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 51358
_Spectral_peak_list.ID 1
_Spectral_peak_list.Name tsr3nc3_fucglc_nhsqc
_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-15N HSQC'
_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 .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
# Number of dimensions 2
#INAME 1 H1
#INAME 2 N15
1 8.489 117.622 0 U 0.000e+00 0.00e+00 - 0 164 165 0
# H/N L37
2 7.636 110.473 0 U 0.000e+00 0.00e+00 - 0 984 986 0
# HE21/NE2 Q63
3 9.077 120.143 0 U 0.000e+00 0.00e+00 - 0 45 46 0
# H/N C65
4 8.987 117.464 0 U 0.000e+00 0.00e+00 - 0 77 78 0
# H/N N61
5 8.598 104.545 0 U 0.000e+00 0.00e+00 - 0 109 110 0
# H/N G46
6 8.470 123.477 0 U 0.000e+00 0.00e+00 - 0 15 16 0
# H/N S24
7 8.217 121.966 0 U 0.000e+00 0.00e+00 - 0 27 28 0
# H/N W14
8 7.199 113.888 0 U 0.000e+00 0.00e+00 - 0 970 971 0
# HD22/ND2 N61
9 7.982 119.416 0 U 0.000e+00 0.00e+00 - 0 63 64 0
# H/N A42
10 8.482 112.577 0 U 0.000e+00 0.00e+00 - 0 95 96 0
# H/N G4
11 5.446 107.956 0 U 0.000e+00 0.00e+00 - 0 988 989 0
# HE22/NE2 Q58
12 8.700 120.423 0 U 0.000e+00 0.00e+00 - 0 49 50 0
# H/N Q44
13 8.476 117.570 0 U 0.000e+00 0.00e+00 - 0 81 82 0
# H/N R34
14 7.636 113.412 0 U 0.000e+00 0.00e+00 - 0 113 114 0
# H/N C27
15 8.682 125.373 0 U 0.000e+00 0.00e+00 - 0 5 6 0
# H/N N11
16 8.416 121.853 0 U 0.000e+00 0.00e+00 - 0 31 32 0
# H/N E56
17 8.603 118.582 0 U 0.000e+00 0.00e+00 - 0 67 68 0
# H/N D53
18 9.275 111.433 0 U 0.000e+00 0.00e+00 - 0 99 100 0
# H/N G15
19 9.800 128.960 0 U 0.000e+00 0.00e+00 - 0 1016 1017 0
# HE1/NE1 W17
20 6.805 110.968 0 U 0.000e+00 0.00e+00 - 0 992 991 0
# HE22/NE2 Q32
21 8.503 120.233 0 U 0.000e+00 0.00e+00 - 0 53 54 0
# H/N K48
22 7.861 116.732 0 U 0.000e+00 0.00e+00 - 0 85 86 0
# H/N S7
23 7.348 109.592 0 U 0.000e+00 0.00e+00 - 0 117 118 0
# H/N T55
24 7.883 113.888 0 U 0.000e+00 0.00e+00 - 0 969 971 0
# HD21/ND2 N61
25 8.320 127.117 0 U 0.000e+00 0.00e+00 - 0 1 2 0
# H/N L68
26 8.177 124.067 0 U 0.000e+00 0.00e+00 - 0 11 12 0
# H/N W20
27 8.768 121.131 0 U 0.000e+00 0.00e+00 - 0 35 36 0
# H/N Q63
28 6.596 108.309 0 U 0.000e+00 0.00e+00 - 0 978 979 0
# HD21/ND2 N39
29 9.082 120.928 0 U 0.000e+00 0.00e+00 - 0 39 40 0
# H/N F45
30 9.013 117.915 0 U 0.000e+00 0.00e+00 - 0 71 72 0
# H/N G52
31 8.399 109.531 0 U 0.000e+00 0.00e+00 - 0 103 104 0
# H/N G29
32 6.212 107.952 0 U 0.000e+00 0.00e+00 - 0 987 989 0
# HE21/NE2 Q58
33 8.410 122.701 0 U 0.000e+00 0.00e+00 - 0 21 22 0
# H/N N6
34 7.012 114.386 0 U 0.000e+00 0.00e+00 - 0 964 965 0
# HD22/ND2 N11
35 8.633 120.091 0 U 0.000e+00 0.00e+00 - 0 57 58 0
# H/N N40
36 8.578 115.663 0 U 0.000e+00 0.00e+00 - 0 89 90 0
# H/N G30
37 6.875 113.166 0 U 0.000e+00 0.00e+00 - 0 973 974 0
# HD22/ND2 N6
38 8.209 120.391 0 U 0.000e+00 0.00e+00 - 0 226 227 0
# H/N W17
39 8.211 123.598 0 U 0.000e+00 0.00e+00 - 0 17 18 0
# H/N I10
40 6.807 111.734 0 U 0.000e+00 0.00e+00 - 0 982 983 0
# HE22/NE2 Q44
41 8.587 120.720 0 U 0.000e+00 0.00e+00 - 0 43 44 0
# H/N Q32
42 8.499 117.788 0 U 0.000e+00 0.00e+00 - 0 75 76 0
# H/N N57
43 8.971 107.030 0 U 0.000e+00 0.00e+00 - 0 107 108 0
# H/N G12
44 8.082 122.196 0 U 0.000e+00 0.00e+00 - 0 25 26 0
# H/N I59
45 7.884 119.506 0 U 0.000e+00 0.00e+00 - 0 61 62 0
# H/N I5
46 8.581 113.140 0 U 0.000e+00 0.00e+00 - 0 93 94 0
# H/N S35
47 9.140 124.290 0 U 0.000e+00 0.00e+00 - 0 7 8 0
# H/N C38
48 7.918 120.499 0 U 0.000e+00 0.00e+00 - 0 47 48 0
# H/N C60
49 8.703 117.392 0 U 0.000e+00 0.00e+00 - 0 79 80 0
# H/N V31
50 7.511 121.187 0 U 0.000e+00 0.00e+00 - 0 111 112 0
# H/N N39
51 7.738 114.387 0 U 0.000e+00 0.00e+00 - 0 963 965 0
# HD21/ND2 N11
52 9.892 128.889 0 U 0.000e+00 0.00e+00 - 0 1029 1030 0
# HE1/NE1 W20
53 8.314 122.159 0 U 0.000e+00 0.00e+00 - 0 29 30 0
# H/N I67
54 7.535 113.166 0 U 0.000e+00 0.00e+00 - 0 972 974 0
# HD21/ND2 N6
55 8.313 121.362 0 U 0.000e+00 0.00e+00 - 0 37 38 0
# H/N I3
56 8.264 119.305 0 U 0.000e+00 0.00e+00 - 0 65 66 0
# H/N C50
57 8.818 111.844 0 U 0.000e+00 0.00e+00 - 0 97 98 0
# H/N G13
58 7.463 111.738 0 U 0.000e+00 0.00e+00 - 0 981 983 0
# HE21/NE2 Q44
59 9.019 123.727 0 U 0.000e+00 0.00e+00 - 0 13 14 0
# H/N D21
60 7.793 110.968 0 U 0.000e+00 0.00e+00 - 0 990 991 0
# HE21/NE2 Q32
61 8.199 120.362 0 U 0.000e+00 0.00e+00 - 0 51 52 0
# H/N 26
62 7.961 117.184 0 U 0.000e+00 0.00e+00 - 0 83 84 0
# H/N I22
63 7.499 106.495 0 U 0.000e+00 0.00e+00 - 0 115 116 0
# H/N G47
64 6.673 111.749 0 U 0.000e+00 0.00e+00 - 0 967 968 0
# HD22/ND2 N57
65 8.489 121.795 0 U 0.000e+00 0.00e+00 - 0 33 34 0
# H/N D64
66 6.810 110.409 0 U 0.000e+00 0.00e+00 - 0 976 977 0
# HD22/ND2 N40
67 8.509 118.088 0 U 0.000e+00 0.00e+00 - 0 69 70 0
# H/N R36
68 9.432 107.907 0 U 0.000e+00 0.00e+00 - 0 101 102 0
# H/N X26
69 6.526 110.471 0 U 0.000e+00 0.00e+00 - 0 985 986 0
# HE22/NE2 Q63
70 8.220 125.383 0 U 0.000e+00 0.00e+00 - 0 3 4 0
# H/N 2
71 7.877 123.389 0 U 0.000e+00 0.00e+00 - 0 19 20 0
# H/N D8
72 8.842 120.239 0 U 0.000e+00 0.00e+00 - 0 55 56 0
# H/N K33
73 8.477 116.391 0 U 0.000e+00 0.00e+00 - 0 87 88 0
# H/N V54
74 6.972 111.243 0 U 0.000e+00 0.00e+00 - 0 119 120 0
# H/N V25
75 9.497 127.283 0 U 0.000e+00 0.00e+00 - 0 1004 1005 0
# HE1/NE1 W14
76 7.511 108.311 0 U 0.000e+00 0.00e+00 - 0 980 979 0
# HD22/ND2 N39
77 8.194 120.693 0 U 0.000e+00 0.00e+00 - 0 41 42 0
# H/N D49
78 8.768 117.899 0 U 0.000e+00 0.00e+00 - 0 73 74 0
# H/N Q58
79 9.180 108.638 0 U 0.000e+00 0.00e+00 - 0 105 106 0
# H/N G28
80 8.287 122.082 0 U 0.000e+00 0.00e+00 - 0 137 138 0
# H/N E69
81 8.652 124.140 0 U 0.000e+00 0.00e+00 - 0 9 10 0
# H/N C23
82 8.362 122.439 0 U 0.000e+00 0.00e+00 - 0 23 24 0
# H/N V51
83 7.272 111.748 0 U 0.000e+00 0.00e+00 - 0 966 968 0
# HD21/ND2 N57
84 9.370 119.845 0 U 0.000e+00 0.00e+00 - 0 59 60 0
# H/N S18
85 8.302 115.270 0 U 0.000e+00 0.00e+00 - 0 91 92 0
# H/N K62
86 7.065 110.406 0 U 0.000e+00 0.00e+00 - 0 975 977 0
# HD21/ND2 N40
;
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 amide . aliased 6.61525 ppm . . . . . . 51358 1
2 . . N 15 amide . aliased 35 ppm . . . . . . 51358 1
stop_
loop_
_Spectral_peak_software.Software_ID
_Spectral_peak_software.Software_label
_Spectral_peak_software.Method_ID
_Spectral_peak_software.Method_label
_Spectral_peak_software.Entry_ID
_Spectral_peak_software.Spectral_peak_list_ID
2 $software_2 . . 51358 1
stop_
save_