######################### # 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 34353 _Spectral_peak_list.ID 1 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 2 _Spectral_peak_list.Sample_label $sample_2 _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 . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 ATOM1 ATOM2 NOTE T1H1'-H6 6.135 7.752 1 T H1' 1 T H6 T1H1'-C2H5 6.138 5.736 1 T H1' 2 C H5 T1H1'-C2H6 6.139 7.677 1 T H1' 2 C H6 T1H1'-A14H2 6.132 8.084 1 T H1' 14 A H2 T1H2"-H1' 2.663 6.135 1 T H2" 1 T H1' T1H2"-H6 2.665 7.754 1 T H2" 1 T H6 T1H2'-H1' 2.360 6.135 1 T H2' 1 T H1' T1H2'-H6 2.361 7.752 1 T H2' 1 T H6 T1H2'-C2H5 2.359 5.736 1 T H2' 2 C H5 T1H2'-C2H6 2.368 7.678 1 T H2' 2 C H6 T1H3'-H1' 4.787 6.134 1 T H3' 1 T H1' T1H3'-H6 4.789 7.752 1 T H3' 1 T H6 T1H4'-H1' 4.170 6.135 1 T H4' 1 T H1' T1H4'-H6 4.171 7.752 1 T H4' 1 T H6 T1H6-H1' 7.752 6.137 1 T H6 1 T H1' T1C7-H1' 1.862 6.136 1 T C7 1 T H1' T1C7-H6 1.862 7.752 1 T C7 1 T H6 T1C7-C2H5 1.861 5.734 1 T C7 2 C H5 T1Q5'-H1' 3.799 6.135 1 T Q5' 1 T H1' T1Q5'-H6 3.800 7.752 1 T Q5' 1 T H6 C2H1'-H6 6.193 7.680 2 C H1' 2 C H6 C2H1'-C3H5 6.190 5.491 2 C H1' 3 C H5 C2H1'-C3H6 6.193 7.560 2 C H1' 3 C H6 C2H1'-A14H2 6.197 8.086 2 C H1' 14 A H2 C2H2"-H1' 2.664 6.192 2 C H2" 2 C H1' C2H2"-H5 2.669 5.735 2 C H2" 2 C H5 C2H2"-H6 2.665 7.677 2 C H2" 2 C H6 C2H2"-C3H5 2.663 5.491 2 C H2" 3 C H5 C2H2'-H1' 2.314 6.195 2 C H2' 2 C H1' C2H2'-H5 2.315 5.737 2 C H2' 2 C H5 C2H2'-H6 2.317 7.678 2 C H2' 2 C H6 C2H2'-C3H5 2.310 5.490 2 C H2' 3 C H5 C2H4'-H1' 4.271 6.194 2 C H4' 2 C H1' C2H4'-H6 4.271 7.677 2 C H4' 2 C H6 C2H5-H6 5.740 7.675 2 C H5 2 C H6 C2H5-C3H5 5.736 5.493 2 C H5 3 C H5 C2H6-T1H1' 7.677 6.139 2 C H6 1 T H1' C2H6-H1' 7.680 6.193 2 C H6 2 C H1' C2H6-H5 7.675 5.740 2 C H6 2 C H5 C2H6-C3H5 7.676 5.491 2 C H6 3 C H5 C3H1'-H6 6.050 7.560 3 C H1' 3 C H6 C3H1'-T4H6 6.047 7.353 3 C H1' 4 T H6 C3H2"-H1' 2.692 6.050 3 C H2" 3 C H1' C3H2"-H6 2.695 7.561 3 C H2" 3 C H6 C3H2"-T4H6 2.701 7.353 3 C H2" 4 T H6 C3H2'-H1' 2.251 6.047 3 C H2' 3 C H1' C3H2'-H5 2.239 5.490 3 C H2' 3 C H5 C3H2'-H6 2.240 7.562 3 C H2' 3 C H6 C3H2'-T4H6 2.239 7.354 3 C H2' 4 T H6 C3H4'-H1' 4.258 6.048 3 C H4' 3 C H1' C3H4'-H6 4.257 7.563 3 C H4' 3 C H6 C3H5-C2H6 5.490 7.677 3 C H5 2 C H6 C3H5-H6 5.494 7.559 3 C H5 3 C H6 C3H6-C2H1' 7.560 6.194 3 C H6 2 C H1' C3H6-H1' 7.560 6.050 3 C H6 3 C H1' C3H6-H5 7.559 5.497 3 C H6 3 C H5 T4H1'-H6 5.845 7.352 4 T H1' 4 T H6 T4H1'-C5H6 5.846 7.601 4 T H1' 5 C H6 T4H2"-H1' 2.489 5.846 4 T H2" 4 T H1' T4H2"-H6 2.493 7.351 4 T H2" 4 T H6 T4H2'-H1' 2.053 5.844 4 T H2' 4 T H1' T4H2'-H6 2.058 7.352 4 T H2' 4 T H6 T4H2'-C5H5 2.055 5.771 4 T H2' 5 C H5 T4H2'-C5H6 2.054 7.601 4 T H2' 5 C H6 T4H4'-H1' 4.017 5.843 4 T H4' 4 T H1' T4H6-C3H1' 7.354 6.048 4 T H6 3 C H1' T4H6-H1' 7.352 5.845 4 T H6 4 T H1' T4H6-C5H5 7.353 5.772 4 T H6 5 C H5 T4C7-C3H1' 1.722 6.045 4 T C7 3 C H1' T4C7-C3H5 1.722 5.492 4 T C7 3 C H5 T4C7-C3H6 1.722 7.562 4 T C7 3 C H6 T4C7-H6 1.723 7.354 4 T C7 4 T H6 T4C7-C5H5 1.722 5.770 4 T C7 5 C H5 C5H1'-H6 6.349 7.605 5 C H1' 5 C H6 C5H2"-H1' 2.821 6.347 5 C H2" 5 C H1' C5H2"-H6 2.824 7.606 5 C H2" 5 C H6 C5H2'-H1' 2.599 6.344 5 C H2' 5 C H1' C5H4'-H1' 4.202 6.345 5 C H4' 5 C H1' C5H5-T4H6 5.772 7.353 5 C H5 4 T H6 C5H5-H6 5.773 7.600 5 C H5 5 C H6 C5H6-T4H1' 7.599 5.845 5 C H6 4 T H1' C5H6-H1' 7.605 6.349 5 C H6 5 C H1' C5H6-H5 7.600 5.773 5 C H6 5 C H5 C6H1'-H6 6.027 7.748 6 C H1' 6 C H6 C6H1'-T7H6 6.033 7.597 6 C H1' 7 T H6 C6H2"-H1' 2.483 6.029 6 C H2" 6 C H1' C6H2"-H6 2.484 7.747 6 C H2" 6 C H6 C6H2'-H1' 2.208 6.028 6 C H2' 6 C H1' C6H2'-H5 2.206 5.814 6 C H2' 6 C H5 C6H2'-H6 2.204 7.747 6 C H2' 6 C H6 C6H3'-H1' 4.711 6.028 6 C H3' 6 C H1' C6H3'-H6 4.710 7.748 6 C H3' 6 C H6 C6H4'-H1' 4.322 6.027 6 C H4' 6 C H1' C6H4'-H6 4.327 7.749 6 C H4' 6 C H6 C6H5-H6 5.819 7.748 6 C H5 6 C H6 C6H6-H1' 7.747 6.030 6 C H6 6 C H1' C6H6-H5 7.748 5.819 6 C H6 6 C H5 C6Q5'-H1' 4.243 6.030 6 C Q5' 6 C H1' C6Q5'-H6 4.243 7.745 6 C Q5' 6 C H6 T7H1'-H6 6.320 7.593 7 T H1' 7 T H6 T7H2"-H1' 2.540 6.315 7 T H2" 7 T H1' T7H2"-H6 2.540 7.590 7 T H2" 7 T H6 T7H2'-H1' 2.346 6.314 7 T H2' 7 T H1' T7H2'-H6 2.347 7.592 7 T H2' 7 T H6 T7H3'-H1' 4.864 6.313 7 T H3' 7 T H1' T7H3'-H6 4.885 7.589 7 T H3' 7 T H6 T7H4'-H1' 4.223 6.313 7 T H4' 7 T H1' T7H4'-H6 4.228 7.592 7 T H4' 7 T H6 T7H6-C6H1' 7.597 6.033 7 T H6 6 C H1' T7H6-H1' 7.592 6.323 7 T H6 7 T H1' T7C7-C6H1' 1.632 6.030 7 T C7 6 C H1' T7C7-C6H5 1.632 5.815 7 T C7 6 C H5 T7C7-C6H6 1.632 7.749 7 T C7 6 C H6 T7C7-H1' 1.629 6.313 7 T C7 7 T H1' T7C7-H6 1.632 7.590 7 T C7 7 T H6 T7Q5'-H1' 3.936 6.316 7 T Q5' 7 T H1' T7Q5'-H6 3.943 7.593 7 T Q5' 7 T H6 A8H1'-H8 5.952 8.007 8 A H1' 8 A H8 A8H1'-G9H8 5.953 7.642 8 A H1' 9 G H8 A8H2"-H1' 2.971 5.950 8 A H2" 8 A H1' A8H2"-H8 2.960 8.008 8 A H2" 8 A H8 A8H2"-G9H8 2.973 7.644 8 A H2" 9 G H8 A8H2'-H1' 2.762 5.955 8 A H2' 8 A H1' A8H2'-H8 2.775 8.006 8 A H2' 8 A H8 A8H2'-G9H8 2.774 7.643 8 A H2' 9 G H8 A8H4'-H1' 4.244 5.951 8 A H4' 8 A H1' A8H4'-H8 4.246 8.009 8 A H4' 8 A H8 A8H8-H1' 8.007 5.955 8 A H8 8 A H1' A8H8-G9H8 8.008 7.641 8 A H8 9 G H8 G9H1'-H8 5.758 7.643 9 G H1' 9 G H8 G9H2"-H8 2.761 7.645 9 G H2" 9 G H8 G9H2'-H1' 2.685 5.758 9 G H2' 9 G H1' G9H2'-H8 2.682 7.645 9 G H2' 9 G H8 G9H2''-H1' 2.773 5.758 9 G H2'' 9 G H1' G9H4'-H1' 4.368 5.762 9 G H4' 9 G H1' G9H8-A8H1' 7.642 5.953 9 G H8 8 A H1' G9H8-A8H8 7.641 8.008 9 G H8 8 A H8 G9H8-H1' 7.639 5.736 9 G H8 9 G H1' G10H1'-H8 5.963 7.326 10 G H1' 10 G H8 G10H1'-A11H8 5.962 6.763 10 G H1' 11 A H8 G10H2"-H8 2.724 7.326 10 G H2" 10 G H8 G10H2"-A11H8 2.730 6.763 10 G H2" 11 A H8 G10H2'-H1' 2.480 5.965 10 G H2' 10 G H1' G10H2'-H8 2.483 7.325 10 G H2' 10 G H8 G10H2'-A11H8 2.479 6.763 10 G H2' 11 A H8 G10H2''-H1' 2.726 5.967 10 G H2'' 10 G H1' G10H8-H1' 7.326 5.964 10 G H8 10 G H1' G10H8-A11H8 7.326 6.764 10 G H8 11 A H8 A11H1'-H8 5.653 6.764 11 A H1' 11 A H8 A11H1'-G12H8 5.656 7.185 11 A H1' 12 G H8 A11H2"-H1' 2.471 5.664 11 A H2" 11 A H1' A11H2"-H8 2.470 6.766 11 A H2" 11 A H8 A11H2"-G12H8 2.480 7.185 11 A H2" 12 G H8 A11H2'-H1' 2.129 5.656 11 A H2' 11 A H1' A11H2'-H8 2.131 6.765 11 A H2' 11 A H8 A11H2'-G12H8 2.129 7.184 11 A H2' 12 G H8 A11H8-G10H1' 6.763 5.962 11 A H8 10 G H1' A11H8-G10H8 6.765 7.327 11 A H8 10 G H8 A11H8-H1' 6.764 5.653 11 A H8 11 A H1' G12H1'-H8 5.880 7.185 12 G H1' 12 G H8 G12H1'-G13H8 5.882 7.288 12 G H1' 13 G H8 G12H2"-H1' 2.802 5.882 12 G H2" 12 G H1' G12H2"-H8 2.798 7.180 12 G H2" 12 G H8 G12H2"-G13H8 2.800 7.290 12 G H2" 13 G H8 G12H2'-H1' 2.496 5.879 12 G H2' 12 G H1' G12H2'-H8 2.495 7.184 12 G H2' 12 G H8 G12H2'-G13H8 2.494 7.290 12 G H2' 13 G H8 G12H4'-H1' 4.403 5.884 12 G H4' 12 G H1' G12H8-A11H1' 7.185 5.658 12 G H8 11 A H1' G12H8-H1' 7.186 5.881 12 G H8 12 G H1' G13H1'-H8 5.838 7.286 13 G H1' 13 G H8 G13H1'-A14H8 5.834 7.933 13 G H1' 14 A H8 G13H2"-H1' 2.870 5.831 13 G H2" 13 G H1' G13H2"-H8 2.872 7.289 13 G H2" 13 G H8 G13H2"-A14H8 2.872 7.933 13 G H2" 14 A H8 G13H2'-H1' 2.572 5.829 13 G H2' 13 G H1' G13H2'-H8 2.568 7.289 13 G H2' 13 G H8 G13H2'-A14H8 2.568 7.935 13 G H2' 14 A H8 G13H4'-H1' 4.348 5.831 13 G H4' 13 G H1' G13H8-G12H1' 7.288 5.882 13 G H8 12 G H1' G13H8-H1' 7.286 5.838 13 G H8 13 G H1' G13H8-A14H8 7.286 7.933 13 G H8 14 A H8 A14H1'-H8 6.214 7.933 14 A H1' 14 A H8 A14H2"-H1' 2.573 6.215 14 A H2" 14 A H1' A14H2"-H8 2.582 7.935 14 A H2" 14 A H8 A14H2'-H1' 2.394 6.214 14 A H2' 14 A H1' A14H2'-H8 2.394 7.933 14 A H2' 14 A H8 A14H8-G13H1' 7.933 5.836 14 A H8 13 G H1' A14H8-G13H8 7.932 7.287 14 A H8 13 G H8 A14H8-H1' 7.932 6.216 14 A H8 14 A H1' T15C7-G13H8 1.915 7.288 15 T C7 13 G H8 T15C7-A14H8 1.920 7.935 15 T C7 14 A H8 T15H1'-H6 5.515 7.209 15 T H1' 15 T H6 T15H2"-H1' 1.945 5.512 15 T H2" 15 T H1' T15H2"-H6 1.954 7.209 15 T H2" 15 T H6 T15H2'-H1' 1.558 5.512 15 T H2' 15 T H1' T15H2'-H6 1.558 7.209 15 T H2' 15 T H6 T15H2'-G16H8 1.557 7.950 15 T H2' 16 G H8 T15H3'-H1' 4.631 5.515 15 T H3' 15 T H1' T15H3'-H6 4.628 7.209 15 T H3' 15 T H6 T15H4'-H1' 3.871 5.512 15 T H4' 15 T H1' T15H4'-H6 3.870 7.209 15 T H4' 15 T H6 T15H5'-H1' 3.810 5.512 15 T H5' 15 T H1' T15H5'-H6 3.814 7.210 15 T H5' 15 T H6 T15H5''-H1' 3.660 5.513 15 T H5'' 15 T H1' T15H5''-H6 3.663 7.210 15 T H5'' 15 T H6 T15H6-H1' 7.210 5.517 15 T H6 15 T H1' T15H6-G16H8 7.208 7.950 15 T H6 16 G H8 T15C7-H6 1.922 7.209 15 T C7 15 T H6 G16H8-T15H6 7.949 7.209 16 G H8 15 T H6 G17H1'-H8 5.685 7.960 17 G H1' 17 G H8 G17H1'-T18H6 5.682 7.038 17 G H1' 18 T H6 G17H2"-H1' 2.262 5.680 17 G H2" 17 G H1' G17H2"-H8 2.860 7.954 17 G H2" 17 G H8 G17H2'-H1' 2.871 5.683 17 G H2' 17 G H1' G17H2'-H8 2.267 7.960 17 G H2' 17 G H8 G17H2'-T18H6 2.264 7.039 17 G H2' 18 T H6 G17H8-H1' 7.960 5.687 17 G H8 17 G H1' T18H1'-H6 6.071 7.038 18 T H1' 18 T H6 T18H2"-H1' 1.660 6.069 18 T H2" 18 T H1' T18H2"-H6 1.662 7.038 18 T H2" 18 T H6 T18H2'-H1' 1.083 6.069 18 T H2' 18 T H1' T18H2'-H6 1.083 7.038 18 T H2' 18 T H6 T18H4'-H1' 4.073 6.069 18 T H4' 18 T H1' T18H4'-H6 4.064 7.036 18 T H4' 18 T H6 T18H6-G17H1' 7.038 5.685 18 T H6 17 G H1' T18H6-H1' 7.038 6.074 18 T H6 18 T H1' T18C7-G10H8 1.964 7.326 18 T C7 10 G H8 T18C7-G17H8 1.956 7.954 18 T C7 17 G H8 T18C7-H1' 1.958 6.071 18 T C7 18 T H1' T18C7-H6 1.964 7.039 18 T C7 18 T H6 T18C7-G17H1' 1.962 5.681 18 T C7 17 G H1' G19H1'-H8 5.616 7.583 19 G H1' 19 G H8 G19H2"-H1' 2.585 5.616 19 G H2" 19 G H1' G19H2'-H1' 2.642 5.617 19 G H2' 19 G H1' G19H4'-H1' 4.298 5.615 19 G H4' 19 G H1' G19H8-H1' 7.583 5.618 19 G H8 19 G H1' G21H1'-H8 6.159 7.909 21 G H1' 21 G H8 G21H1'-T22H6 6.154 7.608 21 G H1' 22 T H6 G21H3'-H8 4.721 7.910 21 G H3' 21 G H8 G21H4'-H1' 4.459 6.157 21 G H4' 21 G H1' G21H4'-H8 4.455 7.910 21 G H4' 21 G H8 G21H8-H1' 7.909 6.159 21 G H8 21 G H1' G21H8-T22H6 7.911 7.616 21 G H8 22 T H6 G21Q2'-H1' 2.773 6.157 21 G Q2' 21 G H1' G21Q2'-H8 2.775 7.910 21 G Q2' 21 G H8 G21Q2'-T22H6 2.779 7.610 21 G Q2' 22 T H6 T22H1'-H6 6.427 7.611 22 T H1' 22 T H6 T22H2"-H1' 2.207 6.427 22 T H2" 22 T H1' T22H2"-H6 2.293 7.608 22 T H2" 22 T H6 T22H2'-H1' 2.287 6.430 22 T H2' 22 T H1' T22H2'-H6 2.203 7.608 22 T H2' 22 T H6 T22H3'-H1' 4.622 6.429 22 T H3' 22 T H1' T22H3'-H6 4.621 7.610 22 T H3' 22 T H6 T22H4'-H1' 4.286 6.427 22 T H4' 22 T H1' T22H4'-H6 4.283 7.610 22 T H4' 22 T H6 T22H6-G21H1' 7.609 6.157 22 T H6 21 G H1' T22H6-G21H8 7.613 7.911 22 T H6 21 G H8 T22H6-H1' 7.610 6.427 22 T H6 22 T H1' T22C7-G21H1' 1.280 6.156 22 T C7 21 G H1' T22C7-G21H8 1.278 7.909 22 T C7 21 G H8 T22C7-H1' 1.276 6.426 22 T C7 22 T H1' T22C7-H6 1.280 7.610 22 T C7 22 T H6 C2H1'-G13H1 6.200 13.058 2 C H1' 13 G H1 C2H41-G13H1 8.947 13.058 2 C H41 13 G H1 C2H42-H41 7.361 8.937 2 C H42 2 C H41 C2H42-C3H41 7.350 9.093 2 C H42 3 C H41 C2H42-G13H1 7.357 13.057 2 C H42 13 G H1 C2H5-H41 5.741 8.940 2 C H5 2 C H41 C2H5-H42 5.738 7.350 2 C H5 2 C H42 C3H41-C2H41 7.011 8.941 3 C H41 2 C H41 C3H41-T4H3 9.098 14.159 3 C H41 4 T H3 C3H41-G12H1 9.106 13.173 3 C H41 12 G H1 C3H42-H41 7.016 9.100 3 C H42 3 C H41 C3H42-T4H3 7.004 14.160 3 C H42 4 T H3 C3H42-G12H1 7.010 13.174 3 C H42 12 G H1 C3H5-H41 5.499 9.097 3 C H5 3 C H41 C3H5-H42 5.506 7.007 3 C H5 3 C H42 C3H5-G12H1 5.503 13.173 3 C H5 12 G H1 T4C7-H3 1.738 14.160 4 T C7 4 T H3 C5H41-G10H1 8.671 13.021 5 C H41 10 G H1 C5H42-H41 7.266 8.664 5 C H42 5 C H41 C5H42-G10H1 7.253 13.018 5 C H42 10 G H1 C5H5-H41 5.743 8.658 5 C H5 5 C H41 C5H5-H42 5.743 7.254 5 C H5 5 C H42 C5H5-G19H22 5.784 10.323 5 C H5 19 G H22 C6H1'-G21H22 6.031 11.009 6 C H1' 21 G H22 C6H41-G9H1 8.558 12.830 6 C H41 9 G H1 C6H42-H41 7.032 8.558 6 C H42 6 C H41 C6H42-G9H1 7.017 12.831 6 C H42 9 G H1 C6H5-G21H22 5.816 11.016 6 C H5 21 G H22 A8H2"-G21H1 2.977 12.463 8 A H2" 21 G H1 A8H2'-G21H1 2.777 12.463 8 A H2' 21 G H1 A8H61-G21H22 6.729 11.015 8 A H61 21 G H22 A8H62-G21H22 7.620 11.015 8 A H62 21 G H22 A8H8-T22H3 8.026 12.462 8 A H8 22 T H3 G9H8-G21H1 7.654 12.462 9 G H8 21 G H1 G10H2"-T18H3 2.729 13.082 10 G H2" 18 T H3 G10H21-H1 8.534 13.015 10 G H21 10 G H1 G10H22-H1 7.089 13.014 10 G H22 10 G H1 G10H22-H21 7.075 8.518 10 G H22 10 G H21 G10H8-T18H3 7.345 13.081 10 G H8 18 T H3 G10H8-G19H1 7.342 13.703 10 G H8 19 G H1 A11H1'-G19H22 5.657 10.325 11 A H1' 19 G H22 A11H2-T4H3 7.197 14.159 11 A H2 4 T H3 A11H2-G19H22 7.194 10.321 11 A H2 19 G H22 A11H2"-G19H1 2.492 13.703 11 A H2" 19 G H1 A11H2'-G17H1 2.140 12.731 11 A H2' 17 G H1 A11H2''-G17H1 2.485 12.732 11 A H2'' 17 G H1 A11H61-G19H22 6.701 10.324 11 A H61 19 G H22 A11H62-T4H3 7.657 14.161 11 A H62 4 T H3 A11H62-T18H3 7.010 13.080 11 A H62 18 T H3 A11H62-G19H22 7.653 10.323 11 A H62 19 G H22 A11H8-T18H3 6.771 13.082 11 A H8 18 T H3 G12H1-T4H3 13.180 14.160 12 G H1 4 T H3 G12H2'-G16H1 2.517 12.863 12 G H2' 16 G H1 G12H8-G17H1 7.198 12.733 12 G H8 17 G H1 G13H1'-G12H1 5.852 13.173 13 G H1' 12 G H1 G13H2"-T15H3 2.583 12.427 13 G H2" 15 T H3 G13H2"-T15H3 2.886 12.429 13 G H2" 15 T H3 G13H8-T15H3 7.297 12.429 13 G H8 15 T H3 G13H8-G16H1 7.298 12.862 13 G H8 16 G H1 A14H2-T1H3 8.098 13.057 14 A H2 1 T H3 A14H61-H62 7.495 7.773 14 A H61 14 A H62 A14H61-T15H3 7.493 12.429 14 A H61 15 T H3 A14H61-G16H1 7.494 12.865 14 A H61 16 G H1 A14H62-T15H3 7.781 12.426 14 A H62 15 T H3 A14H62-G16H1 7.793 12.857 14 A H62 16 G H1 A14H8-T15H3 7.943 12.426 14 A H8 15 T H3 T15C7-H3 1.934 12.427 15 T C7 15 T H3 G16H1-T15H3 12.872 12.423 16 G H1 15 T H3 G17H1'-T18H3 5.674 13.084 17 G H1' 18 T H3 T18H3-G19H1 13.089 13.701 18 T H3 19 G H1 G19H1-G10H8 13.715 7.337 19 G H1 10 G H8 G19H1-A11H8 13.714 6.760 19 G H1 11 A H8 G19H22-T4H3 10.333 14.157 19 G H22 4 T H3 C5H1'-TINAH1 6.343 7.450 5 C H1' 20 X H1 C5H1'-TINAH2 6.349 6.851 5 C H1' 20 X H2 C5H1'-TINAH3 6.345 7.483 5 C H1' 20 X H3 C5H2"-TINAH1 2.820 7.449 5 C H2'' 20 X H1 C5H2"-TINAH2 2.820 6.850 5 C H2'' 20 X H2 C5H2"-TINAH3 2.819 7.479 5 C H2'' 20 X H3 C5H2'-TINAH2 2.597 6.850 5 C H2' 20 X H2 C5H5-TINAH1 5.774 7.448 5 C H5 20 X H1 C6H1'-TINAH1 6.029 7.443 6 C H1' 20 X H1 C6H1'-TINAH2 6.027 6.847 6 C H1' 20 X H2 C6H1'-TINAH3 6.029 7.480 6 C H1' 20 X H3 C6H5-TINAH1 5.816 7.449 6 C H5 20 X H1 C6H5-TINAH2 5.814 6.848 6 C H5 20 X H2 G19H1'-TINAH7 5.617 6.701 19 G H1' 20 X H7 G19H1'-TINAH8 5.621 6.757 19 G H1' 20 X H8 G19H2'-TINAH7 2.641 6.700 19 G H2' 20 X H7 G19H2''-TINAH7 2.586 6.701 19 G H2'' 20 X H7 G21H1'-TINAH7 6.157 6.700 21 G H1' 20 X H7 G21H1'-TINAH8 6.157 6.756 21 G H1' 20 X H8 TINAH1-C5H1' 7.447 6.349 20 X H1 5 C H1' TINAH1-C5H5 7.448 5.774 20 X H1 5 C H5 TINAH1-C6H5 7.449 5.816 20 X H1 6 C H5 TINAH11-C5H5 6.666 5.765 20 X H11 5 C H5 TINAH12-G9H8 6.683 7.642 20 X H12 9 G H8 TINAH12-G10H8 6.682 7.323 20 X H12 10 G H8 TINAH2-C5H1' 6.851 6.351 20 X H2 5 C H1' TINAH2-C6H1' 6.845 6.030 20 X H2 6 C H1' TINAH2-C6H5 6.848 5.813 20 X H2 6 C H5 TINAH3-C5H1' 7.481 6.347 20 X H3 5 C H1' TINAH3-C6H1' 7.480 6.031 20 X H3 6 C H1' TINAH7-G19H1' 6.701 5.620 20 X H7 19 G H1' TINAH7-G21H1' 6.700 6.159 20 X H7 21 G H1' TINAH8-G19H1' 6.758 5.624 20 X H8 19 G H1' TINAH8-G21H1' 6.755 6.159 20 X H8 21 G H1' TINAH1-H10 7.449 7.713 20 X H1 20 X H10 TINAH1-H2 7.448 6.850 20 X H1 20 X H2 TINAH1-H9 7.449 8.034 20 X H1 20 X H9 TINAH10-H1 7.713 7.449 20 X H10 20 X H1 TINAH10-H2 7.712 6.850 20 X H10 20 X H2 TINAH10-H9 7.716 8.035 20 X H10 20 X H9 TINAH11-H4 6.666 7.608 20 X H11 20 X H4 TINAH11-H5 6.665 7.295 20 X H11 20 X H5 TINAH2-H1 6.850 7.448 20 X H2 20 X H1 TINAH2-H10 6.849 7.713 20 X H2 20 X H10 TINAH2-H3 6.850 7.479 20 X H2 20 X H3 TINAH2-H4 6.849 7.607 20 X H2 20 X H4 TINAH3-H2 7.479 6.850 20 X H3 20 X H2 TINAH3-H4 7.479 7.608 20 X H3 20 X H4 TINAH3-H5 7.480 7.299 20 X H3 20 X H5 TINAH4-H11 7.605 6.666 20 X H4 20 X H11 TINAH4-H2 7.608 6.851 20 X H4 20 X H2 TINAH4-H3 7.608 7.479 20 X H4 20 X H3 TINAH4-H3 7.608 7.479 20 X H4 20 X H3 TINAH4-H5 7.608 7.297 20 X H3 20 X H5 TINAH5-H11 7.294 6.667 20 X H5 20 X H11 TINAH5-H3 7.299 7.480 20 X H5 20 X H3 TINAH5-H4 7.297 7.608 20 X H5 20 X H4 TINAH7-H8 6.695 6.755 20 X H7 20 X H8 TINAH7-H9 6.693 8.035 20 X H7 20 X H9 TINAH8-H7 6.755 6.695 20 X H8 20 X H7 TINAH8-H9 6.758 8.032 20 X H8 20 X H9 TINAH9-H1 8.034 7.449 20 X H9 20 X H1 TINAH9-H10 8.035 7.716 20 X H9 20 X H10 TINAH9-H8 8.032 6.758 20 X H9 20 X H8 ; 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 . . D 2 H-aromatic . folded 6613.764 Hz . . . 5.00 . . 34353 1 2 . . D 2 H-aromatic . folded 6613.757 Hz . . . 5.00 . . 34353 1 stop_ save_