Content for NMR-STAR saveframe, "peak_list_1_2_3_4_5_6_7_8"
save_peak_list_1_2_3_4_5_6_7_8
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6_7_8
_Spectral_peak_list.Entry_ID 18224
_Spectral_peak_list.ID 8
_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.Experiment_ID 8
_Spectral_peak_list.Experiment_name '2D 1H-15N HSQC/HMQC'
_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 .
_Spectral_peak_list.Assigned_chem_shift_list_label .
_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 . . 5630.63037109 . . . . . . . 18224 8
2 . . N 15 15N . . 1419.24499512 . . . . . . . 18224 8
stop_
loop_
_Peak.ID
_Peak.Figure_of_merit
_Peak.Restraint
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
1 1.0 . . 18224 8
2 1.0 . . 18224 8
3 1.0 . . 18224 8
4 1.0 . . 18224 8
5 1.0 . . 18224 8
6 1.0 . . 18224 8
7 1.0 . . 18224 8
8 1.0 . . 18224 8
9 1.0 . . 18224 8
10 1.0 . . 18224 8
11 1.0 . . 18224 8
12 1.0 . . 18224 8
13 1.0 . . 18224 8
14 1.0 . . 18224 8
15 1.0 . . 18224 8
16 1.0 . . 18224 8
17 1.0 . . 18224 8
18 1.0 . . 18224 8
19 1.0 . . 18224 8
20 1.0 . . 18224 8
21 1.0 . . 18224 8
22 1.0 . . 18224 8
23 1.0 . . 18224 8
24 1.0 . . 18224 8
25 1.0 . . 18224 8
26 1.0 . . 18224 8
27 1.0 . . 18224 8
28 1.0 . . 18224 8
29 1.0 . . 18224 8
30 1.0 . . 18224 8
31 1.0 . . 18224 8
32 1.0 . . 18224 8
33 1.0 . . 18224 8
34 1.0 . . 18224 8
35 1.0 . . 18224 8
36 1.0 . . 18224 8
37 1.0 . . 18224 8
38 1.0 . . 18224 8
39 1.0 . . 18224 8
40 1.0 . . 18224 8
41 1.0 . . 18224 8
42 1.0 . . 18224 8
43 1.0 . . 18224 8
44 1.0 . . 18224 8
45 1.0 . . 18224 8
46 1.0 . . 18224 8
47 1.0 . . 18224 8
48 1.0 . . 18224 8
49 1.0 . . 18224 8
50 1.0 . . 18224 8
51 1.0 . . 18224 8
52 1.0 . . 18224 8
53 1.0 . . 18224 8
54 1.0 . . 18224 8
55 1.0 . . 18224 8
56 1.0 . . 18224 8
57 1.0 . . 18224 8
58 1.0 . . 18224 8
59 1.0 . . 18224 8
60 1.0 . . 18224 8
61 1.0 . . 18224 8
62 1.0 . . 18224 8
63 1.0 . . 18224 8
64 1.0 . . 18224 8
65 1.0 . . 18224 8
66 1.0 . . 18224 8
67 1.0 . . 18224 8
68 1.0 . . 18224 8
69 1.0 . . 18224 8
70 1.0 . . 18224 8
71 1.0 . . 18224 8
72 1.0 . . 18224 8
73 1.0 . . 18224 8
74 1.0 . . 18224 8
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
1 8546043.0000 . height 18224 8
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2 9616716.0000 . height 18224 8
2 50242175.2500 . volume 18224 8
3 3175610.0000 . height 18224 8
3 16870010.5625 . volume 18224 8
4 7459843.0000 . height 18224 8
4 40555633.0000 . volume 18224 8
5 2169817.0000 . height 18224 8
5 12492319.7500 . volume 18224 8
6 4917989.5000 . height 18224 8
6 29050819.3750 . volume 18224 8
7 5047878.5000 . height 18224 8
7 28970044.6250 . volume 18224 8
8 9445312.0000 . height 18224 8
8 51755958.6250 . volume 18224 8
9 10232022.0000 . height 18224 8
9 53286784.2500 . volume 18224 8
10 5084402.0000 . height 18224 8
10 29086070.1250 . volume 18224 8
11 2610687.5000 . height 18224 8
11 19278321.2500 . volume 18224 8
12 2710107.5000 . height 18224 8
12 18926781.1250 . volume 18224 8
13 3416922.0000 . height 18224 8
13 24087273.0000 . volume 18224 8
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14 17991891.8125 . volume 18224 8
15 11843796.0000 . height 18224 8
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16 14359566.0625 . volume 18224 8
17 10135270.0000 . height 18224 8
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18 9758670.0000 . height 18224 8
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27 2757756.0000 . height 18224 8
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29 3576901.5000 . height 18224 8
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30 10503904.0000 . height 18224 8
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31 8804078.0000 . height 18224 8
31 50119987.2500 . volume 18224 8
32 4400554.0000 . height 18224 8
32 25083413.1250 . volume 18224 8
33 4448889.0000 . height 18224 8
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34 10144790.0000 . height 18224 8
34 52571978.0000 . volume 18224 8
35 5003351.0000 . height 18224 8
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40 5821407.5000 . height 18224 8
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43 2176655.0000 . height 18224 8
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44 11164698.0000 . volume 18224 8
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47 8845951.0000 . height 18224 8
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48 10522442.0000 . height 18224 8
48 55709609.3750 . volume 18224 8
49 2964187.5000 . height 18224 8
49 16674912.7500 . volume 18224 8
50 10355790.0000 . height 18224 8
50 53119190.5000 . volume 18224 8
51 4289328.0000 . height 18224 8
51 23151982.1250 . volume 18224 8
52 1969388.1250 . height 18224 8
52 11428004.3750 . volume 18224 8
53 9186675.0000 . height 18224 8
53 66636609.5000 . volume 18224 8
54 9450744.0000 . height 18224 8
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56 5247281.0000 . height 18224 8
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57 7586004.0000 . height 18224 8
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58 4304087.5000 . height 18224 8
58 21593022.7500 . volume 18224 8
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60 9325787.0000 . height 18224 8
60 72032432.0000 . volume 18224 8
61 6847074.0000 . height 18224 8
61 41006873.0000 . volume 18224 8
62 10725160.0000 . height 18224 8
62 75746566.5000 . volume 18224 8
63 7248767.5000 . height 18224 8
63 48662722.3750 . volume 18224 8
64 3288841.5000 . height 18224 8
64 22936071.3750 . volume 18224 8
65 8340023.0000 . height 18224 8
65 56886505.2500 . volume 18224 8
66 4354482.0000 . height 18224 8
66 34921753.0000 . volume 18224 8
67 3768573.2500 . height 18224 8
67 36171817.3750 . volume 18224 8
68 6557078.5000 . height 18224 8
68 41636736.2500 . volume 18224 8
69 3289401.7500 . height 18224 8
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70 2660637.0000 . height 18224 8
70 21049268.8750 . volume 18224 8
71 3678657.5000 . height 18224 8
71 26374158.4375 . volume 18224 8
72 460733.6250 . height 18224 8
72 3433107.6875 . volume 18224 8
73 6497940.0000 . height 18224 8
73 36163527.6250 . volume 18224 8
74 5389187.0000 . height 18224 8
74 27452021.2500 . volume 18224 8
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 8.189 . 30.9487706602 . . . . . . . . . . . 18224 8
1 2 124.158 . 24.5987332167 . . . . . . . . . . . 18224 8
2 1 7.874 . 33.5443917269 . . . . . . . . . . . 18224 8
2 2 123.122 . 24.2604804449 . . . . . . . . . . . 18224 8
3 1 8.627 . 33.1701846556 . . . . . . . . . . . 18224 8
3 2 122.729 . 24.8395447427 . . . . . . . . . . . 18224 8
4 1 8.303 . 34.3699965658 . . . . . . . . . . . 18224 8
4 2 122.747 . 25.6777192183 . . . . . . . . . . . 18224 8
5 1 8.570 . 40.0166638075 . . . . . . . . . . . 18224 8
5 2 121.053 . 26.9553468394 . . . . . . . . . . . 18224 8
6 1 7.934 . 65.7315696455 . . . . . . . . . . . 18224 8
6 2 121.738 . 27.1367366529 . . . . . . . . . . . 18224 8
7 1 7.883 . 45.2575764759 . . . . . . . . . . . 18224 8
7 2 121.539 . 26.9725827842 . . . . . . . . . . . 18224 8
8 1 8.260 . 31.6703358649 . . . . . . . . . . . 18224 8
8 2 121.345 . 25.7760909937 . . . . . . . . . . . 18224 8
9 1 8.386 . 31.5723372418 . . . . . . . . . . . 18224 8
9 2 121.073 . 24.0052087015 . . . . . . . . . . . 18224 8
10 1 8.056 . 36.3437291095 . . . . . . . . . . . 18224 8
10 2 121.096 . 26.0128473143 . . . . . . . . . . . 18224 8
11 1 7.908 . 103.0116554630 . . . . . . . . . . . 18224 8
11 2 120.510 . 48.5420458430 . . . . . . . . . . . 18224 8
12 1 8.230 . 93.9222831650 . . . . . . . . . . . 18224 8
12 2 120.297 . 38.7167114091 . . . . . . . . . . . 18224 8
13 1 8.002 . 48.8570122065 . . . . . . . . . . . 18224 8
13 2 120.082 . 42.0299886968 . . . . . . . . . . . 18224 8
14 1 7.621 . 35.8332636787 . . . . . . . . . . . 18224 8
14 2 120.074 . 29.4506252237 . . . . . . . . . . . 18224 8
15 1 8.285 . 33.8266411861 . . . . . . . . . . . 18224 8
15 2 120.018 . 29.1470822608 . . . . . . . . . . . 18224 8
16 1 8.494 . 44.3118226401 . . . . . . . . . . . 18224 8
16 2 119.595 . 29.0871688480 . . . . . . . . . . . 18224 8
17 1 8.150 . 36.3537974612 . . . . . . . . . . . 18224 8
17 2 119.770 . 113.8996908520 . . . . . . . . . . . 18224 8
18 1 7.885 . 58.6800317308 . . . . . . . . . . . 18224 8
18 2 119.519 . 49.9014225983 . . . . . . . . . . . 18224 8
19 1 7.574 . 40.0794231997 . . . . . . . . . . . 18224 8
19 2 119.078 . 32.7170799572 . . . . . . . . . . . 18224 8
20 1 8.299 . 35.8587701696 . . . . . . . . . . . 18224 8
20 2 118.854 . 32.0492981279 . . . . . . . . . . . 18224 8
21 1 8.381 . 39.1739427707 . . . . . . . . . . . 18224 8
21 2 118.722 . 24.7272150244 . . . . . . . . . . . 18224 8
22 1 8.161 . 41.4987251768 . . . . . . . . . . . 18224 8
22 2 118.496 . 113.0976589890 . . . . . . . . . . . 18224 8
23 1 7.785 . 40.2549481309 . . . . . . . . . . . 18224 8
23 2 118.401 . 33.7580887223 . . . . . . . . . . . 18224 8
24 1 7.821 . 65.1190782507 . . . . . . . . . . . 18224 8
24 2 118.203 . 35.0847277568 . . . . . . . . . . . 18224 8
25 1 8.350 . 46.1996385827 . . . . . . . . . . . 18224 8
25 2 118.113 . 27.5146585331 . . . . . . . . . . . 18224 8
26 1 7.960 . 45.7317958407 . . . . . . . . . . . 18224 8
26 2 118.022 . 30.4056868975 . . . . . . . . . . . 18224 8
27 1 8.235 . 132.4713169070 . . . . . . . . . . . 18224 8
27 2 117.882 . 52.7429214135 . . . . . . . . . . . 18224 8
28 1 8.108 . 82.3010560281 . . . . . . . . . . . 18224 8
28 2 117.847 . 76.1049650214 . . . . . . . . . . . 18224 8
29 1 8.205 . 103.0240730960 . . . . . . . . . . . 18224 8
29 2 117.570 . 40.7524139467 . . . . . . . . . . . 18224 8
30 1 8.280 . 30.2302259610 . . . . . . . . . . . 18224 8
30 2 117.490 . 27.1627068862 . . . . . . . . . . . 18224 8
31 1 8.006 . 35.7077448942 . . . . . . . . . . . 18224 8
31 2 117.262 . 26.1933488950 . . . . . . . . . . . 18224 8
32 1 8.120 . 36.2933873511 . . . . . . . . . . . 18224 8
32 2 116.818 . 26.0354972490 . . . . . . . . . . . 18224 8
33 1 8.048 . 45.9022865960 . . . . . . . . . . . 18224 8
33 2 116.632 . 31.0512206116 . . . . . . . . . . . 18224 8
34 1 8.210 . 31.5975081210 . . . . . . . . . . . 18224 8
34 2 116.072 . 24.8415855632 . . . . . . . . . . . 18224 8
35 1 7.791 . 33.0084198051 . . . . . . . . . . . 18224 8
35 2 114.094 . 27.1230747875 . . . . . . . . . . . 18224 8
36 1 8.071 . 39.5558689116 . . . . . . . . . . . 18224 8
36 2 113.227 . 29.0522316937 . . . . . . . . . . . 18224 8
37 1 7.467 . 31.8760658512 . . . . . . . . . . . 18224 8
37 2 112.568 . 25.4561580220 . . . . . . . . . . . 18224 8
38 1 6.803 . 32.9819064789 . . . . . . . . . . . 18224 8
38 2 112.560 . 26.7813166686 . . . . . . . . . . . 18224 8
39 1 7.888 . 39.3679263467 . . . . . . . . . . . 18224 8
39 2 112.331 . 29.3538924492 . . . . . . . . . . . 18224 8
40 1 7.362 . 36.4410565092 . . . . . . . . . . . 18224 8
40 2 112.296 . 28.7020142155 . . . . . . . . . . . 18224 8
41 1 6.763 . 39.5780192853 . . . . . . . . . . . 18224 8
41 2 112.293 . 39.7641492873 . . . . . . . . . . . 18224 8
42 1 7.431 . 32.9040445592 . . . . . . . . . . . 18224 8
42 2 112.034 . 25.9916354707 . . . . . . . . . . . 18224 8
43 1 6.813 . 105.1216463660 . . . . . . . . . . . 18224 8
43 2 111.907 . 85.0992096933 . . . . . . . . . . . 18224 8
44 1 7.298 . 50.5323859283 . . . . . . . . . . . 18224 8
44 2 111.907 . 33.4785068949 . . . . . . . . . . . 18224 8
45 1 8.306 . 34.9284544731 . . . . . . . . . . . 18224 8
45 2 111.060 . 25.1961173147 . . . . . . . . . . . 18224 8
46 1 8.056 . 42.0145603953 . . . . . . . . . . . 18224 8
46 2 109.776 . 26.2085334451 . . . . . . . . . . . 18224 8
47 1 8.373 . 31.5639469487 . . . . . . . . . . . 18224 8
47 2 109.726 . 25.8540862872 . . . . . . . . . . . 18224 8
48 1 7.788 . 32.7224786170 . . . . . . . . . . . 18224 8
48 2 109.692 . 24.5693633784 . . . . . . . . . . . 18224 8
49 1 8.599 . 38.1499914034 . . . . . . . . . . . 18224 8
49 2 108.732 . 26.3515812122 . . . . . . . . . . . 18224 8
50 1 8.115 . 33.9595434284 . . . . . . . . . . . 18224 8
50 2 108.372 . 23.8580158483 . . . . . . . . . . . 18224 8
51 1 7.924 . 34.9942343708 . . . . . . . . . . . 18224 8
51 2 107.329 . 25.5619846078 . . . . . . . . . . . 18224 8
52 1 8.348 . 42.2270026160 . . . . . . . . . . . 18224 8
52 2 105.889 . 26.4757646079 . . . . . . . . . . . 18224 8
53 1 7.850 . 35.5926300732 . . . . . . . . . . . 18224 8
53 2 119.124 . 58.6805457612 . . . . . . . . . . . 18224 8
54 1 7.846 . 59.6335046362 . . . . . . . . . . . 18224 8
54 2 119.447 . 57.7491702936 . . . . . . . . . . . 18224 8
55 1 8.136 . 43.6305308421 . . . . . . . . . . . 18224 8
55 2 118.376 . 30.8687522299 . . . . . . . . . . . 18224 8
56 1 7.682 . 36.2339840761 . . . . . . . . . . . 18224 8
56 2 112.149 . 30.7742188888 . . . . . . . . . . . 18224 8
57 1 6.733 . 36.3796395639 . . . . . . . . . . . 18224 8
57 2 112.030 . 29.8762578908 . . . . . . . . . . . 18224 8
58 1 6.859 . 32.6271648876 . . . . . . . . . . . 18224 8
58 2 84.482 . 23.4470971794 . . . . . . . . . . . 18224 8
59 1 8.147 . 35.6013559780 . . . . . . . . . . . 18224 8
59 2 119.047 . 112.8137628890 . . . . . . . . . . . 18224 8
60 1 8.182 . 38.7698662560 . . . . . . . . . . . 18224 8
60 2 119.428 . 98.4313292607 . . . . . . . . . . . 18224 8
61 1 8.359 . 43.3043162473 . . . . . . . . . . . 18224 8
61 2 118.741 . 26.9094759632 . . . . . . . . . . . 18224 8
62 1 8.167 . 35.6013559780 . . . . . . . . . . . 18224 8
62 2 119.018 . 112.8137628890 . . . . . . . . . . . 18224 8
63 1 8.325 . 52.7407110665 . . . . . . . . . . . 18224 8
63 2 118.019 . 29.8383176640 . . . . . . . . . . . 18224 8
64 1 8.001 . 50.1454256116 . . . . . . . . . . . 18224 8
64 2 120.359 . 43.2989560488 . . . . . . . . . . . 18224 8
65 1 8.300 . 43.1586607594 . . . . . . . . . . . 18224 8
65 2 120.145 . 31.0054554774 . . . . . . . . . . . 18224 8
66 1 8.033 . 50.3243066600 . . . . . . . . . . . 18224 8
66 2 117.112 . 49.4379765948 . . . . . . . . . . . 18224 8
67 1 7.862 . 66.4165531724 . . . . . . . . . . . 18224 8
67 2 119.735 . 79.0741578664 . . . . . . . . . . . 18224 8
68 1 8.368 . 57.3687967285 . . . . . . . . . . . 18224 8
68 2 118.084 . 28.6840380768 . . . . . . . . . . . 18224 8
69 1 8.113 . 39.8908094113 . . . . . . . . . . . 18224 8
69 2 118.087 . 89.7904743269 . . . . . . . . . . . 18224 8
70 1 8.112 . 82.5098065199 . . . . . . . . . . . 18224 8
70 2 117.595 . 97.6900355984 . . . . . . . . . . . 18224 8
71 1 7.683 . 38.8215504614 . . . . . . . . . . . 18224 8
71 2 112.035 . 38.2862992039 . . . . . . . . . . . 18224 8
72 1 6.580 . 70.2462185450 . . . . . . . . . . . 18224 8
72 2 71.674 . 46.0819372454 . . . . . . . . . . . 18224 8
73 1 9.915 . 33.7298172039 . . . . . . . . . . . 18224 8
73 2 128.613 . 26.6083227694 . . . . . . . . . . . 18224 8
74 1 9.900 . 32.2343313657 . . . . . . . . . . . 18224 8
74 2 127.920 . 24.1905532654 . . . . . . . . . . . 18224 8
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 . . 8.189 . . 1 . 1 1 64 HIS H . . . . . . . . . . 1 . 18224 8
1 2 1 . . 124.158 . . 1 . 1 1 64 HIS N . . . . . . . . . . 2 . 18224 8
2 1 1 . . 7.874 . . 1 . 1 1 13 ALA H . . . . . . . . . . 11 . 18224 8
2 2 1 . . 123.122 . . 1 . 1 1 13 ALA N . . . . . . . . . . 12 . 18224 8
3 1 1 . . 8.627 . . 1 . 1 1 2 GLU H . . . . . . . . . . 37 . 18224 8
3 2 1 . . 122.729 . . 1 . 1 1 2 GLU N . . . . . . . . . . 38 . 18224 8
4 1 1 . . 8.303 . . 1 . 1 1 20 GLU H . . . . . . . . . . 99 . 18224 8
4 2 1 . . 122.747 . . 1 . 1 1 20 GLU N . . . . . . . . . . 100 . 18224 8
5 1 1 . . 8.570 . . 1 . 1 1 40 LEU H . . . . . . . . . . 60 . 18224 8
5 2 1 . . 121.053 . . 1 . 1 1 40 LEU N . . . . . . . . . . 61 . 18224 8
6 1 1 . . 7.934 . . 1 . 1 1 29 ALA H . . . . . . . . . . 84 . 18224 8
6 2 1 . . 121.738 . . 1 . 1 1 29 ALA N . . . . . . . . . . 85 . 18224 8
7 1 1 . . 7.883 . . 1 . 1 1 24 TRP H . . . . . . . . . . 80 . 18224 8
7 2 1 . . 121.539 . . 1 . 1 1 24 TRP N . . . . . . . . . . 81 . 18224 8
8 1 1 . . 8.260 . . 1 . 1 1 18 GLU H . . . . . . . . . . 21 . 18224 8
8 2 1 . . 121.345 . . 1 . 1 1 18 GLU N . . . . . . . . . . 22 . 18224 8
9 1 1 . . 8.386 . . 1 . 1 1 3 GLU H . . . . . . . . . . 25 . 18224 8
9 2 1 . . 121.073 . . 1 . 1 1 3 GLU N . . . . . . . . . . 26 . 18224 8
10 1 1 . . 8.056 . . 1 . 1 1 23 ASP H . . . . . . . . . . 7 . 18224 8
10 2 1 . . 121.096 . . 1 . 1 1 23 ASP N . . . . . . . . . . 8 . 18224 8
11 1 1 . . 7.908 . . 1 . 1 1 49 VAL H . . . . . . . . . . 43 . 18224 8
11 2 1 . . 120.510 . . 1 . 1 1 49 VAL N . . . . . . . . . . 44 . 18224 8
12 1 1 . . 8.230 . . 1 . 1 1 37 LEU H . . . . . . . . . . 76 . 18224 8
12 2 1 . . 120.297 . . 1 . 1 1 37 LEU N . . . . . . . . . . 77 . 18224 8
13 1 1 . . 8.002 . . 1 . 1 1 48 LEU H . . . . . . . . . . 53 . 18224 8
13 2 1 . . 120.082 . . 1 . 1 1 48 LEU N . . . . . . . . . . 54 . 18224 8
14 1 1 . . 7.621 . . 1 . 1 1 25 LYS H . . . . . . . . . . 70 . 18224 8
14 2 1 . . 120.074 . . 1 . 1 1 25 LYS N . . . . . . . . . . 71 . 18224 8
15 1 1 . . 8.285 . . 1 . 1 1 16 GLN H . . . . . . . . . . 96 . 18224 8
15 2 1 . . 120.018 . . 1 . 1 1 16 GLN N . . . . . . . . . . 97 . 18224 8
16 1 1 . . 8.494 . . 1 . 1 1 41 LEU H . . . . . . . . . . 74 . 18224 8
16 2 1 . . 119.595 . . 1 . 1 1 41 LEU N . . . . . . . . . . 75 . 18224 8
17 1 1 . . 8.150 . . 1 . 1 1 7 PHE H . . . . . . . . . . 27 . 18224 8
17 2 1 . . 119.770 . . 1 . 1 1 7 PHE N . . . . . . . . . . 28 . 18224 8
18 1 1 . . 7.885 . . 1 . 1 1 21 TYR H . . . . . . . . . . 49 . 18224 8
18 2 1 . . 119.519 . . 1 . 1 1 21 TYR N . . . . . . . . . . 50 . 18224 8
19 1 1 . . 7.574 . . 1 . 1 1 33 ALA H . . . . . . . . . . 45 . 18224 8
19 2 1 . . 119.078 . . 1 . 1 1 33 ALA N . . . . . . . . . . 46 . 18224 8
20 1 1 . . 8.299 . . 1 . 1 1 63 HIS H . . . . . . . . . . 33 . 18224 8
20 2 1 . . 118.854 . . 1 . 1 1 63 HIS N . . . . . . . . . . 34 . 18224 8
21 1 1 . . 8.381 . . 1 . 1 1 62 HIS H . . . . . . . . . . 82 . 18224 8
21 2 1 . . 118.722 . . 1 . 1 1 62 HIS N . . . . . . . . . . 83 . 18224 8
22 1 1 . . 8.161 . . 1 . 1 1 8 ASP H . . . . . . . . . . 90 . 18224 8
22 2 1 . . 118.496 . . 1 . 1 1 8 ASP N . . . . . . . . . . 91 . 18224 8
23 1 1 . . 7.785 . . 1 . 1 1 56 LYS H . . . . . . . . . . 56 . 18224 8
23 2 1 . . 118.401 . . 1 . 1 1 56 LYS N . . . . . . . . . . 57 . 18224 8
24 1 1 . . 7.821 . . 1 . 1 1 57 LYS H . . . . . . . . . . 62 . 18224 8
24 2 1 . . 118.203 . . 1 . 1 1 57 LYS N . . . . . . . . . . 63 . 18224 8
25 1 1 . . 8.350 . . 1 . 1 1 61 HIS H . . . . . . . . . . 103 . 18224 8
25 2 1 . . 118.113 . . 1 . 1 1 61 HIS N . . . . . . . . . . 104 . 18224 8
26 1 1 . . 7.960 . . 1 . 1 1 30 LEU H . . . . . . . . . . 23 . 18224 8
26 2 1 . . 118.022 . . 1 . 1 1 30 LEU N . . . . . . . . . . 24 . 18224 8
27 1 1 . . 8.235 . . 1 . 1 1 34 ILE H . . . . . . . . . . 105 . 18224 8
27 2 1 . . 117.882 . . 1 . 1 1 34 ILE N . . . . . . . . . . 106 . 18224 8
28 1 1 . . 8.108 . . 1 . 1 1 36 MET H . . . . . . . . . . 15 . 18224 8
28 2 1 . . 117.847 . . 1 . 1 1 36 MET N . . . . . . . . . . 16 . 18224 8
29 1 1 . . 8.205 . . 1 . 1 1 46 ASN H . . . . . . . . . . 35 . 18224 8
29 2 1 . . 117.570 . . 1 . 1 1 46 ASN N . . . . . . . . . . 36 . 18224 8
30 1 1 . . 8.280 . . 1 . 1 1 14 ASP H . . . . . . . . . . 9 . 18224 8
30 2 1 . . 117.490 . . 1 . 1 1 14 ASP N . . . . . . . . . . 10 . 18224 8
31 1 1 . . 8.006 . . 1 . 1 1 9 ASN H . . . . . . . . . . 51 . 18224 8
31 2 1 . . 117.262 . . 1 . 1 1 9 ASN N . . . . . . . . . . 52 . 18224 8
32 1 1 . . 8.120 . . 1 . 1 1 59 HIS H . . . . . . . . . . 66 . 18224 8
32 2 1 . . 116.818 . . 1 . 1 1 59 HIS N . . . . . . . . . . 67 . 18224 8
33 1 1 . . 8.048 . . 1 . 1 1 27 SER H . . . . . . . . . . 72 . 18224 8
33 2 1 . . 116.632 . . 1 . 1 1 27 SER N . . . . . . . . . . 73 . 18224 8
34 1 1 . . 8.210 . . 1 . 1 1 17 SER H . . . . . . . . . . 78 . 18224 8
34 2 1 . . 116.072 . . 1 . 1 1 17 SER N . . . . . . . . . . 79 . 18224 8
35 1 1 . . 7.791 . . 1 . 1 1 26 SER H . . . . . . . . . . 86 . 18224 8
35 2 1 . . 114.094 . . 1 . 1 1 26 SER N . . . . . . . . . . 87 . 18224 8
36 1 1 . . 8.071 . . 1 . 1 1 52 THR H . . . . . . . . . . 39 . 18224 8
36 2 1 . . 113.227 . . 1 . 1 1 52 THR N . . . . . . . . . . 40 . 18224 8
37 1 1 . . 7.467 . . 1 . 1 1 15 ASN HD22 . . . . . . . . . . 47 . 18224 8
37 2 1 . . 112.568 . . 1 . 1 1 15 ASN ND2 . . . . . . . . . . 48 . 18224 8
38 1 1 . . 6.803 . . 1 . 1 1 15 ASN HD21 . . . . . . . . . . 55 . 18224 8
38 2 1 . . 112.560 . . 1 . 1 1 15 ASN ND2 . . . . . . . . . . 48 . 18224 8
39 1 1 . . 7.888 . . 1 . 1 1 43 THR H . . . . . . . . . . 58 . 18224 8
39 2 1 . . 112.331 . . 1 . 1 1 43 THR N . . . . . . . . . . 59 . 18224 8
40 1 1 . . 7.362 . . 1 . 1 1 9 ASN HD21 . . . . . . . . . . 64 . 18224 8
40 2 1 . . 112.296 . . 1 . 1 1 9 ASN ND2 . . . . . . . . . . 65 . 18224 8
41 1 1 . . 6.763 . . 1 . 1 1 9 ASN HD22 . . . . . . . . . . 69 . 18224 8
41 2 1 . . 112.293 . . 1 . 1 1 9 ASN ND2 . . . . . . . . . . 65 . 18224 8
42 1 1 . . 7.431 . . 1 . 1 1 16 GLN HE21 . . . . . . . . . . 29 . 18224 8
42 2 1 . . 112.034 . . 1 . 1 1 16 GLN NE2 . . . . . . . . . . 30 . 18224 8
43 1 1 . . 6.813 . . 1 . 1 1 46 ASN HD21 . . . . . . . . . . 92 . 18224 8
43 2 1 . . 111.907 . . 1 . 1 1 46 ASN ND2 . . . . . . . . . . 93 . 18224 8
44 1 1 . . 7.298 . . 1 . 1 1 46 ASN HD22 . . . . . . . . . . 98 . 18224 8
44 2 1 . . 111.907 . . 1 . 1 1 46 ASN ND2 . . . . . . . . . . 93 . 18224 8
45 1 1 . . 8.306 . . 1 . 1 1 28 GLY H . . . . . . . . . . 109 . 18224 8
45 2 1 . . 111.060 . . 1 . 1 1 28 GLY N . . . . . . . . . . 110 . 18224 8
46 1 1 . . 8.056 . . 1 . 1 1 45 GLY H . . . . . . . . . . 13 . 18224 8
46 2 1 . . 109.776 . . 1 . 1 1 45 GLY N . . . . . . . . . . 14 . 18224 8
47 1 1 . . 8.373 . . 1 . 1 1 4 GLY H . . . . . . . . . . 19 . 18224 8
47 2 1 . . 109.726 . . 1 . 1 1 4 GLY N . . . . . . . . . . 20 . 18224 8
48 1 1 . . 7.788 . . 1 . 1 1 12 GLY H . . . . . . . . . . 94 . 18224 8
48 2 1 . . 109.692 . . 1 . 1 1 12 GLY N . . . . . . . . . . 95 . 18224 8
49 1 1 . . 8.599 . . 1 . 1 1 47 GLY H . . . . . . . . . . 5 . 18224 8
49 2 1 . . 108.732 . . 1 . 1 1 47 GLY N . . . . . . . . . . 6 . 18224 8
50 1 1 . . 8.115 . . 1 . 1 1 5 GLY H . . . . . . . . . . 101 . 18224 8
50 2 1 . . 108.372 . . 1 . 1 1 5 GLY N . . . . . . . . . . 102 . 18224 8
51 1 1 . . 7.924 . . 1 . 1 1 58 GLY H . . . . . . . . . . 107 . 18224 8
51 2 1 . . 107.329 . . 1 . 1 1 58 GLY N . . . . . . . . . . 108 . 18224 8
52 1 1 . . 8.348 . . 1 . 1 1 42 GLY H . . . . . . . . . . 3 . 18224 8
52 2 1 . . 105.889 . . 1 . 1 1 42 GLY N . . . . . . . . . . 4 . 18224 8
53 1 1 . . 7.850 . . 1 . 1 1 10 TYR H . . . . . . . . . . 31 . 18224 8
53 2 1 . . 119.124 . . 1 . 1 1 10 TYR N . . . . . . . . . . 32 . 18224 8
54 1 1 . . 7.846 . . 1 . 1 1 11 TYR H . . . . . . . . . . 17 . 18224 8
54 2 1 . . 119.447 . . 1 . 1 1 11 TYR N . . . . . . . . . . 18 . 18224 8
55 1 1 . . 8.136 . . 1 . 1 1 15 ASN H . . . . . . . . . . 41 . 18224 8
55 2 1 . . 118.376 . . 1 . 1 1 15 ASN N . . . . . . . . . . 42 . 18224 8
56 1 1 . . 7.682 . . 1 . 1 1 22 THR H . . . . . . . . . . 88 . 18224 8
56 2 1 . . 112.149 . . 1 . 1 1 22 THR N . . . . . . . . . . 89 . 18224 8
57 1 1 . . 6.733 . . 1 . 1 1 16 GLN HE22 . . . . . . . . . . 68 . 18224 8
57 2 1 . . 112.030 . . 1 . 1 1 16 GLN NE2 . . . . . . . . . . 30 . 18224 8
58 1 2 . . 6.859 . . 1 . 1 1 55 ARG HE . . . . . . . . . . 565 . 18224 8
58 2 2 . . 84.482 . . 1 . 1 1 55 ARG NE . . . . . . . . . . 567 . 18224 8
59 1 1 . . 8.147 . . 1 . 1 1 54 PHE H . . . . . . . . . . 219 . 18224 8
59 2 1 . . 119.047 . . 1 . 1 1 54 PHE N . . . . . . . . . . 220 . 18224 8
60 1 2 . . 8.182 . . 1 . 1 1 19 CYS H . . . . . . . . . . 221 . 18224 8
60 2 1 . . 119.428 . . 1 . 1 1 19 CYS N . . . . . . . . . . 222 . 18224 8
61 1 1 . . 8.359 . . 1 . 1 1 35 TYR H . . . . . . . . . . 239 . 18224 8
61 2 1 . . 118.741 . . 1 . 1 1 35 TYR N . . . . . . . . . . 240 . 18224 8
62 1 1 . . 8.167 . . 1 . 1 1 6 ASP H . . . . . . . . . . 243 . 18224 8
62 2 1 . . 119.018 . . 1 . 1 1 6 ASP N . . . . . . . . . . 244 . 18224 8
63 1 1 . . 8.325 . . 1 . 1 1 60 HIS H . . . . . . . . . . 254 . 18224 8
63 2 1 . . 118.019 . . 1 . 1 1 60 HIS N . . . . . . . . . . 255 . 18224 8
64 1 1 . . 8.001 . . 1 . 1 1 53 VAL H . . . . . . . . . . 256 . 18224 8
64 2 1 . . 120.359 . . 1 . 1 1 53 VAL N . . . . . . . . . . 257 . 18224 8
65 1 1 . . 8.300 . . 1 . 1 1 39 PHE H . . . . . . . . . . 260 . 18224 8
65 2 1 . . 120.145 . . 1 . 1 1 39 PHE N . . . . . . . . . . 261 . 18224 8
66 1 1 . . 8.033 . . 1 . 1 1 31 ILE H . . . . . . . . . . 312 . 18224 8
66 2 1 . . 117.112 . . 1 . 1 1 31 ILE N . . . . . . . . . . 313 . 18224 8
67 1 1 . . 7.862 . . 1 . 1 1 50 LEU H . . . . . . . . . . 360 . 18224 8
67 2 1 . . 119.735 . . 1 . 1 1 50 LEU N . . . . . . . . . . 361 . 18224 8
68 1 1 . . 8.368 . . 1 . 1 1 38 VAL H . . . . . . . . . . 371 . 18224 8
68 2 1 . . 118.084 . . 1 . 1 1 38 VAL N . . . . . . . . . . 372 . 18224 8
69 1 1 . . 8.113 . . 1 . 1 1 51 TRP H . . . . . . . . . . 388 . 18224 8
69 2 1 . . 118.087 . . 1 . 1 1 51 TRP N . . . . . . . . . . 389 . 18224 8
70 1 1 . . 8.112 . . 1 . 1 1 55 ARG H . . . . . . . . . . 391 . 18224 8
70 2 1 . . 117.595 . . 1 . 1 1 55 ARG N . . . . . . . . . . 392 . 18224 8
71 1 1 . . 7.683 . . 1 . 1 1 44 THR H . . . . . . . . . . 488 . 18224 8
71 2 1 . . 112.035 . . 1 . 1 1 44 THR N . . . . . . . . . . 490 . 18224 8
72 1 1 . . 6.580 . . 1 . 1 1 55 ARG HH12 . . . . . . . . . . 564 . 18224 8
72 2 1 . . 71.674 . . 1 . 1 1 55 ARG NH1 . . . . . . . . . . 566 . 18224 8
73 1 1 . . 9.915 . . 1 . 1 1 24 TRP HE1 . . . . . . . . . . 608 . 18224 8
73 2 1 . . 128.613 . . 1 . 1 1 24 TRP NE1 . . . . . . . . . . 609 . 18224 8
74 1 1 . . 9.900 . . 1 . 1 1 51 TRP HE1 . . . . . . . . . . 607 . 18224 8
74 2 1 . . 127.920 . . 1 . 1 1 51 TRP NE1 . . . . . . . . . . 606 . 18224 8
stop_
save_