Content for NMR-STAR saveframe, "FullyProtD2O"
save_FullyProtD2O
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode FullyProtD2O
_Spectral_peak_list.Entry_ID 27567
_Spectral_peak_list.ID 11
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $2DD2O
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Experiment_ID 1
_Spectral_peak_list.Experiment_name '2D 1H-1H NOESY'
_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 'Fully Prot'
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
label dataset sw sf
1H 2H
6996.26904297 6996.26904297
699.932983398 699.932983398
1H.L 1H.P 1H.W 1H.B 1H.E 1H.J 1H.U 2H.L 2H.P 2H.W 2H.B 2H.E 2H.J 2H.U vol int stat comment flag0
0 {16.h1'} 5.68747 0.01210 0.01613 ++ {0.0} {} {16.h8} 8.02271 0.03150 0.04200 ++ {0.0} {} 0.0 0.0000 0 {} 0
1 {16.h1'} 5.68747 0.01714 0.02285 ++ {0.0} {} {17.h8} 7.44615 0.02864 0.03818 ++ {0.0} {} 0.0 0.0000 0 {} 0
2 {17.h1'} 5.82260 0.01311 0.01748 ++ {0.0} {} {17.h8} 7.44042 0.02291 0.03055 ++ {0.0} {} 0.0 0.0000 0 {} 0
3 {17.h1'} 5.82260 0.01512 0.02016 ++ {0.0} {} {18.h8} 7.15023 0.04296 0.05728 ++ {0.0} {} 0.0 0.0000 0 {} 0
4 {18.h1'} 5.67876 0.01714 0.02285 ++ {0.0} {} {18.h8} 7.15023 0.04868 0.06491 ++ {0.0} {} 0.0 0.0000 0 {} 0
5 {18.h1'} 5.67809 0.01512 0.02016 ++ {0.0} {} {19.h6} 7.42133 0.03150 0.04200 ++ {0.0} {} 0.0 0.0000 0 {} 0
6 {19.h5} 5.07921 0.02722 0.03630 ++ {0.0} {} {19.h6} 7.42133 0.04009 0.05346 ++ {0.0} {} 0.0 0.0000 0 {} 0
7 {19.h1'} 5.38571 0.01916 0.02554 ++ {0.0} {} {19.h6} 7.42133 0.04582 0.06109 ++ {0.0} {} 0.0 0.0000 0 {} 0
8 {19.h1'} 5.38571 0.01411 0.01882 ++ {0.0} {} {20.h8} 7.81080 0.03150 0.04200 ++ {0.0} {} 0.0 0.0000 0 {} 0
9 {20.h1'} 5.85554 0.01109 0.01479 ++ {0.0} {} {20.h8} 7.81080 0.03723 0.04964 ++ {0.0} {} 0.0 0.0000 0 {} 0
10 {20.h1'} 5.85554 0.01109 0.01479 ++ {0.0} {} {20.h2} 6.82567 0.02005 0.02673 ++ {0.0} {} 0.0 0.0000 0 {} 0
11 {20.h1'} 5.85700 0.01613 0.02151 ++ {0.0} {} {21.h8} 6.85832 0.04009 0.05346 ++ {0.0} {} 0.0 0.0000 0 {} 0
12 {21.h1'} 5.41125 0.02521 0.03361 ++ {0.0} {} {21.h8} 6.86006 0.02577 0.03437 ++ {0.0} {} 0.0 0.0000 0 {} 0
13 {21.h1'} 5.41058 0.02117 0.02823 ++ {0.0} {} {20.h2} 6.82567 0.03437 0.04582 ++ {0.0} {} 0.0 0.0000 0 {} 0
14 {43.h1'} 5.68280 0.01916 0.02554 ++ {0.0} {} {20.h2} 6.82567 0.03150 0.04200 ++ {0.0} {} 0.0 0.0000 0 {} 0
15 {43.h1'} 5.68078 0.01815 0.02420 ++ {0.0} {} {43.h8} 7.69052 0.02577 0.03437 ++ {0.0} {} 0.0 0.0000 0 {} 0
16 {43.h1'} 5.68212 0.01815 0.02420 ++ {0.0} {} {44.h6} 7.58552 0.02864 0.03818 ++ {0.0} {} 0.0 0.0000 0 {} 0
17 {44.h5} 5.05434 0.02319 0.03092 ++ {0.0} {} {44.h6} 7.58552 0.04009 0.05346 ++ {0.0} {} 0.0 0.0000 0 {} 0
18 {44.h1'} 5.35020 0.01411 0.01882 ++ {0.0} {} {44.h6} 7.57586 0.04296 0.05728 ++ {0.0} {} 0.0 0.0000 0 {} 0
19 {44.h1'} 5.35004 0.01109 0.01479 ++ {0.0} {} {45.h6} 7.67619 0.03437 0.04582 ++ {0.0} {} 0.0 0.0000 0 {} 0
20 {45.h5} 5.33075 0.02117 0.02823 ++ {0.0} {} {45.h6} 7.67511 0.04582 0.06109 ++ {0.0} {} 0.0 0.0000 0 {} 0
21 {45.h1'} 5.38010 0.01714 0.02100 ++ {0.0} {} {45.h6} 7.68181 0.03150 0.05612 ++ {0.0} {} 0.0 0.0000 0 {} 0
22 {45.h1'} 5.37902 0.01311 0.02665 ++ {0.0} {} {46.h6} 7.56867 0.02577 0.04873 ++ {0.0} {} 0.0 0.0000 0 {} 0
23 {46.h5} 5.38235 0.02319 0.03092 ++ {0.0} {} {46.h6} 7.56834 0.04868 0.06491 ++ {0.0} {} 0.0 0.0000 0 {} 0
24 {46.h1'} 5.60684 0.01714 0.02285 ++ {0.0} {} {46.h6} 7.56834 0.03150 0.04200 ++ {0.0} {} 0.0 0.0000 0 {} 0
25 {22.h1'} 5.83873 0.01714 0.02285 ++ {0.0} {} {22.h8} 7.60270 0.05441 0.07255 ++ {0.0} {} 0.0 0.0000 0 {} 0
26 {22.h1'} 5.83873 0.01210 0.01613 ++ {0.0} {} {22.h2} 6.95740 0.02005 0.02673 ++ {0.0} {} 0.0 0.0000 0 {} 0
27 {21.h1'} 5.41192 0.01815 0.02420 ++ {0.0} {} {22.h8} 7.59855 0.02241 0.02988 ++ {0.0} {} 0.0 0.0000 0 {} 0
28 {23.h1'} 5.71301 0.01916 0.01956 ++ {0.0} {} {23.h6} 7.67092 0.04009 0.05346 ++ {0.0} {} 0.0 0.0000 0 {} 0
29 {23.h5} 5.72380 0.03025 0.04033 ++ {0.0} {} {23.h6} 7.67143 0.04582 0.06109 ++ {0.0} {} 0.0 0.0000 0 {} 0
30 {25.h1'} 5.89116 0.02117 0.02823 ++ {0.0} {} {25.h6} 7.75734 0.04868 0.06491 ++ {0.0} {} 0.0 0.0000 0 {} 0
31 {25.h5} 5.83201 0.03125 0.04167 ++ {0.0} {} {25.h6} 7.75734 0.04582 0.06109 ++ {0.0} {} 0.0 0.0000 0 {} 0
32 {40.h1'} 5.37092 0.01916 0.02554 ++ {0.0} {} {40.h6} 7.89099 0.03723 0.04964 ++ {0.0} {} 0.0 0.0000 0 {} 0
33 {40.h5} 5.32454 0.03025 0.04033 ++ {0.0} {} {40.h6} 7.89099 0.05441 0.07255 ++ {0.0} {} 0.0 0.0000 0 {} 0
34 {39.h1'} 5.10005 0.01512 0.02016 ++ {0.0} {} {40.h6} 7.89099 0.04582 0.06109 ++ {0.0} {} 0.0 0.0000 0 {} 0
35 {39.h1'} 5.09870 0.02016 0.02689 ++ {0.0} {} {39.h6} 7.33542 0.02577 0.03437 ++ {0.0} {} 0.0 0.0000 0 {} 0
36 {39.h5} 5.45561 0.03831 0.05108 ++ {0.0} {} {39.h6} 7.33542 0.03723 0.04964 ++ {0.0} {} 0.0 0.0000 0 {} 0
37 {38.h1'} 5.56988 0.01210 0.01613 ++ {0.0} {} {39.h6} 7.33542 0.03723 0.04964 ++ {0.0} {} 0.0 0.0000 0 {} 0
38 {38.h1'} 5.56988 0.01311 0.01748 ++ {0.0} {} {38.h6} 7.69816 0.03437 0.04582 ++ {0.0} {} 0.0 0.0000 0 {} 0
39 {38.h5} 5.27701 0.02319 0.02299 ++ {0.0} {} {38.h6} 7.70147 0.05441 0.09773 ++ {0.0} {} 0.0 0.0000 0 {} 0
40 {38.h5} 5.14777 0.01714 0.02285 ++ {0.0} {} {39.h6} 6.99176 0.03150 0.04200 ++ {0.0} {} 0.0 0.0000 0 {} 0
41 {40.h1'} 5.36958 0.01815 0.02420 ++ {0.0} {} {41.h6} 7.73252 0.03150 0.04200 ++ {0.0} {} 0.0 0.0000 0 {} 0
42 {41.h5} 5.52619 0.02521 0.03361 ++ {0.0} {} {41.h6} 7.73252 0.04582 0.06109 ++ {0.0} {} 0.0 0.0000 0 {} 0
43 {41.h1'} 5.31446 0.01613 0.02151 ++ {0.0} {} {41.h6} 7.73252 0.03437 0.04582 ++ {0.0} {} 0.0 0.0000 0 {} 0
44 {42.h5} 5.22864 0.02420 0.03226 ++ {0.0} {} {42.h6} 7.69070 0.04009 0.05346 ++ {0.0} {} 0.0 0.0000 0 {} 0
45 {41.h1'} 5.31421 0.01411 0.02385 ++ {0.0} {} {42.h6} 7.68875 0.04009 0.05507 ++ {0.0} {} 0.0 0.0000 0 {} 0
46 {42.h1'} 5.29682 0.01509 0.02012 ++ {0.0} {} {43.h8} 7.69485 0.02066 0.02754 ++ {0.0} {} 0.0 0.0000 0 {} 0
47 {42.h1'} 5.29700 0.02289 0.01774 ++ {0.0} {} {42.h6} 7.68628 0.01805 0.03191 ++ {0.0} {} 0.0 0.0000 0 {} 0
48 {41.h1'} 5.31661 0.01647 0.02196 ++ {0.0} {} {22.h2} 6.95852 0.03108 0.04144 ++ {0.0} {} 0.0 0.0000 0 {} 0
49 {30.h1'} 5.65123 0.01744 0.02326 ++ {0.0} {} {30.h6} 7.64989 0.02826 0.03768 ++ {0.0} {} 0.0 0.0000 0 {} 0
50 {30.h1'} 5.65123 0.01744 0.02326 ++ {0.0} {} {31.h6} 7.55570 0.03956 0.05275 ++ {0.0} {} 0.0 0.0000 0 {} 0
51 {31.h5} 5.53366 0.01744 0.02326 ++ {0.0} {} {31.h6} 7.55570 0.04804 0.06405 ++ {0.0} {} 0.0 0.0000 0 {} 0
52 {31.h1'} 5.51550 0.01938 0.02584 ++ {0.0} {} {31.h6} 7.55455 0.03956 0.05275 ++ {0.0} {} 0.0 0.0000 0 {} 0
53 {28.h1'} 5.75265 0.01453 0.01938 ++ {0.0} {} {28.h8} 7.43137 0.02543 0.03391 ++ {0.0} {} 0.0 0.0000 0 {} 0
54 {28.h1'} 5.75265 0.01550 0.02067 ++ {0.0} {} {29.h6} 7.38615 0.01978 0.02637 ++ {0.0} {} 0.0 0.0000 0 {} 0
55 {29.h1'} 5.38703 0.01357 0.01809 ++ {0.0} {} {29.h6} 7.38615 0.03108 0.04144 ++ {0.0} {} 0.0 0.0000 0 {} 0
56 {29.h1'} 5.38703 0.01938 0.02584 ++ {0.0} {} {30.h6} 7.65177 0.04239 0.05651 ++ {0.0} {} 0.0 0.0000 0 {} 0
57 {29.h5} 5.01688 0.03488 0.04651 ++ {0.0} {} {29.h6} 7.38427 0.03391 0.04521 ++ {0.0} {} 0.0 0.0000 0 {} 0
58 {27.h1'} 5.92642 0.01647 0.02196 ++ {0.0} {} {27.h8} 7.65743 0.02543 0.03391 ++ {0.0} {} 0.0 0.0000 0 {} 0
59 {27.h1'} 5.92642 0.01744 0.02326 ++ {0.0} {} {28.h8} 7.43325 0.03108 0.04144 ++ {0.0} {} 0.0 0.0000 0 {} 0
60 {27.h1'} 5.92642 0.01066 0.01421 ++ {0.0} {} {27.h2} 7.32775 0.02543 0.03391 ++ {0.0} {} 0.0 0.0000 0 {} 0
61 {28.h1'} 5.75136 0.01550 0.02067 ++ {0.0} {} {27.h2} 7.32775 0.04521 0.06028 ++ {0.0} {} 0.0 0.0000 0 {} 0
62 {39.h1'} 5.09892 0.02035 0.02713 ++ {0.0} {} {27.h2} 7.32022 0.02826 0.03768 ++ {0.0} {} 0.0 0.0000 0 {} 0
63 {34.h1'} 5.81596 0.01550 0.02067 ++ {0.0} {} {34.h8} 7.83451 0.04239 0.05651 ++ {0.0} {} 0.0 0.0000 0 {} 0
64 {35.h1'} 5.74877 0.02035 0.02713 ++ {0.0} {} {35.h8} 8.26402 0.02543 0.03391 ++ {0.0} {} 0.0 0.0000 0 {} 0
65 {37.h5} 5.05500 0.02810 0.03747 ++ {0.0} {} {37.h6} 7.56040 0.05369 0.07159 ++ {0.0} {} 0.0 0.0000 0 {} 0
66 {37.h1'} 5.44839 0.01453 0.01938 ++ {0.0} {} {37.h6} 7.55005 0.03956 0.05275 ++ {0.0} {} 0.0 0.0000 0 {} 0
67 {37.h1'} 5.44839 0.01260 0.01680 ++ {0.0} {} {38.h6} 7.69887 0.02543 0.03391 ++ {0.0} {} 0.0 0.0000 0 {} 0
68 {33.h1'} 5.50653 0.02132 0.02842 ++ {0.0} {} {33.h8} 7.58584 0.01978 0.02637 ++ {0.0} {} 0.0 0.0000 0 {} 0
69 {34.h1'} 5.04853 0.02132 0.02842 ++ {0.0} {} {34.h8} 7.64424 0.02826 0.03768 ++ {0.0} {} 0.0 0.0000 0 {} 0
70 {30.h5} 5.48994 0.05767 0.04512 ++ {0.0} {} {30.h6} 7.64101 0.05785 0.07714 ++ {0.0} {} 0.0 0.0000 0 {} 0
71 {26.h2'} 4.87671 0.01960 0.02613 ++ {0.0} {} {26.h8} 7.67232 0.04232 0.05642 ++ {0.0} {} 0.0 0.0000 0 {} 0
72 {26.h1'} 5.81718 0.01120 0.01313 ++ {0.0} {} {26.h8} 7.67413 0.02257 0.02958 ++ {0.0} {} 0.0 0.0000 0 {} 0
73 {26.h1'} 5.81739 0.01400 0.01867 ++ {0.0} {} {27.h8} 7.65238 0.01975 0.02633 ++ {0.0} {} 0.0 0.0000 0 {} 0
74 {34.h1'} 5.81993 0.01619 0.02159 ++ {0.0} {} {35.h8} 8.26344 0.01719 0.02292 ++ {0.0} {} 0.0 0.0000 0 {} 0
75 {36.h1'} 5.32300 0.01393 0.01858 ++ {0.0} {} {36.h8} 7.32501 0.02885 0.03846 ++ {0.0} {} 0.0 0.0000 0 {} 0
76 {36.h1'} 5.32135 0.01593 0.02123 ++ {0.0} {} {37.h6} 7.56533 0.02623 0.03497 ++ {0.0} {} 0.0 0.0000 0 {} 0
77 {32.h1'} 5.34147 0.01683 0.02244 ++ {0.0} {} {32.h8} 7.65324 0.02998 0.03997 ++ {0.0} {} 0.0 0.0000 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
2 . . H 1 H . . 6995.86924091386 Hz . . . . . . 27567 11
stop_
save_