Content for NMR-STAR saveframe, "spectral_peak_list_1"
save_spectral_peak_list_1
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_1
_Spectral_peak_list.Entry_ID 34282
_Spectral_peak_list.ID 1
_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.Experiment_ID 6
_Spectral_peak_list.Experiment_name '3D 1H-15N 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
;
# Number of dimensions 3
#FORMAT xeasy3D
#INAME 1 H
#INAME 2 HC
#INAME 3 C
#SPECTRUM C13NOESY H HC C
1 2.792 7.488 139.359 4 U 1.118E+04 0.000E+00 e 0 0 0 0
2 3.090 8.184 138.060 3 U 9.370E+03 0.000E+00 e 0 1446 2007 2008 #QU 0.470 #SUP 0.47
3 8.293 8.169 138.040 4 U 1.269E+05 0.000E+00 e 0 0 0 0
4 7.157 8.171 138.070 3 U 1.199E+04 0.000E+00 e 0 2026 2007 2008 #QU 0.958 #SUP 0.96
5 4.741 8.171 138.029 4 U 5.981E+04 0.000E+00 e 0 0 0 0
6 3.931 8.171 138.080 4 U 8.518E+03 0.000E+00 e 0 0 0 0
7 2.195 8.170 138.045 3 U 2.448E+04 0.000E+00 e 0 1452 2007 2008 #QU 0.533 #SUP 0.53
8 3.904 8.153 138.111 4 U 9.035E+03 0.000E+00 e 0 0 0 0 #QU 0.013
9 3.883 8.157 137.882 4 U 7.630E+03 0.000E+00 e 0 0 0 0 #QU 0.010
10 4.772 8.116 137.566 4 U 4.407E+04 0.000E+00 e 0 0 0 0
11 4.923 8.106 137.601 3 U 1.123E+04 0.000E+00 e 0 1410 2005 2006 #QU 0.835 #SUP 0.84
12 4.115 8.108 137.474 4 U 2.531E+04 0.000E+00 e 0 0 0 0
13 2.663 8.106 137.535 4 U 2.005E+04 0.000E+00 e 0 0 0 0
14 7.123 8.428 136.839 3 U 2.010E+04 0.000E+00 e 0 2022 2009 2010 #QU 0.996 #SUP 1.00
15 4.488 8.431 136.822 4 U 3.124E+04 0.000E+00 e 0 0 0 0
16 7.296 8.423 136.745 4 U 9.157E+03 0.000E+00 e 0 0 0 0
17 3.150 8.427 136.715 3 U 1.274E+04 0.000E+00 e 0 1635 2009 2010 #QU 0.696 #SUP 0.70
18 5.579 7.211 134.034 3 U 2.754E+04 0.000E+00 e 0 1445 2013 2014 #QU 0.849 #SUP 0.85
19 8.400 7.215 133.932 3 U 1.881E+04 0.000E+00 e 0 149 2013 2014 #QU 0.949 #SUP 0.95
20 5.051 7.210 133.907 3 U 1.187E+04 0.000E+00 e 0 1979 2013 2014 #QU 0.902 #SUP 0.90
21 6.851 7.213 133.805 3 U 4.277E+05 0.000E+00 e 0 2042 2013 2014 #QU 0.998 #SUP 1.00
22 5.584 7.215 133.861 3 U 3.577E+04 0.000E+00 e 0 1445 2013 2014 #QU 0.947 #SUP 0.95
23 4.711 7.207 133.790 3 U 3.790E+04 0.000E+00 e 0 1462 2013 2014 #QU 0.949 #SUP 0.95
24 4.161 7.211 133.856 4 U 6.917E+03 0.000E+00 e 0 0 0 0
25 3.218 7.212 133.825 3 U 1.523E+05 0.000E+00 e 0 1447 2013 2014 #QU 0.860 #SUP 0.86
26 3.016 7.212 133.830 4 U 2.116E+05 0.000E+00 e 0 0 0 0
27 9.489 7.216 133.769 3 U 2.938E+04 0.000E+00 e 0 194 2013 2014 #QU 0.976 #SUP 0.98
28 8.648 7.216 133.708 3 U 6.186E+04 0.000E+00 e 0 189 2013 2014 #QU 0.608 #SUP 0.61
29 0.914 7.214 133.744 3 U 1.027E+05 0.000E+00 e 0 1485 2013 2014 #QU 0.974 #SUP 0.97
30 8.402 7.211 133.734 3 U 3.282E+04 0.000E+00 e 0 149 2013 2014 #QU 0.997 #SUP 1.00
31 2.758 7.211 133.698 3 U 3.468E+04 0.000E+00 e 0 1481 2013 2014 #QU 0.961 #SUP 0.96
32 1.229 7.207 133.664 3 U 7.544E+03 0.000E+00 e 0 1463 2013 2014 #QU 0.973 #SUP 0.97
33 5.824 7.214 133.627 3 U 6.620E+04 0.000E+00 e 0 1464 2013 2014 #QU 0.931 #SUP 0.93
34 1.895 7.208 133.637 3 U 6.395E+04 0.000E+00 e 0 1486 2013 2014 #QU 0.957 #SUP 0.96
35 4.705 7.214 133.540 3 U 3.669E+04 0.000E+00 e 0 1462 2013 2014 #QU 0.879 #SUP 0.88
36 3.232 7.290 131.914 4 U 7.158E+03 0.000E+00 e 0 0 0 0
37 4.877 7.282 131.920 3 U 1.455E+04 0.000E+00 e 0 1966 2030 2031 #QU 0.803 #SUP 0.80
38 1.935 7.282 131.930 4 U 1.362E+04 0.000E+00 e 0 0 0 0
39 8.161 7.277 131.971 4 U 1.208E+04 0.000E+00 e 0 0 0 0
40 4.248 7.277 131.818 3 U 1.365E+04 0.000E+00 e 0 1611 2030 2031 #QU 0.624 #SUP 0.62
41 0.904 7.278 131.690 4 U 4.183E+04 0.000E+00 e 0 0 0 0
42 8.281 7.280 131.629 3 U 2.692E+04 0.000E+00 e 0 370 2030 2031 #QU 0.524 #SUP 0.52
43 1.561 7.276 131.604 4 U 3.483E+04 0.000E+00 e 0 0 0 0
44 8.242 7.128 131.593 3 U 4.389E+04 0.000E+00 e 0 431 2028 2029 #QU 0.897 #SUP 0.90
45 4.226 7.131 131.575 3 U 2.094E+04 0.000E+00 e 0 1473 2028 2029 #QU 0.202 #SUP 0.20
46 3.920 7.127 131.629 3 U 1.824E+04 0.000E+00 e 0 1437 2028 2029 #QU 0.744 #SUP 0.74
47 2.792 7.127 131.675 3 U 9.481E+04 0.000E+00 e 0 1438 2028 2029 #QU 0.945 #SUP 0.95
48 2.685 7.128 131.644 3 U 9.062E+04 0.000E+00 e 0 1440 2028 2029 #QU 0.954 #SUP 0.95
49 1.946 7.125 131.609 3 U 2.083E+04 0.000E+00 e 0 1718 2028 2029 #QU 0.994 #SUP 0.99
50 0.907 7.129 131.573 3 U 6.630E+04 0.000E+00 e 0 1485 2028 2029 #QU 0.928 #SUP 0.93
51 7.272 7.127 131.507 3 U 1.767E+06 0.000E+00 e 0 2036 2028 2029 #QU 0.901 #SUP 0.90
52 3.037 7.123 131.537 3 U 4.457E+04 0.000E+00 e 0 1477 2028 2029 #QU 0.669 #SUP 0.67
53 1.566 7.124 131.517 3 U 3.474E+04 0.000E+00 e 0 1475 2028 2029 #QU 0.954 #SUP 0.95
54 4.571 7.123 131.507 3 U 3.382E+04 0.000E+00 e 0 1439 2028 2029 #QU 0.986 #SUP 0.99
55 4.213 7.132 131.441 3 U 1.955E+04 0.000E+00 e 0 1473 2028 2029 #QU 0.500 #SUP 0.50
56 4.193 7.278 129.815 3 U 1.438E+04 0.000E+00 e 0 1473 2036 2037 #QU 0.428 #SUP 0.43
57 1.945 7.289 129.632 3 U 2.146E+04 0.000E+00 e 0 1718 2036 2037 #QU 0.984 #SUP 0.98
58 1.561 7.293 129.596 3 U 1.175E+04 0.000E+00 e 0 1475 2036 2037 #QU 0.970 #SUP 0.97
59 3.013 6.959 129.099 3 U 3.513E+04 0.000E+00 e 0 1535 2020 2021 #QU 0.806 #SUP 0.81
60 2.186 6.958 129.106 3 U 2.173E+04 0.000E+00 e 0 1724 2020 2021 #QU 0.740 #SUP 0.74
61 8.405 6.961 129.091 3 U 2.958E+04 0.000E+00 e 0 20 2020 2021 #QU 0.792 #SUP 0.79
62 3.753 6.961 129.046 3 U 9.375E+04 0.000E+00 e 0 1493 2020 2021 #QU 0.914 #SUP 0.91
63 3.455 6.963 129.020 3 U 6.333E+04 0.000E+00 e 0 1984 2020 2021 #QU 0.876 #SUP 0.88
64 2.746 6.966 128.928 3 U 1.263E+04 0.000E+00 e 0 1983 2020 2021 #QU 0.938 #SUP 0.94
65 4.266 7.114 121.132 4 U 1.257E+04 0.000E+00 e 0 0 0 0
66 4.147 7.112 121.132 4 U 2.015E+04 0.000E+00 e 0 0 0 0 #QU 0.162
67 1.598 7.114 121.132 4 U 1.321E+04 0.000E+00 e 0 0 0 0
68 4.145 7.122 121.040 3 U 2.500E+04 0.000E+00 e 0 1973 2022 2023 #QU 0.247 #SUP 0.25
69 2.657 7.123 120.959 3 U 1.193E+04 0.000E+00 e 0 1974 2022 2023 #QU 0.863 #SUP 0.86
70 8.381 7.113 121.045 4 U 1.232E+04 0.000E+00 e 0 0 0 0
71 4.721 7.121 120.923 4 U 2.520E+04 0.000E+00 e 0 0 0 0
72 4.470 7.119 121.004 3 U 5.964E+03 0.000E+00 e 0 1523 2022 2023 #QU 0.831 #SUP 0.83
73 3.163 7.123 120.974 3 U 1.201E+05 0.000E+00 e 0 1633 2022 2023 #QU 0.403 #SUP 0.40
74 7.275 7.150 119.848 4 U 1.702E+05 0.000E+00 e 0 0 0 0
75 4.725 7.145 119.924 3 U 4.177E+04 0.000E+00 e 0 1448 2026 2027 #QU 0.840 #SUP 0.84
76 4.068 7.149 119.858 4 U 1.960E+04 0.000E+00 e 0 0 0 0
77 3.195 7.147 119.878 3 U 8.995E+04 0.000E+00 e 0 1447 2026 2027 #QU 0.713 #SUP 0.71
78 2.206 7.143 119.835 3 U 1.480E+04 0.000E+00 e 0 1452 2026 2027 #QU 0.985 #SUP 0.99
79 3.350 7.148 119.817 4 U 1.353E+04 0.000E+00 e 0 0 0 0
80 0.909 7.147 119.669 3 U 7.710E+03 0.000E+00 e 0 1485 2026 2027 #QU 0.847 #SUP 0.85
81 8.586 7.157 119.073 4 U 6.626E+03 0.000E+00 e 0 0 0 0
82 8.341 7.148 119.027 3 U 1.643E+04 0.000E+00 e 0 425 2024 2025 #QU 0.718 #SUP 0.72
83 3.333 7.146 119.088 3 U 2.336E+04 0.000E+00 e 0 1407 2024 2025 #QU 0.787 #SUP 0.79
84 3.185 7.150 119.078 3 U 5.786E+04 0.000E+00 e 0 1409 2024 2025 #QU 0.878 #SUP 0.88
85 4.933 7.157 118.875 3 U 1.036E+04 0.000E+00 e 0 1410 2024 2025 #QU 0.823 #SUP 0.82
86 4.060 7.151 118.961 3 U 2.304E+04 0.000E+00 e 0 1403 2024 2025 #QU 0.686 #SUP 0.69
87 3.333 7.151 118.895 3 U 2.110E+04 0.000E+00 e 0 1407 2024 2025 #QU 0.765 #SUP 0.76
88 3.657 6.858 118.696 3 U 1.124E+04 0.000E+00 e 0 1981 2042 2041 #QU 0.877 #SUP 0.88
89 8.608 6.849 118.663 4 U 3.543E+04 0.000E+00 e 0 0 0 0
90 2.158 6.854 118.742 3 U 4.812E+04 0.000E+00 e 0 2198 2042 2041 #QU 0.871 #SUP 0.87
91 8.409 6.848 118.538 3 U 1.218E+04 0.000E+00 e 0 149 2042 2041 #QU 0.997 #SUP 1.00
92 3.912 6.848 118.520 3 U 1.392E+04 0.000E+00 e 0 1390 2042 2041 #QU 0.999 #SUP 1.00
93 1.993 6.848 118.584 3 U 9.244E+04 0.000E+00 e 0 2197 2042 2041 #QU 0.891 #SUP 0.89
94 8.574 6.841 118.589 3 U 2.028E+04 0.000E+00 e 0 441 2042 2041 #QU 0.926 #SUP 0.93
95 5.068 6.852 118.462 3 U 5.760E+04 0.000E+00 e 0 1979 2042 2041 #QU 0.972 #SUP 0.97
96 4.722 6.851 118.492 3 U 2.530E+04 0.000E+00 e 0 1448 2042 2041 #QU 0.995 #SUP 1.00
97 3.208 6.849 118.500 3 U 1.533E+05 0.000E+00 e 0 1447 2042 2041 #QU 0.979 #SUP 0.98
98 7.196 6.848 118.513 3 U 3.997E+05 0.000E+00 e 0 2013 2042 2041 #QU 0.845 #SUP 0.84
99 3.068 6.849 118.538 3 U 1.077E+05 0.000E+00 e 0 1391 2042 2041 #VC 0.49953 #QU 0.944 #SUP 0.99
1446 2042 2041 #VC 0.50047 #QU 0.910 #SUP 0.99
100 1.865 6.846 118.477 3 U 1.054E+05 0.000E+00 e 0 2196 2042 2041 #QU 0.865 #SUP 0.86
101 7.859 6.845 118.360 3 U 2.754E+04 0.000E+00 e 0 291 2042 2041 #QU 0.880 #SUP 0.88
102 0.917 6.849 118.344 3 U 2.544E+04 0.000E+00 e 0 1485 2042 2041 #QU 0.943 #SUP 0.94
103 8.384 6.839 118.416 3 U 1.412E+04 0.000E+00 e 0 149 2042 2041 #QU 0.620 #SUP 0.62
104 2.159 6.846 118.309 3 U 4.947E+04 0.000E+00 e 0 2198 2042 2041 #QU 0.909 #SUP 0.91
;
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 . . 11.0721 ppm . . . 4.703 . . 34282 1
2 . . N 15 N . . 30.0513 ppm . . . 116.800 . . 34282 1
3 . . H 1 HN . . 20.0042 ppm . . . 4.703 . . 34282 1
stop_
save_