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 30254
_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 4
_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 .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
Assignment w1 w2
C1H1'-H6 5.673 7.559
C1H1'-G2H8 5.673 7.917
C1H2"-H1' 2.317 5.667
C1H2"-H6 2.315 7.559
C1H2"-G2H8 2.316 7.914
C1H2'-H1' 1.792 5.668
C1H2'-H5 1.794 5.852
C1H2'-H6 1.794 7.559
C1H2'-G2H8 1.794 7.916
C1H4'-H1' 4.009 5.668
C1H5-H6 5.856 7.559
C1H6-G2H8 7.561 7.916
G2H1'-H8 5.485 7.915
G2H1'-A3H8 5.485 8.240
G2H2"-H1' 2.774 5.489
G2H2"-H8 2.773 7.916
G2H2"-A3H8 2.774 8.240
G2H2'-H1' 2.683 5.491
G2H2'-H8 2.683 7.915
G2H2'-A3H8 2.682 8.240
G2H4'-H1' 4.307 5.488
G2H8-A3H8 7.915 8.240
A3H1'-H8 6.298 8.240
A3H1'-T4H6 6.298 7.147
A3H2"-H1' 2.963 6.298
A3H2"-H8 2.962 8.240
A3H2"-T4H6 2.963 7.147
A3H2'-H1' 2.675 6.298
A3H2'-H8 2.666 8.240
A3H2'-T4H6 2.675 7.147
A3H4'-H1' 4.507 6.298
T4H1'-H6 5.940 7.147
T4H1'-T5H6 5.938 7.417
T4H2"-H1' 2.593 5.937
T4H2"-H6 2.593 7.147
T4H2"-T5H6 2.593 7.421
T4H2'-H1' 2.024 5.937
T4H2'-H6 2.024 7.147
T4H2'-T5H6 2.025 7.420
T4H4'-H1' 4.218 5.937
T4H5#-A3H1' 1.332 6.298
T4H5#-A3H2" 1.332 2.971
T4H5#-A3H2' 1.332 2.674
T4H5#-A3H8 1.332 8.240
T4H5#-H6 1.332 7.147
T4H6-A3H8 7.148 8.240
T4H6-T5H6 7.147 7.420
T5H1'-H6 6.158 7.416
T5H2"-H1' 2.648 6.167
T5H2"-H6 2.651 7.421
T5H2'-H1' 2.226 6.168
T5H2'-H6 2.221 7.423
T5H4'-H1' 4.245 6.168
T5H5#-T4H1' 1.511 5.937
T5H5#-T4H2" 1.511 2.599
T5H5#-T4H2' 1.511 2.024
T5H5#-T4H6 1.511 7.147
T5H5#-H6 1.511 7.420
T6H1'-H6 6.168 7.441
T6H4'-H1' 4.239 6.167
T6H5#-T5H2" 1.587 2.650
T6H5#-T5H2' 1.584 2.212
T6H5#-H6 1.597 7.439
T7H1'-H6 6.129 7.434
T7H1'-T8H6 6.130 7.418
T7H2"-H1' 2.653 6.126
T7H2'-H1' 2.197 6.126
T7H4'-H1' 4.232 6.126
T7H5#-T6H1' 1.573 6.168
T7H5#-T6H1' 1.587 6.168
T7H5#-T6H2" 1.570 2.637
T7H5#-T6H2' 1.572 2.223
T7H5#-H6 1.580 7.439
T8H1'-H6 6.060 7.420
T8H1'-T9H6 6.060 7.228
T8H2"-H1' 2.586 6.059
T8H2"-T9H6 2.586 7.227
T8H2'-H1' 2.110 6.059
T8H2'-H6 2.118 7.417
T8H2'-T9H6 2.110 7.227
T8H4'-H1' 4.191 6.059
T8H5#-T7H1' 1.605 6.126
T8H5#-T7H2" 1.599 2.659
T8H5#-T7H2' 1.598 2.201
T8H5#-H6 1.574 7.420
T9H1'-H6 5.739 7.227
T9H1'-G10H8 5.736 7.839
T9H2"-H1' 2.357 5.730
T9H2"-H6 2.356 7.227
T9H2"-G10H8 2.356 7.839
T9H2'-H1' 1.959 5.733
T9H2'-H6 1.959 7.227
T9H2'-G10H8 1.960 7.839
T9H4'-H1' 4.073 5.733
T9H5#-T8H1' 1.640 6.059
T9H5#-T8H2" 1.640 2.591
T9H5#-T8H2' 1.640 2.110
T9H5#-T8H6 1.637 7.419
T9H5#-H6 1.640 7.227
T9H6-T8H6 7.226 7.421
T9H6-G10H8 7.228 7.839
G10H1'-H8 5.565 7.839
G10H1'-G11H8 5.566 7.726
G10H2'-H1' 2.676 5.562
G10H2'-H8 2.669 7.839
G10H2'-G11H8 2.670 7.727
G10H4'-H1' 4.337 5.562
G11H1'-H8 5.937 7.726
G11H1'-C12H6 5.934 7.417
G11H2"-H1' 2.683 5.934
G11H2"-H8 2.684 7.726
G11H2"-C12H5 2.684 5.416
G11H2"-C12H6 2.684 7.413
G11H2'-H1' 2.507 5.934
G11H2'-H8 2.507 7.726
G11H2'-C12H5 2.507 5.416
G11H2'-C12H6 2.507 7.414
G11H4'-H1' 4.349 5.934
G11H8-G10H8 7.727 7.839
C12H1'-H6 6.143 7.414
C12H2'-H1' 2.140 6.144
C12H2'-H5 2.128 5.415
C12H4'-H1' 3.989 6.144
C12H5-G11H8 5.408 7.726
C12H5-H6 5.408 7.414
C12H6-G11H8 7.414 7.726
G13H1'-H8 5.969 7.951
G13H1'-C14H6 5.969 7.446
G13H2"-H1' 2.744 5.966
G13H2"-H8 2.745 7.950
G13H2"-C14H5 2.744 5.374
G13H2"-C14H6 2.744 7.446
G13H2'-H1' 2.615 5.966
G13H2'-H8 2.613 7.951
G13H2'-C14H5 2.614 5.374
G13H2'-C14H6 2.611 7.445
G13H4'-H1' 4.222 5.966
C14H1'-H6 6.016 7.446
C14H1'-C15H6 6.017 7.404
C14H2"-H1' 2.431 6.015
C14H2"-H6 2.430 7.446
C14H2"-C15H5 2.432 5.609
C14H2"-C15H6 2.432 7.407
C14H2'-H1' 2.082 6.016
C14H2'-H5 2.080 5.374
C14H2'-H6 2.081 7.446
C14H2'-C15H5 2.080 5.609
C14H2'-C15H6 2.082 7.407
C14H4'-H1' 4.208 6.015
C14H5-G13H8 5.362 7.951
C14H5-H6 5.362 7.447
C14H6-G13H8 7.449 7.951
C15H1'-H6 5.226 7.405
C15H1'-A16H8 5.226 8.150
C15H2"-H1' 2.179 5.249
C15H2"-H6 2.183 7.405
C15H2"-A16H8 2.179 8.150
C15H2'-H1' 1.893 5.243
C15H2'-H5 1.892 5.610
C15H2'-H6 1.895 7.405
C15H2'-A16H8 1.892 8.150
C15H4'-H1' 4.006 5.249
C15H5-C14H6 5.613 7.446
C15H5-H6 5.613 7.404
C15H6-A16H8 7.404 8.151
A16H1'-H8 5.679 8.150
A16H1'-A17H8 5.679 8.022
A16H2"-H1' 2.743 5.672
A16H2"-H8 2.742 8.150
A16H2"-A17H8 2.742 8.021
A16H2'-H1' 2.659 5.673
A16H2'-H8 2.658 8.150
A16H2'-A17H8 2.660 8.023
A17H1'-H8 5.663 8.023
A17H1'-A18H8 5.658 7.934
A17H2-A16H2 6.953 7.179
A17H2"-H1' 2.712 5.654
A17H2"-H8 2.715 8.022
A17H2'-H1' 2.514 5.654
A17H2'-H8 2.513 8.023
A17H2'-A18H8 2.515 7.935
A17H4'-H1' 4.363 5.655
A17H8-A16H8 8.022 8.150
A18H1'-H8 5.718 7.934
A18H1'-A19H8 5.718 7.878
A18H2"-H1' 2.772 5.708
A18H2"-A19H8 2.771 7.879
A18H2'-H1' 2.454 5.708
A18H2'-H8 2.460 7.935
A18H4'-H1' 4.372 5.709
A19H1'-H8 5.799 7.878
A19H1'-A20H8 5.799 7.860
A19H2"-H1' 2.849 5.793
A19H2"-H8 2.848 7.877
A19H2"-A20H8 2.850 7.859
A19H2'-H1' 2.431 5.793
A19H2'-H8 2.435 7.878
A19H2'-A20H8 2.436 7.861
A19H4'-H1' 4.384 5.793
A20H1'-H8 5.873 7.859
A20H1'-A21H8 5.873 7.936
A20H2-A21H2 6.965 7.606
A20H2"-H1' 2.881 5.868
A20H2"-H8 2.871 7.858
A20H2"-A21H8 2.876 7.936
A20H2'-H1' 2.464 5.868
A20H2'-H8 2.463 7.861
A20H4'-H1' 4.423 5.868
A21H1'-H8 6.051 7.936
A21H1'-T22H6 6.051 7.025
A21H2-A3H2 7.607 7.835
A21H2"-H1' 2.862 6.050
A21H2"-H8 2.864 7.935
A21H2"-T22H6 2.861 7.025
A21H2'-H1' 2.415 6.050
A21H2'-H8 2.424 7.936
A21H2'-T22H6 2.417 7.023
A21H4'-H1' 4.450 6.051
T22H1'-H6 5.885 7.025
T22H1'-C23H6 5.886 7.409
T22H2"-H1' 2.407 5.881
T22H2"-H6 2.402 7.025
T22H2"-C23H5 2.409 5.569
T22H2"-C23H6 2.405 7.407
T22H2'-H1' 1.915 5.881
T22H2'-H6 1.915 7.025
T22H2'-C23H5 1.916 5.569
T22H4'-H1' 4.181 5.882
T22H5#-A21H1' 1.157 6.050
T22H5#-A21H2" 1.157 2.869
T22H5#-A21H2' 1.158 2.415
T22H5#-A21H8 1.157 7.936
T22H5#-H6 1.157 7.025
T22H5#-C23H5 1.157 5.569
T22H6-A21H8 7.025 7.936
T22H6-C23H6 7.026 7.409
C23H1'-H6 5.710 7.409
C23H1'-G24H8 5.710 7.915
C23H2"-H1' 2.349 5.706
C23H2"-H5 2.350 5.569
C23H2"-H6 2.348 7.410
C23H2"-G24H8 2.347 7.917
C23H2'-H1' 1.966 5.706
C23H2'-H5 1.963 5.569
C23H2'-H6 1.965 7.410
C23H2'-G24H8 1.966 7.916
C23H4'-H1' 4.100 5.705
C23H5-T22H6 5.572 7.025
C23H5-H6 5.571 7.410
C23H6-G24H8 7.411 7.917
G24H1'-H8 6.142 7.916
G24H2"-H1' 2.588 6.143
G24H2"-H8 2.589 7.916
G24H2'-H1' 2.337 6.142
;
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 . . 22 ppm . . . 4.76 . . 30254 1
2 . . H 1 H . . 22 ppm . . . 4.76 . . 30254 1
stop_
save_