Content for NMR-STAR saveframe, "spectral_peak_list_1"
save_spectral_peak_list_1
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_1
_Spectral_peak_list.Entry_ID 51400
_Spectral_peak_list.ID 1
_Spectral_peak_list.Name 'peak list 1'
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $sample_1
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Chem_shift_reference_ID 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1
_Spectral_peak_list.Experiment_ID 1
_Spectral_peak_list.Experiment_name '2D 1H-1H TOCSY'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 2
_Spectral_peak_list.Chemical_shift_list .
_Spectral_peak_list.Assigned_chem_shift_list_ID 1
_Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1
_Spectral_peak_list.Details 'Default list'
_Spectral_peak_list.Text_data_format .
_Spectral_peak_list.Text_data .
loop_
_Spectral_dim.ID
_Spectral_dim.Axis_code
_Spectral_dim.Spectrometer_frequency
_Spectral_dim.Atom_type
_Spectral_dim.Atom_isotope_number
_Spectral_dim.Spectral_region
_Spectral_dim.Magnetization_linkage_ID
_Spectral_dim.Under_sampling_type
_Spectral_dim.Sweep_width
_Spectral_dim.Sweep_width_units
_Spectral_dim.Value_first_point
_Spectral_dim.Absolute_peak_positions
_Spectral_dim.Acquisition
_Spectral_dim.Center_frequency_offset
_Spectral_dim.Encoding_code
_Spectral_dim.Encoded_reduced_dimension_ID
_Spectral_dim.Entry_ID
_Spectral_dim.Spectral_peak_list_ID
1 . . H 1 1H . folded 8417.50841751 Hz . . . . . . 51400 1
2 . . H 1 1H . folded 8417.50841751 Hz . . . . . . 51400 1
stop_
loop_
_Spectral_peak_software.Software_ID
_Spectral_peak_software.Software_label
_Spectral_peak_software.Method_ID
_Spectral_peak_software.Method_label
_Spectral_peak_software.Entry_ID
_Spectral_peak_software.Spectral_peak_list_ID
1 $software_1 . . 51400 1
stop_
loop_
_Peak.ID
_Peak.Figure_of_merit
_Peak.Type
_Peak.Restraint
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
1 1.0 . . . 51400 1
2 1.0 . . . 51400 1
3 1.0 . . . 51400 1
4 1.0 . . . 51400 1
5 1.0 . . . 51400 1
6 1.0 . . . 51400 1
7 1.0 . . . 51400 1
8 1.0 . . . 51400 1
9 1.0 . . . 51400 1
10 1.0 . . . 51400 1
11 1.0 . . . 51400 1
12 1.0 . . . 51400 1
13 1.0 . . . 51400 1
14 1.0 . . . 51400 1
15 1.0 . . . 51400 1
16 1.0 . . . 51400 1
17 1.0 . . . 51400 1
18 1.0 . . . 51400 1
19 1.0 . . . 51400 1
20 1.0 . . . 51400 1
21 1.0 . . . 51400 1
22 1.0 . . . 51400 1
23 1.0 . . . 51400 1
24 1.0 . . . 51400 1
25 1.0 . . . 51400 1
26 1.0 . . . 51400 1
27 1.0 . . . 51400 1
28 1.0 . . . 51400 1
29 1.0 . . . 51400 1
30 1.0 . . . 51400 1
31 1.0 . . . 51400 1
32 1.0 . . . 51400 1
33 1.0 . . . 51400 1
34 1.0 . . . 51400 1
35 1.0 . . . 51400 1
36 1.0 . . . 51400 1
37 1.0 . . . 51400 1
38 1.0 . . . 51400 1
39 1.0 . . . 51400 1
40 1.0 . . . 51400 1
41 1.0 . . . 51400 1
42 1.0 . . . 51400 1
43 1.0 . . . 51400 1
44 1.0 . . . 51400 1
45 1.0 . . . 51400 1
46 1.0 . . . 51400 1
47 1.0 . . . 51400 1
48 1.0 . . . 51400 1
49 1.0 . . . 51400 1
50 1.0 . . . 51400 1
51 1.0 . . . 51400 1
52 1.0 . . . 51400 1
53 1.0 . . . 51400 1
54 1.0 . . . 51400 1
55 1.0 . . . 51400 1
56 1.0 . . . 51400 1
57 1.0 . . . 51400 1
58 1.0 . . . 51400 1
59 1.0 . . . 51400 1
60 1.0 . . . 51400 1
61 1.0 . . . 51400 1
62 1.0 . . . 51400 1
63 1.0 . . . 51400 1
64 1.0 . . . 51400 1
65 1.0 . . . 51400 1
66 1.0 . . . 51400 1
67 1.0 . . . 51400 1
68 1.0 . . . 51400 1
69 1.0 . . . 51400 1
70 1.0 . . . 51400 1
71 1.0 . . . 51400 1
72 1.0 . . . 51400 1
73 1.0 . . . 51400 1
74 1.0 . . . 51400 1
75 1.0 . . . 51400 1
76 1.0 . . . 51400 1
77 1.0 . . . 51400 1
78 1.0 . . . 51400 1
79 1.0 . . . 51400 1
80 1.0 . . . 51400 1
81 1.0 . . . 51400 1
82 1.0 . . . 51400 1
83 1.0 . . . 51400 1
84 1.0 . . . 51400 1
85 1.0 . . . 51400 1
86 1.0 . . . 51400 1
87 1.0 . . . 51400 1
88 1.0 . . . 51400 1
89 1.0 . . . 51400 1
90 1.0 . . . 51400 1
91 1.0 . . . 51400 1
92 1.0 . . . 51400 1
93 1.0 . . . 51400 1
94 1.0 . . . 51400 1
95 1.0 . . . 51400 1
96 1.0 . . . 51400 1
97 1.0 . . . 51400 1
98 1.0 . . . 51400 1
99 1.0 . . . 51400 1
stop_
loop_
_Peak_general_char.Peak_ID
_Peak_general_char.Intensity_val
_Peak_general_char.Intensity_val_err
_Peak_general_char.Measurement_method
_Peak_general_char.Entry_ID
_Peak_general_char.Spectral_peak_list_ID
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stop_
loop_
_Peak_char.Peak_ID
_Peak_char.Spectral_dim_ID
_Peak_char.Chem_shift_val
_Peak_char.Chem_shift_val_err
_Peak_char.Line_width_val
_Peak_char.Line_width_val_err
_Peak_char.Phase_val
_Peak_char.Phase_val_err
_Peak_char.Decay_rate_val
_Peak_char.Decay_rate_val_err
_Peak_char.Coupling_pattern
_Peak_char.Bounding_box_upper_val
_Peak_char.Bounding_box_lower_val
_Peak_char.Bounding_box_range_val
_Peak_char.Details
_Peak_char.Derivation_method_ID
_Peak_char.Entry_ID
_Peak_char.Spectral_peak_list_ID
1 1 8.680 . 14.05764007410 . . . . . . . . . . . 51400 1
1 2 4.478 . 29.44660106490 . . . . . . . . . . . 51400 1
2 1 8.681 . 14.05738921280 . . . . . . . . . . . 51400 1
2 2 2.903 . 26.95002941170 . . . . . . . . . . . 51400 1
3 1 8.681 . 13.66115379010 . . . . . . . . . . . 51400 1
3 2 2.832 . 22.18868194610 . . . . . . . . . . . 51400 1
4 1 8.485 . 18.40519182610 . . . . . . . . . . . 51400 1
4 2 4.572 . 21.58360449150 . . . . . . . . . . . 51400 1
5 1 8.489 . 11.82321847890 . . . . . . . . . . . 51400 1
5 2 2.828 . 33.94153383040 . . . . . . . . . . . 51400 1
6 1 8.489 . 12.18433331960 . . . . . . . . . . . 51400 1
6 2 2.800 . 32.26427518160 . . . . . . . . . . . 51400 1
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8 1 8.489 . 11.65188021130 . . . . . . . . . . . 51400 1
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54 2 2.733 . 35.04682871630 . . . . . . . . . . . 51400 1
55 1 8.077 . 12.54732962010 . . . . . . . . . . . 51400 1
55 2 2.717 . 33.98217336100 . . . . . . . . . . . 51400 1
56 1 7.988 . 15.11226097740 . . . . . . . . . . . 51400 1
56 2 4.464 . 16.26082943750 . . . . . . . . . . . 51400 1
57 1 7.988 . 13.42283555550 . . . . . . . . . . . 51400 1
57 2 3.056 . 26.70619222850 . . . . . . . . . . . 51400 1
58 1 7.988 . 14.61241983810 . . . . . . . . . . . 51400 1
58 2 2.831 . 27.88674550430 . . . . . . . . . . . 51400 1
59 1 3.980 . 21.36535516090 . . . . . . . . . . . 51400 1
59 2 3.738 . 18.06101012310 . . . . . . . . . . . 51400 1
60 1 3.986 . 33.00832979610 . . . . . . . . . . . 51400 1
60 2 1.150 . 20.39502365420 . . . . . . . . . . . 51400 1
61 1 3.893 . 20.34334622650 . . . . . . . . . . . 51400 1
61 2 1.901 . 19.05291570160 . . . . . . . . . . . 51400 1
62 1 3.880 . 22.24688176760 . . . . . . . . . . . 51400 1
62 2 0.826 . 32.12780663460 . . . . . . . . . . . 51400 1
63 1 8.114 . 9.65276651511 . . . . . . . . . . . 51400 1
63 2 1.899 . 36.41803657970 . . . . . . . . . . . 51400 1
64 1 2.897 . 26.86373312470 . . . . . . . . . . . 51400 1
64 2 1.371 . 58.99103803670 . . . . . . . . . . . 51400 1
65 1 2.895 . 27.49490015430 . . . . . . . . . . . 51400 1
65 2 1.348 . 57.48185645850 . . . . . . . . . . . 51400 1
66 1 2.898 . 25.25922425270 . . . . . . . . . . . 51400 1
66 2 1.588 . 24.55430400090 . . . . . . . . . . . 51400 1
67 1 2.893 . 33.56524188110 . . . . . . . . . . . 51400 1
67 2 1.760 . 23.03759658380 . . . . . . . . . . . 51400 1
68 1 2.892 . 30.89607765380 . . . . . . . . . . . 51400 1
68 2 1.672 . 25.65357821560 . . . . . . . . . . . 51400 1
69 1 4.230 . 29.15660540260 . . . . . . . . . . . 51400 1
69 2 1.586 . 21.86858292780 . . . . . . . . . . . 51400 1
70 1 4.233 . 42.00220910790 . . . . . . . . . . . 51400 1
70 2 1.669 . 31.16399752170 . . . . . . . . . . . 51400 1
72 1 4.235 . 31.68428385700 . . . . . . . . . . . 51400 1
72 2 1.758 . 36.94133325060 . . . . . . . . . . . 51400 1
73 1 4.234 . 24.39876999520 . . . . . . . . . . . 51400 1
73 2 1.363 . 55.95009736340 . . . . . . . . . . . 51400 1
74 1 4.233 . 24.01645737460 . . . . . . . . . . . 51400 1
74 2 1.354 . 56.92695126390 . . . . . . . . . . . 51400 1
75 1 3.090 . 24.49108695340 . . . . . . . . . . . 51400 1
75 2 1.784 . 25.34100503630 . . . . . . . . . . . 51400 1
76 1 3.088 . 25.33097058430 . . . . . . . . . . . 51400 1
76 2 1.667 . 25.36609116630 . . . . . . . . . . . 51400 1
77 1 4.265 . 21.42506015020 . . . . . . . . . . . 51400 1
77 2 1.553 . 47.96819253400 . . . . . . . . . . . 51400 1
78 1 3.086 . 27.53152590410 . . . . . . . . . . . 51400 1
78 2 1.558 . 67.67184244660 . . . . . . . . . . . 51400 1
79 1 3.084 . 25.63300758900 . . . . . . . . . . . 51400 1
79 2 1.520 . 62.51614101810 . . . . . . . . . . . 51400 1
80 1 4.261 . 22.99444844020 . . . . . . . . . . . 51400 1
80 2 1.520 . 57.30424665840 . . . . . . . . . . . 51400 1
81 1 4.257 . 47.38268226080 . . . . . . . . . . . 51400 1
81 2 1.781 . 39.64310944680 . . . . . . . . . . . 51400 1
82 1 4.261 . 48.24915718950 . . . . . . . . . . . 51400 1
82 2 1.667 . 30.41693257160 . . . . . . . . . . . 51400 1
83 1 3.739 . 11.04040579360 . . . . . . . . . . . 51400 1
83 2 1.156 . 13.86560574930 . . . . . . . . . . . 51400 1
84 1 3.733 . 18.20500450900 . . . . . . . . . . . 51400 1
84 2 3.987 . 20.41158050000 . . . . . . . . . . . 51400 1
85 1 8.250 . 16.51482650330 . . . . . . . . . . . 51400 1
85 2 1.340 . 52.53436990860 . . . . . . . . . . . 51400 1
86 1 8.249 . 18.39327591440 . . . . . . . . . . . 51400 1
86 2 1.370 . 57.02528889330 . . . . . . . . . . . 51400 1
87 1 8.251 . 17.25022640290 . . . . . . . . . . . 51400 1
87 2 1.588 . 21.21232976820 . . . . . . . . . . . 51400 1
88 1 8.251 . 15.55829236800 . . . . . . . . . . . 51400 1
88 2 1.761 . 48.26671748050 . . . . . . . . . . . 51400 1
89 1 8.250 . 16.29093279340 . . . . . . . . . . . 51400 1
89 2 1.671 . 49.52754637210 . . . . . . . . . . . 51400 1
90 1 8.251 . 15.41266738370 . . . . . . . . . . . 51400 1
90 2 4.232 . 23.54584157670 . . . . . . . . . . . 51400 1
91 1 8.198 . 18.32604508610 . . . . . . . . . . . 51400 1
91 2 1.674 . 50.31224051710 . . . . . . . . . . . 51400 1
92 1 7.073 . 20.23622845160 . . . . . . . . . . . 51400 1
92 2 1.667 . 26.69966983470 . . . . . . . . . . . 51400 1
93 1 7.073 . 18.91444026420 . . . . . . . . . . . 51400 1
93 2 1.784 . 23.79770632140 . . . . . . . . . . . 51400 1
94 1 7.072 . 16.94894198220 . . . . . . . . . . . 51400 1
94 2 1.541 . 45.46760710000 . . . . . . . . . . . 51400 1
95 1 7.066 . 24.79588343240 . . . . . . . . . . . 51400 1
95 2 3.094 . 19.04890192080 . . . . . . . . . . . 51400 1
96 1 7.418 . 44.36607513360 . . . . . . . . . . . 51400 1
96 2 2.903 . 28.01568821220 . . . . . . . . . . . 51400 1
97 1 7.423 . 37.47165403780 . . . . . . . . . . . 51400 1
97 2 1.585 . 27.86868349070 . . . . . . . . . . . 51400 1
98 1 7.425 . 38.11912705200 . . . . . . . . . . . 51400 1
98 2 1.370 . 53.11034745240 . . . . . . . . . . . 51400 1
99 1 7.422 . 35.76855667510 . . . . . . . . . . . 51400 1
99 2 1.337 . 52.33518603670 . . . . . . . . . . . 51400 1
stop_
loop_
_Assigned_peak_chem_shift.Peak_ID
_Assigned_peak_chem_shift.Spectral_dim_ID
_Assigned_peak_chem_shift.Set_ID
_Assigned_peak_chem_shift.Magnetization_linkage_ID
_Assigned_peak_chem_shift.Assembly_atom_ID
_Assigned_peak_chem_shift.Val
_Assigned_peak_chem_shift.Contribution_fractional_val
_Assigned_peak_chem_shift.Figure_of_merit
_Assigned_peak_chem_shift.Assigned_chem_shift_list_ID
_Assigned_peak_chem_shift.Atom_chem_shift_ID
_Assigned_peak_chem_shift.Entity_assembly_ID
_Assigned_peak_chem_shift.Entity_ID
_Assigned_peak_chem_shift.Comp_index_ID
_Assigned_peak_chem_shift.Comp_ID
_Assigned_peak_chem_shift.Atom_ID
_Assigned_peak_chem_shift.Ambiguity_code
_Assigned_peak_chem_shift.Ambiguity_set_ID
_Assigned_peak_chem_shift.Auth_atom_peak_num
_Assigned_peak_chem_shift.Auth_entity_ID
_Assigned_peak_chem_shift.Auth_seq_ID
_Assigned_peak_chem_shift.Auth_comp_ID
_Assigned_peak_chem_shift.Auth_atom_ID
_Assigned_peak_chem_shift.Auth_ambiguity_code
_Assigned_peak_chem_shift.Auth_ambiguity_set_ID
_Assigned_peak_chem_shift.Auth_amb_atom_grp_ID
_Assigned_peak_chem_shift.Resonance_ID
_Assigned_peak_chem_shift.Details
_Assigned_peak_chem_shift.Entry_ID
_Assigned_peak_chem_shift.Spectral_peak_list_ID
1 1 1 . . 8.680 . . 1 . 1 1 2 TYR H . . . . . . . . . . 1 . 51400 1
1 2 1 . . 4.478 . . 1 . 1 1 2 TYR HA . . . . . . . . . . 2 . 51400 1
2 1 1 . . 8.681 . . 1 . 1 1 2 TYR H . . . . . . . . . . 1 . 51400 1
2 2 1 . . 2.903 . . 1 . 1 1 2 TYR HB2 . . . . . . . . . . 3 . 51400 1
3 1 1 . . 8.681 . . 1 . 1 1 2 TYR H . . . . . . . . . . 1 . 51400 1
3 2 1 . . 2.832 . . 1 . 1 1 2 TYR HB3 . . . . . . . . . . 4 . 51400 1
4 1 1 . . 8.485 . . 1 . 1 1 5 ASP H . . . . . . . . . . 6 . 51400 1
4 2 1 . . 4.572 . . 1 . 1 1 5 ASP HA . . . . . . . . . . 7 . 51400 1
5 1 1 . . 8.489 . . 1 . 1 1 5 ASP H . . . . . . . . . . 6 . 51400 1
5 2 1 . . 2.828 . . 1 . . . . . . . . . . . . . . . . 8 . 51400 1
6 1 1 . . 8.489 . . 1 . 1 1 5 ASP H . . . . . . . . . . 6 . 51400 1
6 2 1 . . 2.800 . . 1 . 1 1 5 ASP HB2 . . . . . . . . . . 9 . 51400 1
7 1 1 . . 8.489 . . 1 . 1 1 5 ASP H . . . . . . . . . . 6 . 51400 1
7 2 1 . . 2.688 . . 1 . . . . . . . . . . . . . . . . 10 . 51400 1
8 1 1 . . 8.489 . . 1 . 1 1 5 ASP H . . . . . . . . . . 6 . 51400 1
8 2 1 . . 2.664 . . 1 . 1 1 5 ASP HB3 . . . . . . . . . . 11 . 51400 1
9 1 1 . . 8.438 . . 1 . 1 1 9 HIS H . . . . . . . . . . 12 . 51400 1
9 2 1 . . 4.600 . . 1 . 1 1 9 HIS HA . . . . . . . . . . 13 . 51400 1
10 1 1 . . 8.441 . . 1 . 1 1 9 HIS H . . . . . . . . . . 12 . 51400 1
10 2 1 . . 3.251 . . 1 . . . . . . . . . . . . . . . . 14 . 51400 1
11 1 1 . . 8.442 . . 1 . 1 1 9 HIS H . . . . . . . . . . 12 . 51400 1
11 2 1 . . 3.232 . . 1 . 1 1 9 HIS HB2 . . . . . . . . . . 15 . 51400 1
12 1 1 . . 8.441 . . 1 . 1 1 9 HIS H . . . . . . . . . . 12 . 51400 1
12 2 1 . . 3.118 . . 1 . 1 1 9 HIS HB3 . . . . . . . . . . 16 . 51400 1
13 1 1 . . 8.356 . . 1 . 1 1 11 GLN H . . . . . . . . . . 17 . 51400 1
13 2 1 . . 4.251 . . 1 . 1 1 11 GLN HA . . . . . . . . . . 18 . 51400 1
14 1 1 . . 8.357 . . 1 . 1 1 11 GLN H . . . . . . . . . . 17 . 51400 1
14 2 1 . . 2.292 . . 1 . 1 1 11 GLN HG2 . . . . . . . . . . 19 . 51400 1
15 1 1 . . 8.356 . . 1 . 1 1 11 GLN H . . . . . . . . . . 17 . 51400 1
15 2 1 . . 2.080 . . 1 . . . . . . . . . . . . . . . . 21 . 51400 1
16 1 1 . . 8.356 . . 1 . 1 1 11 GLN H . . . . . . . . . . 17 . 51400 1
16 2 1 . . 2.059 . . 1 . 1 1 11 GLN HB2 . . . . . . . . . . 20 . 51400 1
17 1 1 . . 8.356 . . 1 . 1 1 11 GLN H . . . . . . . . . . 17 . 51400 1
17 2 1 . . 1.916 . . 1 . 1 1 11 GLN HB3 . . . . . . . . . . 22 . 51400 1
18 1 3 . . 8.310 . . 1 . 1 1 6 ALA H . . . . . . . . . . 24 . 51400 1
18 2 2 . . 4.156 . . 1 . 1 1 6 ALA HA . . . . . . . . . . 23 . 51400 1
19 1 1 . . 8.311 . . 1 . 1 1 6 ALA H . . . . . . . . . . 24 . 51400 1
19 2 1 . . 1.283 . . 1 . 1 1 6 ALA MB . . . . . . . . . . 25 . 51400 1
20 1 1 . . 8.281 . . 1 . 1 1 10 ASP H . . . . . . . . . . 26 . 51400 1
20 2 1 . . 4.576 . . 1 . 1 1 10 ASP HA . . . . . . . . . . 27 . 51400 1
21 1 1 . . 8.283 . . 1 . 1 1 10 ASP H . . . . . . . . . . 26 . 51400 1
21 2 1 . . 2.818 . . 1 . . . . . . . . . . . . . . . . 28 . 51400 1
22 1 1 . . 8.283 . . 1 . 1 1 10 ASP H . . . . . . . . . . 26 . 51400 1
22 2 1 . . 2.792 . . 1 . 1 1 10 ASP HB2 . . . . . . . . . . 29 . 51400 1
23 1 1 . . 8.283 . . 1 . 1 1 10 ASP H . . . . . . . . . . 26 . 51400 1
23 2 1 . . 2.716 . . 1 . 1 1 10 ASP HB3 . . . . . . . . . . 30 . 51400 1
24 1 1 . . 8.264 . . 1 . 1 1 12 SER H . . . . . . . . . . 31 . 51400 1
24 2 1 . . 4.317 . . 1 . 1 1 12 SER HA . . . . . . . . . . 32 . 51400 1
25 1 1 . . 8.265 . . 1 . 1 1 12 SER H . . . . . . . . . . 31 . 51400 1
25 2 1 . . 3.799 . . 1 . 1 1 12 SER HB2 . . . . . . . . . . 33 . 51400 1
26 1 1 . . 8.257 . . 1 . 1 1 3 HIS H . . . . . . . . . . 34 . 51400 1
26 2 1 . . 4.513 . . 1 . 1 1 3 HIS HA . . . . . . . . . . 35 . 51400 1
27 1 1 . . 8.259 . . 1 . 1 1 3 HIS H . . . . . . . . . . 34 . 51400 1
27 2 1 . . 3.041 . . 1 . 1 1 3 HIS HB2 . . . . . . . . . . 36 . 51400 1
28 1 1 . . 8.259 . . 1 . 1 1 3 HIS H . . . . . . . . . . 34 . 51400 1
28 2 1 . . 2.954 . . 1 . 1 1 3 HIS HB3 . . . . . . . . . . 37 . 51400 1
29 1 1 . . 8.247 . . 1 . 1 1 16 GLN H . . . . . . . . . . 38 . 51400 1
29 2 1 . . 4.222 . . 1 . 1 1 16 GLN HA . . . . . . . . . . 39 . 51400 1
30 1 2 . . 8.247 . . 1 . 1 1 7 ASN H . . . . . . . . . . 48 . 51400 1
30 2 2 . . 2.774 . . 1 . . . . . . . . . . . . . . . . 40 . 51400 1
31 1 2 . . 8.247 . . 1 . 1 1 7 ASN H . . . . . . . . . . 48 . 51400 1
31 2 1 . . 2.751 . . 1 . 1 1 7 ASN HB2 . . . . . . . . . . 41 . 51400 1
32 1 2 . . 8.246 . . 1 . 1 1 7 ASN H . . . . . . . . . . 48 . 51400 1
32 2 1 . . 2.655 . . 1 . 1 1 7 ASN HB3 . . . . . . . . . . 42 . 51400 1
33 1 1 . . 8.248 . . 1 . 1 1 16 GLN H . . . . . . . . . . 38 . 51400 1
33 2 1 . . 2.189 . . 1 . 1 1 16 GLN HG2 . . . . . . . . . . 43 . 51400 1
34 1 1 . . 8.247 . . 1 . 1 1 16 GLN H . . . . . . . . . . 38 . 51400 1
34 2 1 . . 1.963 . . 1 . . . . . . . . . . . . . . . . 44 . 51400 1
35 1 1 . . 8.247 . . 1 . 1 1 16 GLN H . . . . . . . . . . 38 . 51400 1
35 2 1 . . 1.947 . . 1 . 1 1 16 GLN HB2 . . . . . . . . . . 45 . 51400 1
36 1 1 . . 8.247 . . 1 . 1 1 16 GLN H . . . . . . . . . . 38 . 51400 1
36 2 1 . . 1.862 . . 1 . . . . . . . . . . . . . . . . 46 . 51400 1
37 1 1 . . 8.247 . . 1 . 1 1 16 GLN H . . . . . . . . . . 38 . 51400 1
37 2 1 . . 1.843 . . 1 . 1 1 16 GLN HB3 . . . . . . . . . . 47 . 51400 1
38 1 1 . . 8.243 . . 1 . 1 1 7 ASN H . . . . . . . . . . 48 . 51400 1
38 2 1 . . 4.561 . . 1 . 1 1 7 ASN HA . . . . . . . . . . 49 . 51400 1
39 1 1 . . 8.222 . . 1 . 1 1 15 SER H . . . . . . . . . . 50 . 51400 1
39 2 1 . . 4.323 . . 1 . 1 1 15 SER HA . . . . . . . . . . 51 . 51400 1
40 1 1 . . 8.223 . . 1 . 1 1 15 SER H . . . . . . . . . . 50 . 51400 1
40 2 1 . . 3.794 . . 1 . 1 1 15 SER HB2 . . . . . . . . . . 52 . 51400 1
41 1 1 . . 8.222 . . 1 . 1 1 15 SER H . . . . . . . . . . 50 . 51400 1
41 2 1 . . 3.762 . . 1 . 1 1 15 SER HB3 . . . . . . . . . . 53 . 51400 1
42 1 1 . . 8.198 . . 1 . 1 1 17 GLN H . . . . . . . . . . 54 . 51400 1
42 2 1 . . 4.174 . . 1 . 1 1 17 GLN HA . . . . . . . . . . 55 . 51400 1
43 1 1 . . 8.200 . . 1 . 1 1 17 GLN H . . . . . . . . . . 54 . 51400 1
43 2 2 . . 2.170 . . 1 . . . . . . . . . . . . . . . . 56 . 51400 1
44 1 1 . . 8.200 . . 1 . 1 1 17 GLN H . . . . . . . . . . 54 . 51400 1
44 2 1 . . 2.131 . . 1 . 1 1 17 GLN HG2 . . . . . . . . . . 57 . 51400 1
45 1 1 . . 8.199 . . 1 . 1 1 17 GLN H . . . . . . . . . . 54 . 51400 1
45 2 1 . . 1.886 . . 1 . 1 1 17 GLN HB2 . . . . . . . . . . 58 . 51400 1
46 1 1 . . 8.199 . . 1 . 1 1 17 GLN H . . . . . . . . . . 54 . 51400 1
46 2 2 . . 1.804 . . 1 . 1 1 17 GLN HB3 . . . . . . . . . . 119 . 51400 1
47 1 2 . . 8.199 . . 1 . 1 1 13 ARG H . . . . . . . . . . 62 . 51400 1
47 2 2 . . 1.786 . . 1 . 1 1 13 ARG HB3 . . . . . . . . . . 115 . 51400 1
48 1 1 . . 8.197 . . 1 . 1 1 13 ARG H . . . . . . . . . . 62 . 51400 1
48 2 1 . . 4.266 . . 1 . 1 1 13 ARG HA . . . . . . . . . . 63 . 51400 1
49 1 1 . . 8.196 . . 1 . 1 1 13 ARG H . . . . . . . . . . 62 . 51400 1
49 2 1 . . 1.553 . . 1 . 1 1 13 ARG HG2 . . . . . . . . . . 64 . 51400 1
50 1 1 . . 8.198 . . 1 . 1 1 13 ARG H . . . . . . . . . . 62 . 51400 1
50 2 1 . . 1.518 . . 1 . 1 1 13 ARG HG3 . . . . . . . . . . 65 . 51400 1
51 1 1 . . 8.113 . . 1 . 1 1 4 VAL H . . . . . . . . . . 66 . 51400 1
51 2 1 . . 3.890 . . 1 . 1 1 4 VAL HA . . . . . . . . . . 67 . 51400 1
52 1 1 . . 8.114 . . 1 . 1 1 4 VAL H . . . . . . . . . . 66 . 51400 1
52 2 1 . . 0.855 . . 1 . 1 1 4 VAL MG1 . . . . . . . . . . 70 . 51400 1
53 1 1 . . 8.078 . . 1 . 1 1 8 ASP H . . . . . . . . . . 71 . 51400 1
53 2 1 . . 4.539 . . 1 . 1 1 8 ASP HA . . . . . . . . . . 72 . 51400 1
54 1 1 . . 8.078 . . 1 . 1 1 8 ASP H . . . . . . . . . . 71 . 51400 1
54 2 1 . . 2.733 . . 1 . 1 1 8 ASP HB2 . . . . . . . . . . 73 . 51400 1
55 1 1 . . 8.077 . . 1 . 1 1 8 ASP H . . . . . . . . . . 71 . 51400 1
55 2 1 . . 2.717 . . 1 . 1 1 8 ASP HB3 . . . . . . . . . . 74 . 51400 1
56 1 1 . . 7.988 . . 1 . 1 1 18 TYR H . . . . . . . . . . 75 . 51400 1
56 2 1 . . 4.464 . . 1 . 1 1 18 TYR HA . . . . . . . . . . 76 . 51400 1
57 1 1 . . 7.988 . . 1 . 1 1 18 TYR H . . . . . . . . . . 75 . 51400 1
57 2 1 . . 3.056 . . 1 . 1 1 18 TYR HB2 . . . . . . . . . . 77 . 51400 1
58 1 1 . . 7.988 . . 1 . 1 1 18 TYR H . . . . . . . . . . 75 . 51400 1
58 2 1 . . 2.831 . . 1 . 1 1 18 TYR HB3 . . . . . . . . . . 78 . 51400 1
59 1 1 . . 3.980 . . 1 . 1 1 1 THR HB . . . . . . . . . . 91 . 51400 1
59 2 1 . . 3.738 . . 1 . 1 1 1 THR HA . . . . . . . . . . 102 . 51400 1
60 1 1 . . 3.986 . . 1 . 1 1 1 THR HB . . . . . . . . . . 91 . 51400 1
60 2 1 . . 1.150 . . 1 . 1 1 1 THR HG1 . . . . . . . . . . 103 . 51400 1
61 1 1 . . 3.893 . . 1 . 1 1 4 VAL HA . . . . . . . . . . 67 . 51400 1
61 2 1 . . 1.901 . . 1 . 1 1 4 VAL HB . . . . . . . . . . 105 . 51400 1
62 1 1 . . 3.880 . . 1 . 1 1 4 VAL HA . . . . . . . . . . 67 . 51400 1
62 2 1 . . 0.826 . . 1 . 1 1 4 VAL MG1 . . . . . . . . . . 70 . 51400 1
63 1 2 . . 8.114 . . 1 . 1 1 4 VAL H . . . . . . . . . . 66 . 51400 1
63 2 1 . . 1.899 . . 1 . 1 1 4 VAL HB . . . . . . . . . . 105 . 51400 1
64 1 1 . . 2.897 . . 1 . 1 1 14 LYS HE2 . . . . . . . . . . 106 . 51400 1
64 2 1 . . 1.371 . . 1 . 1 1 14 LYS HG3 . . . . . . . . . . 108 . 51400 1
65 1 1 . . 2.895 . . 1 . 1 1 14 LYS HE2 . . . . . . . . . . 106 . 51400 1
65 2 1 . . 1.348 . . 1 . 1 1 14 LYS HG2 . . . . . . . . . . 107 . 51400 1
66 1 1 . . 2.898 . . 1 . 1 1 14 LYS HE2 . . . . . . . . . . 106 . 51400 1
66 2 1 . . 1.588 . . 1 . 1 1 14 LYS HD2 . . . . . . . . . . 109 . 51400 1
67 1 1 . . 2.893 . . 1 . 1 1 14 LYS HE2 . . . . . . . . . . 106 . 51400 1
67 2 1 . . 1.760 . . 1 . 1 1 14 LYS HB3 . . . . . . . . . . 111 . 51400 1
68 1 1 . . 2.892 . . 1 . 1 1 14 LYS HE2 . . . . . . . . . . 106 . 51400 1
68 2 1 . . 1.672 . . 1 . 1 1 14 LYS HB2 . . . . . . . . . . 110 . 51400 1
69 1 1 . . 4.230 . . 1 . 1 1 14 LYS HA . . . . . . . . . . 112 . 51400 1
69 2 1 . . 1.586 . . 1 . 1 1 14 LYS HD2 . . . . . . . . . . 109 . 51400 1
70 1 1 . . 4.233 . . 1 . 1 1 14 LYS HA . . . . . . . . . . 112 . 51400 1
70 2 1 . . 1.669 . . 1 . 1 1 14 LYS HB2 . . . . . . . . . . 110 . 51400 1
72 1 1 . . 4.235 . . 1 . 1 1 14 LYS HA . . . . . . . . . . 112 . 51400 1
72 2 1 . . 1.758 . . 1 . 1 1 14 LYS HB3 . . . . . . . . . . 111 . 51400 1
73 1 1 . . 4.234 . . 1 . 1 1 14 LYS HA . . . . . . . . . . 112 . 51400 1
73 2 1 . . 1.363 . . 1 . 1 1 14 LYS HG3 . . . . . . . . . . 108 . 51400 1
74 1 1 . . 4.233 . . 1 . 1 1 14 LYS HA . . . . . . . . . . 112 . 51400 1
74 2 1 . . 1.354 . . 1 . 1 1 14 LYS HG2 . . . . . . . . . . 107 . 51400 1
75 1 1 . . 3.090 . . 1 . 1 1 13 ARG HD2 . . . . . . . . . . 113 . 51400 1
75 2 1 . . 1.784 . . 1 . 1 1 13 ARG HB3 . . . . . . . . . . 115 . 51400 1
76 1 1 . . 3.088 . . 1 . 1 1 13 ARG HD2 . . . . . . . . . . 113 . 51400 1
76 2 1 . . 1.667 . . 1 . 1 1 13 ARG HB2 . . . . . . . . . . 114 . 51400 1
77 1 1 . . 4.265 . . 1 . 1 1 13 ARG HA . . . . . . . . . . 63 . 51400 1
77 2 1 . . 1.553 . . 1 . 1 1 13 ARG HG2 . . . . . . . . . . 64 . 51400 1
78 1 1 . . 3.086 . . 1 . 1 1 13 ARG HD2 . . . . . . . . . . 113 . 51400 1
78 2 1 . . 1.558 . . 1 . 1 1 13 ARG HG2 . . . . . . . . . . 64 . 51400 1
79 1 1 . . 3.084 . . 1 . 1 1 13 ARG HD2 . . . . . . . . . . 113 . 51400 1
79 2 1 . . 1.520 . . 1 . 1 1 13 ARG HG3 . . . . . . . . . . 65 . 51400 1
80 1 1 . . 4.261 . . 1 . 1 1 13 ARG HA . . . . . . . . . . 63 . 51400 1
80 2 1 . . 1.520 . . 1 . 1 1 13 ARG HG3 . . . . . . . . . . 65 . 51400 1
81 1 1 . . 4.257 . . 1 . 1 1 13 ARG HA . . . . . . . . . . 63 . 51400 1
81 2 1 . . 1.781 . . 1 . 1 1 13 ARG HB3 . . . . . . . . . . 115 . 51400 1
82 1 1 . . 4.261 . . 1 . 1 1 13 ARG HA . . . . . . . . . . 63 . 51400 1
82 2 1 . . 1.667 . . 1 . 1 1 13 ARG HB2 . . . . . . . . . . 114 . 51400 1
83 1 1 . . 3.739 . . 1 . 1 1 1 THR HA . . . . . . . . . . 102 . 51400 1
83 2 1 . . 1.156 . . 1 . 1 1 1 THR HG1 . . . . . . . . . . 103 . 51400 1
84 1 1 . . 3.733 . . 1 . 1 1 1 THR HA . . . . . . . . . . 102 . 51400 1
84 2 1 . . 3.987 . . 1 . 1 1 1 THR HB . . . . . . . . . . 91 . 51400 1
85 1 1 . . 8.250 . . 1 . 1 1 14 LYS H . . . . . . . . . . 116 . 51400 1
85 2 1 . . 1.340 . . 1 . 1 1 14 LYS HG2 . . . . . . . . . . 107 . 51400 1
86 1 1 . . 8.249 . . 1 . 1 1 14 LYS H . . . . . . . . . . 116 . 51400 1
86 2 1 . . 1.370 . . 1 . 1 1 14 LYS HG3 . . . . . . . . . . 108 . 51400 1
87 1 1 . . 8.251 . . 1 . 1 1 14 LYS H . . . . . . . . . . 116 . 51400 1
87 2 1 . . 1.588 . . 1 . 1 1 14 LYS HD2 . . . . . . . . . . 109 . 51400 1
88 1 1 . . 8.251 . . 1 . 1 1 14 LYS H . . . . . . . . . . 116 . 51400 1
88 2 1 . . 1.761 . . 1 . 1 1 14 LYS HB3 . . . . . . . . . . 111 . 51400 1
89 1 1 . . 8.250 . . 1 . 1 1 14 LYS H . . . . . . . . . . 116 . 51400 1
89 2 1 . . 1.671 . . 1 . 1 1 14 LYS HB2 . . . . . . . . . . 110 . 51400 1
90 1 1 . . 8.251 . . 1 . 1 1 14 LYS H . . . . . . . . . . 116 . 51400 1
90 2 1 . . 4.232 . . 1 . 1 1 14 LYS HA . . . . . . . . . . 112 . 51400 1
91 1 1 . . 8.198 . . 1 . 1 1 13 ARG H . . . . . . . . . . 62 . 51400 1
91 2 1 . . 1.674 . . 1 . 1 1 13 ARG HB2 . . . . . . . . . . 114 . 51400 1
92 1 1 . . 7.073 . . 1 . 1 1 13 ARG HE . . . . . . . . . . 162 . 51400 1
92 2 1 . . 1.667 . . 1 . 1 1 13 ARG HB2 . . . . . . . . . . 114 . 51400 1
93 1 1 . . 7.073 . . 1 . 1 1 13 ARG HE . . . . . . . . . . 162 . 51400 1
93 2 1 . . 1.784 . . 1 . 1 1 13 ARG HB3 . . . . . . . . . . 115 . 51400 1
94 1 1 . . 7.072 . . 1 . 1 1 13 ARG HE . . . . . . . . . . 162 . 51400 1
94 2 1 . . 1.541 . . 1 . 1 1 13 ARG HG2 . . . . . . . . . . 64 . 51400 1
95 1 1 . . 7.066 . . 1 . 1 1 13 ARG HE . . . . . . . . . . 162 . 51400 1
95 2 1 . . 3.094 . . 1 . 1 1 13 ARG HD2 . . . . . . . . . . 113 . 51400 1
96 1 1 . . 7.418 . . 1 . 1 1 14 LYS QZ . . . . . . . . . . 164 . 51400 1
96 2 1 . . 2.903 . . 1 . 1 1 14 LYS HE2 . . . . . . . . . . 106 . 51400 1
97 1 1 . . 7.423 . . 1 . 1 1 14 LYS QZ . . . . . . . . . . 164 . 51400 1
97 2 1 . . 1.585 . . 1 . 1 1 14 LYS HD2 . . . . . . . . . . 109 . 51400 1
98 1 1 . . 7.425 . . 1 . 1 1 14 LYS QZ . . . . . . . . . . 164 . 51400 1
98 2 1 . . 1.370 . . 1 . 1 1 14 LYS HG3 . . . . . . . . . . 108 . 51400 1
99 1 1 . . 7.422 . . 1 . 1 1 14 LYS QZ . . . . . . . . . . 164 . 51400 1
99 2 1 . . 1.337 . . 1 . 1 1 14 LYS HG2 . . . . . . . . . . 107 . 51400 1
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