Content for NMR-STAR saveframe, "spectral_peak_list_5"
save_spectral_peak_list_5
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_5
_Spectral_peak_list.Entry_ID 31013
_Spectral_peak_list.ID 5
_Spectral_peak_list.Name .
_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 6
_Spectral_peak_list.Experiment_name '2D 1H-13C HSQC aromatic'
_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
;
Accessed via the Ponderosa Web client Automatic NOE assignments via CYANA.
Structure calculation and refinement via simulated annealing carried out using X-PLOR NIH.
Lee W, Stark JL, Markley JL. (2014)
PONDEROSA-C/S: Client-server based software package for automated protein 3D structure determination.
Journal of Biomolecular NMR 60(2-3):73-5.
;
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
label dataset sw sf
H1 C13 N15
20200518_AO11_best_trosy_hnca_S.nv
2806.52709961 6034.48681641 1945.43103027
799.963989258 201.184997559 81.0690002441
H1.L H1.P H1.W H1.B H1.E H1.J H1.U C13.L C13.P C13.W C13.B C13.E C13.J C13.U N15.L N15.P N15.W N15.B N15.E N15.J N15.U vol int stat comment flag0 flag8 flag9
0 {} 8.31978 0.01742 0.00240 ++ {0.0} {} {} 70.01763 0.31437 0.04691 ++ {0.0} {} {} 131.12302 0.55981 0.09393 ++ {0.0} {} 0.0416466109455 0.0416 0 {} 0 0 0
1 {} 7.34801 0.02149 0.01006 ++ {0.0} {} {} 70.12699 0.36433 0.11044 ++ {0.0} {} {} 131.20770 0.58404 0.18359 ++ {0.0} {} 0.229952067137 0.0454 0 {} 0 0 0
2 {} 7.27708 0.02023 0.00320 ++ {0.0} {} {} 70.18400 0.32254 0.05142 ++ {0.0} {} {} 131.17728 0.57634 0.10599 ++ {0.0} {} 0.0804420784116 0.0419 0 {} 0 0 0
3 {} 6.36328 0.01366 0.00246 ++ {0.0} {} {} 70.10674 0.42189 0.07586 ++ {0.0} {} {} 131.14865 0.54400 0.12521 ++ {0.0} {} 0.0838552862406 0.0423 0 {} 0 0 0
4 {} 9.30845 0.01514 0.00316 ++ {0.0} {} {} 67.73759 0.40827 0.08523 ++ {0.0} {} {} 131.19272 0.52410 0.11621 ++ {0.0} {} 0.0803214460611 0.0430 0 {} 0 0 0
5 {} 9.14050 0.01416 0.00033 ++ {0.0} {} {} 67.55696 0.57321 0.01323 ++ {0.0} {} {} 130.13126 0.49623 0.01183 ++ {0.0} {} 0.0389930531383 0.0390 0 {} 0 0 0
6 {} 8.01824 0.00818 0.00118 ++ {0.0} {} {} 70.03294 0.39251 0.05643 ++ {0.0} {} {} 128.30066 0.54094 0.08116 ++ {0.0} {} 0.0415242277086 0.0415 0 {} 0 0 0
7 {} 8.02090 0.02068 0.00552 ++ {0.0} {} {} 69.96011 0.88386 0.15740 ++ {0.0} {} {} 128.33965 0.52585 0.13962 ++ {0.0} {} 0.161032512784 0.0429 0 {} 0 0 0
8 {} 7.91263 0.01354 0.00030 ++ {0.0} {} {} 41.17293 0.38003 0.00837 ++ {0.0} {} {} 128.07898 0.48058 0.01095 ++ {0.0} {} 0.0777333080769 0.0390 0 {} 0 0 0
9 {} 8.01364 0.02415 0.05547 ++ {0.0} {} {} 55.91010 0.48792 0.69703 ++ {0.0} {} {} 127.94003 0.56700 1.11252 ++ {0.0} {} 28.8111190796 1.5538 0 {} 0 0 0
10 {} 8.01317 0.01889 0.01816 ++ {0.0} {} {} 54.42482 0.58825 0.56556 ++ {0.0} {} {} 127.97734 0.53865 0.52260 ++ {0.0} {} 1.00333166122 0.0739 0 {} 0 0 0
11 {} 6.16138 0.01863 0.00368 ++ {0.0} {} {} 42.69384 0.49166 0.09402 ++ {0.0} {} {} 128.04509 0.46018 0.08865 ++ {0.0} {} 0.0841968506575 0.0426 0 {} 0 0 0
12 {} 8.41893 0.02331 0.03657 ++ {0.0} {} {} 60.25367 0.51154 0.71698 ++ {0.0} {} {} 127.72371 0.56104 0.75156 ++ {0.0} {} 2.37100315094 0.1336 0 {} 0 0 0
13 {} 8.42243 0.02653 0.04723 ++ {0.0} {} {} 52.97148 0.43717 0.85956 ++ {0.0} {} {} 127.76154 0.56948 0.95356 ++ {0.0} {} 5.57921028137 0.3257 0 {} 0 0 0
14 {} 7.85886 0.01844 0.00027 ++ {0.0} {} {} 48.14742 0.41282 0.00516 ++ {0.0} {} {} 127.69659 0.37909 0.00474 ++ {0.0} {} 0.0387814939022 0.0388 0 {} 0 0 0
15 {} 8.26642 0.01347 0.00060 ++ {0.0} {} {} 60.15367 0.41666 0.01843 ++ {0.0} {} {} 127.64922 0.52406 0.02425 ++ {0.0} {} 0.0786646455526 0.0394 0 {} 0 0 0
16 {} 8.75092 0.01732 0.00336 ++ {0.0} {} {} 42.03904 0.37223 0.07420 ++ {0.0} {} {} 127.36506 0.55889 0.12410 ++ {0.0} {} 0.078977547586 0.0428 0 {} 0 0 0
17 {} 6.60404 0.01448 0.00036 ++ {0.0} {} {} 56.76182 0.53160 0.01349 ++ {0.0} {} {} 127.23870 0.64443 0.01966 ++ {0.0} {} 0.0390200950205 0.0390 0 {} 0 0 0
18 {} 8.29260 0.01611 0.00573 ++ {0.0} {} {} 67.30711 0.42780 0.15034 ++ {0.0} {} {} 127.11142 0.49482 0.17438 ++ {0.0} {} 0.165514037013 0.0468 0 {} 0 0 0
19 {} 8.00769 0.02594 0.00452 ++ {0.0} {} {} 65.63141 0.41206 0.03068 ++ {0.0} {} {} 127.07014 0.50942 0.03990 ++ {0.0} {} 0.0400290861726 0.0400 0 {} 0 0 0
20 {} 8.74334 0.02058 0.01514 ++ {0.0} {} {} 56.50984 0.44264 0.27911 ++ {0.0} {} {} 126.87526 0.53822 0.37002 ++ {0.0} {} 0.560680925846 0.0562 0 {} 0 0 0
21 {} 7.29987 0.01711 0.00252 ++ {0.0} {} {} 63.54321 0.51544 0.07637 ++ {0.0} {} {} 126.61913 0.60201 0.09993 ++ {0.0} {} 0.0415775440633 0.0416 0 {} 0 0 0
22 {} 8.36651 0.01911 0.02168 ++ {0.0} {} {} 55.09579 0.38080 0.43884 ++ {0.0} {} {} 126.52319 0.46417 0.52473 ++ {0.0} {} 0.656124651432 0.0909 0 {} 0 0 0
23 {} 8.36729 0.02174 0.03939 ++ {0.0} {} {} 52.30900 0.45200 0.78248 ++ {0.0} {} {} 126.51762 0.51602 0.81483 ++ {0.0} {} 2.73443102837 0.2414 0 {} 0 0 0
24 {} 8.28904 0.02599 0.03785 ++ {0.0} {} {} 57.60947 0.35786 0.54927 ++ {0.0} {} {} 126.20096 0.47081 0.67219 ++ {0.0} {} 1.5311858654 0.1480 0 {} 0 0 0
25 {} 8.28885 0.02060 0.02699 ++ {0.0} {} {} 55.86132 0.44526 0.66007 ++ {0.0} {} {} 126.18893 0.49340 0.66074 ++ {0.0} {} 1.4030393362 0.1185 0 {} 0 0 0
26 {} 8.19171 0.02439 0.01601 ++ {0.0} {} {} 57.54908 0.31540 0.14159 ++ {0.0} {} {} 126.04010 0.47539 0.21970 ++ {0.0} {} 0.252010405064 0.0497 0 {} 0 0 0
27 {} 8.19049 0.03119 0.04532 ++ {0.0} {} {} 52.50296 0.39783 0.66529 ++ {0.0} {} {} 126.03381 0.57529 0.82033 ++ {0.0} {} 2.60619831085 0.1657 0 {} 0 0 0
28 {} 9.06938 0.01511 0.00238 ++ {0.0} {} {} 51.15215 0.40955 0.06453 ++ {0.0} {} {} 125.94566 0.56393 0.09738 ++ {0.0} {} 0.0789588987827 0.0418 0 {} 0 0 0
29 {} 7.87254 0.01570 0.00177 ++ {0.0} {} {} 65.92487 0.41536 0.04759 ++ {0.0} {} {} 125.65491 0.51278 0.06130 ++ {0.0} {} 0.0408810675144 0.0409 0 {} 0 0 0
30 {} 8.21753 0.02425 0.03965 ++ {0.0} {} {} 52.43802 0.32923 0.58346 ++ {0.0} {} {} 125.66371 0.54149 0.84132 ++ {0.0} {} 1.96226859093 0.2087 0 {} 0 0 0
31 {} 7.81087 0.02035 0.00664 ++ {0.0} {} {} 49.24586 0.51975 0.17344 ++ {0.0} {} {} 125.75995 0.55767 0.19765 ++ {0.0} {} 0.150236979127 0.0462 0 {} 0 0 0
32 {} 8.21971 0.02241 0.02263 ++ {0.0} {} {} 55.02699 0.32378 0.32832 ++ {0.0} {} {} 125.56707 0.58766 0.59456 ++ {0.0} {} 0.597345411777 0.0782 0 {} 0 0 0
33 {} 7.74060 0.01440 0.00096 ++ {0.0} {} {} 43.40820 0.46947 0.03161 ++ {0.0} {} {} 125.46733 0.56417 0.04082 ++ {0.0} {} 0.039874099195 0.0399 0 {} 0 0 0
34 {} 8.11614 0.01842 0.02034 ++ {0.0} {} {} 55.15230 0.38526 0.43493 ++ {0.0} {} {} 125.09003 0.52904 0.59105 ++ {0.0} {} 0.630298674107 0.0885 0 {} 0 0 0
35 {} 8.11698 0.02474 0.04482 ++ {0.0} {} {} 52.55372 0.45120 0.82830 ++ {0.0} {} {} 125.04475 0.48598 0.87225 ++ {0.0} {} 4.24107837677 0.3223 0 {} 0 0 0
36 {} 6.63955 0.01272 0.00325 ++ {0.0} {} {} 45.94012 0.39154 0.10019 ++ {0.0} {} {} 124.70284 0.49814 0.12905 ++ {0.0} {} 0.085956543684 0.0442 0 {} 0 0 0
37 {} 8.11570 0.01926 0.02450 ++ {0.0} {} {} 55.91841 0.32452 0.41299 ++ {0.0} {} {} 124.48638 0.43691 0.56097 ++ {0.0} {} 0.654649674892 0.1060 0 {} 0 0 0
38 {} 6.47234 0.01089 0.00230 ++ {0.0} {} {} 41.06113 0.37898 0.07994 ++ {0.0} {} {} 124.41514 0.53810 0.13699 ++ {0.0} {} 0.0847566649318 0.0431 0 {} 0 0 0
39 {} 8.20714 0.03438 0.07552 ++ {0.0} {} {} 55.74614 0.41458 0.93492 ++ {0.0} {} {} 124.19308 0.55954 1.01091 ++ {0.0} {} 8.72712802887 0.4927 0 {} 0 0 0
40 {} 8.49306 0.01815 0.00224 ++ {0.0} {} {} 52.49849 0.40746 0.04773 ++ {0.0} {} {} 124.26951 0.55209 0.06953 ++ {0.0} {} 0.0409369505942 0.0409 0 {} 0 0 0
41 {} 8.35751 0.02114 0.02075 ++ {0.0} {} {} 62.33797 0.39669 0.38791 ++ {0.0} {} {} 123.74480 0.46789 0.45707 ++ {0.0} {} 0.72901147604 0.0754 0 {} 0 0 0
42 {} 7.23698 0.01757 0.00220 ++ {0.0} {} {} 61.47255 0.36631 0.04502 ++ {0.0} {} {} 123.68081 0.57153 0.07881 ++ {0.0} {} 0.0410624369979 0.0411 0 {} 0 0 0
43 {} 7.54190 0.03862 0.04408 ++ {0.0} {} {} 59.22588 0.30583 0.37485 ++ {0.0} {} {} 123.65880 0.55473 0.64056 ++ {0.0} {} 1.30884087086 0.0995 0 {} 0 0 0
44 {} 7.54059 0.02978 0.07021 ++ {0.0} {} {} 57.69804 0.49766 0.88682 ++ {0.0} {} {} 123.64740 0.56335 0.97694 ++ {0.0} {} 7.84975242615 0.4119 0 {} 0 0 0
45 {} 8.18617 0.02731 0.05452 ++ {0.0} {} {} 56.49506 0.45046 0.90940 ++ {0.0} {} {} 123.62994 0.56480 1.00865 ++ {0.0} {} 8.78279495239 0.5251 0 {} 0 0 0
46 {} 8.32371 0.02444 0.03753 ++ {0.0} {} {} 55.78982 0.49767 0.79994 ++ {0.0} {} {} 123.62547 0.71477 1.06900 ++ {0.0} {} 3.05438303947 0.1459 0 {} 0 0 0
47 {} 8.36109 0.02271 0.04135 ++ {0.0} {} {} 54.24223 0.38108 0.89753 ++ {0.0} {} {} 123.69642 0.52447 0.94284 ++ {0.0} {} 3.58312678337 0.3515 0 {} 0 0 0
48 {} 8.18625 0.02728 0.06708 ++ {0.0} {} {} 53.92123 0.45359 0.99696 ++ {0.0} {} {} 123.62361 0.55066 1.05223 ++ {0.0} {} 25.447977066 1.5365 0 {} 0 0 0
49 {} 8.20889 0.02080 0.01886 ++ {0.0} {} {} 60.31980 0.59999 0.53039 ++ {0.0} {} {} 123.21111 0.51895 0.46754 ++ {0.0} {} 1.15705323219 0.0694 0 {} 0 0 0
50 {} 8.41728 0.01322 0.00485 ++ {0.0} {} {} 56.74704 0.45730 0.16785 ++ {0.0} {} {} 123.20929 0.52625 0.20209 ++ {0.0} {} 0.0912169441581 0.0472 0 {} 0 0 0
51 {} 8.12078 0.02209 0.04105 ++ {0.0} {} {} 60.26653 0.48087 0.85760 ++ {0.0} {} {} 123.06426 0.57390 0.97636 ++ {0.0} {} 5.75869226456 0.3749 0 {} 0 0 0
52 {} 8.17053 0.02757 0.03546 ++ {0.0} {} {} 52.08200 0.56602 0.81108 ++ {0.0} {} {} 122.99463 0.42379 0.59335 ++ {0.0} {} 2.2871029377 0.1202 0 {} 0 0 0
53 {} 8.27174 0.02362 0.04998 ++ {0.0} {} {} 67.76167 0.46838 0.82838 ++ {0.0} {} {} 122.86597 0.52193 0.94132 ++ {0.0} {} 8.87780570984 0.5811 0 {} 0 0 0
54 {} 8.27124 0.02148 0.04261 ++ {0.0} {} {} 59.81453 0.47335 0.84332 ++ {0.0} {} {} 122.85144 0.54396 0.94212 ++ {0.0} {} 4.11341667175 0.2852 0 {} 0 0 0
55 {} 8.09421 0.01574 0.02248 ++ {0.0} {} {} 56.18589 0.32246 0.40298 ++ {0.0} {} {} 122.92599 0.64682 0.78358 ++ {0.0} {} 0.814030408859 0.1027 0 {} 0 0 0
56 {} 8.08104 0.02314 0.04441 ++ {0.0} {} {} 54.35555 0.40895 0.90186 ++ {0.0} {} {} 122.90517 0.57718 1.00236 ++ {0.0} {} 5.6745672226 0.3978 0 {} 0 0 0
57 {} 7.90438 0.02506 0.02650 ++ {0.0} {} {} 58.97559 0.33779 0.36044 ++ {0.0} {} {} 122.69602 0.57271 0.59895 ++ {0.0} {} 0.803481042385 0.0826 0 {} 0 0 0
58 {} 8.01011 0.02949 0.03146 ++ {0.0} {} {} 58.16170 0.45479 0.49592 ++ {0.0} {} {} 122.76968 0.51389 0.55288 ++ {0.0} {} 1.35887718201 0.0844 0 {} 0 0 0
59 {} 7.94213 0.01292 0.01094 ++ {0.0} {} {} 57.17737 0.40662 0.34430 ++ {0.0} {} {} 122.66908 0.59397 0.52242 ++ {0.0} {} 0.613623440266 0.0668 0 {} 0 0 0
60 {} 8.64155 0.02777 0.03716 ++ {0.0} {} {} 57.02114 0.51594 0.81282 ++ {0.0} {} {} 122.66288 0.52950 0.72133 ++ {0.0} {} 2.51901483536 0.1360 0 {} 0 0 0
61 {} 8.14782 0.02410 0.05877 ++ {0.0} {} {} 56.94087 0.41256 0.90781 ++ {0.0} {} {} 122.64784 0.49165 0.92947 ++ {0.0} {} 7.43577957153 0.5211 0 {} 0 0 0
62 {} 7.95480 0.02789 0.05340 ++ {0.0} {} {} 55.67966 0.61890 1.27640 ++ {0.0} {} {} 122.66997 0.65578 1.12184 ++ {0.0} {} 8.59995365143 0.3251 0 {} 0 0 0
63 {} 8.14972 0.02885 0.06995 ++ {0.0} {} {} 55.37022 0.49744 1.12802 ++ {0.0} {} {} 122.64524 0.48323 1.02661 ++ {0.0} {} 21.8286952972 1.2083 0 {} 0 0 0
64 {} 8.03111 0.03021 0.04314 ++ {0.0} {} {} 60.33715 0.40394 0.77844 ++ {0.0} {} {} 122.48010 0.53957 0.78419 ++ {0.0} {} 2.61789989471 0.1717 0 {} 0 0 0
65 {} 8.40495 0.01161 0.01209 ++ {0.0} {} {} 56.56501 0.67508 0.11660 ++ {0.0} {} {} 122.44924 0.53139 0.09665 ++ {0.0} {} 0.214538425207 0.0423 0 {} 0 0 0
66 {} 8.37175 0.02376 0.03330 ++ {0.0} {} {} 56.28348 0.49657 0.73103 ++ {0.0} {} {} 122.50362 0.56544 0.75197 ++ {0.0} {} 2.29131627083 0.1380 0 {} 0 0 0
67 {} 8.03117 0.01980 0.01975 ++ {0.0} {} {} 56.20304 0.33464 0.33373 ++ {0.0} {} {} 122.51086 0.55487 0.55383 ++ {0.0} {} 0.510418653488 0.0769 0 {} 0 0 0
68 {} 8.21349 0.02471 0.00655 ++ {0.0} {} {} 54.34591 0.30142 0.08298 ++ {0.0} {} {} 122.44300 0.47985 0.13433 ++ {0.0} {} 0.160471573472 0.0447 0 {} 0 0 0
69 {} 8.50657 0.02481 0.03567 ++ {0.0} {} {} 53.86847 0.37546 0.57957 ++ {0.0} {} {} 122.60849 0.46080 0.66901 ++ {0.0} {} 1.71227753162 0.1411 0 {} 0 0 0
70 {} 8.50757 0.02953 0.05607 ++ {0.0} {} {} 52.32669 0.46494 0.90432 ++ {0.0} {} {} 122.60040 0.47231 0.91707 ++ {0.0} {} 8.99703216553 0.4737 0 {} 0 0 0
71 {} 8.37264 0.01960 0.02153 ++ {0.0} {} {} 52.37982 0.35812 0.41302 ++ {0.0} {} {} 122.48603 0.55045 0.61810 ++ {0.0} {} 0.754509925842 0.0910 0 {} 0 0 0
72 {} 8.10181 0.02806 0.02889 ++ {0.0} {} {} 53.54697 0.62189 0.65310 ++ {0.0} {} {} 122.26439 0.48520 0.50534 ++ {0.0} {} 1.67864239216 0.0806 0 {} 0 0 0
73 {} 8.10438 0.02348 0.03382 ++ {0.0} {} {} 60.93760 0.36932 0.59569 ++ {0.0} {} {} 122.16330 0.58748 0.81325 ++ {0.0} {} 1.56435215473 0.1553 0 {} 0 0 0
74 {} 7.97595 0.02452 0.04245 ++ {0.0} {} {} 60.41307 0.33073 0.57394 ++ {0.0} {} {} 122.14587 0.58230 0.88784 ++ {0.0} {} 1.98105680943 0.2080 0 {} 0 0 0
75 {} 8.51342 0.02636 0.03102 ++ {0.0} {} {} 57.26668 0.43601 0.47450 ++ {0.0} {} {} 122.23676 0.43577 0.47817 ++ {0.0} {} 1.0286488533 0.0845 0 {} 0 0 0
76 {} 8.47748 0.02233 0.03276 ++ {0.0} {} {} 56.91054 0.39568 0.70441 ++ {0.0} {} {} 122.22182 0.50440 0.77860 ++ {0.0} {} 1.73272871971 0.1684 0 {} 0 0 0
77 {} 8.20748 0.02652 0.06437 ++ {0.0} {} {} 56.95962 0.44757 0.93742 ++ {0.0} {} {} 122.15423 0.56074 1.06182 ++ {0.0} {} 21.4433746338 1.2397 0 {} 0 0 0
78 {} 8.51748 0.03493 0.01776 ++ {0.0} {} {} 56.41496 0.35124 0.60918 ++ {0.0} {} {} 122.13241 0.61097 0.31023 ++ {0.0} {} 0.476557314396 0.0480 0 {} 0 0 0
79 {} 8.47500 0.02320 0.02330 ++ {0.0} {} {} 55.53415 0.36532 0.36760 ++ {0.0} {} {} 122.20869 0.54385 0.54679 ++ {0.0} {} 0.72416138649 0.0776 0 {} 0 0 0
80 {} 8.28162 0.02259 0.02606 ++ {0.0} {} {} 52.32578 0.50635 0.62453 ++ {0.0} {} {} 122.07681 0.48095 0.57413 ++ {0.0} {} 1.36375045776 0.0961 0 {} 0 0 0
81 {} 8.52802 0.02281 0.05438 ++ {0.0} {} {} 61.35077 0.33367 0.78881 ++ {0.0} {} {} 121.98019 0.56453 1.03600 ++ {0.0} {} 6.7736120224 0.7304 0 {} 0 0 0
82 {} 6.96147 0.01071 0.00015 ++ {0.0} {} {} 61.23576 0.46160 0.00664 ++ {0.0} {} {} 121.95071 0.57366 0.01111 ++ {0.0} {} 0.0388182513416 0.0388 0 {} 0 0 0
83 {} 8.32837 0.02574 0.06343 ++ {0.0} {} {} 59.55041 0.48529 0.81746 ++ {0.0} {} {} 121.97000 0.56658 1.07580 ++ {0.0} {} 18.6487636566 1.1516 0 {} 0 0 0
84 {} 8.16857 0.01397 0.00389 ++ {0.0} {} {} 59.04674 0.35096 0.09763 ++ {0.0} {} {} 121.95247 0.55152 0.19795 ++ {0.0} {} 0.164844766259 0.0448 0 {} 0 0 0
85 {} 8.73546 0.02622 0.05906 ++ {0.0} {} {} 58.69585 0.40532 0.99244 ++ {0.0} {} {} 122.02364 0.48603 0.97773 ++ {0.0} {} 8.12795448303 0.6552 0 {} 0 0 0
86 {} 8.52822 0.02253 0.03936 ++ {0.0} {} {} 58.66387 0.44955 0.85525 ++ {0.0} {} {} 122.01494 0.51443 0.81761 ++ {0.0} {} 2.90741968155 0.2418 0 {} 0 0 0
87 {} 6.97091 0.03022 0.06448 ++ {0.0} {} {} 55.86705 0.39179 0.84863 ++ {0.0} {} {} 122.03453 0.46403 0.79775 ++ {0.0} {} 4.23631572723 0.3128 0 {} 0 0 0
88 {} 8.02888 0.02576 0.04982 ++ {0.0} {} {} 55.15187 0.43990 0.90147 ++ {0.0} {} {} 121.96384 0.59721 1.03934 ++ {0.0} {} 6.3868355751 0.3475 0 {} 0 0 0
89 {} 8.02890 0.02980 0.04048 ++ {0.0} {} {} 52.49820 0.35154 0.48617 ++ {0.0} {} {} 122.00938 0.55042 0.72567 ++ {0.0} {} 1.41126894951 0.1249 0 {} 0 0 0
90 {} 8.18587 0.02824 0.05801 ++ {0.0} {} {} 56.49983 0.50801 0.90918 ++ {0.0} {} {} 121.73784 0.58573 1.21352 ++ {0.0} {} 28.9389057159 1.3875 0 {} 0 0 0
91 {} 8.18487 0.02694 0.06051 ++ {0.0} {} {} 55.37385 0.45885 0.97203 ++ {0.0} {} {} 121.74323 0.56500 1.04090 ++ {0.0} {} 8.56048679352 0.5051 0 {} 0 0 0
92 {} 8.52601 0.01667 0.00188 ++ {0.0} {} {} 54.62294 0.51766 0.05380 ++ {0.0} {} {} 121.82617 0.61491 0.07084 ++ {0.0} {} 0.0406524352729 0.0407 0 {} 0 0 0
93 {} 8.04741 0.02752 0.05972 ++ {0.0} {} {} 60.70470 0.41305 0.85870 ++ {0.0} {} {} 121.55251 0.53617 1.00570 ++ {0.0} {} 8.47480392456 0.6178 0 {} 0 0 0
94 {} 8.04683 0.02831 0.04636 ++ {0.0} {} {} 58.58467 0.39612 0.79088 ++ {0.0} {} {} 121.54884 0.51401 0.81231 ++ {0.0} {} 3.31234121323 0.2691 0 {} 0 0 0
95 {} 8.08157 0.02191 0.03305 ++ {0.0} {} {} 57.87395 0.40795 0.66261 ++ {0.0} {} {} 121.61513 0.63138 0.92446 ++ {0.0} {} 2.08866381645 0.1504 0 {} 0 0 0
96 {} 8.30433 0.02864 0.08243 ++ {0.0} {} {} 57.46721 0.53170 1.00511 ++ {0.0} {} {} 121.61044 0.56889 1.07154 ++ {0.0} {} 25.0094642639 1.2674 0 {} 0 0 0
97 {} 8.06751 0.02091 0.00617 ++ {0.0} {} {} 56.98046 0.55474 0.18376 ++ {0.0} {} {} 121.59375 0.64855 0.29134 ++ {0.0} {} 0.225004062057 0.0461 0 {} 0 0 0
98 {} 7.72249 0.01898 0.00882 ++ {0.0} {} {} 56.47794 0.36932 0.16848 ++ {0.0} {} {} 121.56938 0.56651 0.31077 ++ {0.0} {} 0.314815372229 0.0499 0 {} 0 0 0
99 {} 7.86117 0.02443 0.07582 ++ {0.0} {} {} 57.87632 0.40071 0.90154 ++ {0.0} {} {} 121.35527 0.52386 1.07988 ++ {0.0} {} 16.8278827667 1.3669 0 {} 0 0 0
100 {} 8.23677 0.02729 0.08243 ++ {0.0} {} {} 57.44296 0.48387 0.97005 ++ {0.0} {} {} 121.43815 0.53949 1.06316 ++ {0.0} {} 20.8013973236 1.2273 0 {} 0 0 0
101 {} 8.48655 0.02211 0.02757 ++ {0.0} {} {} 57.22709 0.44381 0.59650 ++ {0.0} {} {} 121.39229 0.61559 0.79884 ++ {0.0} {} 1.77535068989 0.1131 0 {} 0 0 0
102 {} 8.23742 0.04134 0.08243 ++ {0.0} {} {} 56.54837 0.56561 0.80801 ++ {0.0} {} {} 121.41382 0.60360 1.18068 ++ {0.0} {} 20.3712978363 0.6630 0 {} 0 0 0
103 {} 8.27911 0.01954 0.02049 ++ {0.0} {} {} 55.08413 0.53218 0.56447 ++ {0.0} {} {} 121.48714 0.49955 0.51935 ++ {0.0} {} 1.15202486515 0.0803 0 {} 0 0 0
104 {} 8.20786 0.02911 0.03152 ++ {0.0} {} {} 52.50095 0.48577 0.53580 ++ {0.0} {} {} 121.48342 0.57613 0.62578 ++ {0.0} {} 1.70846641064 0.0848 0 {} 0 0 0
105 {} 7.97261 0.03266 0.04414 ++ {0.0} {} {} 61.85564 0.37531 0.59144 ++ {0.0} {} {} 121.22819 0.57894 0.78183 ++ {0.0} {} 2.31189012527 0.1490 0 {} 0 0 0
106 {} 8.26306 0.02131 0.02572 ++ {0.0} {} {} 60.83475 0.37312 0.47378 ++ {0.0} {} {} 121.27467 0.50364 0.63012 ++ {0.0} {} 0.879117071629 0.1056 0 {} 0 0 0
107 {} 8.26428 0.01804 0.01100 ++ {0.0} {} {} 60.11718 0.17072 0.24218 ++ {0.0} {} {} 121.24469 0.56980 0.39887 ++ {0.0} {} 0.280738413334 0.0569 0 {} 0 0 0
108 {} 8.36409 0.02344 0.02806 ++ {0.0} {} {} 59.09031 0.50581 0.62125 ++ {0.0} {} {} 121.15274 0.52341 0.63577 ++ {0.0} {} 1.63400876522 0.1026 0 {} 0 0 0
109 {} 7.96660 0.05358 0.09368 ++ {0.0} {} {} 58.85107 0.49568 0.95841 ++ {0.0} {} {} 121.26038 0.51485 0.98350 ++ {0.0} {} 17.428314209 0.5521 0 {} 0 0 0
110 {} 8.08862 0.01633 0.02316 ++ {0.0} {} {} 56.53403 0.72241 0.36234 ++ {0.0} {} {} 121.14923 0.56292 0.26267 ++ {0.0} {} 0.662872314453 0.0495 0 {} 0 0 0
111 {} 7.91274 0.02510 0.05300 ++ {0.0} {} {} 59.82240 0.49719 0.92203 ++ {0.0} {} {} 120.97678 0.50069 0.96724 ++ {0.0} {} 10.9183559418 0.6927 0 {} 0 0 0
112 {} 8.07895 0.02681 0.06744 ++ {0.0} {} {} 59.55156 0.51308 0.98092 ++ {0.0} {} {} 120.96604 0.49665 1.01386 ++ {0.0} {} 18.1545410156 0.9827 0 {} 0 0 0
113 {} 7.91222 0.02549 0.05019 ++ {0.0} {} {} 58.68187 0.43063 0.93846 ++ {0.0} {} {} 120.99062 0.56216 0.96520 ++ {0.0} {} 4.5274014473 0.3155 0 {} 0 0 0
114 {} 8.29324 0.02535 0.03659 ++ {0.0} {} {} 58.41770 0.56541 0.81318 ++ {0.0} {} {} 121.05326 0.53059 0.71253 ++ {0.0} {} 2.84882378578 0.1622 0 {} 0 0 0
115 {} 8.16102 0.02626 0.05156 ++ {0.0} {} {} 57.49548 0.47707 0.98225 ++ {0.0} {} {} 121.06095 0.55220 1.01892 ++ {0.0} {} 7.58848524094 0.4340 0 {} 0 0 0
116 {} 7.96392 0.03101 0.08457 ++ {0.0} {} {} 56.77955 0.51266 1.08637 ++ {0.0} {} {} 120.96625 0.49840 1.01959 ++ {0.0} {} 19.8943214417 0.9722 0 {} 0 0 0
117 {} 8.15928 0.03336 0.09742 ++ {0.0} {} {} 56.55087 0.50926 0.72751 ++ {0.0} {} {} 121.05659 0.56138 1.17207 ++ {0.0} {} 30.6163406372 1.4347 0 {} 0 0 0
118 {} 8.14333 0.02549 0.02417 ++ {0.0} {} {} 52.55392 0.46451 0.43339 ++ {0.0} {} {} 121.06030 0.54679 0.51721 ++ {0.0} {} 1.13652074337 0.0722 0 {} 0 0 0
119 {} 7.96262 0.02955 0.05638 ++ {0.0} {} {} 45.96475 0.45584 0.85264 ++ {0.0} {} {} 120.97472 0.51161 0.90700 ++ {0.0} {} 6.37811756134 0.3818 0 {} 0 0 0
120 {} 8.02956 0.01901 0.00585 ++ {0.0} {} {} 45.76372 0.47103 0.15546 ++ {0.0} {} {} 121.03622 0.79103 0.37538 ++ {0.0} {} 0.213400617242 0.0462 0 {} 0 0 0
121 {} 8.02969 0.02844 0.04309 ++ {0.0} {} {} 67.76244 0.46003 0.76147 ++ {0.0} {} {} 120.84314 0.54553 0.81365 ++ {0.0} {} 3.44382286072 0.2131 0 {} 0 0 0
122 {} 8.02929 0.02567 0.05688 ++ {0.0} {} {} 59.56009 0.48080 0.94926 ++ {0.0} {} {} 120.86469 0.55786 1.05286 ++ {0.0} {} 16.4456710815 1.0170 0 {} 0 0 0
123 {} 8.00821 0.03375 0.07108 ++ {0.0} {} {} 57.87640 0.17444 0.82439 ++ {0.0} {} {} 120.75617 0.70231 1.69381 ++ {0.0} {} 5.71857786179 0.3460 0 {} 0 0 0
124 {} 8.00953 0.03184 0.06744 ++ {0.0} {} {} 57.07626 0.40221 0.57459 ++ {0.0} {} {} 120.76300 0.49418 1.06682 ++ {0.0} {} 14.781414032 1.0435 0 {} 0 0 0
125 {} 8.22498 0.02335 0.03702 ++ {0.0} {} {} 54.53625 0.32791 0.56272 ++ {0.0} {} {} 120.84390 0.56499 0.84478 ++ {0.0} {} 1.7909758091 0.1973 0 {} 0 0 0
126 {} 8.11734 0.02516 0.04058 ++ {0.0} {} {} 54.51432 0.35605 0.79621 ++ {0.0} {} {} 120.79369 0.53390 0.91017 ++ {0.0} {} 3.10486769676 0.3077 0 {} 0 0 0
127 {} 8.11708 0.02316 0.02707 ++ {0.0} {} {} 57.69327 0.52087 0.65787 ++ {0.0} {} {} 120.58721 0.52062 0.63940 ++ {0.0} {} 1.5034288168 0.1010 0 {} 0 0 0
128 {} 8.30356 0.02408 0.00788 ++ {0.0} {} {} 56.46566 0.57853 0.18490 ++ {0.0} {} {} 120.66438 0.58769 0.20191 ++ {0.0} {} 0.281299829483 0.0460 0 {} 0 0 0
129 {} 8.00484 0.02036 0.00450 ++ {0.0} {} {} 53.08215 0.82869 0.14879 ++ {0.0} {} {} 120.69993 0.27423 0.13780 ++ {0.0} {} 0.202929362655 0.0428 0 {} 0 0 0
130 {} 8.02938 0.02656 0.03414 ++ {0.0} {} {} 54.37271 0.39938 0.55186 ++ {0.0} {} {} 120.54148 0.50090 0.65620 ++ {0.0} {} 1.41055846214 0.1169 0 {} 0 0 0
131 {} 7.95172 0.01442 0.02265 ++ {0.0} {} {} 45.09155 0.38772 0.21414 ++ {0.0} {} {} 120.54308 0.47956 0.26523 ++ {0.0} {} 0.304722368717 0.0532 0 {} 0 0 0
132 {} 8.44813 0.02721 0.05501 ++ {0.0} {} {} 63.07677 0.51379 0.93164 ++ {0.0} {} {} 120.28822 0.57735 0.98859 ++ {0.0} {} 6.51112031937 0.3470 0 {} 0 0 0
133 {} 8.16426 0.02328 0.03498 ++ {0.0} {} {} 60.96262 0.41832 0.68599 ++ {0.0} {} {} 120.32504 0.52504 0.80012 ++ {0.0} {} 2.14114713669 0.1978 0 {} 0 0 0
134 {} 8.16259 0.02287 0.05006 ++ {0.0} {} {} 60.15637 0.55421 1.15689 ++ {0.0} {} {} 120.34586 0.46791 0.94598 ++ {0.0} {} 9.76369571686 0.6215 0 {} 0 0 0
135 {} 8.05038 0.02325 0.03782 ++ {0.0} {} {} 60.25228 0.40539 0.72246 ++ {0.0} {} {} 120.25850 0.57498 0.95548 ++ {0.0} {} 4.30611228943 0.3416 0 {} 0 0 0
136 {} 8.05192 0.02206 0.05470 ++ {0.0} {} {} 59.22506 0.33616 0.87595 ++ {0.0} {} {} 120.24281 0.58124 1.21473 ++ {0.0} {} 8.50435161591 1.0309 0 {} 0 0 0
137 {} 8.13604 0.02326 0.00250 ++ {0.0} {} {} 58.75570 0.34636 0.03348 ++ {0.0} {} {} 120.32043 0.52124 0.05308 ++ {0.0} {} 0.0797159299254 0.0405 0 {} 0 0 0
138 {} 8.08187 0.02562 0.06687 ++ {0.0} {} {} 58.68579 0.43401 0.62001 ++ {0.0} {} {} 120.23566 0.53653 1.07634 ++ {0.0} {} 13.8972120285 0.9979 0 {} 0 0 0
139 {} 8.81259 0.01768 0.00303 ++ {0.0} {} {} 57.22247 0.40721 0.07454 ++ {0.0} {} {} 120.19052 0.51290 0.09551 ++ {0.0} {} 0.083959646523 0.0424 0 {} 0 0 0
140 {} 8.44801 0.03317 0.07911 ++ {0.0} {} {} 55.87355 0.41238 1.02771 ++ {0.0} {} {} 120.30791 0.53760 1.01708 ++ {0.0} {} 13.1020431519 0.8351 0 {} 0 0 0
141 {} 8.42511 0.02344 0.03058 ++ {0.0} {} {} 56.79390 0.37222 0.47522 ++ {0.0} {} {} 120.02551 0.63767 0.80169 ++ {0.0} {} 1.30681538582 0.1066 0 {} 0 0 0
142 {} 8.80747 0.01637 0.00017 ++ {0.0} {} {} 56.40508 0.29795 0.00302 ++ {0.0} {} {} 120.11106 0.55764 0.00636 ++ {0.0} {} 0.0387355796993 0.0387 0 {} 0 0 0
143 {} 8.39719 0.01336 0.03587 ++ {0.0} {} {} 64.92429 0.38218 0.52330 ++ {0.0} {} {} 119.85538 0.52276 0.68610 ++ {0.0} {} 0.928449451923 0.1218 0 {} 0 0 0
144 {} 8.36959 0.01574 0.02248 ++ {0.0} {} {} 64.98859 0.40611 0.40765 ++ {0.0} {} {} 119.83553 0.45892 0.46053 ++ {0.0} {} 0.597416400909 0.0774 0 {} 0 0 0
145 {} 8.29053 0.01849 0.03153 ++ {0.0} {} {} 59.55678 0.46448 0.72586 ++ {0.0} {} {} 119.84470 0.56727 0.92061 ++ {0.0} {} 2.10303902626 0.1849 0 {} 0 0 0
146 {} 8.39579 0.03195 0.10111 ++ {0.0} {} {} 59.26844 0.37765 0.85311 ++ {0.0} {} {} 119.86290 0.53442 0.98301 ++ {0.0} {} 6.68559265137 0.4839 0 {} 0 0 0
147 {} 8.50102 0.02489 0.04091 ++ {0.0} {} {} 58.89043 0.63276 0.96695 ++ {0.0} {} {} 119.87854 0.55945 0.83418 ++ {0.0} {} 4.12755537033 0.2052 0 {} 0 0 0
148 {} 7.97984 0.02480 0.04054 ++ {0.0} {} {} 58.85645 0.45214 0.74851 ++ {0.0} {} {} 119.82614 0.50182 0.82259 ++ {0.0} {} 3.57135462761 0.2685 0 {} 0 0 0
149 {} 7.97913 0.02702 0.06702 ++ {0.0} {} {} 57.84687 0.36143 0.91854 ++ {0.0} {} {} 119.82919 0.48029 1.13235 ++ {0.0} {} 9.65008544922 0.9319 0 {} 0 0 0
150 {} 7.15678 0.03002 0.04298 ++ {0.0} {} {} 56.32547 0.40346 0.55726 ++ {0.0} {} {} 119.87181 0.54236 0.67381 ++ {0.0} {} 1.65400958061 0.1167 0 {} 0 0 0
151 {} 7.93493 0.02362 0.02786 ++ {0.0} {} {} 55.95781 0.34736 0.42371 ++ {0.0} {} {} 119.87278 0.54543 0.63786 ++ {0.0} {} 0.985645830631 0.0988 0 {} 0 0 0
152 {} 7.15835 0.03102 0.07659 ++ {0.0} {} {} 53.87963 0.39423 0.92521 ++ {0.0} {} {} 119.84607 0.50734 0.99636 ++ {0.0} {} 8.25443553925 0.6112 0 {} 0 0 0
153 {} 7.80738 0.02186 0.04058 ++ {0.0} {} {} 61.34231 0.31928 0.58341 ++ {0.0} {} {} 119.71073 0.55918 0.88065 ++ {0.0} {} 2.07288885117 0.2564 0 {} 0 0 0
154 {} 8.23265 0.02707 0.05568 ++ {0.0} {} {} 61.00703 0.49199 0.90930 ++ {0.0} {} {} 119.71231 0.55634 1.01490 ++ {0.0} {} 10.9717292786 0.6545 0 {} 0 0 0
155 {} 8.23356 0.02355 0.03763 ++ {0.0} {} {} 59.53060 0.42392 0.81967 ++ {0.0} {} {} 119.71917 0.59723 0.97708 ++ {0.0} {} 3.5807094574 0.2632 0 {} 0 0 0
156 {} 7.80765 0.02220 0.05629 ++ {0.0} {} {} 59.27498 0.37472 0.89593 ++ {0.0} {} {} 119.72603 0.56303 1.04584 ++ {0.0} {} 8.56301116943 0.9347 0 {} 0 0 0
157 {} 8.28946 0.02315 0.05256 ++ {0.0} {} {} 58.60454 0.45043 0.96383 ++ {0.0} {} {} 119.80319 0.44658 0.95871 ++ {0.0} {} 10.1227092743 0.8471 0 {} 0 0 0
158 {} 8.16435 0.02442 0.03967 ++ {0.0} {} {} 62.29746 0.33006 0.65413 ++ {0.0} {} {} 119.44891 0.49311 0.87232 ++ {0.0} {} 2.57434773445 0.2916 0 {} 0 0 0
159 {} 7.86940 0.04130 0.08856 ++ {0.0} {} {} 59.99649 0.40373 0.90647 ++ {0.0} {} {} 119.48013 0.54439 1.08338 ++ {0.0} {} 15.360827446 0.7555 0 {} 0 0 0
160 {} 7.87987 0.03157 0.07086 ++ {0.0} {} {} 58.59209 0.41951 0.87317 ++ {0.0} {} {} 119.56997 0.54064 1.04504 ++ {0.0} {} 10.2769002914 0.6817 0 {} 0 0 0
161 {} 7.86429 0.03688 0.05952 ++ {0.0} {} {} 57.70058 0.58050 1.10354 ++ {0.0} {} {} 119.48954 0.55188 0.88679 ++ {0.0} {} 6.80143070221 0.2656 0 {} 0 0 0
162 {} 7.86598 0.01970 0.00573 ++ {0.0} {} {} 56.01827 0.43645 0.12362 ++ {0.0} {} {} 119.54170 0.59509 0.20541 ++ {0.0} {} 0.150130555034 0.0449 0 {} 0 0 0
163 {} 8.16303 0.02219 0.02961 ++ {0.0} {} {} 45.19312 0.31268 0.45445 ++ {0.0} {} {} 119.45907 0.49558 0.71151 ++ {0.0} {} 1.04671227932 0.1410 0 {} 0 0 0
164 {} 8.04698 0.02414 0.05201 ++ {0.0} {} {} 59.72006 0.34636 0.83643 ++ {0.0} {} {} 119.24976 0.45307 0.90370 ++ {0.0} {} 5.73166227341 0.6513 0 {} 0 0 0
165 {} 8.20752 0.02472 0.03959 ++ {0.0} {} {} 57.45144 0.46556 0.76321 ++ {0.0} {} {} 119.24642 0.46305 0.75056 ++ {0.0} {} 2.85804462433 0.2092 0 {} 0 0 0
166 {} 8.20904 0.02851 0.07435 ++ {0.0} {} {} 56.26558 0.48717 0.98561 ++ {0.0} {} {} 119.25644 0.46127 0.91471 ++ {0.0} {} 13.5311365128 0.7066 0 {} 0 0 0
167 {} 8.04655 0.02468 0.04303 ++ {0.0} {} {} 58.60375 0.47786 0.86584 ++ {0.0} {} {} 119.22327 0.49751 0.82984 ++ {0.0} {} 4.33925008774 0.2562 0 {} 0 0 0
168 {} 7.59896 0.02412 0.01140 ++ {0.0} {} {} 58.30141 0.25841 0.13100 ++ {0.0} {} {} 119.19917 0.54269 0.29293 ++ {0.0} {} 0.315596580505 0.0516 0 {} 0 0 0
169 {} 8.16300 0.01947 0.01791 ++ {0.0} {} {} 57.02145 0.39107 0.35789 ++ {0.0} {} {} 119.22466 0.53160 0.48849 ++ {0.0} {} 0.526431083679 0.0710 0 {} 0 0 0
170 {} 7.43503 0.02549 0.03955 ++ {0.0} {} {} 55.53110 0.38237 0.77614 ++ {0.0} {} {} 118.89762 0.48960 0.75288 ++ {0.0} {} 2.16981863976 0.1845 0 {} 0 0 0
171 {} 8.14622 0.02072 0.01236 ++ {0.0} {} {} 59.34962 0.54488 0.40084 ++ {0.0} {} {} 118.82093 0.55785 0.43870 ++ {0.0} {} 0.805166423321 0.0607 0 {} 0 0 0
172 {} 7.94652 0.02486 0.03680 ++ {0.0} {} {} 59.09185 0.43031 0.65680 ++ {0.0} {} {} 118.82595 0.56366 0.79336 ++ {0.0} {} 1.93919098377 0.1464 0 {} 0 0 0
173 {} 8.73997 0.01576 0.01040 ++ {0.0} {} {} 57.93182 0.51527 0.33630 ++ {0.0} {} {} 118.40304 0.59288 0.44747 ++ {0.0} {} 0.496572703123 0.0573 0 {} 0 0 0
174 {} 8.21163 0.01877 0.02416 ++ {0.0} {} {} 57.10989 0.40927 0.61446 ++ {0.0} {} {} 118.40425 0.69019 0.98492 ++ {0.0} {} 1.73864674568 0.1230 0 {} 0 0 0
175 {} 7.97319 0.01570 0.00123 ++ {0.0} {} {} 49.54834 0.69015 0.06139 ++ {0.0} {} {} 118.44242 0.61327 0.05603 ++ {0.0} {} 0.0401367582381 0.0401 0 {} 0 0 0
176 {} 8.26843 0.02655 0.05869 ++ {0.0} {} {} 60.89541 0.39925 0.88301 ++ {0.0} {} {} 118.19479 0.56184 1.05443 ++ {0.0} {} 12.4474496841 0.8454 0 {} 0 0 0
177 {} 7.86664 0.00983 0.00300 ++ {0.0} {} {} 58.60276 0.39633 0.12095 ++ {0.0} {} {} 118.12688 0.52165 0.15711 ++ {0.0} {} 0.0901436060667 0.0455 0 {} 0 0 0
178 {} 8.47455 0.02201 0.04294 ++ {0.0} {} {} 60.24700 0.43421 0.87580 ++ {0.0} {} {} 118.08304 0.51463 1.01011 ++ {0.0} {} 5.85916805267 0.4919 0 {} 0 0 0
179 {} 8.21659 0.01860 0.01699 ++ {0.0} {} {} 56.05200 0.43134 0.38233 ++ {0.0} {} {} 117.95824 0.51269 0.46218 ++ {0.0} {} 0.724846065044 0.0692 0 {} 0 0 0
180 {} 7.86275 0.01915 0.02360 ++ {0.0} {} {} 55.49034 0.33022 0.42835 ++ {0.0} {} {} 118.07629 0.54935 0.68880 ++ {0.0} {} 0.787841975689 0.1097 0 {} 0 0 0
181 {} 8.47595 0.02105 0.04039 ++ {0.0} {} {} 52.33218 0.44013 0.84209 ++ {0.0} {} {} 118.09338 0.47388 0.80348 ++ {0.0} {} 3.4747428894 0.2980 0 {} 0 0 0
182 {} 7.91049 0.03551 0.01605 ++ {0.0} {} {} 53.97910 0.45305 0.04417 ++ {0.0} {} {} 117.70494 0.50531 0.05032 ++ {0.0} {} 0.154184922576 0.0405 0 {} 0 0 0
183 {} 7.55092 0.01891 0.00093 ++ {0.0} {} {} 68.65701 0.37213 0.01825 ++ {0.0} {} {} 117.47912 0.55903 0.03313 ++ {0.0} {} 0.0395078510046 0.0395 0 {} 0 0 0
184 {} 7.58958 0.01785 0.02616 ++ {0.0} {} {} 57.97429 0.38786 0.63630 ++ {0.0} {} {} 117.54057 0.50675 0.73478 ++ {0.0} {} 1.13729894161 0.1495 0 {} 0 0 0
185 {} 7.59287 0.01774 0.00615 ++ {0.0} {} {} 55.49919 0.31604 0.10168 ++ {0.0} {} {} 117.50176 0.55385 0.19326 ++ {0.0} {} 0.0853638350964 0.0459 0 {} 0 0 0
186 {} 7.72605 0.01499 0.00192 ++ {0.0} {} {} 53.47034 0.43246 0.05544 ++ {0.0} {} {} 117.51811 0.62651 0.09145 ++ {0.0} {} 0.154269844294 0.0412 0 {} 0 0 0
187 {} 8.25196 0.02117 0.00043 ++ {0.0} {} {} 52.46975 0.41058 0.00725 ++ {0.0} {} {} 117.48241 0.61135 0.01337 ++ {0.0} {} 0.0388823747635 0.0389 0 {} 0 0 0
188 {} 8.20589 0.02319 0.03628 ++ {0.0} {} {} 60.16445 0.30441 0.49924 ++ {0.0} {} {} 117.20935 0.48087 0.76738 ++ {0.0} {} 1.55863523483 0.2141 0 {} 0 0 0
189 {} 8.20630 0.02500 0.05788 ++ {0.0} {} {} 58.45576 0.40399 1.06024 ++ {0.0} {} {} 117.18740 0.44539 0.90839 ++ {0.0} {} 8.16088008881 0.7712 0 {} 0 0 0
190 {} 8.70514 0.02670 0.02774 ++ {0.0} {} {} 57.56679 0.31194 0.32907 ++ {0.0} {} {} 117.26685 0.56662 0.58842 ++ {0.0} {} 0.849835038185 0.0816 0 {} 0 0 0
191 {} 8.70873 0.03270 0.06903 ++ {0.0} {} {} 56.28751 0.50257 0.87395 ++ {0.0} {} {} 117.23803 0.54296 0.96003 ++ {0.0} {} 6.94671297073 0.3557 0 {} 0 0 0
192 {} 8.00183 0.02430 0.04841 ++ {0.0} {} {} 61.82804 0.33619 0.76483 ++ {0.0} {} {} 117.08262 0.57105 1.01413 ++ {0.0} {} 4.9480509758 0.5378 0 {} 0 0 0
193 {} 8.00193 0.02326 0.03712 ++ {0.0} {} {} 61.03288 0.21843 1.01221 ++ {0.0} {} {} 117.07370 0.58025 0.89820 ++ {0.0} {} 1.93448066711 0.2159 0 {} 0 0 0
194 {} 9.45760 0.01487 0.00219 ++ {0.0} {} {} 68.66159 0.39244 0.05778 ++ {0.0} {} {} 116.80325 0.48722 0.07239 ++ {0.0} {} 0.0828939527273 0.0416 0 {} 0 0 0
195 {} 7.65096 0.01826 0.02648 ++ {0.0} {} {} 58.45010 0.33744 0.49873 ++ {0.0} {} {} 116.70011 0.56935 0.77256 ++ {0.0} {} 1.02178585529 0.1477 0 {} 0 0 0
196 {} 7.65167 0.02324 0.05653 ++ {0.0} {} {} 57.22671 0.50994 1.02052 ++ {0.0} {} {} 116.70993 0.55200 1.02163 ++ {0.0} {} 14.8250455856 0.9002 0 {} 0 0 0
197 {} 8.05422 0.01941 0.02804 ++ {0.0} {} {} 55.31610 0.38640 0.63727 ++ {0.0} {} {} 116.72873 0.57921 0.82280 ++ {0.0} {} 1.28231620789 0.1644 0 {} 0 0 0
198 {} 8.05332 0.02017 0.04010 ++ {0.0} {} {} 46.17321 0.37385 0.84315 ++ {0.0} {} {} 116.74589 0.53839 0.98815 ++ {0.0} {} 4.32063579559 0.5305 0 {} 0 0 0
199 {} 8.45090 0.02464 0.03040 ++ {0.0} {} {} 58.55557 0.39924 0.50842 ++ {0.0} {} {} 116.52019 0.54480 0.64731 ++ {0.0} {} 1.43684613705 0.1061 0 {} 0 0 0
200 {} 7.93180 0.02540 0.02315 ++ {0.0} {} {} 58.62389 0.46164 0.42089 ++ {0.0} {} {} 116.60918 0.51258 0.47044 ++ {0.0} {} 1.05151665211 0.0708 0 {} 0 0 0
201 {} 7.40949 0.02522 0.05363 ++ {0.0} {} {} 58.71438 0.38271 1.01610 ++ {0.0} {} {} 116.48147 0.51710 0.99737 ++ {0.0} {} 7.85362625122 0.6561 0 {} 0 0 0
202 {} 7.40854 0.02448 0.03959 ++ {0.0} {} {} 57.23186 0.52608 0.89224 ++ {0.0} {} {} 116.47890 0.54408 0.93583 ++ {0.0} {} 4.31585645676 0.2708 0 {} 0 0 0
203 {} 8.32230 0.02123 0.01500 ++ {0.0} {} {} 56.05677 0.45220 0.23845 ++ {0.0} {} {} 116.59134 0.59355 0.35306 ++ {0.0} {} 0.464415103197 0.0523 0 {} 0 0 0
204 {} 7.90046 0.01850 0.01529 ++ {0.0} {} {} 53.08104 0.35633 0.28944 ++ {0.0} {} {} 116.37303 0.60324 0.51298 ++ {0.0} {} 0.484692931175 0.0649 0 {} 0 0 0
205 {} 7.20514 0.01407 0.00191 ++ {0.0} {} {} 58.13538 0.38735 0.05253 ++ {0.0} {} {} 116.14616 0.75728 0.16383 ++ {0.0} {} 0.0413421988487 0.0413 0 {} 0 0 0
206 {} 7.86109 0.02408 0.02929 ++ {0.0} {} {} 54.85410 0.34552 0.42846 ++ {0.0} {} {} 115.74850 0.53959 0.63119 ++ {0.0} {} 0.999845027924 0.1014 0 {} 0 0 0
207 {} 7.86343 0.02898 0.05288 ++ {0.0} {} {} 52.25175 0.42383 0.91576 ++ {0.0} {} {} 115.75136 0.57179 0.99161 ++ {0.0} {} 7.99184083939 0.4380 0 {} 0 0 0
208 {} 8.02971 0.03208 0.03234 ++ {0.0} {} {} 61.88950 0.51482 0.52119 ++ {0.0} {} {} 115.55280 0.53564 0.54002 ++ {0.0} {} 1.51407039165 0.0779 0 {} 0 0 0
209 {} 7.34126 0.02314 0.03290 ++ {0.0} {} {} 56.27557 0.47373 0.72024 ++ {0.0} {} {} 115.46600 0.54121 0.78660 ++ {0.0} {} 2.49555754662 0.1612 0 {} 0 0 0
210 {} 8.30637 0.04224 0.06902 ++ {0.0} {} {} 55.61632 0.48491 0.69272 ++ {0.0} {} {} 115.32024 0.45055 0.79547 ++ {0.0} {} 8.80120658875 0.3400 0 {} 0 0 0
211 {} 9.08433 0.01567 0.00497 ++ {0.0} {} {} 59.10973 0.45769 0.14512 ++ {0.0} {} {} 115.28453 0.43342 0.13633 ++ {0.0} {} 0.088628128171 0.0458 0 {} 0 0 0
212 {} 7.96302 0.01865 0.01893 ++ {0.0} {} {} 61.55261 0.38245 0.39022 ++ {0.0} {} {} 114.77097 0.50915 0.51930 ++ {0.0} {} 0.587945103645 0.0787 0 {} 0 0 0
213 {} 6.78512 0.01512 0.01201 ++ {0.0} {} {} 64.63132 0.39901 0.31818 ++ {0.0} {} {} 113.65002 0.45342 0.36105 ++ {0.0} {} 0.370362699032 0.0641 0 {} 0 0 0
214 {} 7.65985 0.01818 0.01830 ++ {0.0} {} {} 64.65435 0.39410 0.39777 ++ {0.0} {} {} 113.44173 0.44142 0.44543 ++ {0.0} {} 0.556612551212 0.0778 0 {} 0 0 0
215 {} 7.54529 0.01950 0.02626 ++ {0.0} {} {} 64.65269 0.33784 0.49846 ++ {0.0} {} {} 113.46624 0.52667 0.74440 ++ {0.0} {} 0.898446798325 0.1469 0 {} 0 0 0
216 {} 6.89312 0.01185 0.00895 ++ {0.0} {} {} 64.56165 0.33316 0.25144 ++ {0.0} {} {} 113.51603 0.61232 0.50838 ++ {0.0} {} 0.29346832633 0.0619 0 {} 0 0 0
217 {} 7.99447 0.01755 0.00132 ++ {0.0} {} {} 66.34290 0.41590 0.02849 ++ {0.0} {} {} 113.39556 0.49842 0.03499 ++ {0.0} {} 0.0399059057236 0.0399 0 {} 0 0 0
218 {} 7.70737 0.02108 0.01882 ++ {0.0} {} {} 63.52503 0.43624 0.36829 ++ {0.0} {} {} 113.32777 0.58723 0.52354 ++ {0.0} {} 0.720688641071 0.0667 0 {} 0 0 0
219 {} 7.59375 0.01977 0.02281 ++ {0.0} {} {} 63.58446 0.54090 0.66806 ++ {0.0} {} {} 113.30417 0.55329 0.65352 ++ {0.0} {} 1.51497483253 0.1011 0 {} 0 0 0
220 {} 7.25728 0.02258 0.01844 ++ {0.0} {} {} 63.10117 0.49955 0.35162 ++ {0.0} {} {} 113.24597 0.46537 0.32899 ++ {0.0} {} 0.587907373905 0.0595 0 {} 0 0 0
221 {} 7.43306 0.01222 0.01359 ++ {0.0} {} {} 64.44390 0.37211 0.41369 ++ {0.0} {} {} 112.70890 0.46650 0.51268 ++ {0.0} {} 0.418331742287 0.0868 0 {} 0 0 0
222 {} 6.82156 0.01814 0.01804 ++ {0.0} {} {} 64.38461 0.34128 0.33872 ++ {0.0} {} {} 112.83187 0.54460 0.54101 ++ {0.0} {} 0.471285670996 0.0765 0 {} 0 0 0
223 {} 7.35160 0.01302 0.01258 ++ {0.0} {} {} 63.83234 0.36323 0.35102 ++ {0.0} {} {} 112.82108 0.57013 0.55351 ++ {0.0} {} 0.549213111401 0.0746 0 {} 0 0 0
224 {} 7.54748 0.01303 0.01510 ++ {0.0} {} {} 64.46597 0.48917 0.58323 ++ {0.0} {} {} 112.64786 0.24249 0.60837 ++ {0.0} {} 0.314608424902 0.0913 0 {} 0 0 0
225 {} 7.46946 0.01940 0.00716 ++ {0.0} {} {} 63.85840 0.38417 0.13499 ++ {0.0} {} {} 112.65101 0.69292 0.25113 ++ {0.0} {} 0.246013596654 0.0468 0 {} 0 0 0
226 {} 6.88219 0.01149 0.00311 ++ {0.0} {} {} 63.60395 0.45504 0.12312 ++ {0.0} {} {} 112.46103 0.50692 0.14136 ++ {0.0} {} 0.122228883207 0.0446 0 {} 0 0 0
227 {} 6.76627 0.01797 0.01746 ++ {0.0} {} {} 63.59836 0.33723 0.32506 ++ {0.0} {} {} 112.43329 0.50553 0.49157 ++ {0.0} {} 0.463839411736 0.0744 0 {} 0 0 0
228 {} 7.30025 0.02064 0.00206 ++ {0.0} {} {} 64.69335 0.39545 0.03096 ++ {0.0} {} {} 112.17776 0.44410 0.03668 ++ {0.0} {} 0.0401091724634 0.0401 0 {} 0 0 0
229 {} 7.54417 0.01775 0.01333 ++ {0.0} {} {} 63.64407 0.28342 0.20540 ++ {0.0} {} {} 112.21201 0.53913 0.43831 ++ {0.0} {} 0.347412824631 0.0604 0 {} 0 0 0
230 {} 7.42979 0.01610 0.01803 ++ {0.0} {} {} 63.60677 0.36711 0.43110 ++ {0.0} {} {} 112.23759 0.57749 0.64781 ++ {0.0} {} 0.668331444263 0.0933 0 {} 0 0 0
231 {} 7.36130 0.02738 0.05036 ++ {0.0} {} {} 61.44128 0.52458 0.95477 ++ {0.0} {} {} 111.07904 0.56905 0.99913 ++ {0.0} {} 8.37032699585 0.4561 0 {} 0 0 0
232 {} 7.36084 0.02435 0.02789 ++ {0.0} {} {} 58.76295 0.37666 0.46928 ++ {0.0} {} {} 111.12739 0.55013 0.65735 ++ {0.0} {} 1.31429541111 0.1022 0 {} 0 0 0
233 {} 8.35040 0.02413 0.03618 ++ {0.0} {} {} 45.05490 0.43677 0.72149 ++ {0.0} {} {} 110.99968 0.43118 0.68666 ++ {0.0} {} 1.74657416344 0.1727 0 {} 0 0 0
234 {} 8.35535 0.02294 0.00992 ++ {0.0} {} {} 56.96200 0.40080 0.16225 ++ {0.0} {} {} 110.98666 0.42735 0.17269 ++ {0.0} {} 0.231507301331 0.0483 0 {} 0 0 0
235 {} 8.41958 0.02712 0.02996 ++ {0.0} {} {} 45.27007 0.52971 0.57934 ++ {0.0} {} {} 110.36049 0.64086 0.68742 ++ {0.0} {} 1.85646212101 0.0857 0 {} 0 0 0
236 {} 8.13578 0.03874 0.05326 ++ {0.0} {} {} 57.07010 0.41194 0.77682 ++ {0.0} {} {} 109.08506 0.48683 0.72892 ++ {0.0} {} 3.18099522591 0.1717 0 {} 0 0 0
237 {} 8.13787 0.03683 0.07775 ++ {0.0} {} {} 45.97107 0.45473 0.93935 ++ {0.0} {} {} 109.08015 0.50769 1.01309 ++ {0.0} {} 14.572259903 0.7025 0 {} 0 0 0
238 {} 7.85116 0.02066 0.00747 ++ {0.0} {} {} 45.63258 0.33559 0.11382 ++ {0.0} {} {} 108.32796 0.47890 0.16814 ++ {0.0} {} 0.151376068592 0.0464 0 {} 0 0 0
239 {} 6.97151 0.01569 0.00183 ++ {0.0} {} {} 70.13326 0.41815 0.04978 ++ {0.0} {} {} 107.44527 0.53450 0.06718 ++ {0.0} {} 0.0808719024062 0.0410 0 {} 0 0 0
240 {} 7.67329 0.02570 0.00466 ++ {0.0} {} {} 70.09342 0.41787 0.08890 ++ {0.0} {} {} 107.34096 0.63775 0.18143 ++ {0.0} {} 0.0787718072534 0.0431 0 {} 0 0 0
241 {} 6.89491 0.02285 0.00069 ++ {0.0} {} {} 70.11836 0.43547 0.01292 ++ {0.0} {} {} 107.40692 0.37410 0.01110 ++ {0.0} {} 0.0391192771494 0.0391 0 {} 0 0 0
242 {} 6.51114 0.04058 0.00140 ++ {0.0} {} {} 70.11855 0.43010 0.03068 ++ {0.0} {} {} 107.30928 0.55594 0.04438 ++ {0.0} {} 0.0399644076824 0.0400 0 {} 0 0 0
;
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 H-aromatic . 'not observed' 2403.259 Hz . . . 4.786 . . 31013 5
2 . . C 13 C-aromatic . 'not observed' 6034.487 Hz . . . 125.143 . . 31013 5
stop_
save_