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 30999
_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.Chem_shift_reference_ID 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_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 1
_Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1
_Spectral_peak_list.Details 'modified for non-standard amino acids and cyclic peptide analysis'
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
# Number of dimensions 2
# Number of peaks 133
#FORMAT xeasy2D
#INAME 1 H1
#INAME 2 H2
#SPECTRUM NOESY H1 H2
1 3.014 8.571 1 U 4.54e+06 0 e 0 0 0 0
2 4.311 7.032 1 U 5.96e+06 0 e 0 0 0 0
3 4.335 8.572 1 U 2.31e+07 0 e 0 0 0 0
4 4.539 7.037 1 U 1.36e+07 0 e 0 0 0 0
5 0.864 4.536 1 U 6.25e+06 0 e 0 0 0 0
6 0.812 4.538 1 U 1.01e+06 0 e 0 0 0 0
7 1.360 4.535 1 U 1.79e+07 0 e 0 0 0 0
8 1.576 4.541 1 U 4.21e+06 0 e 0 0 0 0
9 2.860 4.536 1 U 1.26e+06 0 e 0 0 0 0
10 3.014 4.536 1 U 2.57e+06 0 e 0 0 0 0
11 7.034 4.546 1 U 5.62e+06 0 e 0 0 0 0
12 7.039 4.312 1 U 8.54e+06 0 e 0 0 0 0
13 8.573 4.536 1 U 3.56e+07 0 e 0 0 0 0
14 8.574 4.341 1 U 1.29e+07 0 e 0 0 0 0
15 7.039 8.570 1 U 2.45e+06 0 e 0 0 0 0
16 5.352 8.570 1 U 4.83e+05 0 e 0 0 0 0
17 4.537 8.570 1 U 3.07e+07 0 e 0 0 0 0
18 3.477 8.577 1 U 9.57e+05 0 e 0 0 0 0
19 1.994 8.570 1 U 9.81e+06 0 e 0 0 0 0
20 1.358 8.570 1 U 4.17e+06 0 e 0 0 0 0
21 0.894 8.570 1 U 8.74e+06 0 e 0 0 0 0
22 0.863 8.570 1 U 3.02e+06 0 e 0 0 0 0
23 5.344 7.033 1 U 9.97e+05 0 e 0 0 0 0
24 3.477 7.032 1 U 1.28e+06 0 e 0 0 0 0
25 3.014 7.032 1 U 1.83e+07 0 e 0 0 0 0
26 2.027 7.045 1 U 6.8e+05 0 e 0 0 0 0
27 1.738 7.032 1 U 1.86e+06 0 e 0 0 0 0
28 1.681 7.045 1 U 1.36e+06 0 e 0 0 0 0
29 1.574 7.044 1 U 2.06e+06 0 e 0 0 0 0
30 1.354 7.046 1 U 5.59e+06 0 e 0 0 0 0
31 0.873 7.032 1 U 7.1e+05 0 e 0 0 0 0
32 0.840 7.032 1 U 7.44e+05 0 e 0 0 0 0
33 1.993 4.336 1 U 9.28e+06 0 e 0 0 0 0
34 1.993 0.860 1 U 1.41e+07 0 e 0 0 0 0
35 1.992 0.898 1 U 1.54e+07 0 e 0 0 0 0
36 3.013 0.856 1 U 1.81e+07 0 e 0 0 0 0
37 3.013 0.892 1 U 1.05e+07 0 e 0 0 0 0
38 3.476 0.886 1 U 1.51e+06 0 e 0 0 0 0
39 4.335 0.893 1 U 1.3e+07 0 e 0 0 0 0
40 4.335 0.856 1 U 1.2e+07 0 e 0 0 0 0
41 4.537 0.863 1 U 5.79e+06 0 e 0 0 0 0
42 5.345 0.884 1 U 9.9e+06 0 e 0 0 0 0
43 8.573 0.895 1 U 1.02e+07 0 e 0 0 0 0
44 8.574 0.860 1 U 3.6e+06 0 e 0 0 0 0
45 7.040 0.861 1 U 1.13e+06 0 e 0 0 0 0
46 7.039 0.840 1 U 1.01e+06 0 e 0 0 0 0
47 1.363 0.840 1 U 3.72e+06 0 e 0 0 0 0
48 1.364 0.861 1 U 4.25e+06 0 e 0 0 0 0
49 0.885 5.346 1 U 1.01e+07 0 e 0 0 0 0
50 0.860 5.347 1 U 1.73e+06 0 e 0 0 0 0
51 4.307 1.734 1 U 1.61e+06 0 e 0 0 0 0
52 4.316 2.016 1 U 3.5e+06 0 e 0 0 0 0
53 7.039 1.577 1 U 3.02e+06 0 e 0 0 0 0
54 7.039 1.680 1 U 2.04e+06 0 e 0 0 0 0
55 7.040 1.737 1 U 2.22e+06 0 e 0 0 0 0
56 7.039 1.356 1 U 6.63e+06 0 e 0 0 0 0
57 7.040 2.027 1 U 7.79e+05 0 e 0 0 0 0
58 4.307 1.691 1 U 8.33e+05 0 e 0 0 0 0
59 3.477 1.687 1 U 3.55e+06 0 e 0 0 0 0
60 3.022 1.678 1 U 9.53e+06 0 e 0 0 0 0
61 3.478 2.018 1 U 2.49e+06 0 e 0 0 0 0
62 3.013 2.000 1 U 4.46e+06 0 e 0 0 0 0
63 3.475 1.733 1 U 4.3e+06 0 e 0 0 0 0
64 3.020 1.737 1 U 4.37e+06 0 e 0 0 0 0
65 2.014 1.680 1 U 3.64e+06 0 e 0 0 0 0
66 2.014 1.739 1 U 1.88e+07 0 e 0 0 0 0
67 1.727 2.023 1 U 1.97e+07 0 e 0 0 0 0
68 1.699 2.020 1 U 8.75e+06 0 e 0 0 0 0
69 0.898 1.990 1 U 1.64e+07 0 e 0 0 0 0
70 0.858 1.993 1 U 1.55e+07 0 e 0 0 0 0
71 4.536 1.355 1 U 1.22e+07 0 e 0 0 0 0
72 5.344 1.522 1 U 2.13e+07 0 e 0 0 0 0
73 8.573 1.357 1 U 4.72e+06 0 e 0 0 0 0
74 8.573 1.994 1 U 1.19e+07 0 e 0 0 0 0
75 3.013 1.523 1 U 2.31e+07 0 e 0 0 0 0
76 3.013 1.362 1 U 6.52e+06 0 e 0 0 0 0
77 3.477 1.521 1 U 1.57e+06 0 e 0 0 0 0
78 4.334 1.354 1 U 1.07e+06 0 e 0 0 0 0
79 4.323 1.525 1 U 8.02e+05 0 e 0 0 0 0
80 5.351 1.385 1 U -1.57e+06 0 e 0 0 0 0
81 5.348 4.314 1 U 1.11e+06 0 e 0 0 0 0
82 3.013 4.336 1 U 8.45e+07 0 e 0 0 0 0
83 3.470 4.317 1 U 1.26e+06 0 e 0 0 0 0
84 1.359 4.335 1 U 1.28e+06 0 e 0 0 0 0
85 0.856 4.336 1 U 1.55e+07 0 e 0 0 0 0
86 0.894 4.336 1 U 1.3e+07 0 e 0 0 0 0
87 3.016 5.347 1 U 1.35e+07 0 e 0 0 0 0
88 3.478 5.347 1 U 3.04e+07 0 e 0 0 0 0
89 1.707 5.347 1 U 1.11e+06 0 e 0 0 0 0
90 1.745 5.350 1 U 1.19e+06 0 e 0 0 0 0
91 1.689 4.311 1 U 3.52e+06 0 e 0 0 0 0
92 1.741 4.309 1 U 8.94e+06 0 e 0 0 0 0
93 1.736 4.536 1 U 6.64e+05 0 e 0 0 0 0
94 1.997 4.534 1 U 5.73e+05 0 e 0 0 0 0
95 1.523 4.320 1 U 9.73e+05 0 e 0 0 0 0
96 1.578 4.310 1 U 7.11e+05 0 e 0 0 0 0
97 0.855 3.012 1 U 2.24e+07 0 e 0 0 0 0
98 0.894 3.012 1 U 1.01e+07 0 e 0 0 0 0
99 1.361 3.012 1 U 7.49e+06 0 e 0 0 0 0
100 1.523 3.012 1 U 3.2e+07 0 e 0 0 0 0
101 1.677 3.017 1 U 6.84e+06 0 e 0 0 0 0
102 1.747 3.022 1 U 6.27e+06 0 e 0 0 0 0
103 1.994 3.012 1 U 4.88e+06 0 e 0 0 0 0
104 2.022 3.473 1 U 1.97e+06 0 e 0 0 0 0
105 1.706 3.480 1 U 6.95e+06 0 e 0 0 0 0
106 1.524 3.485 1 U 1.33e+06 0 e 0 0 0 0
107 3.023 3.479 1 U 8.96e+07 0 e 0 0 0 0
108 3.478 3.021 1 U 8.37e+07 0 e 0 0 0 0
109 4.335 3.012 1 U 9.01e+07 0 e 0 0 0 0
110 4.538 3.012 1 U 2.74e+06 0 e 0 0 0 0
111 4.344 3.475 1 U 8.97e+05 0 e 0 0 0 0
112 5.346 3.013 1 U 1.41e+07 0 e 0 0 0 0
113 5.345 3.480 1 U 2.83e+07 0 e 0 0 0 0
114 7.040 3.012 1 U 2.47e+07 0 e 0 0 0 0
115 8.574 3.012 1 U 6.04e+06 0 e 0 0 0 0
116 4.321 5.347 1 U 9.22e+05 0 e 0 0 0 0
117 8.573 7.046 1 U 2.14e+06 0 e 0 0 0 0
118 7.040 5.346 1 U 1.17e+06 0 e 0 0 0 0
119 8.573 5.348 1 U 5.87e+05 0 e 0 0 0 0
120 2.031 4.307 1 U 1.14e+07 0 e 0 0 0 0
121 1.574 8.580 1 U 5.04e+05 0 e 0 0 0 0
122 1.745 8.568 1 U 3.38e+05 0 e 0 0 0 0
123 8.568 3.490 1 U 9.05e+05 0 e 0 0 0 0
124 8.565 1.736 1 U 4.1e+05 0 e 0 0 0 0
125 8.574 1.579 1 U 4.03e+05 0 e 0 0 0 0
126 8.574 1.685 1 U 4.45e+05 0 e 0 0 0 0
127 2.671 0.248 1 U -2.55e+04 0 e 0 0 0 0
128 3.031 1.362 1 U 4.5e+05 0 e 0 0 0 0
129 3.475 4.540 1 U 4.66e+05 0 e 0 0 0 0
130 1.524 0.894 1 U 7.84e+06 0 e 0 0 0 0
131 0.897 1.519 1 U 8.26e+06 0 e 0 0 0 0
132 0.900 1.383 1 U 1.88e+07 0 e 0 0 0 0
133 1.389 0.903 1 U 1.45e+07 0 e 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 . . 7211.5 Hz . . . 4.97 . 2 30999 1
2 . . H 1 H . . 6596 Hz . . . 4.97 . 1 30999 1
stop_
save_