Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 17194
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.01
_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' . . . 17194 1
2 '2D 1H-1H NOESY' . . . 17194 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $XEASY . . 17194 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 GLY HA2 H 1 3.80989 0.01 . 1 . . . . 1 GLY QA . 17194 1
2 . 1 1 1 1 GLY HA3 H 1 3.80989 0.01 . 1 . . . . 1 GLY QA . 17194 1
3 . 1 1 2 2 ILE H H 1 8.84112 0.00176 . 1 . . . . 2 ILE H . 17194 1
4 . 1 1 2 2 ILE HA H 1 4.03698 0.01 . 1 . . . . 2 ILE HA . 17194 1
5 . 1 1 2 2 ILE HB H 1 1.74644 0.00254 . 1 . . . . 2 ILE HB . 17194 1
6 . 1 1 2 2 ILE HD11 H 1 0.85580 0.01 . 1 . . . . 2 ILE QD1 . 17194 1
7 . 1 1 2 2 ILE HD12 H 1 0.85580 0.01 . 1 . . . . 2 ILE QD1 . 17194 1
8 . 1 1 2 2 ILE HD13 H 1 0.85580 0.01 . 1 . . . . 2 ILE QD1 . 17194 1
9 . 1 1 2 2 ILE HG12 H 1 1.51098 0.01 . 2 . . . . 2 ILE HG12 . 17194 1
10 . 1 1 2 2 ILE HG13 H 1 1.63206 0.01 . 2 . . . . 2 ILE HG13 . 17194 1
11 . 1 1 2 2 ILE HG21 H 1 1.15689 0.01 . 1 . . . . 2 ILE QG2 . 17194 1
12 . 1 1 2 2 ILE HG22 H 1 1.15689 0.01 . 1 . . . . 2 ILE QG2 . 17194 1
13 . 1 1 2 2 ILE HG23 H 1 1.15689 0.01 . 1 . . . . 2 ILE QG2 . 17194 1
14 . 1 1 3 3 ARG H H 1 7.73727 0.01 . 1 . . . . 3 ARG H . 17194 1
15 . 1 1 3 3 ARG HA H 1 4.07130 0.01 . 1 . . . . 3 ARG HA . 17194 1
16 . 1 1 3 3 ARG HB2 H 1 1.90066 0.01 . 2 . . . . 3 ARG HB2 . 17194 1
17 . 1 1 3 3 ARG HB3 H 1 2.01413 0.01 . 2 . . . . 3 ARG HB3 . 17194 1
18 . 1 1 4 4 CYS H H 1 8.34308 0.01 . 1 . . . . 4 CYS H . 17194 1
19 . 1 1 4 4 CYS HA H 1 4.19742 0.01 . 1 . . . . 4 CYS HA . 17194 1
20 . 1 1 4 4 CYS HB2 H 1 3.64605 0.01 . 1 . . . . 4 CYS QB . 17194 1
21 . 1 1 4 4 CYS HB3 H 1 3.64605 0.01 . 1 . . . . 4 CYS QB . 17194 1
22 . 1 1 5 5 PRO HA H 1 4.00162 0.01635 . 1 . . . . 5 PRO HA . 17194 1
23 . 1 1 5 5 PRO HB2 H 1 1.80480 0.00833 . 1 . . . . 5 PRO QB . 17194 1
24 . 1 1 5 5 PRO HB3 H 1 1.80480 0.00833 . 1 . . . . 5 PRO QB . 17194 1
25 . 1 1 5 5 PRO HD2 H 1 2.99936 0.01 . 2 . . . . 5 PRO HD2 . 17194 1
26 . 1 1 5 5 PRO HD3 H 1 3.12329 0.01 . 2 . . . . 5 PRO HD3 . 17194 1
27 . 1 1 5 5 PRO HG2 H 1 1.50541 0.00494 . 1 . . . . 5 PRO QG . 17194 1
28 . 1 1 5 5 PRO HG3 H 1 1.50541 0.00494 . 1 . . . . 5 PRO QG . 17194 1
29 . 1 1 6 6 LYS H H 1 8.65929 0.01 . 1 . . . . 6 LYS H . 17194 1
30 . 1 1 6 6 LYS HA H 1 4.12721 0.00278 . 1 . . . . 6 LYS HA . 17194 1
31 . 1 1 6 6 LYS HB2 H 1 1.78341 0.01 . 1 . . . . 6 LYS QB . 17194 1
32 . 1 1 6 6 LYS HB3 H 1 1.78341 0.01 . 1 . . . . 6 LYS QB . 17194 1
33 . 1 1 6 6 LYS HD2 H 1 1.19986 0.01 . 1 . . . . 6 LYS QD . 17194 1
34 . 1 1 6 6 LYS HD3 H 1 1.19986 0.01 . 1 . . . . 6 LYS QD . 17194 1
35 . 1 1 6 6 LYS HG2 H 1 1.46933 0.01 . 1 . . . . 6 LYS QG . 17194 1
36 . 1 1 6 6 LYS HG3 H 1 1.46933 0.01 . 1 . . . . 6 LYS QG . 17194 1
37 . 1 1 7 7 SER H H 1 8.35578 0.00896 . 1 . . . . 7 SER H . 17194 1
38 . 1 1 7 7 SER HA H 1 4.32025 0.01 . 1 . . . . 7 SER HA . 17194 1
39 . 1 1 7 7 SER HB2 H 1 3.93648 0.01 . 2 . . . . 7 SER HB2 . 17194 1
40 . 1 1 7 7 SER HB3 H 1 4.20843 0.01 . 2 . . . . 7 SER HB3 . 17194 1
41 . 1 1 8 8 TRP H H 1 8.17787 0.00576 . 1 . . . . 8 TRP H . 17194 1
42 . 1 1 8 8 TRP HA H 1 4.94584 0.01 . 1 . . . . 8 TRP HA . 17194 1
43 . 1 1 8 8 TRP HB2 H 1 3.20801 0.01 . 1 . . . . 8 TRP HB2 . 17194 1
44 . 1 1 8 8 TRP HB3 H 1 3.53297 0.01 . 1 . . . . 8 TRP HB3 . 17194 1
45 . 1 1 8 8 TRP HD1 H 1 7.19005 0.00548 . 1 . . . . 8 TRP HD1 . 17194 1
46 . 1 1 8 8 TRP HE1 H 1 10.65709 0.01 . 1 . . . . 8 TRP HE1 . 17194 1
47 . 1 1 8 8 TRP HE3 H 1 7.40709 0.01 . 1 . . . . 8 TRP HE3 . 17194 1
48 . 1 1 8 8 TRP HH2 H 1 6.98300 0.00527 . 1 . . . . 8 TRP HH2 . 17194 1
49 . 1 1 8 8 TRP HZ2 H 1 7.40682 0.01 . 1 . . . . 8 TRP HZ2 . 17194 1
50 . 1 1 8 8 TRP HZ3 H 1 6.81128 0.01 . 1 . . . . 8 TRP HZ3 . 17194 1
51 . 1 1 9 9 LYS H H 1 9.28744 0.00547 . 1 . . . . 9 LYS H . 17194 1
52 . 1 1 9 9 LYS HA H 1 4.69338 0.01 . 1 . . . . 9 LYS HA . 17194 1
53 . 1 1 9 9 LYS HB2 H 1 1.90700 0.01 . 1 . . . . 9 LYS QB . 17194 1
54 . 1 1 9 9 LYS HB3 H 1 1.90700 0.01 . 1 . . . . 9 LYS QB . 17194 1
55 . 1 1 9 9 LYS HD2 H 1 1.13323 0.01 . 1 . . . . 9 LYS QD . 17194 1
56 . 1 1 9 9 LYS HD3 H 1 1.13323 0.01 . 1 . . . . 9 LYS QD . 17194 1
57 . 1 1 9 9 LYS HE2 H 1 3.20047 0.01 . 2 . . . . 9 LYS HE2 . 17194 1
58 . 1 1 9 9 LYS HE3 H 1 3.54501 0.01 . 2 . . . . 9 LYS HE3 . 17194 1
59 . 1 1 9 9 LYS HG2 H 1 1.36989 0.01 . 2 . . . . 9 LYS HG2 . 17194 1
60 . 1 1 9 9 LYS HG3 H 1 1.45843 0.01 . 2 . . . . 9 LYS HG3 . 17194 1
61 . 1 1 10 10 CYS H H 1 8.84360 0.01 . 1 . . . . 10 CYS H . 17194 1
62 . 1 1 10 10 CYS HA H 1 4.51952 0.01 . 1 . . . . 10 CYS HA . 17194 1
63 . 1 1 10 10 CYS HB2 H 1 3.23991 0.01 . 1 . . . . 10 CYS QB . 17194 1
64 . 1 1 10 10 CYS HB3 H 1 3.23991 0.01 . 1 . . . . 10 CYS QB . 17194 1
65 . 1 1 11 11 LYS H H 1 7.73516 0.00720 . 1 . . . . 11 LYS H . 17194 1
66 . 1 1 11 11 LYS HA H 1 4.08672 0.01 . 1 . . . . 11 LYS HA . 17194 1
67 . 1 1 11 11 LYS HB2 H 1 1.66000 0.01 . 2 . . . . 11 LYS HB2 . 17194 1
68 . 1 1 11 11 LYS HB3 H 1 1.77130 0.01 . 2 . . . . 11 LYS HB3 . 17194 1
69 . 1 1 11 11 LYS HD2 H 1 0.90000 0.01 . 1 . . . . 11 LYS QD . 17194 1
70 . 1 1 11 11 LYS HD3 H 1 0.90000 0.01 . 1 . . . . 11 LYS QD . 17194 1
71 . 1 1 11 11 LYS HE2 H 1 2.88000 0.01 . 1 . . . . 11 LYS QE . 17194 1
72 . 1 1 11 11 LYS HE3 H 1 2.88000 0.01 . 1 . . . . 11 LYS QE . 17194 1
73 . 1 1 11 11 LYS HG2 H 1 1.50000 0.01 . 1 . . . . 11 LYS QG . 17194 1
74 . 1 1 11 11 LYS HG3 H 1 1.50000 0.01 . 1 . . . . 11 LYS QG . 17194 1
75 . 1 1 12 12 ALA H H 1 8.22803 0.01 . 1 . . . . 12 ALA H . 17194 1
76 . 1 1 12 12 ALA HA H 1 4.20132 0.00759 . 1 . . . . 12 ALA HA . 17194 1
77 . 1 1 12 12 ALA HB1 H 1 1.46293 0.01 . 1 . . . . 12 ALA QB . 17194 1
78 . 1 1 12 12 ALA HB2 H 1 1.46293 0.01 . 1 . . . . 12 ALA QB . 17194 1
79 . 1 1 12 12 ALA HB3 H 1 1.46293 0.01 . 1 . . . . 12 ALA QB . 17194 1
80 . 1 1 13 13 PHE H H 1 7.89016 0.01 . 1 . . . . 13 PHE H . 17194 1
81 . 1 1 13 13 PHE HA H 1 4.18607 0.01204 . 1 . . . . 13 PHE HA . 17194 1
82 . 1 1 13 13 PHE HB2 H 1 3.13707 0.01 . 1 . . . . 13 PHE HB2 . 17194 1
83 . 1 1 13 13 PHE HB3 H 1 3.33535 0.01 . 1 . . . . 13 PHE HB3 . 17194 1
84 . 1 1 13 13 PHE HD1 H 1 7.16702 0.00821 . 1 . . . . 13 PHE QD . 17194 1
85 . 1 1 13 13 PHE HD2 H 1 7.16702 0.00821 . 1 . . . . 13 PHE QD . 17194 1
86 . 1 1 13 13 PHE HE1 H 1 7.06552 0.00058 . 1 . . . . 13 PHE QE . 17194 1
87 . 1 1 13 13 PHE HE2 H 1 7.06552 0.00058 . 1 . . . . 13 PHE QE . 17194 1
88 . 1 1 14 14 LYS H H 1 8.33118 0.01 . 1 . . . . 14 LYS H . 17194 1
89 . 1 1 14 14 LYS HA H 1 3.98056 0.01 . 1 . . . . 14 LYS HA . 17194 1
90 . 1 1 14 14 LYS HB2 H 1 1.95835 0.01 . 2 . . . . 14 LYS HB2 . 17194 1
91 . 1 1 14 14 LYS HB3 H 1 2.10285 0.01 . 2 . . . . 14 LYS HB3 . 17194 1
92 . 1 1 14 14 LYS HD2 H 1 1.17000 0.01 . 1 . . . . 14 LYS QD . 17194 1
93 . 1 1 14 14 LYS HD3 H 1 1.17000 0.01 . 1 . . . . 14 LYS QD . 17194 1
94 . 1 1 14 14 LYS HE2 H 1 3.13000 0.01 . 2 . . . . 14 LYS HE2 . 17194 1
95 . 1 1 14 14 LYS HE3 H 1 3.30000 0.01 . 2 . . . . 14 LYS HE3 . 17194 1
96 . 1 1 14 14 LYS HG2 H 1 1.79470 0.00692 . 1 . . . . 14 LYS QG . 17194 1
97 . 1 1 14 14 LYS HG3 H 1 1.79470 0.00692 . 1 . . . . 14 LYS QG . 17194 1
98 . 1 1 15 15 GLN H H 1 8.12021 0.04299 . 1 . . . . 15 GLN H . 17194 1
99 . 1 1 15 15 GLN HA H 1 4.13973 0.01 . 1 . . . . 15 GLN HA . 17194 1
100 . 1 1 15 15 GLN HB2 H 1 1.77382 0.01 . 2 . . . . 15 GLN HB2 . 17194 1
101 . 1 1 15 15 GLN HB3 H 1 1.88032 0.01 . 2 . . . . 15 GLN HB3 . 17194 1
102 . 1 1 15 15 GLN HE21 H 1 6.92645 0.01 . 2 . . . . 15 GLN HE21 . 17194 1
103 . 1 1 15 15 GLN HE22 H 1 7.62221 0.01 . 2 . . . . 15 GLN HE22 . 17194 1
104 . 1 1 15 15 GLN HG2 H 1 2.09033 0.01 . 2 . . . . 15 GLN HG2 . 17194 1
105 . 1 1 15 15 GLN HG3 H 1 2.16797 0.01 . 2 . . . . 15 GLN HG3 . 17194 1
106 . 1 1 16 16 ARG H H 1 8.73936 0.01 . 1 . . . . 16 ARG H . 17194 1
107 . 1 1 16 16 ARG HA H 1 4.01510 0.01 . 1 . . . . 16 ARG HA . 17194 1
108 . 1 1 16 16 ARG HB2 H 1 1.79054 0.01 . 2 . . . . 16 ARG HB2 . 17194 1
109 . 1 1 16 16 ARG HB3 H 1 1.88498 0.01 . 2 . . . . 16 ARG HB3 . 17194 1
110 . 1 1 16 16 ARG HD2 H 1 3.41544 0.01 . 2 . . . . 16 ARG HD2 . 17194 1
111 . 1 1 16 16 ARG HD3 H 1 3.41544 0.01 . 2 . . . . 16 ARG HD3 . 17194 1
112 . 1 1 16 16 ARG HE H 1 7.19000 0.01 . 1 . . . . 16 ARG HE . 17194 1
113 . 1 1 16 16 ARG HG2 H 1 1.62978 0.01 . 1 . . . . 16 ARG QG . 17194 1
114 . 1 1 16 16 ARG HG3 H 1 1.62978 0.01 . 1 . . . . 16 ARG QG . 17194 1
115 . 1 1 17 17 VAL H H 1 8.08144 0.01 . 1 . . . . 17 VAL H . 17194 1
116 . 1 1 17 17 VAL HA H 1 3.45135 0.01 . 1 . . . . 17 VAL HA . 17194 1
117 . 1 1 17 17 VAL HB H 1 1.88348 0.00862 . 1 . . . . 17 VAL HB . 17194 1
118 . 1 1 17 17 VAL HG11 H 1 0.56781 0.01 . 2 . . . . 17 VAL QG1 . 17194 1
119 . 1 1 17 17 VAL HG12 H 1 0.56781 0.01 . 2 . . . . 17 VAL QG1 . 17194 1
120 . 1 1 17 17 VAL HG13 H 1 0.56781 0.01 . 2 . . . . 17 VAL QG1 . 17194 1
121 . 1 1 17 17 VAL HG21 H 1 0.74158 0.01 . 2 . . . . 17 VAL QG2 . 17194 1
122 . 1 1 17 17 VAL HG22 H 1 0.74158 0.01 . 2 . . . . 17 VAL QG2 . 17194 1
123 . 1 1 17 17 VAL HG23 H 1 0.74158 0.01 . 2 . . . . 17 VAL QG2 . 17194 1
124 . 1 1 18 18 LEU H H 1 8.17361 0.01 . 1 . . . . 18 LEU H . 17194 1
125 . 1 1 18 18 LEU HA H 1 3.93114 0.00292 . 1 . . . . 18 LEU HA . 17194 1
126 . 1 1 18 18 LEU HB2 H 1 1.61379 0.00145 . 2 . . . . 18 LEU HB2 . 17194 1
127 . 1 1 18 18 LEU HB3 H 1 1.90001 0.01 . 2 . . . . 18 LEU HB3 . 17194 1
128 . 1 1 18 18 LEU HD11 H 1 0.85126 0.01 . 2 . . . . 18 LEU QD1 . 17194 1
129 . 1 1 18 18 LEU HD12 H 1 0.85126 0.01 . 2 . . . . 18 LEU QD1 . 17194 1
130 . 1 1 18 18 LEU HD13 H 1 0.85126 0.01 . 2 . . . . 18 LEU QD1 . 17194 1
131 . 1 1 18 18 LEU HD21 H 1 0.90998 0.01 . 2 . . . . 18 LEU QD2 . 17194 1
132 . 1 1 18 18 LEU HD22 H 1 0.90998 0.01 . 2 . . . . 18 LEU QD2 . 17194 1
133 . 1 1 18 18 LEU HD23 H 1 0.90998 0.01 . 2 . . . . 18 LEU QD2 . 17194 1
134 . 1 1 18 18 LEU HG H 1 1.59000 0.01 . 1 . . . . 18 LEU HG . 17194 1
135 . 1 1 19 19 LYS H H 1 7.93576 0.01 . 1 . . . . 19 LYS H . 17194 1
136 . 1 1 19 19 LYS HA H 1 3.92678 0.00601 . 1 . . . . 19 LYS HA . 17194 1
137 . 1 1 19 19 LYS HB2 H 1 1.96023 0.01 . 2 . . . . 19 LYS HB2 . 17194 1
138 . 1 1 19 19 LYS HB3 H 1 2.10137 0.01 . 2 . . . . 19 LYS HB3 . 17194 1
139 . 1 1 19 19 LYS HD2 H 1 1.38458 0.01 . 2 . . . . 19 LYS HD2 . 17194 1
140 . 1 1 19 19 LYS HD3 H 1 1.53476 0.01 . 2 . . . . 19 LYS HD3 . 17194 1
141 . 1 1 19 19 LYS HE2 H 1 2.99240 0.01 . 2 . . . . 19 LYS HE2 . 17194 1
142 . 1 1 19 19 LYS HE3 H 1 3.13460 0.01 . 2 . . . . 19 LYS HE3 . 17194 1
143 . 1 1 19 19 LYS HG2 H 1 1.76342 0.01 . 2 . . . . 19 LYS HG2 . 17194 1
144 . 1 1 19 19 LYS HG3 H 1 1.89374 0.01 . 2 . . . . 19 LYS HG3 . 17194 1
145 . 1 1 20 20 ARG H H 1 7.54373 0.01 . 1 . . . . 20 ARG H . 17194 1
146 . 1 1 20 20 ARG HA H 1 4.19197 0.01 . 1 . . . . 20 ARG HA . 17194 1
147 . 1 1 20 20 ARG HB2 H 1 1.95459 0.00821 . 1 . . . . 20 ARG QB . 17194 1
148 . 1 1 20 20 ARG HB3 H 1 1.95459 0.00821 . 1 . . . . 20 ARG QB . 17194 1
149 . 1 1 20 20 ARG HD2 H 1 2.96053 0.01 . 1 . . . . 20 ARG QD . 17194 1
150 . 1 1 20 20 ARG HD3 H 1 2.96053 0.01 . 1 . . . . 20 ARG QD . 17194 1
151 . 1 1 20 20 ARG HE H 1 7.16000 0.01 . 1 . . . . 20 ARG HE . 17194 1
152 . 1 1 20 20 ARG HG2 H 1 1.57030 0.01 . 2 . . . . 20 ARG HG2 . 17194 1
153 . 1 1 20 20 ARG HG3 H 1 1.67021 0.01 . 2 . . . . 20 ARG HG3 . 17194 1
154 . 1 1 21 21 LEU H H 1 8.47328 0.01 . 1 . . . . 21 LEU H . 17194 1
155 . 1 1 21 21 LEU HA H 1 4.07397 0.01 . 1 . . . . 21 LEU HA . 17194 1
156 . 1 1 21 21 LEU HB2 H 1 1.79060 0.01 . 2 . . . . 21 LEU HB2 . 17194 1
157 . 1 1 21 21 LEU HB3 H 1 1.65352 0.01 . 2 . . . . 21 LEU HB3 . 17194 1
158 . 1 1 21 21 LEU HD11 H 1 0.74353 0.01 . 2 . . . . 21 LEU QD1 . 17194 1
159 . 1 1 21 21 LEU HD12 H 1 0.74353 0.01 . 2 . . . . 21 LEU QD1 . 17194 1
160 . 1 1 21 21 LEU HD13 H 1 0.74353 0.01 . 2 . . . . 21 LEU QD1 . 17194 1
161 . 1 1 21 21 LEU HD21 H 1 0.84435 0.00400 . 2 . . . . 21 LEU QD2 . 17194 1
162 . 1 1 21 21 LEU HD22 H 1 0.84435 0.00400 . 2 . . . . 21 LEU QD2 . 17194 1
163 . 1 1 21 21 LEU HD23 H 1 0.84435 0.00400 . 2 . . . . 21 LEU QD2 . 17194 1
164 . 1 1 21 21 LEU HG H 1 1.63010 0.00101 . 1 . . . . 21 LEU HG . 17194 1
165 . 1 1 22 22 LEU H H 1 8.49854 0.00039 . 1 . . . . 22 LEU H . 17194 1
166 . 1 1 22 22 LEU HA H 1 3.97529 0.00173 . 1 . . . . 22 LEU HA . 17194 1
167 . 1 1 22 22 LEU HB2 H 1 1.60700 0.01 . 2 . . . . 22 LEU HB2 . 17194 1
168 . 1 1 22 22 LEU HB3 H 1 1.76388 0.01 . 2 . . . . 22 LEU HB3 . 17194 1
169 . 1 1 22 22 LEU HD11 H 1 0.87610 0.01 . 1 . . . . 22 LEU QQD . 17194 1
170 . 1 1 22 22 LEU HD12 H 1 0.87610 0.01 . 1 . . . . 22 LEU QQD . 17194 1
171 . 1 1 22 22 LEU HD13 H 1 0.87610 0.01 . 1 . . . . 22 LEU QQD . 17194 1
172 . 1 1 22 22 LEU HD21 H 1 0.87610 0.01 . 1 . . . . 22 LEU QQD . 17194 1
173 . 1 1 22 22 LEU HD22 H 1 0.87610 0.01 . 1 . . . . 22 LEU QQD . 17194 1
174 . 1 1 22 22 LEU HD23 H 1 0.87610 0.01 . 1 . . . . 22 LEU QQD . 17194 1
175 . 1 1 22 22 LEU HG H 1 1.60730 0.01 . 1 . . . . 22 LEU HG . 17194 1
176 . 1 1 23 23 ALA H H 1 7.63510 0.00105 . 1 . . . . 23 ALA H . 17194 1
177 . 1 1 23 23 ALA HA H 1 4.09888 0.01 . 1 . . . . 23 ALA HA . 17194 1
178 . 1 1 23 23 ALA HB1 H 1 1.50825 0.00754 . 1 . . . . 23 ALA QB . 17194 1
179 . 1 1 23 23 ALA HB2 H 1 1.50825 0.00754 . 1 . . . . 23 ALA QB . 17194 1
180 . 1 1 23 23 ALA HB3 H 1 1.50825 0.00754 . 1 . . . . 23 ALA QB . 17194 1
181 . 1 1 24 24 MET H H 1 7.93594 0.01 . 1 . . . . 24 MET H . 17194 1
182 . 1 1 24 24 MET HA H 1 4.19710 0.01 . 1 . . . . 24 MET HA . 17194 1
183 . 1 1 24 24 MET HB2 H 1 2.17832 0.01 . 1 . . . . 24 MET HB2 . 17194 1
184 . 1 1 24 24 MET HB3 H 1 2.29463 0.01 . 1 . . . . 24 MET HB3 . 17194 1
185 . 1 1 24 24 MET HE1 H 1 2.08107 0.01 . 1 . . . . 24 MET QE . 17194 1
186 . 1 1 24 24 MET HE2 H 1 2.08107 0.01 . 1 . . . . 24 MET QE . 17194 1
187 . 1 1 24 24 MET HE3 H 1 2.08107 0.01 . 1 . . . . 24 MET QE . 17194 1
188 . 1 1 24 24 MET HG2 H 1 2.59100 0.00005 . 2 . . . . 24 MET HG2 . 17194 1
189 . 1 1 24 24 MET HG3 H 1 2.79702 0.00004 . 2 . . . . 24 MET HG3 . 17194 1
190 . 1 1 25 25 LEU H H 1 7.94794 0.00579 . 1 . . . . 25 LEU H . 17194 1
191 . 1 1 25 25 LEU HA H 1 4.17157 0.01 . 1 . . . . 25 LEU HA . 17194 1
192 . 1 1 25 25 LEU HB2 H 1 1.90973 0.00479 . 1 . . . . 25 LEU QB . 17194 1
193 . 1 1 25 25 LEU HB3 H 1 1.90973 0.00479 . 1 . . . . 25 LEU QB . 17194 1
194 . 1 1 25 25 LEU HD11 H 1 0.83557 0.01 . 1 . . . . 25 LEU QQD . 17194 1
195 . 1 1 25 25 LEU HD12 H 1 0.83557 0.01 . 1 . . . . 25 LEU QQD . 17194 1
196 . 1 1 25 25 LEU HD13 H 1 0.83557 0.01 . 1 . . . . 25 LEU QQD . 17194 1
197 . 1 1 25 25 LEU HD21 H 1 0.83557 0.01 . 1 . . . . 25 LEU QQD . 17194 1
198 . 1 1 25 25 LEU HD22 H 1 0.83557 0.01 . 1 . . . . 25 LEU QQD . 17194 1
199 . 1 1 25 25 LEU HD23 H 1 0.83557 0.01 . 1 . . . . 25 LEU QQD . 17194 1
200 . 1 1 25 25 LEU HG H 1 1.63051 0.01 . 1 . . . . 25 LEU HG . 17194 1
201 . 1 1 26 26 ARG H H 1 7.78817 0.01 . 1 . . . . 26 ARG H . 17194 1
202 . 1 1 26 26 ARG HA H 1 4.14878 0.01 . 1 . . . . 26 ARG HA . 17194 1
203 . 1 1 26 26 ARG HB2 H 1 1.97822 0.01 . 2 . . . . 26 ARG HB2 . 17194 1
204 . 1 1 26 26 ARG HB3 H 1 2.03867 0.01 . 2 . . . . 26 ARG HB3 . 17194 1
205 . 1 1 26 26 ARG HD2 H 1 3.28556 0.01 . 2 . . . . 26 ARG HD2 . 17194 1
206 . 1 1 26 26 ARG HD3 H 1 3.28556 0.01 . 2 . . . . 26 ARG HD3 . 17194 1
207 . 1 1 26 26 ARG HE H 1 7.05000 0.01 . 1 . . . . 26 ARG HE . 17194 1
208 . 1 1 26 26 ARG HG2 H 1 2.26268 0.01 . 1 . . . . 26 ARG QG . 17194 1
209 . 1 1 26 26 ARG HG3 H 1 2.26268 0.01 . 1 . . . . 26 ARG QG . 17194 1
210 . 1 1 27 27 GLN H H 1 8.12133 0.01 . 1 . . . . 27 GLN H . 17194 1
211 . 1 1 27 27 GLN HA H 1 4.08221 0.01 . 1 . . . . 27 GLN HA . 17194 1
212 . 1 1 27 27 GLN HB2 H 1 1.80449 0.01 . 2 . . . . 27 GLN HB2 . 17194 1
213 . 1 1 27 27 GLN HB3 H 1 1.88789 0.01 . 2 . . . . 27 GLN HB3 . 17194 1
214 . 1 1 27 27 GLN HE21 H 1 6.86229 0.01 . 2 . . . . 27 GLN HE21 . 17194 1
215 . 1 1 27 27 GLN HE22 H 1 7.52999 0.01 . 2 . . . . 27 GLN HE22 . 17194 1
216 . 1 1 27 27 GLN HG2 H 1 2.02074 0.01 . 2 . . . . 27 GLN HG2 . 17194 1
217 . 1 1 27 27 GLN HG3 H 1 2.10110 0.01 . 2 . . . . 27 GLN HG3 . 17194 1
218 . 1 1 28 28 HIS H H 1 7.79652 0.01 . 1 . . . . 28 HIS H . 17194 1
219 . 1 1 28 28 HIS HA H 1 4.49867 0.01 . 1 . . . . 28 HIS HA . 17194 1
220 . 1 1 28 28 HIS HB2 H 1 2.98160 0.01 . 1 . . . . 28 HIS HB2 . 17194 1
221 . 1 1 28 28 HIS HB3 H 1 3.27636 0.00821 . 1 . . . . 28 HIS HB3 . 17194 1
222 . 1 1 28 28 HIS HD1 H 1 8.12000 0.01 . 1 . . . . 28 HIS HD1 . 17194 1
223 . 1 1 28 28 HIS HD2 H 1 7.22000 0.01 . 1 . . . . 28 HIS HD2 . 17194 1
224 . 1 1 28 28 HIS HE1 H 1 8.46000 0.01 . 1 . . . . 28 HIS HE1 . 17194 1
225 . 1 1 29 29 ALA H H 1 7.92813 0.01 . 1 . . . . 29 ALA H . 17194 1
226 . 1 1 29 29 ALA HA H 1 4.28363 0.01 . 1 . . . . 29 ALA HA . 17194 1
227 . 1 1 29 29 ALA HB1 H 1 1.26241 0.00190 . 1 . . . . 29 ALA QB . 17194 1
228 . 1 1 29 29 ALA HB2 H 1 1.26241 0.00190 . 1 . . . . 29 ALA QB . 17194 1
229 . 1 1 29 29 ALA HB3 H 1 1.26241 0.00190 . 1 . . . . 29 ALA QB . 17194 1
230 . 1 1 30 30 PHE H H 1 7.73568 0.01 . 1 . . . . 30 PHE H . 17194 1
231 . 1 1 30 30 PHE HA H 1 4.48171 0.01 . 1 . . . . 30 PHE HA . 17194 1
232 . 1 1 30 30 PHE HB2 H 1 2.94111 0.02137 . 1 . . . . 30 PHE HB2 . 17194 1
233 . 1 1 30 30 PHE HB3 H 1 3.18489 0.02313 . 1 . . . . 30 PHE HB3 . 17194 1
234 . 1 1 30 30 PHE HD1 H 1 7.26697 0.01 . 1 . . . . 30 PHE HB3 . 17194 1
235 . 1 1 30 30 PHE HD2 H 1 7.26697 0.01 . 1 . . . . 30 PHE HB3 . 17194 1
236 . 1 1 30 30 PHE HE1 H 1 7.26697 0.01 . 1 . . . . 30 PHE HB3 . 17194 1
237 . 1 1 30 30 PHE HE2 H 1 7.26697 0.01 . 1 . . . . 30 PHE HB3 . 17194 1
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