Content for NMR-STAR saveframe, "spectral_peak_list_3"
save_spectral_peak_list_3
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_3
_Spectral_peak_list.Entry_ID 36186
_Spectral_peak_list.ID 3
_Spectral_peak_list.Name .
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $sample_1
_Spectral_peak_list.Sample_condition_list_ID 2
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_2
_Spectral_peak_list.Chem_shift_reference_ID .
_Spectral_peak_list.Chem_shift_reference_label .
_Spectral_peak_list.Experiment_ID 3
_Spectral_peak_list.Experiment_name '3D F1-15N/13C filtered, F2-13C edited NOESY'
_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 1
_Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
label dataset sw sf
H Hy C
xfcnoe_rok_seq9_0623b.nv
{9469.70 } {7122.51 } {8361.20 }
{949.9640 } {949.9640 } {238.8740 }
H.L H.P H.W H.B H.E H.J H.U Hy.L Hy.P Hy.W Hy.B Hy.E Hy.J Hy.U C.L C.P C.W C.B C.E C.J C.U vol int stat comment flag0
0 {?} 3.213 0.026 0.038 ? 0.000 {?} {?} 4.073 0.035 0.075 ? 0.000 {?} {?} 43.475 0.724 0.957 ? 0.000 {?} 5000.49707 23.33914 0 {?} 0
1 {?} 3.206 0.025 0.025 ++ 0.000 {?} {?} 6.232 0.054 0.044 ++ 0.000 {?} {?} 43.354 0.655 0.550 ++ 0.000 {?} 399.09430 4.73981 0 {?} 0
2 {?} 3.207 0.034 0.037 ++ 0.000 {?} {?} 5.901 0.079 0.079 ? 0.000 {?} {?} 43.401 0.677 0.774 ++ 0.000 {?} 1289.81677 6.88955 0 {?} 0
3 {?} 3.207 0.038 0.049 ++ 0.000 {?} {?} 4.995 0.085 0.110 ++ 0.000 {?} {?} 43.388 0.647 0.788 ? 0.000 {?} 1977.53650 8.25438 0 {?} 0
4 {?} 3.207 0.051 0.050 ++ 0.000 {?} {?} 4.820 0.081 0.078 ++ 0.000 {?} {?} 43.393 0.631 0.607 ++ 0.000 {?} 1262.46045 5.73824 0 {?} 0
5 {?} 3.205 0.018 0.044 ? 0.000 {?} {?} 4.149 0.023 0.049 ? 0.000 {?} {?} 43.410 0.618 0.957 ? 0.000 {?} 4457.84814 22.61180 0 {?} 0
6 {?} 3.203 0.029 0.048 ++ 0.000 {?} {?} 6.025 0.048 0.106 ? 0.000 {?} {?} 43.372 0.737 0.957 ? 0.000 {?} 3233.72144 13.06554 0 {?} 0
7 {?} 3.204 0.022 0.055 ++ 0.000 {?} {?} 4.388 0.052 0.113 ? 0.000 {?} {?} 43.390 0.638 0.957 ? 0.000 {?} 6658.88672 20.95858 0 {?} 0
8 {?} 3.081 0.028 0.028 ++ 0.000 {?} {?} 4.076 0.047 0.047 ++ 0.000 {?} {?} 42.021 0.337 0.337 ++ 0.000 {?} 377.37900 3.57852 0 {?} 0
9 {?} 3.060 0.037 0.046 ++ 0.000 {?} {?} 5.006 0.088 0.109 ++ 0.000 {?} {?} 41.868 0.712 0.957 ? 0.000 {?} 2184.25806 8.31201 0 {?} 0
10 {?} 1.868 0.032 0.052 ? 0.000 {?} {?} 4.390 0.062 0.084 ++ 0.000 {?} {?} 31.046 0.782 0.957 ? 0.000 {?} 3113.81885 9.55500 0 {?} 0
11 {?} 1.868 0.031 0.033 ? 0.000 {?} {?} 4.150 0.047 0.078 ? 0.000 {?} {?} 31.027 0.723 0.957 ? 0.000 {?} 1825.50073 6.90473 0 {?} 0
12 {?} 1.768 0.036 0.036 ? 0.000 {?} {?} 4.388 0.042 0.085 ? 0.000 {?} {?} 31.062 0.792 0.957 ? 0.000 {?} 2166.61035 10.18292 0 {?} 0
13 {?} 1.768 0.026 0.031 ? 0.000 {?} {?} 4.138 0.079 0.093 ? 0.000 {?} {?} 31.062 0.776 0.957 ? 0.000 {?} 1983.79749 7.92987 0 {?} 0
14 {?} 1.867 0.025 0.037 ? 0.000 {?} {?} 4.070 0.087 0.087 ++ 0.000 {?} {?} 30.059 0.957 0.957 ? 0.000 {?} 1662.30273 5.66821 0 {?} 0
15 {?} 1.845 0.027 0.027 ++ 0.000 {?} {?} 4.166 0.044 0.055 ? 0.000 {?} {?} 30.082 0.711 0.711 ? 0.000 {?} 829.78137 4.77050 0 {?} 0
16 {?} 1.359 0.038 0.038 ++ 0.000 {?} {?} 4.152 nan 0.075 ++ 0.000 {?} {?} 28.033 0.119 0.119 ++ 0.000 {?} 148.10490 3.12760 0 {?} 0
17 {?} 1.668 0.060 0.060 ++ 0.000 {?} {?} 5.000 0.075 0.075 ++ 0.000 {?} {?} 27.174 0.682 0.682 ++ 0.000 {?} 1545.91467 4.73488 0 {?} 0
18 {?} 1.670 0.023 0.032 ++ 0.000 {?} {?} 4.156 0.034 0.074 ? 0.000 {?} {?} 27.191 0.788 0.957 ? 0.000 {?} 3409.76538 13.45421 0 {?} 0
19 {?} 1.663 0.030 0.044 ++ 0.000 {?} {?} 4.386 0.046 0.104 ? 0.000 {?} {?} 27.164 0.652 0.957 ? 0.000 {?} 4883.74902 15.44458 0 {?} 0
20 {?} 1.676 0.019 0.033 ? 0.000 {?} {?} 6.040 0.071 0.071 ++ 0.000 {?} {?} 27.136 0.313 0.313 ++ 0.000 {?} 636.76929 3.73236 0 {?} 0
21 {?} 1.274 0.027 0.022 ++ 0.000 {?} {?} 7.250 0.086 0.068 ++ 0.000 {?} {?} 22.809 0.516 0.516 ++ 0.000 {?} 513.42249 4.72772 0 {?} 0
22 {?} 1.272 0.030 0.031 ++ 0.000 {?} {?} 4.151 0.111 0.114 ++ 0.000 {?} {?} 22.854 0.679 0.693 ++ 0.000 {?} 1681.93762 6.16569 0 {?} 0
23 {?} 1.274 0.035 0.041 ++ 0.000 {?} {?} 7.148 0.077 0.090 ++ 0.000 {?} {?} 22.817 0.753 0.957 ? 0.000 {?} 1560.73999 7.60851 0 {?} 0
24 {?} 1.272 0.038 0.056 ++ 0.000 {?} {?} 4.809 0.058 0.082 ++ 0.000 {?} {?} 22.858 0.731 0.957 ? 0.000 {?} 3471.52686 14.82179 0 {?} 0
25 {?} 1.268 0.035 0.050 ++ 0.000 {?} {?} 4.563 0.057 0.083 ? 0.000 {?} {?} 22.868 0.721 0.957 ? 0.000 {?} 3053.01782 13.41700 0 {?} 0
26 {?} 1.219 0.015 0.015 ++ 0.000 {?} {?} 6.036 0.068 0.068 ++ 0.000 {?} {?} 21.668 0.406 0.406 ++ 0.000 {?} 341.28769 4.05998 0 {?} 0
27 {?} 1.219 0.025 0.025 ++ 0.000 {?} {?} 4.997 0.070 0.071 ++ 0.000 {?} {?} 21.617 0.697 0.703 ++ 0.000 {?} 697.03668 6.07500 0 {?} 0
28 {?} 1.219 0.007 0.026 ? 0.000 {?} {?} 4.084 0.031 0.061 ? 0.000 {?} {?} 21.663 0.604 0.957 ? 0.000 {?} 2564.96338 16.45431 0 {?} 0
29 {?} 1.218 0.019 0.019 ++ 0.000 {?} {?} 4.810 0.053 0.053 ++ 0.000 {?} {?} 21.658 0.462 0.462 ++ 0.000 {?} 359.39740 4.47757 0 {?} 0
30 {?} 1.218 0.023 0.035 ++ 0.000 {?} {?} 4.367 0.052 0.117 ? 0.000 {?} {?} 21.673 0.609 0.957 ? 0.000 {?} 4014.72290 20.07112 0 {?} 0
31 {?} 1.218 0.010 0.034 ? 0.000 {?} {?} 4.198 0.054 0.089 ? 0.000 {?} {?} 21.661 0.593 0.957 ? 0.000 {?} 3739.83252 19.19258 0 {?} 0
32 {?} 1.388 0.020 0.023 ++ 0.000 {?} {?} 4.346 0.073 0.080 ++ 0.000 {?} {?} 19.640 0.586 0.957 ? 0.000 {?} 928.61249 7.13816 0 {?} 0
33 {?} 1.383 0.024 0.031 ++ 0.000 {?} {?} 4.067 0.058 0.087 ? 0.000 {?} {?} 19.645 0.623 0.957 ? 0.000 {?} 2170.84204 10.92059 0 {?} 0
34 {?} 1.384 0.016 0.016 ++ 0.000 {?} {?} 4.818 0.056 0.056 ++ 0.000 {?} {?} 19.565 0.480 0.480 ++ 0.000 {?} 344.26999 4.22022 0 {?} 0
35 {?} 1.384 0.011 0.011 ++ 0.000 {?} {?} 5.009 0.039 0.039 ++ 0.000 {?} {?} 19.622 0.317 0.317 ++ 0.000 {?} 209.03290 3.81817 0 {?} 0
36 {?} 1.632 0.045 0.068 ++ 0.000 {?} {?} 5.005 0.052 0.079 ++ 0.000 {?} {?} 18.460 0.714 0.957 ? 0.000 {?} 3145.52515 13.06090 0 {?} 0
37 {?} 1.626 0.044 0.047 ++ 0.000 {?} {?} 4.067 0.118 0.125 ++ 0.000 {?} {?} 18.475 0.700 0.745 ++ 0.000 {?} 2173.21631 6.65845 0 {?} 0
38 {?} 1.989 0.027 0.043 ++ 0.000 {?} {?} 4.789 0.076 0.117 ++ 0.000 {?} {?} 17.131 0.644 0.957 ? 0.000 {?} 2532.09717 15.01685 0 {?} 0
39 {?} 1.989 0.027 0.027 ++ 0.000 {?} {?} 4.169 0.058 0.072 ? 0.000 {?} {?} 17.166 0.516 0.519 ? 0.000 {?} 802.87109 6.05282 0 {?} 0
40 {?} 1.989 0.023 0.028 ++ 0.000 {?} {?} 4.063 0.062 0.083 ? 0.000 {?} {?} 17.070 0.606 0.957 ? 0.000 {?} 1282.68604 8.82314 0 {?} 0
41 {?} 1.273 0.011 0.011 ++ 0.000 {?} {?} 2.371 0.043 0.043 ? 0.000 {?} {?} 22.813 0.305 0.305 ++ 0.000 {?} 137.38110 3.59796 0 {?} 0
42 {?} 1.270 0.013 0.050 ? 0.000 {?} {?} 1.476 0.033 0.100 ? 0.000 {?} {?} 22.863 0.667 0.957 ? 0.000 {?} 7960.71533 34.17680 0 {?} 0
43 {?} 1.272 0.017 0.017 ++ 0.000 {?} {?} 1.812 0.028 0.028 ++ 0.000 {?} {?} 22.850 0.314 0.314 ++ 0.000 {?} 132.78850 3.34734 0 {?} 0
44 {?} 1.385 0.022 0.028 ++ 0.000 {?} {?} 4.171 0.033 0.049 ? 0.000 {?} {?} 19.699 0.198 0.198 EE 0.000 {?} 495.02350 4.69345 0 {?} 0
45 {?} 1.272 0.018 0.018 ++ 0.000 {?} {?} 5.054 0.052 0.035 ++ 0.000 {?} {?} 22.843 0.076 0.076 EE 0.000 {?} 64.43120 2.41468 0 {?} 0
46 {?} 3.211 0.024 0.024 ++ 0.000 {?} {?} 5.650 0.049 0.032 ++ 0.000 {?} {?} 43.353 0.080 0.080 EE 0.000 {?} 74.21350 2.64343 0 {?} 0
47 {?} 3.328 0.016 0.040 ? 0.000 {?} {?} 4.407 0.060 0.053 ++ 0.000 {?} {?} 43.900 0.118 0.118 EE 0.000 {?} 118.78400 4.41427 0 {?} 0
48 {?} 3.331 nan 0.035 ? 0.000 {?} {?} 4.159 nan 0.060 ++ 0.000 {?} {?} 43.900 0.131 0.131 EE 0.000 {?} 129.08640 4.83552 0 {?} 0
49 {?} 1.362 0.026 0.026 ++ 0.000 {?} {?} 4.288 0.050 0.050 ++ 0.000 {?} {?} 28.039 0.081 0.081 EE 0.000 {?} 59.41830 3.48327 0 {?} 0
50 {?} 1.362 0.028 0.028 ++ 0.000 {?} {?} 4.412 0.049 0.040 ++ 0.000 {?} {?} 28.039 0.101 0.101 EE 0.000 {?} 64.27710 3.94916 0 {?} 0
51 {?} 1.759 0.049 0.049 ? 0.000 {?} {?} 4.156 0.052 0.052 ++ 0.000 {?} {?} 28.039 0.058 0.058 EE 0.000 {?} 120.83360 2.68750 0 {?} 0
52 {?} 1.266 0.033 0.040 ++ 0.000 {?} {?} 5.642 0.046 0.056 ++ 0.000 {?} {?} 22.794 0.190 0.190 EE 0.000 {?} 44.50460 2.35538 0 {?} 0
53 {?} 1.764 0.035 0.035 ++ 0.000 {?} {?} 4.287 0.056 0.043 ++ 0.000 {?} {?} 27.996 0.102 0.102 EE 0.000 {?} 79.67750 1.36143 0 {?} 0
54 {?} 1.769 0.046 0.046 ++ 0.000 {?} {?} 4.411 0.047 0.047 ++ 0.000 {?} {?} 27.996 0.103 0.103 EE 0.000 {?} 64.70140 1.41635 0 {?} 0
55 {?} 3.326 0.057 0.063 ? 0.000 {?} {?} 4.273 0.075 0.074 ++ 0.000 {?} {?} 43.890 0.143 0.143 EE 0.000 {?} 261.97360 1.53965 0 {?} 0
56 {?} 3.274 0.035 0.035 ? 0.000 {?} {?} 4.271 0.056 0.051 ++ 0.000 {?} {?} 43.890 0.127 0.127 EE 0.000 {?} 149.83270 1.29508 0 {?} 0
57 {?} 3.254 0.052 0.054 ? 0.000 {?} {?} 4.409 0.054 0.060 ++ 0.000 {?} {?} 43.890 0.168 0.168 EE 0.000 {?} 538.41052 1.79630 0 {?} 0
58 {?} 3.267 0.054 0.054 ? 0.000 {?} {?} 4.166 0.070 0.091 ++ 0.000 {?} {?} 43.890 0.208 0.208 EE 0.000 {?} 1057.35181 2.31959 0 {?} 0
59 {?} 1.677 0.018 0.052 ? 0.000 {?} {?} 4.069 0.062 0.062 ? 0.000 {?} {?} 27.212 0.228 0.228 EE 0.000 {?} 2369.63501 13.47127 0 {?} 0
60 {?} 1.769 0.039 0.039 ++ 0.000 {?} {?} 4.227 0.073 0.082 ? 0.000 {?} {?} 31.047 0.097 0.097 EE 0.000 {?} 254.06110 5.44548 0 {?} 0
61 {?} 1.856 0.026 0.026 ++ 0.000 {?} {?} 4.237 0.047 0.056 ? 0.000 {?} {?} 31.047 0.069 0.069 EE 0.000 {?} 154.71449 5.73483 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-aliphatic . . 9469.69733 Hz . . . 4.677 . . 36186 3
2 . . H 1 H . . 7122.5066 Hz . . . 4.677 . . 36186 3
3 . . C 13 C . . 8361.2041 Hz . . . 29.133 . . 36186 3
stop_
save_