 . . . . A 20 GLU CB . 34279 1
222 . 1 1 20 20 GLU CG C 13 33.47 0.30 . 1 . . . . A 20 GLU CG . 34279 1
223 . 1 1 21 21 GLY H H 1 7.886 0.03 . 1 . . . . A 21 GLY H . 34279 1
224 . 1 1 21 21 GLY HA2 H 1 3.901 0.03 . 1 . . . . A 21 GLY HA2 . 34279 1
225 . 1 1 21 21 GLY HA3 H 1 3.81 0.03 . 1 . . . . A 21 GLY HA3 . 34279 1
226 . 1 1 21 21 GLY CA C 13 46.294 0.30 . 1 . . . . A 21 GLY CA . 34279 1
227 . 1 1 21 21 GLY N N 15 105.97 0.30 . 1 . . . . A 21 GLY N . 34279 1
228 . 1 1 22 22 PHE H H 1 7.857 0.03 . 1 . . . . A 22 PHE H . 34279 1
229 . 1 1 22 22 PHE HA H 1 4.332 0.03 . 1 . . . . A 22 PHE HA . 34279 1
230 . 1 1 22 22 PHE HB2 H 1 3.044 0.03 . 1 . . . . A 22 PHE HB2 . 34279 1
231 . 1 1 22 22 PHE HB3 H 1 2.883 0.03 . 1 . . . . A 22 PHE HB3 . 34279 1
232 . 1 1 22 22 PHE HD1 H 1 7.141 0.03 . 1 . . . . A 22 PHE HD1 . 34279 1
233 . 1 1 22 22 PHE HD2 H 1 7.141 0.03 . 1 . . . . A 22 PHE HD2 . 34279 1
234 . 1 1 22 22 PHE HE1 H 1 7.07 0.03 . 1 . . . . A 22 PHE HE1 . 34279 1
235 . 1 1 22 22 PHE HE2 H 1 7.07 0.03 . 1 . . . . A 22 PHE HE2 . 34279 1
236 . 1 1 22 22 PHE HZ H 1 7.071 0.03 . 1 . . . . A 22 PHE HZ . 34279 1
237 . 1 1 22 22 PHE CA C 13 60.083 0.30 . 1 . . . . A 22 PHE CA . 34279 1
238 . 1 1 22 22 PHE CB C 13 39.517 0.30 . 1 . . . . A 22 PHE CB . 34279 1
239 . 1 1 22 22 PHE CD1 C 13 131.71 0.30 . 1 . . . . A 22 PHE CD1 . 34279 1
240 . 1 1 22 22 PHE CE1 C 13 130.912 0.30 . 1 . . . . A 22 PHE CE1 . 34279 1
241 . 1 1 22 22 PHE CZ C 13 129.144 0.30 . 1 . . . . A 22 PHE CZ . 34279 1
242 . 1 1 22 22 PHE N N 15 120.309 0.30 . 1 . . . . A 22 PHE N . 34279 1
243 . 1 1 23 23 LEU H H 1 7.873 0.03 . 1 . . . . A 23 LEU H . 34279 1
244 . 1 1 23 23 LEU HA H 1 4.091 0.03 . 1 . . . . A 23 LEU HA . 34279 1
245 . 1 1 23 23 LEU HB2 H 1 1.772 0.03 . 1 . . . . A 23 LEU HB2 . 34279 1
246 . 1 1 23 23 LEU HB3 H 1 1.609 0.03 . 1 . . . . A 23 LEU HB3 . 34279 1
247 . 1 1 23 23 LEU HG H 1 1.781 0.03 . 1 . . . . A 23 LEU HG . 34279 1
248 . 1 1 23 23 LEU HD11 H 1 0.897 0.03 . 2 . . . . A 23 LEU HD11 . 34279 1
249 . 1 1 23 23 LEU HD12 H 1 0.897 0.03 . 2 . . . . A 23 LEU HD12 . 34279 1
250 . 1 1 23 23 LEU HD13 H 1 0.897 0.03 . 2 . . . . A 23 LEU HD13 . 34279 1
251 . 1 1 23 23 LEU HD21 H 1 0.849 0.03 . 2 . . . . A 23 LEU HD21 . 34279 1
252 . 1 1 23 23 LEU HD22 H 1 0.849 0.03 . 2 . . . . A 23 LEU HD22 . 34279 1
253 . 1 1 23 23 LEU HD23 H 1 0.849 0.03 . 2 . . . . A 23 LEU HD23 . 34279 1
254 . 1 1 23 23 LEU CA C 13 56.625 0.30 . 1 . . . . A 23 LEU CA . 34279 1
255 . 1 1 23 23 LEU CB C 13 41.853 0.30 . 1 . . . . A 23 LEU CB . 34279 1
256 . 1 1 23 23 LEU CG C 13 26.916 0.30 . 1 . . . . A 23 LEU CG . 34279 1
257 . 1 1 23 23 LEU CD1 C 13 25.299 0.30 . 2 . . . . A 23 LEU CD1 . 34279 1
258 . 1 1 23 23 LEU CD2 C 13 23.559 0.30 . 2 . . . . A 23 LEU CD2 . 34279 1
259 . 1 1 23 23 LEU N N 15 117.786 0.30 . 1 . . . . A 23 LEU N . 34279 1
260 . 1 1 24 24 ASN H H 1 7.848 0.03 . 1 . . . . A 24 ASN H . 34279 1
261 . 1 1 24 24 ASN HA H 1 4.532 0.03 . 1 . . . . A 24 ASN HA . 34279 1
262 . 1 1 24 24 ASN HB2 H 1 2.794 0.03 . 1 . . . . A 24 ASN HB2 . 34279 1
263 . 1 1 24 24 ASN HB3 H 1 2.794 0.03 . 1 . . . . A 24 ASN HB3 . 34279 1
264 . 1 1 24 24 ASN HD21 H 1 7.527 0.03 . 1 . . . . A 24 ASN HD21 . 34279 1
265 . 1 1 24 24 ASN HD22 H 1 6.811 0.03 . 1 . . . . A 24 ASN HD22 . 34279 1
266 . 1 1 24 24 ASN CB C 13 38.86 0.30 . 1 . . . . A 24 ASN CB . 34279 1
267 . 1 1 24 24 ASN N N 15 114.977 0.30 . 1 . . . . A 24 ASN N . 34279 1
268 . 1 1 24 24 ASN ND2 N 15 111.948 0.30 . 1 . . . . A 24 ASN ND2 . 34279 1
269 . 1 1 25 25 ALA H H 1 7.601 0.03 . 1 . . . . A 25 ALA H . 34279 1
270 . 1 1 25 25 ALA HA H 1 4.333 0.03 . 1 . . . . A 25 ALA HA . 34279 1
271 . 1 1 25 25 ALA HB1 H 1 1.326 0.03 . 1 . . . . A 25 ALA HB1 . 34279 1
272 . 1 1 25 25 ALA HB2 H 1 1.326 0.03 . 1 . . . . A 25 ALA HB2 . 34279 1
273 . 1 1 25 25 ALA HB3 H 1 1.326 0.03 . 1 . . . . A 25 ALA HB3 . 34279 1
274 . 1 1 25 25 ALA CA C 13 52.224 0.30 . 1 . . . . A 25 ALA CA . 34279 1
275 . 1 1 25 25 ALA CB C 13 19.464 0.30 . 1 . . . . A 25 ALA CB . 34279 1
276 . 1 1 25 25 ALA N N 15 120.256 0.30 . 1 . . . . A 25 ALA N . 34279 1
277 . 1 1 26 26 TRP H H 1 7.751 0.03 . 1 . . . . A 26 TRP H . 34279 1
278 . 1 1 26 26 TRP HA H 1 4.459 0.03 . 1 . . . . A 26 TRP HA . 34279 1
279 . 1 1 26 26 TRP HB2 H 1 3.247 0.03 . 1 . . . . A 26 TRP HB2 . 34279 1
280 . 1 1 26 26 TRP HB3 H 1 3.139 0.03 . 1 . . . . A 26 TRP HB3 . 34279 1
281 . 1 1 26 26 TRP HD1 H 1 7.216 0.03 . 1 . . . . A 26 TRP HD1 . 34279 1
282 . 1 1 26 26 TRP HE1 H 1 10.294 0.03 . 1 . . . . A 26 TRP HE1 . 34279 1
283 . 1 1 26 26 TRP HE3 H 1 7.506 0.03 . 1 . . . . A 26 TRP HE3 . 34279 1
284 . 1 1 26 26 TRP HZ2 H 1 7.434 0.03 . 1 . . . . A 26 TRP HZ2 . 34279 1
285 . 1 1 26 26 TRP HZ3 H 1 6.977 0.03 . 1 . . . . A 26 TRP HZ3 . 34279 1
286 . 1 1 26 26 TRP HH2 H 1 7.061 0.03 . 1 . . . . A 26 TRP HH2 . 34279 1
287 . 1 1 26 26 TRP CB C 13 29.318 0.30 . 1 . . . . A 26 TRP CB . 34279 1
288 . 1 1 26 26 TRP CD1 C 13 126.564 0.30 . 1 . . . . A 26 TRP CD1 . 34279 1
289 . 1 1 26 26 TRP CE3 C 13 120.55 0.30 . 1 . . . . A 26 TRP CE3 . 34279 1
290 . 1 1 26 26 TRP CZ2 C 13 114.102 0.30 . 1 . . . . A 26 TRP CZ2 . 34279 1
291 . 1 1 26 26 TRP CZ3 C 13 121.057 0.30 . 1 . . . . A 26 TRP CZ3 . 34279 1
292 . 1 1 26 26 TRP CH2 C 13 123.521 0.30 . 1 . . . . A 26 TRP CH2 . 34279 1
293 . 1 1 26 26 TRP N N 15 119.623 0.30 . 1 . . . . A 26 TRP N . 34279 1
294 . 1 1 26 26 TRP NE1 N 15 129.502 0.30 . 1 . . . . A 26 TRP NE1 . 34279 1
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