######################### # Spectral peak lists # ######################### 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 34706 _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 3 _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 7.441 84.017 0 U 0.000e+00 0.00e+00 - 0 125 165 0 # HE/NE R1 2 7.674 116.519 0 U 0.000e+00 0.00e+00 - 0 45 161 0 # H/N I12 3 7.660 119.823 0 U 0.000e+00 0.00e+00 - 0 19 149 0 # H/N Y5 4 7.993 122.709 0 U 0.000e+00 0.00e+00 - 0 96 157 0 # H/N A11 5 10.599 130.165 0 U 0.000e+00 0.00e+00 - 0 254 253 0 # HE1/NE1 W16 6 8.597 117.087 0 U 0.000e+00 0.00e+00 - 0 27 152 0 # H/N N10 7 7.901 118.424 0 U 0.000e+00 0.00e+00 - 0 90 160 0 # H/N W16 8 8.023 121.536 0 U 0.000e+00 0.00e+00 - 0 37 155 0 # H/N I7 9 8.395 122.534 0 U 0.000e+00 0.00e+00 - 0 11 145 0 # H/N K22 10 7.618 119.524 0 U 0.000e+00 0.00e+00 - 0 51 159 0 # H/N R15 11 7.946 120.194 0 U 0.000e+00 0.00e+00 - 0 31 151 0 # H/N K6 12 7.992 111.106 0 U 0.000e+00 0.00e+00 - 0 41 158 0 # H/N S14 13 8.269 128.572 0 U 0.000e+00 0.00e+00 - 0 17 148 0 # H/N A19 14 8.044 121.069 0 U 0.000e+00 0.00e+00 - 0 35 154 0 # H/N I4 15 8.882 126.882 0 U 0.000e+00 0.00e+00 - 0 5 144 0 # H/N A2 16 7.672 117.931 0 U 0.000e+00 0.00e+00 - 0 47 167 0 # H/N I17 17 7.483 84.551 0 U 0.000e+00 0.00e+00 - 0 87 164 0 # HE/NE R15 18 6.936 112.340 0 U 0.000e+00 0.00e+00 - 0 143 166 0 # HD22/ND2 N10 19 8.453 119.770 0 U 0.000e+00 0.00e+00 - 0 21 150 0 # H/N V3 20 7.880 121.882 0 U 0.000e+00 0.00e+00 - 0 39 156 0 # H/N I18 21 8.359 121.128 0 U 0.000e+00 0.00e+00 - 0 15 147 0 # H/N K21 22 7.719 112.340 0 U 0.000e+00 0.00e+00 - 0 142 166 0 # HD21/ND2 N10 23 8.351 120.554 0 U 0.000e+00 0.00e+00 - 0 13 146 0 # H/N C23 24 8.316 121.356 0 U 0.000e+00 0.00e+00 - 0 33 153 0 # H/N A13 ; 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 HN . 'not observed' 14 ppm . . . 4.7 . . 34706 1 2 . . N 15 N . folded 33 ppm . . . 117.5 . . 34706 1 stop_ save_