Content for NMR-STAR saveframe, "peak_list_1_2_3_4"
save_peak_list_1_2_3_4
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode peak_list_1_2_3_4
_Spectral_peak_list.Entry_ID 18863
_Spectral_peak_list.ID 4
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $methanol_CN
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $methanol_25c
_Spectral_peak_list.Experiment_ID 4
_Spectral_peak_list.Experiment_name '3D HNCACB'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 3
_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 . . 3749.812 . . . . . . . 18863 4
2 . . C 13 13C . . 12500.000 . . . . . . . 18863 4
3 . . N 15 15N . . 2000.000 . . . . . . . 18863 4
stop_
loop_
_Peak.ID
_Peak.Figure_of_merit
_Peak.Restraint
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
1 1.0 . . 18863 4
2 1.0 . . 18863 4
3 1.0 . . 18863 4
4 1.0 . . 18863 4
5 1.0 . . 18863 4
6 1.0 . . 18863 4
7 1.0 . . 18863 4
8 1.0 . . 18863 4
9 1.0 . . 18863 4
10 1.0 . . 18863 4
11 1.0 . . 18863 4
12 1.0 . . 18863 4
13 1.0 . . 18863 4
14 1.0 . . 18863 4
15 1.0 . . 18863 4
16 1.0 . . 18863 4
17 1.0 . . 18863 4
18 1.0 . . 18863 4
19 1.0 . . 18863 4
20 1.0 . . 18863 4
21 1.0 . . 18863 4
22 1.0 . . 18863 4
23 1.0 . . 18863 4
24 1.0 . . 18863 4
25 1.0 . . 18863 4
26 1.0 . . 18863 4
27 1.0 . . 18863 4
28 1.0 . . 18863 4
29 1.0 . . 18863 4
30 1.0 . . 18863 4
31 1.0 . . 18863 4
32 1.0 . . 18863 4
33 1.0 . . 18863 4
34 1.0 . . 18863 4
35 1.0 . . 18863 4
36 1.0 . . 18863 4
37 1.0 . . 18863 4
38 1.0 . . 18863 4
39 1.0 . . 18863 4
40 1.0 . . 18863 4
41 1.0 . . 18863 4
42 1.0 . . 18863 4
43 1.0 . . 18863 4
44 1.0 . . 18863 4
45 1.0 . . 18863 4
46 1.0 . . 18863 4
47 1.0 . . 18863 4
48 1.0 . . 18863 4
49 1.0 . . 18863 4
50 1.0 . . 18863 4
51 1.0 . . 18863 4
52 1.0 . . 18863 4
53 1.0 . . 18863 4
54 1.0 . . 18863 4
55 1.0 . . 18863 4
56 1.0 . . 18863 4
57 1.0 . . 18863 4
58 1.0 . . 18863 4
59 1.0 . . 18863 4
60 1.0 . . 18863 4
61 1.0 . . 18863 4
62 1.0 . . 18863 4
63 1.0 . . 18863 4
64 1.0 . . 18863 4
65 1.0 . . 18863 4
66 1.0 . . 18863 4
67 1.0 . . 18863 4
68 1.0 . . 18863 4
69 1.0 . . 18863 4
70 1.0 . . 18863 4
71 1.0 . . 18863 4
72 1.0 . . 18863 4
73 1.0 . . 18863 4
74 1.0 . . 18863 4
75 1.0 . . 18863 4
76 1.0 . . 18863 4
77 1.0 . . 18863 4
78 1.0 . . 18863 4
79 1.0 . . 18863 4
80 1.0 . . 18863 4
81 1.0 . . 18863 4
82 1.0 . . 18863 4
83 1.0 . . 18863 4
84 1.0 . . 18863 4
85 1.0 . . 18863 4
86 1.0 . . 18863 4
87 1.0 . . 18863 4
88 1.0 . . 18863 4
89 1.0 . . 18863 4
90 1.0 . . 18863 4
91 1.0 . . 18863 4
92 1.0 . . 18863 4
93 1.0 . . 18863 4
94 1.0 . . 18863 4
95 1.0 . . 18863 4
96 1.0 . . 18863 4
97 1.0 . . 18863 4
98 1.0 . . 18863 4
99 1.0 . . 18863 4
100 1.0 . . 18863 4
101 1.0 . . 18863 4
102 1.0 . . 18863 4
103 1.0 . . 18863 4
104 1.0 . . 18863 4
105 1.0 . . 18863 4
106 1.0 . . 18863 4
107 1.0 . . 18863 4
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 93122.8984375 . height 18863 4
1 1169883.4599000 . volume 18863 4
2 84133.6718750 . height 18863 4
2 913364.5957030 . volume 18863 4
3 100480.1718750 . height 18863 4
3 1331045.6503900 . volume 18863 4
4 432958.6250000 . height 18863 4
4 6066695.9023400 . volume 18863 4
5 147144.5781250 . height 18863 4
5 1805439.5996100 . volume 18863 4
6 87653.5078125 . height 18863 4
6 992808.3721920 . volume 18863 4
7 116516.5312500 . height 18863 4
7 1905445.5390600 . volume 18863 4
8 91464.6250000 . height 18863 4
8 947860.9458010 . volume 18863 4
9 99333.1640625 . height 18863 4
9 965612.7076420 . volume 18863 4
10 80747.6171875 . height 18863 4
10 891140.3549800 . volume 18863 4
11 106851.0781250 . height 18863 4
11 1767046.5937500 . volume 18863 4
12 223838.5625000 . height 18863 4
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14 175382.3750000 . height 18863 4
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24 269313.6250000 . height 18863 4
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26 527632.3125000 . height 18863 4
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29 225562.8750000 . height 18863 4
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31 162610.7968750 . height 18863 4
31 2607895.7519500 . volume 18863 4
32 173800.8125000 . height 18863 4
32 2562656.1198700 . volume 18863 4
33 89779.7812500 . height 18863 4
33 1229000.7119100 . volume 18863 4
34 186202.6406250 . height 18863 4
34 2918462.2558600 . volume 18863 4
35 135488.3906250 . height 18863 4
35 2433161.1914100 . volume 18863 4
36 128661.7656250 . height 18863 4
36 1639405.7500000 . volume 18863 4
37 245814.4375000 . height 18863 4
37 3578814.6992200 . volume 18863 4
38 97224.7968750 . height 18863 4
38 1642220.5610400 . volume 18863 4
39 208731.1406250 . height 18863 4
39 3349120.3125000 . volume 18863 4
40 101602.9375000 . height 18863 4
40 1653916.6474600 . volume 18863 4
41 134155.5156250 . height 18863 4
41 1818605.8864700 . volume 18863 4
42 163668.3750000 . height 18863 4
42 2422370.0061000 . volume 18863 4
43 118428.1796880 . height 18863 4
43 1905223.0546900 . volume 18863 4
44 85251.2656250 . height 18863 4
44 1182905.0688500 . volume 18863 4
45 233566.4375000 . height 18863 4
45 2842059.9284700 . volume 18863 4
46 83106.4453125 . height 18863 4
46 970759.3255460 . volume 18863 4
47 185402.3281250 . height 18863 4
47 2676783.7265600 . volume 18863 4
48 115261.2734380 . height 18863 4
48 1829152.3222700 . volume 18863 4
49 585849.8125000 . height 18863 4
49 8273243.1796900 . volume 18863 4
50 1717049.2500000 . height 18863 4
50 23800277.1250000 . volume 18863 4
51 1481024.5000000 . height 18863 4
51 20573303.4688000 . volume 18863 4
52 1498082.8750000 . height 18863 4
52 22309794.3125000 . volume 18863 4
53 728558.6875000 . height 18863 4
53 10429411.8281000 . volume 18863 4
54 243632.0468750 . height 18863 4
54 4027885.2109400 . volume 18863 4
55 1605854.1250000 . height 18863 4
55 23032220.4062000 . volume 18863 4
56 271505.7500000 . height 18863 4
56 4440471.0781200 . volume 18863 4
57 834339.7500000 . height 18863 4
57 11640421.6406000 . volume 18863 4
58 930405.6875000 . height 18863 4
58 13772252.2188000 . volume 18863 4
59 92944.8984375 . height 18863 4
59 1411262.7143600 . volume 18863 4
60 126665.9609380 . height 18863 4
60 1813747.4529100 . volume 18863 4
61 162239.7812500 . height 18863 4
61 2293627.2773400 . volume 18863 4
62 157784.8125000 . height 18863 4
62 2220545.8759800 . volume 18863 4
63 138531.7812500 . height 18863 4
63 2288832.6386700 . volume 18863 4
64 193027.5156250 . height 18863 4
64 3167840.2421900 . volume 18863 4
65 1086268.7500000 . height 18863 4
65 14735809.4688000 . volume 18863 4
66 104739.7656250 . height 18863 4
66 2140130.5000000 . volume 18863 4
67 231307.3125000 . height 18863 4
67 3436514.1562500 . volume 18863 4
68 333934.3125000 . height 18863 4
68 4309380.6250000 . volume 18863 4
69 113077.5781250 . height 18863 4
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70 161448.6406250 . height 18863 4
70 2642722.4882800 . volume 18863 4
71 85710.2890625 . height 18863 4
71 1258355.6494100 . volume 18863 4
72 221038.8281250 . height 18863 4
72 3144763.5468800 . volume 18863 4
73 204245.5000000 . height 18863 4
73 2965942.0898400 . volume 18863 4
74 105145.0625000 . height 18863 4
74 1699259.4824200 . volume 18863 4
75 1049972.7500000 . height 18863 4
75 18579844.8438000 . volume 18863 4
76 259012.8281250 . height 18863 4
76 3733048.4140600 . volume 18863 4
77 90604.8281250 . height 18863 4
77 1043210.7771000 . volume 18863 4
78 583467.1250000 . height 18863 4
78 9020504.2656200 . volume 18863 4
79 181256.1718750 . height 18863 4
79 2609625.9160200 . volume 18863 4
80 85411.7031250 . height 18863 4
80 1156270.7109400 . volume 18863 4
81 178027.3906250 . height 18863 4
81 3397448.7656200 . volume 18863 4
82 79956.1093750 . height 18863 4
82 1019617.0507800 . volume 18863 4
83 83598.2578125 . height 18863 4
83 1249315.2226600 . volume 18863 4
84 80749.8359375 . height 18863 4
84 604555.5385740 . volume 18863 4
85 483024.3437500 . height 18863 4
85 7188247.9062500 . volume 18863 4
86 137056.2968750 . height 18863 4
86 1717382.9453100 . volume 18863 4
87 621875.5000000 . height 18863 4
87 9383306.0312500 . volume 18863 4
88 910301.0625000 . height 18863 4
88 14056689.0000000 . volume 18863 4
89 83059.8593750 . height 18863 4
89 526412.9562990 . volume 18863 4
90 107341.4843750 . height 18863 4
90 1905463.5781200 . volume 18863 4
91 345596.0937500 . height 18863 4
91 5445533.3750000 . volume 18863 4
92 832824.0625000 . height 18863 4
92 12605155.2969000 . volume 18863 4
93 619183.5000000 . height 18863 4
93 9190473.6367200 . volume 18863 4
94 252999.5468750 . height 18863 4
94 3304675.8007800 . volume 18863 4
95 157062.3281250 . height 18863 4
95 2009549.1269500 . volume 18863 4
96 80271.3359375 . height 18863 4
96 651308.8529050 . volume 18863 4
97 697331.1250000 . height 18863 4
97 9923976.6406200 . volume 18863 4
98 203867.3750000 . height 18863 4
98 2939148.3613300 . volume 18863 4
99 598668.4375000 . height 18863 4
99 8362722.4062500 . volume 18863 4
100 1467024.8750000 . height 18863 4
100 20401135.3281000 . volume 18863 4
101 338827.7187500 . height 18863 4
101 4506974.3125000 . volume 18863 4
102 118377.8828120 . height 18863 4
102 1424233.1606400 . volume 18863 4
103 532776.0625000 . height 18863 4
103 7144008.5156200 . volume 18863 4
104 155634.0625000 . height 18863 4
104 2238875.7519500 . volume 18863 4
105 99404.0781250 . height 18863 4
105 1014171.1147500 . volume 18863 4
106 175442.8437500 . height 18863 4
106 3080994.0195300 . volume 18863 4
107 16248.8535156 . height 18863 4
107 275585.7699890 . volume 18863 4
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 10.146 . . . . . . . . . . . . 8 18863 4
1 2 53.176 . . . . . . . . . . . . 8 18863 4
1 3 128.611 . . . . . . . . . . . . 8 18863 4
2 1 9.748 . . . . . . . . . . . . 8 18863 4
2 2 47.573 . . . . . . . . . . . . 8 18863 4
2 3 128.255 . . . . . . . . . . . . 8 18863 4
3 1 8.334 . . . . . . . . . . . . 8 18863 4
3 2 19.276 . . . . . . . . . . . . 8 18863 4
3 3 124.993 . . . . . . . . . . . . 8 18863 4
4 1 7.935 . . . . . . . . . . . . 8 18863 4
4 2 19.917 . . . . . . . . . . . . 8 18863 4
4 3 123.928 . . . . . . . . . . . . 8 18863 4
5 1 8.301 . . . . . . . . . . . . 8 18863 4
5 2 19.414 . . . . . . . . . . . . 8 18863 4
5 3 123.728 . . . . . . . . . . . . 8 18863 4
6 1 8.314 . . . . . . . . . . . . 8 18863 4
6 2 18.874 . . . . . . . . . . . . 8 18863 4
6 3 123.779 . . . . . . . . . . . . 8 18863 4
7 1 8.529 . . . . . . . . . . . . 8 18863 4
7 2 19.371 . . . . . . . . . . . . 8 18863 4
7 3 123.508 . . . . . . . . . . . . 8 18863 4
8 1 8.534 . . . . . . . . . . . . 8 18863 4
8 2 40.262 . . . . . . . . . . . . 8 18863 4
8 3 123.411 . . . . . . . . . . . . 8 18863 4
9 1 8.237 . . . . . . . . . . . . 8 18863 4
9 2 39.745 . . . . . . . . . . . . 8 18863 4
9 3 123.012 . . . . . . . . . . . . 8 18863 4
10 1 8.131 . . . . . . . . . . . . 8 18863 4
10 2 64.309 . . . . . . . . . . . . 8 18863 4
10 3 123.151 . . . . . . . . . . . . 8 18863 4
11 1 8.127 . . . . . . . . . . . . 8 18863 4
11 2 33.351 . . . . . . . . . . . . 8 18863 4
11 3 123.140 . . . . . . . . . . . . 8 18863 4
12 1 8.010 . . . . . . . . . . . . 8 18863 4
12 2 33.778 . . . . . . . . . . . . 8 18863 4
12 3 122.750 . . . . . . . . . . . . 8 18863 4
13 1 8.009 . . . . . . . . . . . . 8 18863 4
13 2 29.066 . . . . . . . . . . . . 8 18863 4
13 3 122.720 . . . . . . . . . . . . 8 18863 4
14 1 8.161 . . . . . . . . . . . . 8 18863 4
14 2 32.083 . . . . . . . . . . . . 8 18863 4
14 3 122.703 . . . . . . . . . . . . 8 18863 4
15 1 8.158 . . . . . . . . . . . . 8 18863 4
15 2 19.996 . . . . . . . . . . . . 8 18863 4
15 3 122.641 . . . . . . . . . . . . 8 18863 4
16 1 8.105 . . . . . . . . . . . . 8 18863 4
16 2 19.289 . . . . . . . . . . . . 8 18863 4
16 3 122.690 . . . . . . . . . . . . 8 18863 4
17 1 8.120 . . . . . . . . . . . . 8 18863 4
17 2 40.020 . . . . . . . . . . . . 8 18863 4
17 3 122.519 . . . . . . . . . . . . 8 18863 4
18 1 8.025 . . . . . . . . . . . . 8 18863 4
18 2 40.413 . . . . . . . . . . . . 8 18863 4
18 3 122.298 . . . . . . . . . . . . 8 18863 4
19 1 8.005 . . . . . . . . . . . . 8 18863 4
19 2 20.224 . . . . . . . . . . . . 8 18863 4
19 3 122.336 . . . . . . . . . . . . 8 18863 4
20 1 8.027 . . . . . . . . . . . . 8 18863 4
20 2 19.321 . . . . . . . . . . . . 8 18863 4
20 3 122.368 . . . . . . . . . . . . 8 18863 4
21 1 7.822 . . . . . . . . . . . . 8 18863 4
21 2 18.888 . . . . . . . . . . . . 8 18863 4
21 3 122.504 . . . . . . . . . . . . 8 18863 4
22 1 7.822 . . . . . . . . . . . . 8 18863 4
22 2 44.393 . . . . . . . . . . . . 8 18863 4
22 3 122.381 . . . . . . . . . . . . 8 18863 4
23 1 7.912 . . . . . . . . . . . . 8 18863 4
23 2 19.888 . . . . . . . . . . . . 8 18863 4
23 3 121.850 . . . . . . . . . . . . 8 18863 4
24 1 7.914 . . . . . . . . . . . . 8 18863 4
24 2 39.857 . . . . . . . . . . . . 8 18863 4
24 3 121.787 . . . . . . . . . . . . 8 18863 4
25 1 7.855 . . . . . . . . . . . . 8 18863 4
25 2 39.614 . . . . . . . . . . . . 8 18863 4
25 3 121.529 . . . . . . . . . . . . 8 18863 4
26 1 7.854 . . . . . . . . . . . . 8 18863 4
26 2 19.548 . . . . . . . . . . . . 8 18863 4
26 3 121.594 . . . . . . . . . . . . 8 18863 4
27 1 8.542 . . . . . . . . . . . . 8 18863 4
27 2 38.640 . . . . . . . . . . . . 8 18863 4
27 3 121.517 . . . . . . . . . . . . 8 18863 4
28 1 8.291 . . . . . . . . . . . . 8 18863 4
28 2 44.186 . . . . . . . . . . . . 8 18863 4
28 3 121.326 . . . . . . . . . . . . 8 18863 4
29 1 8.152 . . . . . . . . . . . . 8 18863 4
29 2 33.602 . . . . . . . . . . . . 8 18863 4
29 3 121.239 . . . . . . . . . . . . 8 18863 4
30 1 7.951 . . . . . . . . . . . . 8 18863 4
30 2 43.422 . . . . . . . . . . . . 8 18863 4
30 3 121.028 . . . . . . . . . . . . 8 18863 4
31 1 8.310 . . . . . . . . . . . . 8 18863 4
31 2 43.324 . . . . . . . . . . . . 8 18863 4
31 3 121.038 . . . . . . . . . . . . 8 18863 4
32 1 8.574 . . . . . . . . . . . . 8 18863 4
32 2 19.445 . . . . . . . . . . . . 8 18863 4
32 3 120.998 . . . . . . . . . . . . 8 18863 4
33 1 8.777 . . . . . . . . . . . . 8 18863 4
33 2 56.400 . . . . . . . . . . . . 8 18863 4
33 3 120.889 . . . . . . . . . . . . 8 18863 4
34 1 8.806 . . . . . . . . . . . . 8 18863 4
34 2 40.907 . . . . . . . . . . . . 8 18863 4
34 3 120.794 . . . . . . . . . . . . 8 18863 4
35 1 8.082 . . . . . . . . . . . . 8 18863 4
35 2 43.064 . . . . . . . . . . . . 8 18863 4
35 3 120.577 . . . . . . . . . . . . 8 18863 4
36 1 8.051 . . . . . . . . . . . . 8 18863 4
36 2 40.240 . . . . . . . . . . . . 8 18863 4
36 3 120.660 . . . . . . . . . . . . 8 18863 4
37 1 8.056 . . . . . . . . . . . . 8 18863 4
37 2 33.017 . . . . . . . . . . . . 8 18863 4
37 3 120.664 . . . . . . . . . . . . 8 18863 4
38 1 8.066 . . . . . . . . . . . . 8 18863 4
38 2 19.926 . . . . . . . . . . . . 8 18863 4
38 3 120.369 . . . . . . . . . . . . 8 18863 4
39 1 8.397 . . . . . . . . . . . . 8 18863 4
39 2 38.604 . . . . . . . . . . . . 8 18863 4
39 3 120.630 . . . . . . . . . . . . 8 18863 4
40 1 8.203 . . . . . . . . . . . . 8 18863 4
40 2 39.909 . . . . . . . . . . . . 8 18863 4
40 3 120.598 . . . . . . . . . . . . 8 18863 4
41 1 8.242 . . . . . . . . . . . . 8 18863 4
41 2 19.185 . . . . . . . . . . . . 8 18863 4
41 3 120.614 . . . . . . . . . . . . 8 18863 4
42 1 8.199 . . . . . . . . . . . . 8 18863 4
42 2 38.843 . . . . . . . . . . . . 8 18863 4
42 3 120.422 . . . . . . . . . . . . 8 18863 4
43 1 8.351 . . . . . . . . . . . . 8 18863 4
43 2 43.514 . . . . . . . . . . . . 8 18863 4
43 3 120.520 . . . . . . . . . . . . 8 18863 4
44 1 8.339 . . . . . . . . . . . . 8 18863 4
44 2 40.133 . . . . . . . . . . . . 8 18863 4
44 3 120.512 . . . . . . . . . . . . 8 18863 4
45 1 8.511 . . . . . . . . . . . . 8 18863 4
45 2 40.254 . . . . . . . . . . . . 8 18863 4
45 3 120.393 . . . . . . . . . . . . 8 18863 4
46 1 8.509 . . . . . . . . . . . . 8 18863 4
46 2 43.919 . . . . . . . . . . . . 8 18863 4
46 3 120.301 . . . . . . . . . . . . 8 18863 4
47 1 8.285 . . . . . . . . . . . . 8 18863 4
47 2 38.819 . . . . . . . . . . . . 8 18863 4
47 3 120.303 . . . . . . . . . . . . 8 18863 4
48 1 8.294 . . . . . . . . . . . . 8 18863 4
48 2 33.320 . . . . . . . . . . . . 8 18863 4
48 3 120.350 . . . . . . . . . . . . 8 18863 4
49 1 8.031 . . . . . . . . . . . . 8 18863 4
49 2 19.723 . . . . . . . . . . . . 8 18863 4
49 3 120.270 . . . . . . . . . . . . 8 18863 4
50 1 7.787 . . . . . . . . . . . . 8 18863 4
50 2 20.189 . . . . . . . . . . . . 8 18863 4
50 3 120.322 . . . . . . . . . . . . 8 18863 4
51 1 7.878 . . . . . . . . . . . . 8 18863 4
51 2 19.924 . . . . . . . . . . . . 8 18863 4
51 3 120.284 . . . . . . . . . . . . 8 18863 4
52 1 8.195 . . . . . . . . . . . . 8 18863 4
52 2 44.168 . . . . . . . . . . . . 8 18863 4
52 3 120.134 . . . . . . . . . . . . 8 18863 4
53 1 8.195 . . . . . . . . . . . . 8 18863 4
53 2 33.670 . . . . . . . . . . . . 8 18863 4
53 3 120.119 . . . . . . . . . . . . 8 18863 4
54 1 8.538 . . . . . . . . . . . . 8 18863 4
54 2 38.926 . . . . . . . . . . . . 8 18863 4
54 3 120.072 . . . . . . . . . . . . 8 18863 4
55 1 7.717 . . . . . . . . . . . . 8 18863 4
55 2 20.426 . . . . . . . . . . . . 8 18863 4
55 3 119.863 . . . . . . . . . . . . 8 18863 4
56 1 7.627 . . . . . . . . . . . . 8 18863 4
56 2 43.950 . . . . . . . . . . . . 8 18863 4
56 3 119.795 . . . . . . . . . . . . 8 18863 4
57 1 7.629 . . . . . . . . . . . . 8 18863 4
57 2 20.584 . . . . . . . . . . . . 8 18863 4
57 3 119.874 . . . . . . . . . . . . 8 18863 4
58 1 7.820 . . . . . . . . . . . . 8 18863 4
58 2 43.059 . . . . . . . . . . . . 8 18863 4
58 3 119.695 . . . . . . . . . . . . 8 18863 4
59 1 8.082 . . . . . . . . . . . . 8 18863 4
59 2 30.602 . . . . . . . . . . . . 8 18863 4
59 3 119.811 . . . . . . . . . . . . 8 18863 4
60 1 8.227 . . . . . . . . . . . . 8 18863 4
60 2 39.321 . . . . . . . . . . . . 8 18863 4
60 3 119.669 . . . . . . . . . . . . 8 18863 4
61 1 8.467 . . . . . . . . . . . . 8 18863 4
61 2 38.730 . . . . . . . . . . . . 8 18863 4
61 3 119.652 . . . . . . . . . . . . 8 18863 4
62 1 8.182 . . . . . . . . . . . . 8 18863 4
62 2 29.438 . . . . . . . . . . . . 8 18863 4
62 3 119.496 . . . . . . . . . . . . 8 18863 4
63 1 8.075 . . . . . . . . . . . . 8 18863 4
63 2 33.945 . . . . . . . . . . . . 8 18863 4
63 3 119.410 . . . . . . . . . . . . 8 18863 4
64 1 7.963 . . . . . . . . . . . . 8 18863 4
64 2 19.411 . . . . . . . . . . . . 8 18863 4
64 3 119.608 . . . . . . . . . . . . 8 18863 4
65 1 7.512 . . . . . . . . . . . . 8 18863 4
65 2 43.339 . . . . . . . . . . . . 8 18863 4
65 3 119.412 . . . . . . . . . . . . 8 18863 4
66 1 7.634 . . . . . . . . . . . . 8 18863 4
66 2 43.266 . . . . . . . . . . . . 8 18863 4
66 3 119.230 . . . . . . . . . . . . 8 18863 4
67 1 7.620 . . . . . . . . . . . . 8 18863 4
67 2 40.032 . . . . . . . . . . . . 8 18863 4
67 3 119.281 . . . . . . . . . . . . 8 18863 4
68 1 7.636 . . . . . . . . . . . . 8 18863 4
68 2 20.551 . . . . . . . . . . . . 8 18863 4
68 3 119.113 . . . . . . . . . . . . 8 18863 4
69 1 8.039 . . . . . . . . . . . . 8 18863 4
69 2 43.653 . . . . . . . . . . . . 8 18863 4
69 3 118.831 . . . . . . . . . . . . 8 18863 4
70 1 8.026 . . . . . . . . . . . . 8 18863 4
70 2 43.240 . . . . . . . . . . . . 8 18863 4
70 3 118.744 . . . . . . . . . . . . 8 18863 4
71 1 8.028 . . . . . . . . . . . . 8 18863 4
71 2 19.394 . . . . . . . . . . . . 8 18863 4
71 3 118.859 . . . . . . . . . . . . 8 18863 4
72 1 8.390 . . . . . . . . . . . . 8 18863 4
72 2 39.593 . . . . . . . . . . . . 8 18863 4
72 3 118.607 . . . . . . . . . . . . 8 18863 4
73 1 7.486 . . . . . . . . . . . . 8 18863 4
73 2 31.466 . . . . . . . . . . . . 8 18863 4
73 3 118.290 . . . . . . . . . . . . 8 18863 4
74 1 8.399 . . . . . . . . . . . . 8 18863 4
74 2 28.429 . . . . . . . . . . . . 8 18863 4
74 3 118.021 . . . . . . . . . . . . 8 18863 4
75 1 7.829 . . . . . . . . . . . . 8 18863 4
75 2 42.991 . . . . . . . . . . . . 8 18863 4
75 3 118.053 . . . . . . . . . . . . 8 18863 4
76 1 7.586 . . . . . . . . . . . . 8 18863 4
76 2 44.367 . . . . . . . . . . . . 8 18863 4
76 3 117.998 . . . . . . . . . . . . 8 18863 4
77 1 7.986 . . . . . . . . . . . . 8 18863 4
77 2 20.302 . . . . . . . . . . . . 8 18863 4
77 3 117.996 . . . . . . . . . . . . 8 18863 4
78 1 7.964 . . . . . . . . . . . . 8 18863 4
78 2 39.993 . . . . . . . . . . . . 8 18863 4
78 3 117.857 . . . . . . . . . . . . 8 18863 4
79 1 7.965 . . . . . . . . . . . . 8 18863 4
79 2 19.921 . . . . . . . . . . . . 8 18863 4
79 3 117.822 . . . . . . . . . . . . 8 18863 4
80 1 7.666 . . . . . . . . . . . . 8 18863 4
80 2 49.474 . . . . . . . . . . . . 8 18863 4
80 3 118.050 . . . . . . . . . . . . 8 18863 4
81 1 7.794 . . . . . . . . . . . . 8 18863 4
81 2 43.130 . . . . . . . . . . . . 8 18863 4
81 3 117.705 . . . . . . . . . . . . 8 18863 4
82 1 7.786 . . . . . . . . . . . . 8 18863 4
82 2 34.238 . . . . . . . . . . . . 8 18863 4
82 3 117.812 . . . . . . . . . . . . 8 18863 4
83 1 7.776 . . . . . . . . . . . . 8 18863 4
83 2 19.789 . . . . . . . . . . . . 8 18863 4
83 3 117.695 . . . . . . . . . . . . 8 18863 4
84 1 7.792 . . . . . . . . . . . . 8 18863 4
84 2 21.024 . . . . . . . . . . . . 8 18863 4
84 3 117.610 . . . . . . . . . . . . 8 18863 4
85 1 7.889 . . . . . . . . . . . . 8 18863 4
85 2 39.779 . . . . . . . . . . . . 8 18863 4
85 3 117.498 . . . . . . . . . . . . 8 18863 4
86 1 7.890 . . . . . . . . . . . . 8 18863 4
86 2 19.807 . . . . . . . . . . . . 8 18863 4
86 3 117.494 . . . . . . . . . . . . 8 18863 4
87 1 7.681 . . . . . . . . . . . . 8 18863 4
87 2 34.051 . . . . . . . . . . . . 8 18863 4
87 3 117.312 . . . . . . . . . . . . 8 18863 4
88 1 7.744 . . . . . . . . . . . . 8 18863 4
88 2 43.742 . . . . . . . . . . . . 8 18863 4
88 3 117.200 . . . . . . . . . . . . 8 18863 4
89 1 7.903 . . . . . . . . . . . . 8 18863 4
89 2 51.166 . . . . . . . . . . . . 8 18863 4
89 3 116.950 . . . . . . . . . . . . 8 18863 4
90 1 7.950 . . . . . . . . . . . . 8 18863 4
90 2 33.018 . . . . . . . . . . . . 8 18863 4
90 3 116.969 . . . . . . . . . . . . 8 18863 4
91 1 7.947 . . . . . . . . . . . . 8 18863 4
91 2 29.324 . . . . . . . . . . . . 8 18863 4
91 3 116.982 . . . . . . . . . . . . 8 18863 4
92 1 7.979 . . . . . . . . . . . . 8 18863 4
92 2 40.328 . . . . . . . . . . . . 8 18863 4
92 3 116.809 . . . . . . . . . . . . 8 18863 4
93 1 7.880 . . . . . . . . . . . . 8 18863 4
93 2 40.911 . . . . . . . . . . . . 8 18863 4
93 3 116.638 . . . . . . . . . . . . 8 18863 4
94 1 7.879 . . . . . . . . . . . . 8 18863 4
94 2 19.526 . . . . . . . . . . . . 8 18863 4
94 3 116.585 . . . . . . . . . . . . 8 18863 4
95 1 8.395 . . . . . . . . . . . . 8 18863 4
95 2 29.699 . . . . . . . . . . . . 8 18863 4
95 3 116.128 . . . . . . . . . . . . 8 18863 4
96 1 8.371 . . . . . . . . . . . . 8 18863 4
96 2 32.094 . . . . . . . . . . . . 8 18863 4
96 3 115.930 . . . . . . . . . . . . 8 18863 4
97 1 7.075 . . . . . . . . . . . . 8 18863 4
97 2 43.197 . . . . . . . . . . . . 8 18863 4
97 3 116.132 . . . . . . . . . . . . 8 18863 4
98 1 7.074 . . . . . . . . . . . . 8 18863 4
98 2 32.592 . . . . . . . . . . . . 8 18863 4
98 3 116.086 . . . . . . . . . . . . 8 18863 4
99 1 8.129 . . . . . . . . . . . . 8 18863 4
99 2 65.126 . . . . . . . . . . . . 8 18863 4
99 3 115.353 . . . . . . . . . . . . 8 18863 4
100 1 7.588 . . . . . . . . . . . . 8 18863 4
100 2 65.833 . . . . . . . . . . . . 8 18863 4
100 3 114.047 . . . . . . . . . . . . 8 18863 4
101 1 7.588 . . . . . . . . . . . . 8 18863 4
101 2 20.456 . . . . . . . . . . . . 8 18863 4
101 3 114.055 . . . . . . . . . . . . 8 18863 4
102 1 6.746 . . . . . . . . . . . . 8 18863 4
102 2 58.455 . . . . . . . . . . . . 8 18863 4
102 3 108.433 . . . . . . . . . . . . 8 18863 4
103 1 8.066 . . . . . . . . . . . . 8 18863 4
103 2 43.924 . . . . . . . . . . . . 8 18863 4
103 3 107.339 . . . . . . . . . . . . 8 18863 4
104 1 7.925 . . . . . . . . . . . . 8 18863 4
104 2 40.045 . . . . . . . . . . . . 8 18863 4
104 3 106.583 . . . . . . . . . . . . 8 18863 4
105 1 7.940 . . . . . . . . . . . . 8 18863 4
105 2 39.128 . . . . . . . . . . . . 8 18863 4
105 3 106.498 . . . . . . . . . . . . 8 18863 4
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 . . 10.146 . . 1 . 1 1 67 TRP HE1 . . . . . . . . . . 1 . 18863 4
1 3 1 . . 128.611 . . 1 . 1 1 67 TRP NE1 . . . . . . . . . . 2 . 18863 4
2 1 1 . . 9.748 . . 1 . 1 1 49 TRP HE1 . . . . . . . . . . 3 . 18863 4
2 3 1 . . 128.255 . . 1 . 1 1 49 TRP NE1 . . . . . . . . . . 4 . 18863 4
3 1 1 . . 8.334 . . 1 . 1 1 35 ALA H . . . . . . . . . . 5 . 18863 4
3 3 1 . . 124.993 . . 1 . 1 1 35 ALA N . . . . . . . . . . 6 . 18863 4
4 1 1 . . 7.935 . . 1 . 1 1 59 ALA H . . . . . . . . . . 7 . 18863 4
4 3 1 . . 123.928 . . 1 . 1 1 59 ALA N . . . . . . . . . . 8 . 18863 4
5 1 1 . . 8.301 . . 1 . 1 1 33 ALA H . . . . . . . . . . 9 . 18863 4
5 3 1 . . 123.728 . . 1 . 1 1 33 ALA N . . . . . . . . . . 10 . 18863 4
6 1 1 . . 8.314 . . 1 . 1 1 33 ALA H . . . . . . . . . . 9 . 18863 4
6 3 1 . . 123.779 . . 1 . 1 1 33 ALA N . . . . . . . . . . 10 . 18863 4
7 1 1 . . 8.529 . . 1 . 1 1 29 ALA H . . . . . . . . . . 11 . 18863 4
7 3 1 . . 123.508 . . 1 . 1 1 29 ALA N . . . . . . . . . . 12 . 18863 4
8 1 1 . . 8.534 . . 1 . 1 1 29 ALA H . . . . . . . . . . 11 . 18863 4
8 3 1 . . 123.411 . . 1 . 1 1 29 ALA N . . . . . . . . . . 12 . 18863 4
9 1 1 . . 8.237 . . 1 . 1 1 38 ILE H . . . . . . . . . . 13 . 18863 4
9 3 1 . . 123.012 . . 1 . 1 1 38 ILE N . . . . . . . . . . 14 . 18863 4
10 1 1 . . 8.131 . . 1 . 1 1 32 VAL H . . . . . . . . . . 15 . 18863 4
10 3 1 . . 123.151 . . 1 . 1 1 32 VAL N . . . . . . . . . . 16 . 18863 4
11 1 1 . . 8.127 . . 1 . 1 1 32 VAL H . . . . . . . . . . 15 . 18863 4
11 3 1 . . 123.140 . . 1 . 1 1 32 VAL N . . . . . . . . . . 16 . 18863 4
12 1 1 . . 8.010 . . 1 . 1 1 67 TRP H . . . . . . . . . . 19 . 18863 4
12 3 1 . . 122.750 . . 1 . 1 1 67 TRP N . . . . . . . . . . 20 . 18863 4
13 1 1 . . 8.009 . . 1 . 1 1 67 TRP H . . . . . . . . . . 19 . 18863 4
13 3 1 . . 122.720 . . 1 . 1 1 67 TRP N . . . . . . . . . . 20 . 18863 4
14 1 1 . . 8.161 . . 1 . 1 1 80 ALA H . . . . . . . . . . 21 . 18863 4
14 3 1 . . 122.703 . . 1 . 1 1 80 ALA N . . . . . . . . . . 22 . 18863 4
15 1 1 . . 8.158 . . 1 . 1 1 80 ALA H . . . . . . . . . . 21 . 18863 4
15 3 1 . . 122.641 . . 1 . 1 1 80 ALA N . . . . . . . . . . 22 . 18863 4
16 1 1 . . 8.105 . . 1 . 1 1 47 ALA H . . . . . . . . . . 23 . 18863 4
16 3 1 . . 122.690 . . 1 . 1 1 47 ALA N . . . . . . . . . . 24 . 18863 4
17 1 1 . . 8.120 . . 1 . 1 1 47 ALA H . . . . . . . . . . 23 . 18863 4
17 3 1 . . 122.519 . . 1 . 1 1 47 ALA N . . . . . . . . . . 24 . 18863 4
18 1 1 . . 8.025 . . 1 . 1 1 9 ALA H . . . . . . . . . . 25 . 18863 4
18 3 1 . . 122.298 . . 1 . 1 1 9 ALA N . . . . . . . . . . 26 . 18863 4
19 1 1 . . 8.005 . . 1 . 1 1 9 ALA H . . . . . . . . . . 25 . 18863 4
19 3 1 . . 122.336 . . 1 . 1 1 9 ALA N . . . . . . . . . . 26 . 18863 4
20 1 1 . . 8.027 . . 1 . 1 1 9 ALA H . . . . . . . . . . 25 . 18863 4
20 3 1 . . 122.368 . . 1 . 1 1 9 ALA N . . . . . . . . . . 26 . 18863 4
21 1 1 . . 7.822 . . 1 . 1 1 56 ALA H . . . . . . . . . . 27 . 18863 4
21 3 1 . . 122.504 . . 1 . 1 1 56 ALA N . . . . . . . . . . 28 . 18863 4
22 1 1 . . 7.822 . . 1 . 1 1 56 ALA H . . . . . . . . . . 27 . 18863 4
22 3 1 . . 122.381 . . 1 . 1 1 56 ALA N . . . . . . . . . . 28 . 18863 4
23 1 1 . . 7.912 . . 1 . 1 1 82 ALA H . . . . . . . . . . 29 . 18863 4
23 3 1 . . 121.850 . . 1 . 1 1 82 ALA N . . . . . . . . . . 30 . 18863 4
24 1 1 . . 7.914 . . 1 . 1 1 82 ALA H . . . . . . . . . . 29 . 18863 4
24 3 1 . . 121.787 . . 1 . 1 1 82 ALA N . . . . . . . . . . 30 . 18863 4
25 1 1 . . 7.855 . . 1 . 1 1 62 ALA H . . . . . . . . . . 33 . 18863 4
25 3 1 . . 121.529 . . 1 . 1 1 62 ALA N . . . . . . . . . . 34 . 18863 4
26 1 1 . . 7.854 . . 1 . 1 1 62 ALA H . . . . . . . . . . 33 . 18863 4
26 3 1 . . 121.594 . . 1 . 1 1 62 ALA N . . . . . . . . . . 34 . 18863 4
27 1 1 . . 8.542 . . 1 . . . . . . . . . . . . . . . . 35 . 18863 4
27 3 1 . . 121.517 . . 1 . . . . . . . . . . . . . . . . 36 . 18863 4
28 1 1 . . 8.291 . . 1 . 1 1 3 LEU H . . . . . . . . . . 37 . 18863 4
28 3 1 . . 121.326 . . 1 . 1 1 3 LEU N . . . . . . . . . . 38 . 18863 4
29 1 1 . . 8.152 . . 1 . 1 1 44 PHE H . . . . . . . . . . 39 . 18863 4
29 3 1 . . 121.239 . . 1 . 1 1 44 PHE N . . . . . . . . . . 40 . 18863 4
30 1 1 . . 7.951 . . 1 . 1 1 24 LEU H . . . . . . . . . . 43 . 18863 4
30 2 1 . . 43.422 . . 1 . 1 1 24 LEU CB . . . . . . . . . . 600 . 18863 4
30 3 1 . . 121.028 . . 1 . 1 1 24 LEU N . . . . . . . . . . 44 . 18863 4
31 1 1 . . 8.310 . . 1 . 1 1 27 LEU H . . . . . . . . . . 45 . 18863 4
31 3 1 . . 121.038 . . 1 . 1 1 27 LEU N . . . . . . . . . . 46 . 18863 4
32 1 1 . . 8.574 . . 1 . 1 1 30 ALA H . . . . . . . . . . 47 . 18863 4
32 3 1 . . 120.998 . . 1 . 1 1 30 ALA N . . . . . . . . . . 48 . 18863 4
33 1 1 . . 8.777 . . 1 . 1 1 18 ASP H . . . . . . . . . . 49 . 18863 4
33 3 1 . . 120.889 . . 1 . 1 1 18 ASP N . . . . . . . . . . 50 . 18863 4
34 1 1 . . 8.806 . . 1 . 1 1 18 ASP H . . . . . . . . . . 49 . 18863 4
34 3 1 . . 120.794 . . 1 . 1 1 18 ASP N . . . . . . . . . . 50 . 18863 4
35 1 1 . . 8.082 . . 1 . 1 1 39 LEU H . . . . . . . . . . 51 . 18863 4
35 3 1 . . 120.577 . . 1 . 1 1 39 LEU N . . . . . . . . . . 52 . 18863 4
36 1 2 . . 8.051 . . 1 . 1 1 17 ASP H . . . . . . . . . . 228 . 18863 4
36 3 2 . . 120.660 . . 1 . 1 1 17 ASP N . . . . . . . . . . 229 . 18863 4
37 1 1 . . 8.056 . . 1 . 1 1 39 LEU H . . . . . . . . . . 51 . 18863 4
37 3 1 . . 120.664 . . 1 . 1 1 39 LEU N . . . . . . . . . . 52 . 18863 4
38 1 1 . . 8.066 . . 1 . 1 1 39 LEU H . . . . . . . . . . 51 . 18863 4
39 1 1 . . 8.397 . . 1 . . . . . . . . . . . . . . . . 53 . 18863 4
39 3 1 . . 120.630 . . 1 . . . . . . . . . . . . . . . . 54 . 18863 4
40 1 1 . . 8.203 . . 1 . 1 1 50 TYR H . . . . . . . . . . 55 . 18863 4
40 3 1 . . 120.598 . . 1 . 1 1 50 TYR N . . . . . . . . . . 56 . 18863 4
41 1 1 . . 8.242 . . 1 . 1 1 10 ALA H . . . . . . . . . . 57 . 18863 4
41 3 1 . . 120.614 . . 1 . 1 1 50 TYR N . . . . . . . . . . 56 . 18863 4
42 1 1 . . 8.199 . . 1 . 1 1 50 TYR H . . . . . . . . . . 55 . 18863 4
42 3 1 . . 120.422 . . 1 . 1 1 50 TYR N . . . . . . . . . . 56 . 18863 4
43 1 1 . . 8.351 . . 1 . 1 1 42 LEU H . . . . . . . . . . 59 . 18863 4
43 3 1 . . 120.520 . . 1 . 1 1 42 LEU N . . . . . . . . . . 60 . 18863 4
44 1 1 . . 8.339 . . 1 . 1 1 42 LEU H . . . . . . . . . . 59 . 18863 4
44 3 1 . . 120.512 . . 1 . 1 1 42 LEU N . . . . . . . . . . 60 . 18863 4
45 1 1 . . 8.511 . . 1 . 1 1 28 ASN H . . . . . . . . . . 61 . 18863 4
45 3 1 . . 120.393 . . 1 . 1 1 28 ASN N . . . . . . . . . . 62 . 18863 4
46 1 1 . . 8.509 . . 1 . 1 1 28 ASN H . . . . . . . . . . 61 . 18863 4
46 3 1 . . 120.301 . . 1 . 1 1 28 ASN N . . . . . . . . . . 62 . 18863 4
47 1 1 . . 8.285 . . 1 . 1 1 43 VAL H . . . . . . . . . . 63 . 18863 4
47 3 1 . . 120.303 . . 1 . 1 1 43 VAL N . . . . . . . . . . 64 . 18863 4
48 1 1 . . 8.294 . . 1 . 1 1 43 VAL H . . . . . . . . . . 63 . 18863 4
48 3 1 . . 120.350 . . 1 . 1 1 43 VAL N . . . . . . . . . . 64 . 18863 4
49 1 1 . . 8.031 . . 1 . 1 1 60 ALA H . . . . . . . . . . 65 . 18863 4
49 3 1 . . 120.270 . . 1 . 1 1 60 ALA N . . . . . . . . . . 66 . 18863 4
50 1 1 . . 7.787 . . 1 . 1 1 84 ALA H . . . . . . . . . . 67 . 18863 4
50 3 1 . . 120.322 . . 1 . 1 1 84 ALA N . . . . . . . . . . 68 . 18863 4
51 1 1 . . 7.878 . . 1 . 1 1 83 ALA H . . . . . . . . . . 69 . 18863 4
51 3 1 . . 120.284 . . 1 . 1 1 83 ALA N . . . . . . . . . . 70 . 18863 4
52 1 1 . . 8.195 . . 1 . 1 1 12 ASP H . . . . . . . . . . 71 . 18863 4
52 3 1 . . 120.134 . . 1 . 1 1 12 ASP N . . . . . . . . . . 72 . 18863 4
53 1 1 . . 8.195 . . 1 . 1 1 12 ASP H . . . . . . . . . . 71 . 18863 4
53 3 1 . . 120.119 . . 1 . 1 1 12 ASP N . . . . . . . . . . 72 . 18863 4
54 1 1 . . 8.538 . . 1 . . . . . . . . . . . . . . . . 73 . 18863 4
54 3 1 . . 120.072 . . 1 . . . . . . . . . . . . . . . . 74 . 18863 4
55 1 1 . . 7.717 . . 1 . 1 1 85 ALA H . . . . . . . . . . 75 . 18863 4
55 3 1 . . 119.863 . . 1 . 1 1 85 ALA N . . . . . . . . . . 76 . 18863 4
56 1 1 . . 7.627 . . 1 . 1 1 75 ALA H . . . . . . . . . . 77 . 18863 4
56 3 1 . . 119.795 . . 1 . 1 1 75 ALA N . . . . . . . . . . 78 . 18863 4
57 1 1 . . 7.629 . . 1 . 1 1 75 ALA H . . . . . . . . . . 77 . 18863 4
57 3 1 . . 119.874 . . 1 . 1 1 75 ALA N . . . . . . . . . . 78 . 18863 4
58 1 1 . . 7.820 . . 1 . 1 1 70 LEU H . . . . . . . . . . 79 . 18863 4
58 2 1 . . 43.059 . . 1 . 1 1 70 LEU CB . . . . . . . . . . 592 . 18863 4
58 3 1 . . 119.695 . . 1 . 1 1 70 LEU N . . . . . . . . . . 80 . 18863 4
59 1 1 . . 8.082 . . 1 . 1 1 49 TRP H . . . . . . . . . . 81 . 18863 4
59 3 1 . . 119.811 . . 1 . 1 1 49 TRP N . . . . . . . . . . 82 . 18863 4
60 1 1 . . 8.227 . . 1 . 1 1 51 ILE H . . . . . . . . . . 83 . 18863 4
60 3 1 . . 119.669 . . 1 . 1 1 51 ILE N . . . . . . . . . . 84 . 18863 4
61 1 1 . . 8.467 . . 1 . 1 1 45 PHE H . . . . . . . . . . 85 . 18863 4
61 3 1 . . 119.652 . . 1 . 1 1 45 PHE N . . . . . . . . . . 86 . 18863 4
62 1 1 . . 8.182 . . 1 . 1 1 22 GLU H . . . . . . . . . . 87 . 18863 4
62 3 1 . . 119.496 . . 1 . 1 1 22 GLU N . . . . . . . . . . 88 . 18863 4
63 1 1 . . 8.075 . . 1 . 1 1 52 LYS H . . . . . . . . . . 89 . 18863 4
63 3 1 . . 119.410 . . 1 . 1 1 52 LYS N . . . . . . . . . . 90 . 18863 4
64 1 1 . . 7.963 . . 1 . 1 1 48 ALA H . . . . . . . . . . 91 . 18863 4
64 3 1 . . 119.608 . . 1 . 1 1 48 ALA N . . . . . . . . . . 92 . 18863 4
65 1 1 . . 7.512 . . 1 . 1 1 72 LEU H . . . . . . . . . . 93 . 18863 4
65 2 1 . . 43.339 . . 1 . 1 1 72 LEU CB . . . . . . . . . . 590 . 18863 4
65 3 1 . . 119.412 . . 1 . 1 1 72 LEU N . . . . . . . . . . 94 . 18863 4
66 1 1 . . 7.634 . . 1 . 1 1 8 PHE H . . . . . . . . . . 95 . 18863 4
66 3 1 . . 119.230 . . 1 . 1 1 8 PHE N . . . . . . . . . . 96 . 18863 4
67 1 1 . . 7.620 . . 1 . 1 1 8 PHE H . . . . . . . . . . 95 . 18863 4
67 3 1 . . 119.281 . . 1 . 1 1 8 PHE N . . . . . . . . . . 96 . 18863 4
68 1 1 . . 7.636 . . 1 . 1 1 76 LEU H . . . . . . . . . . 97 . 18863 4
68 3 1 . . 119.113 . . 1 . 1 1 76 LEU N . . . . . . . . . . 98 . 18863 4
69 1 1 . . 8.039 . . 1 . 1 1 21 LEU H . . . . . . . . . . 99 . 18863 4
69 3 1 . . 118.831 . . 1 . 1 1 21 LEU N . . . . . . . . . . 100 . 18863 4
70 1 1 . . 8.026 . . 1 . 1 1 21 LEU H . . . . . . . . . . 99 . 18863 4
70 3 1 . . 118.744 . . 1 . 1 1 21 LEU N . . . . . . . . . . 100 . 18863 4
71 1 1 . . 8.028 . . 1 . 1 1 21 LEU H . . . . . . . . . . 99 . 18863 4
71 3 1 . . 118.859 . . 1 . 1 1 21 LEU N . . . . . . . . . . 100 . 18863 4
72 1 1 . . 8.390 . . 1 . 1 1 23 ASN H . . . . . . . . . . 101 . 18863 4
72 3 1 . . 118.607 . . 1 . 1 1 23 ASN N . . . . . . . . . . 102 . 18863 4
73 1 1 . . 7.486 . . 1 . 1 1 54 ARG H . . . . . . . . . . 105 . 18863 4
73 3 1 . . 118.290 . . 1 . 1 1 54 ARG N . . . . . . . . . . 106 . 18863 4
74 1 1 . . 8.399 . . 1 . 1 1 19 LYS H . . . . . . . . . . 107 . 18863 4
74 3 1 . . 118.021 . . 1 . 1 1 19 LYS N . . . . . . . . . . 108 . 18863 4
75 1 1 . . 7.829 . . 1 . 1 1 71 LEU H . . . . . . . . . . 109 . 18863 4
75 2 1 . . 42.991 . . 1 . 1 1 71 LEU CB . . . . . . . . . . 591 . 18863 4
75 3 1 . . 118.053 . . 1 . 1 1 71 LEU N . . . . . . . . . . 110 . 18863 4
76 1 1 . . 7.586 . . 1 . 1 1 55 LEU H . . . . . . . . . . 111 . 18863 4
76 3 1 . . 117.998 . . 1 . 1 1 55 LEU N . . . . . . . . . . 112 . 18863 4
77 1 1 . . 7.986 . . 1 . 1 1 81 TYR H . . . . . . . . . . 113 . 18863 4
77 3 1 . . 117.996 . . 1 . 1 1 81 TYR N . . . . . . . . . . 114 . 18863 4
78 1 1 . . 7.964 . . 1 . 1 1 81 TYR H . . . . . . . . . . 113 . 18863 4
78 3 1 . . 117.857 . . 1 . 1 1 81 TYR N . . . . . . . . . . 114 . 18863 4
79 1 1 . . 7.965 . . 1 . 1 1 81 TYR H . . . . . . . . . . 113 . 18863 4
79 3 1 . . 117.822 . . 1 . 1 1 81 TYR N . . . . . . . . . . 114 . 18863 4
80 3 1 . . 118.050 . . 1 . 1 1 79 ARG N . . . . . . . . . . 116 . 18863 4
81 1 1 . . 7.794 . . 1 . 1 1 11 MET H . . . . . . . . . . 117 . 18863 4
81 3 1 . . 117.705 . . 1 . 1 1 11 MET N . . . . . . . . . . 118 . 18863 4
82 1 1 . . 7.786 . . 1 . 1 1 11 MET H . . . . . . . . . . 117 . 18863 4
82 3 1 . . 117.812 . . 1 . 1 1 11 MET N . . . . . . . . . . 118 . 18863 4
83 1 1 . . 7.776 . . 1 . 1 1 11 MET H . . . . . . . . . . 117 . 18863 4
83 3 1 . . 117.695 . . 1 . 1 1 11 MET N . . . . . . . . . . 118 . 18863 4
84 1 1 . . 7.792 . . 1 . 1 1 11 MET H . . . . . . . . . . 117 . 18863 4
84 3 1 . . 117.610 . . 1 . 1 1 11 MET N . . . . . . . . . . 118 . 18863 4
85 1 1 . . 7.889 . . 1 . 1 1 61 TYR H . . . . . . . . . . 119 . 18863 4
85 3 1 . . 117.498 . . 1 . 1 1 61 TYR N . . . . . . . . . . 120 . 18863 4
86 1 1 . . 7.890 . . 1 . 1 1 61 TYR H . . . . . . . . . . 119 . 18863 4
86 3 1 . . 117.494 . . 1 . 1 1 61 TYR N . . . . . . . . . . 120 . 18863 4
87 1 1 . . 7.681 . . 1 . 1 1 66 VAL H . . . . . . . . . . 121 . 18863 4
87 3 1 . . 117.312 . . 1 . 1 1 66 VAL N . . . . . . . . . . 122 . 18863 4
88 1 1 . . 7.744 . . 1 . 1 1 74 LEU H . . . . . . . . . . 125 . 18863 4
88 2 1 . . 43.742 . . 1 . 1 1 74 LEU CB . . . . . . . . . . 593 . 18863 4
88 3 1 . . 117.200 . . 1 . 1 1 74 LEU N . . . . . . . . . . 126 . 18863 4
89 1 1 . . 7.903 . . 1 . 1 1 7 GLU H . . . . . . . . . . 127 . 18863 4
89 3 1 . . 116.950 . . 1 . 1 1 7 GLU N . . . . . . . . . . 128 . 18863 4
90 1 1 . . 7.950 . . 1 . 1 1 7 GLU H . . . . . . . . . . 127 . 18863 4
90 3 1 . . 116.969 . . 1 . 1 1 7 GLU N . . . . . . . . . . 128 . 18863 4
91 1 1 . . 7.947 . . 1 . 1 1 7 GLU H . . . . . . . . . . 127 . 18863 4
91 3 1 . . 116.982 . . 1 . 1 1 7 GLU N . . . . . . . . . . 128 . 18863 4
92 1 1 . . 7.979 . . 1 . 1 1 64 TYR H . . . . . . . . . . 129 . 18863 4
92 3 1 . . 116.809 . . 1 . 1 1 64 TYR N . . . . . . . . . . 130 . 18863 4
93 1 1 . . 7.880 . . 1 . 1 1 63 PHE H . . . . . . . . . . 131 . 18863 4
93 3 1 . . 116.638 . . 1 . 1 1 63 PHE N . . . . . . . . . . 132 . 18863 4
94 1 1 . . 7.879 . . 1 . 1 1 63 PHE H . . . . . . . . . . 131 . 18863 4
94 3 1 . . 116.585 . . 1 . 1 1 63 PHE N . . . . . . . . . . 132 . 18863 4
95 1 1 . . 8.395 . . 1 . 1 1 36 HIS H . . . . . . . . . . 133 . 18863 4
95 3 1 . . 116.128 . . 1 . 1 1 36 HIS N . . . . . . . . . . 134 . 18863 4
96 1 1 . . 8.371 . . 1 . 1 1 36 HIS H . . . . . . . . . . 133 . 18863 4
96 3 1 . . 115.930 . . 1 . 1 1 36 HIS N . . . . . . . . . . 134 . 18863 4
97 1 1 . . 7.075 . . 1 . 1 1 69 LEU H . . . . . . . . . . 135 . 18863 4
97 3 1 . . 116.132 . . 1 . 1 1 69 LEU N . . . . . . . . . . 136 . 18863 4
98 1 1 . . 7.074 . . 1 . 1 1 69 LEU H . . . . . . . . . . 135 . 18863 4
98 3 1 . . 116.086 . . 1 . 1 1 69 LEU N . . . . . . . . . . 136 . 18863 4
99 1 1 . . 8.129 . . 1 . 1 1 5 SER H . . . . . . . . . . 139 . 18863 4
99 3 1 . . 115.353 . . 1 . 1 1 5 SER N . . . . . . . . . . 140 . 18863 4
100 1 1 . . 7.588 . . 1 . 1 1 86 SER H . . . . . . . . . . 143 . 18863 4
100 3 1 . . 114.047 . . 1 . 1 1 86 SER N . . . . . . . . . . 144 . 18863 4
101 1 1 . . 7.588 . . 1 . 1 1 86 SER H . . . . . . . . . . 143 . 18863 4
101 3 1 . . 114.055 . . 1 . 1 1 86 SER N . . . . . . . . . . 144 . 18863 4
102 1 1 . . 6.746 . . 1 . 1 1 23 ASN HD22 . . . . . . . . . . 153 . 18863 4
102 3 1 . . 108.433 . . 1 . . . . . . . . . . . . . . . . 154 . 18863 4
103 1 1 . . 8.066 . . 1 . 1 1 4 GLY H . . . . . . . . . . 157 . 18863 4
103 3 1 . . 107.339 . . 1 . 1 1 4 GLY N . . . . . . . . . . 158 . 18863 4
104 1 1 . . 7.925 . . 1 . 1 1 65 GLY H . . . . . . . . . . 159 . 18863 4
104 3 1 . . 106.583 . . 1 . 1 1 65 GLY N . . . . . . . . . . 160 . 18863 4
105 1 1 . . 7.940 . . 1 . 1 1 65 GLY H . . . . . . . . . . 159 . 18863 4
105 3 1 . . 106.498 . . 1 . 1 1 65 GLY N . . . . . . . . . . 160 . 18863 4
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