Content for NMR-STAR saveframe, "spectral_peak_list_3"
save_spectral_peak_list_3
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_3
_Spectral_peak_list.Entry_ID 30597
_Spectral_peak_list.ID 3
_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 .
_Spectral_peak_list.Chem_shift_reference_label .
_Spectral_peak_list.Experiment_ID 7
_Spectral_peak_list.Experiment_name '2D 1H-13C HSQC aliphatic'
_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 Volume
P3HA-P3HD2 4.470 3.839 7.57E+05 bx
P3HA-P3HD3 4.469 3.894 5.51E+05 bx
P3HA-P3HB2 4.469 2.426 5.63E+06 bx
P3HD3-P3HB2 3.887 2.424 7.07E+05 bx
P3HD2-P3HB2 3.837 2.428 4.78E+05 bx
P3HA-P3HB3 4.469 2.001 3.17E+06 bx
P3HD3-P3HB3 3.884 2.007 5.04E+05 bx
P3HD2-P3HB3 3.834 2.000 1.21E+06 bx
P3HB2-P3HB3 2.427 2.004 1.20E+07 bx
P3HD3-P3HD2 3.893 3.829 1.23E+07 bx
P19HA-P19HB2 4.508 2.510 8.15E+06 bx
P19HA-P19HD2 4.506 3.679 9.26E+05 bx
P19HA-P19HB3 4.507 2.147 3.40E+06 bx
P19HD2-P19HB2 3.679 2.509 7.67E+05 bx
P19HD2-P19HB3 3.678 2.142 3.70E+06 bx
P29HD3-P29HB3 3.778 1.679 1.22E+06 bx
P29HD3-P29HB2 3.781 2.381 1.09E+06 bx
P29HA-P29HB2 4.371 2.382 6.21E+06 bx
P29HA-P29HD3 4.366 3.776 1.17E+06 bx
P29HB2-P29HB3 2.382 1.676 1.55E+07 bx
Q4QG-Q4HA 2.429 4.211 2.16E+06 bx
Q4QB-Q4HA 2.097 4.207 7.18E+06 bx
Q4HA-Q4QG 4.211 2.428 2.95E+06 bx
Q4HA-Q4QB 4.209 2.102 9.72E+06 bx
Q4QG-Q4QB 2.427 2.095 6.64E+06 bx
Q4QB-Q4QG 2.096 2.428 5.94E+06 bx
Q5HA-Q5QB 4.252 2.216 6.33E+06 bx
Q5HA-Q5QG 4.251 2.492 4.90E+06 bx
Q5QG-Q5HA 2.493 4.249 3.95E+06 bx
Q5QB-Q5HA 2.216 4.249 3.49E+06 bx
Q5QG-Q5QB 2.492 2.216 6.30E+06 bx
Q5QB-Q5QG 2.217 2.490 3.75E+06 bx
A6HA-A6QB 4.042 1.459 7.07E+06 bx
A6QB-A6HA 1.457 4.041 8.25E+06 bx
Y10QE-A6QB 6.545 1.457 3.64E+06 bx
Y10QD-A6QB 7.267 1.458 2.37E+06 bx
K7HA-K7HB3 4.185 1.893 4.06E+06 bx
K7HA-K7HB2 4.185 1.953 2.64E+06 bx
K7HA-K7HD3 4.186 1.706 3.10E+05 bx
K7HA-K7HD2 4.197 1.670 3.29E+05 bx
K7HA-K7HG2 4.185 1.399 1.26E+06 bx
K7HA-K7HG3 4.183 1.519 1.48E+06 bx
K7HG3-K7HA 1.514 4.182 9.84E+05 bx
K7HG2-K7HA 1.397 4.185 7.78E+05 bx
K7HD2-K7HA 1.711 4.194 3.72E+05 bx
K7HB2-K7HE2 1.946 2.998 2.66E+05 bx
K7HB3-K7HE2 1.894 2.988 2.98E+05 bx
K7HG3-K7HE2 1.515 2.999 6.34E+05 bx
K7HG2-K7HE2 1.396 2.999 6.75E+05 bx
K7HD2-K7HE2 1.717 2.994 1.59E+06 bx
K7HD3-K7HE2 1.679 2.985 1.08E+06 bx
K7HE2-K7HG2 2.996 1.401 9.39E+05 bx
K7HE2-K7HG3 2.998 1.517 7.31E+05 bx
K7HE2-K7HD3 2.997 1.720 2.75E+06 bx
K7HE2-K7HB2 3.001 1.967 3.98E+05 bx
K17QG-K17HB2 1.399 1.899 3.00E+06 bx
K17QG-K17HD3 1.407 1.693 1.95E+06 bx
L30HB2-L30HB3 1.499 1.926 1.52E+07 bx
K7HE2-K7HB3 3.004 1.880 3.25E+05 bx
K7HE2-K7HD2 2.984 1.681 1.88E+06 bx
K7HG3-K7QD 1.513 1.701 1.93E+06 bx
K7QD-K7HG3 1.703 1.508 1.35E+06 bx
K17HD3-K17QG 1.693 1.405 2.07E+06 bx
K7HA-K7HE2 4.188 2.994 1.10E+06 bx
K7HB2-K7HB3 1.954 1.885 3.27E+06 bx
K7HB3-K7HB2 1.889 1.959 2.59E+06 bx
K7HB3-K7HD2 1.893 1.669 4.69E+05 bx
K7HB3-K7HD3 1.892 1.706 3.08E+05 bx
K7HB2-K7QD 1.948 1.683 1.72E+06 bx
K7QD-K7HB2 1.683 1.947 1.69E+06 bx
C9HA-C9HB2 4.083 2.829 4.84E+06 bx
C9HA-C9HB3 4.084 3.257 2.54E+06 bx
C9HB3-C9HB2 3.256 2.828 1.42E+07 bx
C9HB2-C9HB3 2.833 3.256 1.33E+07 bx
C9HB3-C9HA 3.255 4.081 1.86E+06 bx
C9HB2-C9HA 2.829 4.083 3.87E+06 bx
C13HA-C13HB2 4.080 3.468 3.36E+06 bx
C13HA-C13HB3 4.080 3.720 3.02E+06 bx
C13HB3-C13HB2 3.719 3.467 1.21E+07 bx
C13HB2-C13HB3 3.468 3.718 1.22E+07 bx
C13HB3-C13HA 3.722 4.079 2.38E+06 bx
C13HB2-C13HA 3.469 4.078 2.85E+06 bx
Y8QD-? 7.169 4.382 5.56E+06 bx
?-Y8HB2 4.383 3.099 4.89E+06 bx
?-Y8HB3 4.380 3.138 4.50E+06 bx
Y8HB3-? 3.144 4.382 3.71E+06 bx
Y8HB2-? 3.099 4.382 2.97E+06 bx
Y8HB2-Y8HB3 3.097 3.151 1.01E+07 bx
Y8HB3-Y8HB2 3.151 3.083 8.22E+06 bx
Y8QD-Y8QE 7.168 6.799 1.98E+07 bx
Y8QE-Y8QD 6.800 7.169 2.13E+07 bx
Y8QE-? 6.800 4.382 6.37E+05 bx
Y8QE-Y8HB3 6.801 3.100 6.93E+05 bx
Y8QE-Y8HB2 6.797 3.152 6.04E+05 bx
Y8QE-E11HB2 6.798 2.070 1.68E+06 bx
Y8QE-Q12HB3 6.797 1.967 8.98E+05 bx
Y10QD-Y10HA 7.267 4.215 6.25E+06 bx
Y8QD-Y8HB3 7.169 3.097 6.49E+06 bx
Y8QD-Y8HB2 7.169 3.147 6.02E+06 bx
Y8QD-Q12HB3 7.170 1.959 5.30E+05 bx
Y8QD-E11HB2 7.169 2.080 8.59E+05 bx
?-Y8QD 4.384 7.170 4.68E+06 bx
Y8HB2-Y8QD 3.147 7.169 4.14E+06 bx
Y8HB3-Y8QD 3.097 7.170 4.16E+06 bx
Y8QD-Q5HA 7.169 4.247 1.24E+06 bx
Y8QD-C9HA 7.167 4.082 9.16E+05 bx
Y10HA-Y10HB3 4.218 2.974 2.25E+06 bx
Y10HA-Y10HB2 4.219 3.127 3.72E+06 bx
Y10HB3-Y10HB2 2.972 3.126 1.48E+07 bx
Y10HB2-Y10HB3 3.121 2.971 1.48E+07 bx
Y10HB2-Y10HA 3.121 4.217 2.95E+06 bx
Y10HB3-Y10HA 2.974 4.219 1.58E+06 bx
Y10QD-Y10HB2 7.267 3.126 6.54E+06 bx
Y10QD-Y10HB3 7.268 2.973 6.87E+06 bx
Y10QD-Y10QE 7.267 6.545 1.86E+07 bx
Y10QE-Y10HB3 6.544 2.973 6.95E+05 bx
Y10QE-Y10HB2 6.543 3.127 6.45E+05 bx
Y10QD-A6HA 7.266 4.050 8.42E+05 bx
Y10QD-C9HB3 7.267 3.197 9.85E+05 bx
Y10QD-C9HB2 7.269 2.820 5.78E+05 bx
Y10QD-C27HB3 7.268 2.251 9.25E+05 bx
Y10QD-C27HB2 7.265 1.789 5.48E+05 bx
Y10QE-C27HB2 6.545 1.786 1.20E+06 bx
Y10QE-Y24HB2 6.545 2.707 6.49E+05 bx
Y10QE-C27HB3 6.545 2.247 1.82E+06 bx
E11HA-E11HG3 4.200 2.278 5.72E+06 bx
E11HA-E11HB2 4.199 2.092 7.52E+06 bx
E11HB2-E11HG3 2.094 2.275 1.55E+07 bx
E11HG3-E11HB2 2.275 2.092 1.55E+07 bx
E11HG2-E11HB2 2.498 2.091 4.44E+06 bx
E11HG2-E11HG3 2.497 2.282 8.88E+06 bx
E11HG3-E11HG2 2.283 2.499 8.53E+06 bx
E11HG3-E11HA 2.275 4.199 4.39E+06 bx
E11HG2-E11HA 2.499 4.200 1.09E+06 bx
E11HB2-E11HA 2.091 4.199 5.99E+06 bx
Q12HB3-Q12HA 1.961 3.964 1.15E+06 bx
Q12HG3-Q12HA 2.106 3.966 4.32E+06 bx
F20QD-F20HB3 7.322 3.043 6.67E+06 bx
F20QD-F20HB2 7.322 3.367 6.14E+06 bx
F20QD-F20HA 7.322 4.192 3.95E+06 bx
F20QD-D21HA 7.322 4.276 1.69E+06 bx
F20QD-Y24HB2 7.319 2.712 9.36E+05 bx
D21HA-F20QD 4.276 7.320 1.87E+06 bx
F20HA-F20QD 4.194 7.322 3.05E+06 bx
F20HB2-F20QD 3.366 7.322 4.07E+06 bx
F20HB3-F20QD 3.044 7.322 4.29E+06 bx
F20HA-F20HB2 4.193 3.367 4.76E+06 bx
F20HA-F20HB3 4.196 3.045 3.46E+06 bx
F20HB2-F20HB3 3.366 3.043 1.62E+07 bx
F20HB3-F20HB2 3.043 3.367 1.57E+07 bx
D21HA-D21HB2 4.276 2.735 1.09E+07 bx
D21HB2-D21HB3 2.728 2.665 1.58E+07 bx
D21HB2-D21HA 2.729 4.274 5.44E+06 bx
D21HB3-D21HA 2.676 4.274 3.69E+06 bx
Q22HA-Q22QB 4.092 2.020 8.99E+06 bx
Q22HA-Q22HG2 4.091 2.360 2.67E+06 bx
Q22HA-Q22HG3 4.092 2.436 2.19E+06 bx
Q22HG3-Q22HA 2.432 4.091 1.57E+06 bx
Q22QB-Q22HA 2.021 4.091 7.13E+06 bx
Q22QB-Q22HG2 2.023 2.359 3.65E+06 bx
P3HB3-P3HB2 2.003 2.428 1.08E+07 bx
Q22HG2-Q22HG3 2.364 2.440 3.72E+06 bx
Q22HG3-Q22HG2 2.432 2.354 2.92E+06 bx
Q22HG2-Q22QB 2.363 2.021 3.39E+06 bx
C23HA-C23HB3 4.049 2.816 3.73E+06 bx
C23HA-C23HB2 4.055 3.195 2.53E+06 bx
C23HB3-C23HB2 2.813 3.194 1.30E+07 bx
C23HB2-C23HB3 3.194 2.813 1.37E+07 bx
C23HB2-C23HA 3.194 4.054 2.07E+06 bx
C23HB3-C23HA 2.818 4.052 4.09E+06 bx
Y24QD-Y24HB2 7.150 2.707 6.56E+06 bx
Y24QD-Y24HB3 7.150 2.907 6.71E+06 bx
Y24HA-Y24HB2 4.060 2.707 4.25E+06 bx
Y24HA-Y24HB3 4.056 2.905 1.91E+06 bx
Y24HB2-Y24HB3 2.710 2.907 1.36E+07 bx
Y24HB3-Y24HA 2.907 4.058 1.72E+06 bx
Y24HB2-Y24HA 2.708 4.058 3.20E+06 bx
Y24QD-Y24HA 7.150 4.058 3.67E+06 bx
Y24QD-Q25HA 7.151 3.874 1.65E+06 bx
Y10QE-Y24HA 6.545 4.058 3.89E+06 bx
Y24QD-Y24QE 7.149 6.874 2.09E+07 bx
Y24QD-Y10QE 7.149 6.545 1.36E+06 bx
Y24QE-Y24QD 6.875 7.149 2.27E+07 bx
Y10QE-Y24QD 6.543 7.148 1.10E+06 bx
Y10QE-Y10QD 6.545 7.267 1.94E+07 bx
Y24QD-S28HB2 7.150 3.570 7.20E+05 bx
Y24QD-S28HB3 7.151 3.277 1.08E+06 bx
Y24QD-Q25HG3 7.150 2.586 5.75E+05 bx
Y10QE-Y24HB3 6.545 2.908 3.42E+05 bx
Y24QE-Y24HA 6.874 4.061 5.57E+05 bx
Y24QE-Q25HA 6.878 3.875 3.31E+05 bx
Y24QE-S28HB2 6.875 3.572 1.09E+06 bx
Y24QE-S28HB3 6.873 3.274 1.22E+06 bx
Y24QE-Y24HB3 6.877 2.908 7.03E+05 bx
Y24QE-Y24HB2 6.875 2.707 5.65E+05 bx
P29HD3-P29HD2 3.779 3.127 1.73E+07 bx
S28HB2-S28HB3 3.567 3.276 1.53E+07 bx
Q25HA-Q25HG3 3.876 2.590 1.47E+06 bx
Q25HA-Q25QB 3.874 2.172 8.88E+06 bx
M26HG2-M26HG3 2.578 2.497 1.37E+07 bx
M26HG2-M26HB2 2.584 2.175 5.03E+06 bx
M26HB2-Q25HG3 2.174 2.587 6.40E+06 bx
Q25HG2-Q25HA 2.583 3.874 8.65E+05 bx
Q25QB-Q25HA 2.173 3.873 7.46E+06 bx
M26HA-M26QE 4.159 2.070 4.17E+06 bx
M26HA-M26HB2 4.159 2.173 4.51E+06 bx
M26HB2-M26HA 2.173 4.158 2.63E+06 bx
M26QE-M26HA 2.072 4.159 3.03E+06 bx
M26HB2-M26QE 2.174 2.070 3.07E+06 bx
M26QE-M26HB2 2.079 2.181 2.10E+06 bx
C27HB3-C27HB2 2.242 1.788 8.47E+06 bx
C27HA-C27HB2 4.744 1.797 3.83E+05 bx
C27HA-C27HB3 4.748 2.249 8.03E+05 bx
C27HB2-C27HB3 1.789 2.246 8.32E+06 bx
S28HA-S28HB3 4.380 3.276 7.01E+06 bx
S28HA-S28HB2 4.380 3.571 8.57E+06 bx
S28HB3-S28HB2 3.279 3.571 1.45E+07 bx
S28HB2-S28HA 3.567 4.379 4.93E+06 bx
S28HB3-S28HA 3.276 4.378 3.83E+06 bx
P29HA-P29HG3 4.365 1.822 2.22E+06 bx
P29HD3-P29HG3 3.780 1.823 3.96E+06 bx
P29HA-P29HB3 4.365 1.679 3.35E+06 bx
P29HA-P29HG2 4.365 1.979 1.31E+06 bx
P29HD3-P29HG2 3.780 1.981 3.83E+06 bx
P29HD2-P29HD3 3.127 3.778 1.49E+07 bx
P29HB2-P29HD3 2.382 3.777 8.76E+05 bx
P29HG2-P29HD3 1.981 3.778 3.38E+06 bx
P29HG3-P29HD3 1.823 3.779 2.92E+06 bx
P29HB3-P29HD3 1.683 3.777 9.05E+05 bx
P29HD2-P29HG2 3.128 1.981 3.11E+06 bx
P29HD2-P29HG3 3.127 1.822 1.81E+06 bx
P29HD2-P29HB3 3.127 1.679 1.78E+06 bx
P29HD2-P29HB2 3.127 2.382 7.12E+05 bx
P29HB2-P29HD2 2.382 3.126 8.20E+05 bx
P29HG2-P29HD2 1.981 3.127 3.00E+06 bx
P29HG3-P29HD2 1.824 3.127 1.58E+06 bx
P29HB3-P29HD2 1.677 3.128 1.29E+06 bx
P29HB2-P29HG3 2.381 1.822 3.17E+06 bx
P29HB2-P29HG2 2.379 1.978 3.55E+06 bx
P29HG2-P29HB2 1.979 2.382 3.48E+06 bx
P29HG3-P29HB2 1.821 2.381 2.70E+06 bx
P29HB3-P29HB2 1.676 2.382 1.35E+07 bx
P29HG2-P29HG3 1.977 1.820 1.96E+07 bx
P29HG2-P29HB3 1.981 1.677 3.14E+06 bx
R32QG-R32HB2 1.686 1.817 1.99E+06 bx
R32HB2-R32QG 1.814 1.683 2.25E+06 bx
L30HA-L30HB3 4.244 1.923 2.22E+06 bx
L30HA-L30HG 4.247 1.696 2.05E+06 bx
L30HA-L30HB2 4.247 1.499 4.77E+06 bx
L30HA-L30QD1 4.248 0.940 1.00E+06 bx
L30HA-L30QD2 4.247 0.871 6.80E+06 bx
L30QD2-L30HA 0.871 4.244 8.33E+06 bx
L30QD1-L30HA 0.939 4.245 1.37E+06 bx
L30HB2-L30HA 1.499 4.245 4.06E+06 bx
L30HG-L30HA 1.695 4.244 1.84E+06 bx
L30HB3-L30HA 1.926 4.245 2.00E+06 bx
L30HG-L30HB3 1.694 1.923 1.78E+06 bx
L30QD1-L30HB3 0.939 1.926 4.32E+06 bx
L30QD2-L30HB3 0.871 1.929 1.78E+06 bx
L30QD1-L30HG 0.939 1.699 5.98E+06 bx
L30QD2-L30HG 0.872 1.698 6.09E+06 bx
L30QD1-L30HB2 0.939 1.501 3.91E+06 bx
L30QD2-L30HB2 0.872 1.502 3.23E+06 bx
L30HB3-L30HB2 1.927 1.499 1.46E+07 bx
L30HB3-L30HG 1.924 1.697 1.36E+06 bx
L30HB3-L30QD1 1.928 0.946 3.33E+06 bx
L30HB3-L30QD2 1.926 0.871 1.16E+06 bx
L30HG-L30QD1 1.698 0.940 4.04E+06 bx
L30HG-L30QD2 1.697 0.871 4.58E+06 bx
L30HB2-L30QD2 1.499 0.870 2.36E+06 bx
L30HB2-L30QD1 1.499 0.938 2.99E+06 bx
L30HG-L30HB2 1.696 1.499 1.21E+06 bx
L30HB2-L30HG 1.500 1.696 1.27E+06 bx
E31HA-E31HG3 4.280 2.252 2.64E+06 bx
E31HA-E31HG2 4.278 2.381 1.52E+06 bx
E31HA-E31HB2 4.281 2.169 3.91E+06 bx
E31HA-E31HB3 4.280 2.117 3.97E+06 bx
E31HG2-E31HA 2.383 4.277 1.20E+06 bx
E31HG3-E31HA 2.250 4.279 2.06E+06 bx
E31HB2-E31HA 2.172 4.278 2.65E+06 bx
E31HB3-E31HA 2.122 4.278 2.28E+06 bx
E31HG2-E31HG3 2.385 2.250 1.19E+07 bx
E31HG3-E31HG2 2.251 2.385 1.13E+07 bx
E31HB3-E31HG2 2.121 2.386 1.49E+06 bx
E31HG2-E31HB3 2.375 2.123 1.57E+06 bx
E31HG3-E31HB3 2.251 2.118 1.25E+06 bx
R32HA-R32QG 4.496 1.682 2.09E+06 bx
R32HA-R32HB2 4.495 1.807 2.25E+06 bx
R32HA-R32HB3 4.499 1.972 1.86E+06 bx
R32HB3-R32HA 1.966 4.495 1.40E+06 bx
R32HB2-R32HA 1.819 4.495 1.01E+06 bx
R32QG-R32HA 1.686 4.493 1.04E+06 bx
R32QG-R32QD 1.688 3.244 1.90E+06 bx
R32HB2-R32QD 1.806 3.242 7.66E+05 bx
R32HB3-R32QD 1.966 3.239 6.93E+05 bx
R32QD-R32HB3 3.257 1.967 5.68E+05 bx
R32QD-R32HB3 3.237 1.961 6.29E+05 bx
R32QD-R32HB2 3.231 1.808 4.80E+05 bx
R32QD-R32HB2 3.257 1.802 6.90E+05 bx
R32QD-R32QG 3.230 1.691 1.32E+06 bx
R32QD-R32QG 3.248 1.684 1.48E+06 bx
R32HB2-R32HB3 1.821 1.967 1.68E+07 bx
R32HB3-R32HB2 1.966 1.821 1.55E+07 bx
R32HB3-R32QG 1.966 1.687 2.53E+06 bx
R32QG-R32HB3 1.685 1.966 2.47E+06 bx
R32HA-R32QD 4.503 3.254 7.22E+05 bx
R32QD-R32HA 3.252 4.499 4.67E+05 bx
S33QB-S33HA 3.877 4.309 2.04E+06 bx
S33HA-S33QB 4.308 3.883 4.59E+06 bx
N14HA-N14HB2 4.649 3.016 3.83E+06 bx
N14HB2-N14HA 3.019 4.644 1.35E+06 bx
V15HA-V15HB 3.750 2.104 3.39E+06 bx
V15HA-V15QG1 3.751 0.962 5.97E+06 bx
V15HA-V15QG2 3.751 1.080 7.68E+06 bx
V15HB-V15HA 2.104 3.749 2.32E+06 bx
V15QG2-V15HA 1.080 3.750 7.78E+06 bx
V15QG1-V15HA 0.962 3.750 5.76E+06 bx
V15HB-V15QG2 2.103 1.080 5.39E+06 bx
V15HB-V15QG1 2.104 0.962 5.70E+06 bx
V15QG2-V15HB 1.080 2.103 8.23E+06 bx
V15QG1-V15HB 0.963 2.105 8.25E+06 bx
V15QG2-V15QG1 1.076 0.963 8.16E+06 bx
V15QG1-V15QG2 0.964 1.076 1.10E+07 bx
N16HA-N16HB3 4.776 2.653 4.87E+05 bx
N16HA-N16HB2 4.774 2.958 7.78E+05 bx
N16HB3-N16HB2 2.671 2.959 1.46E+07 bx
N16HB2-N16HB3 2.961 2.673 1.28E+07 bx
K17HA-K17QG 4.027 1.403 3.32E+06 bx
K17HA-K17HD2 4.030 1.773 8.83E+05 bx
K17HA-K17HD3 4.030 1.693 5.85E+05 bx
K17HA-K17HB2 4.030 1.907 7.43E+06 bx
K17HA-K17HB3 4.027 2.105 3.32E+06 bx
K17HA-K17QE 4.029 3.052 3.96E+05 bx
K17HB3-K17HA 2.102 4.028 2.32E+06 bx
K17HB2-K17HA 1.907 4.027 5.88E+06 bx
K17HD2-K17HA 1.774 4.032 7.87E+05 bx
K17HD3-K17HA 1.697 4.031 7.26E+05 bx
K17QG-K17HA 1.406 4.028 2.05E+06 bx
K17HE3-K17HB3 3.049 2.104 3.51E+05 bx
K17QE-K17HB2 3.054 1.910 3.70E+05 bx
K17QE-K17HD3 3.051 1.691 2.52E+06 bx
K17QE-K17HD2 3.036 1.774 1.41E+06 bx
K17QE-K17QG 3.051 1.404 7.23E+05 bx
K17HB3-K17QE 2.099 3.052 3.03E+05 bx
K17HD2-K17QE 1.775 3.034 1.18E+06 bx
K17HD3-K17QE 1.693 3.055 1.88E+06 bx
K17QG-K17QE 1.402 3.052 5.39E+05 bx
K17QG-K17HB3 1.418 2.102 1.98E+06 bx
K17HB2-K17HB3 1.906 2.103 1.54E+07 bx
K17HD3-K17HB3 1.694 2.102 5.22E+05 bx
K17HB3-K17HB2 2.103 1.905 1.50E+07 bx
K17HB3-K17HD3 2.102 1.692 4.90E+05 bx
K17HB3-K17QG 2.103 1.416 2.39E+06 bx
K17HD2-K17HB2 1.774 1.915 1.89E+06 bx
K17HD3-K17HB2 1.693 1.908 1.43E+06 bx
K17QG-K17HD2 1.390 1.772 8.59E+05 bx
K17HD2-K17QG 1.763 1.400 1.15E+06 bx
V18HA-V18QG1 4.285 0.973 6.01E+06 bx
V18HA-V18QG2 4.285 1.063 5.97E+06 bx
V18HA-V18HB 4.286 1.941 2.35E+06 bx
V18HB-V18HA 1.943 4.284 1.66E+06 bx
V18QG2-V18HA 1.063 4.284 5.92E+06 bx
V18QG1-V18HA 0.973 4.284 6.61E+06 bx
V18QG2-V18HB 1.063 1.940 6.74E+06 bx
V18QG1-V18HB 0.973 1.941 7.65E+06 bx
V18HB-V18QG1 1.940 0.972 5.19E+06 bx
V18HB-V18QG2 1.941 1.063 5.14E+06 bx
V18QG1-V18QG2 0.973 1.064 7.31E+06 bx
V18QG2-V18QG1 1.063 0.973 5.82E+06 bx
P19HD2-P19HA 3.680 4.506 3.05E+05 bx
P19HB2-P19HA 2.510 4.505 5.01E+06 bx
P19HB3-P19HA 2.148 4.504 1.75E+06 bx
P19QG-P19HA 2.102 4.504 9.32E+05 bx
P19HA-P19QG 4.509 2.105 1.88E+06 bx
P19HD2-P19QG 3.679 2.102 1.97E+06 bx
P19QG-P19HD2 2.099 3.676 1.48E+06 bx
P19HB3-P19HD2 2.145 3.678 3.06E+06 bx
P19HB2-P19HD2 2.507 3.678 6.09E+05 bx
P19HB2-P19QG 2.507 2.103 4.16E+06 bx
P19HB2-P19HB3 2.509 2.152 1.42E+07 bx
P19HB3-P19HB2 2.151 2.509 1.16E+07 bx
P19QG-P19HB2 2.098 2.505 4.41E+06 bx
P3HA-P3HG2 4.469 2.090 1.47E+06 bx
P3HD2-P3HD3 3.834 3.900 8.63E+06 bx
P3HB2-P3HA 2.428 4.466 3.65E+06 bx
P3HB3-P3HA 2.000 4.466 1.67E+06 bx
P3HB3-P3HD2 2.007 3.833 8.43E+05 bx
P3HB2-P3HD3 2.430 3.895 5.60E+05 bx
P3HB2-P3HD2 2.431 3.835 4.65E+05 bx
P3HG2-P3HD3 2.133 3.894 7.35E+05 bx
P3HG2-P3HD2 2.134 3.833 1.84E+06 bx
P3HD2-P3HG2 3.834 2.134 2.21E+06 bx
S2HA-S2QB 4.860 3.973 2.97E+06 bx
S2HA-P3HD3 4.860 3.890 3.11E+06 bx
S2HA-P3HD2 4.860 3.834 2.19E+06 bx
S2QB-S2HA 3.982 4.868 4.57E+05 bx
P3HD3-S2HA 3.891 4.871 8.78E+05 bx
P3HD2-S2HA 3.835 4.869 6.28E+05 bx
P19HD3-V18QG1 4.125 0.972 6.47E+05 bx
P19HD3-V18QG2 4.122 1.063 2.17E+06 bx
P19HD2-V18QG1 3.677 0.975 8.73E+05 bx
P19HD2-V18QG2 3.678 1.063 4.51E+06 bx
P19HD3-P19HB3 4.122 2.136 2.95E+06 bx
P19HD3-P19QG 4.121 2.104 2.82E+06 bx
P19HD3-P19HD2 4.121 3.677 1.68E+07 bx
P19HA-P19HD3 4.506 4.121 1.31E+06 bx
P19HD3-P19HA 4.123 4.506 4.34E+05 bx
P19HD2-P19HD3 3.678 4.120 1.60E+07 bx
P19HD3-P19HB2 4.124 2.511 5.93E+05 bx
P19HB2-P19HD3 2.508 4.119 8.15E+05 bx
P19HB3-P19HD3 2.140 4.119 2.19E+06 bx
P19QG-P19HD3 2.100 4.119 2.25E+06 bx
V18HA-P19HD2 4.285 3.677 7.52E+06 bx
Q12HA-V15QG2 3.967 1.080 4.44E+06 bx
Q12HA-V15QG1 3.965 0.963 1.55E+06 bx
?-E11HB2 4.383 2.094 2.11E+06 bx
?-E11HB3 4.383 2.268 4.07E+06 bx
Q5HA-Y8HB3 4.250 3.094 1.85E+06 bx
Q5HA-Y8HB2 4.253 3.150 1.16E+06 bx
E11HB3-? 2.274 4.383 2.33E+06 bx
E11HB2-? 2.096 4.381 1.32E+06 bx
P29HB2-P29HA 2.382 4.366 5.43E+06 bx
P29HG3-P29HA 1.822 4.364 1.65E+06 bx
P29HB3-P29HA 1.681 4.364 2.28E+06 bx
P29HG2-P29HA 1.979 4.366 1.08E+06 bx
P29HD3-S28HA 3.779 4.372 1.76E+06 bx
F20HA-C23HB2 4.192 3.193 3.40E+06 bx
F20HA-C23HB3 4.194 2.814 2.60E+06 bx
Y10HA-C13HB2 4.218 3.468 1.24E+06 bx
C23HB2-F20HA 3.194 4.192 2.59E+06 bx
C23HB3-F20HA 2.812 4.192 1.91E+06 bx
Y24HB3-D21HA 2.909 4.275 1.92E+06 bx
D21HA-Y24HB3 4.276 2.908 2.85E+06 bx
Y8HB2-Q5HA 3.149 4.251 1.22E+06 bx
Y8HB3-Q5HA 3.097 4.251 1.73E+06 bx
D21HA-D21HB3 4.275 2.671 3.52E+06 bx
P19HD2-V18HA 3.678 4.284 6.05E+06 bx
P19HD3-V18HA 4.121 4.284 9.09E+06 bx
V18HA-P19HD3 4.285 4.120 1.19E+07 bx
C13HB2-C23HB2 3.470 3.193 7.83E+05 bx
C13HB2-C23HB3 3.468 2.812 1.27E+06 bx
C13HB2-V18HB 3.468 1.940 2.92E+06 bx
C13HB2-V18QG2 3.464 1.061 8.60E+05 bx
C13HB2-V18QG1 3.468 0.973 8.91E+05 bx
C23HB2-C13HB2 3.193 3.468 5.14E+05 bx
C13HB3-C23HB3 3.720 2.815 5.47E+05 bx
C13HB3-C23HB2 3.720 3.188 3.77E+05 bx
C23HB2-C13HB3 3.195 3.715 3.43E+05 bx
C23HB3-C13HB3 2.816 3.715 6.39E+05 bx
C23HB3-C13HB2 2.818 3.466 1.03E+06 bx
C13HB3-V18HB 3.719 1.941 1.16E+06 bx
C13HA-V18HB 4.081 1.942 3.81E+06 bx
C23HB2-V18HB 3.197 1.937 4.02E+05 bx
V18HB-C13HB3 1.941 3.719 9.87E+05 bx
V18HB-C13HB2 1.941 3.466 2.50E+06 bx
V18HB-C13HA 1.941 4.079 2.88E+06 bx
C23HB3-V18HB 2.821 1.938 9.00E+05 bx
V18HB-C23HB3 1.944 2.813 8.84E+05 bx
C9HB3-C27HB3 3.256 2.248 1.31E+06 bx
C9HB2-C27HB3 2.834 2.250 6.40E+05 bx
C27HB3-C9HB2 2.255 2.829 6.32E+05 bx
C27HB3-C9HB3 2.255 3.254 1.29E+06 bx
C9HB3-L30QD1 3.255 0.939 1.84E+06 bx
C9HB2-L30QD1 2.830 0.939 3.18E+06 bx
C9HB3-A6QB 3.257 1.456 7.68E+05 bx
A6HA-L30QD1 4.041 0.939 3.65E+06 bx
A6HA-C9HB3 4.041 3.256 3.12E+06 bx
A6QB-C9HB3 1.457 3.256 7.26E+05 bx
L30QD1-C9HB2 0.938 2.827 3.79E+06 bx
L30QD1-C9HB3 0.938 3.256 2.07E+06 bx
L30QD1-A6HA 0.939 4.040 3.56E+06 bx
A6HA-E31HG3 4.044 2.247 7.99E+05 bx
E31HA-A6QB 4.278 1.457 2.34E+06 bx
P3HA-A6QB 4.469 1.458 1.87E+06 bx
L30HB2-A6HA 1.501 4.042 8.72E+05 bx
E31HG3-A6HA 2.240 4.044 7.45E+05 bx
C9HB3-A6HA 3.256 4.041 2.55E+06 bx
E31HG3-A6QB 2.252 1.457 1.99E+06 bx
A6QB-E31HG3 1.457 2.249 2.84E+06 bx
E11HA-E11HG2 4.202 2.500 1.65E+06 bx
Y24HA-M26HB3 4.057 2.069 2.05E+06 bx
C23HA-Q25QB 4.052 2.173 1.44E+06 bx
A1HA-A1QB 3.596 1.292 1.70E+06 bx
A1QB-A1HA 1.295 3.595 1.35E+06 bx
P3HG2-P3HB3 2.134 2.004 1.43E+07 bx
P3HB3-P3HG2 2.007 2.134 1.40E+07 bx
A6QB-P3HA 1.458 4.467 1.64E+06 bx
Q4HA-K7HB3 4.214 1.890 1.00E+06 bx
Y8QD-Q5QB 7.168 2.204 4.16E+05 bx
Y8QD-Q5QG 7.169 2.492 4.29E+05 bx
A6QB-E31HA 1.457 4.278 2.43E+06 bx
E31HG2-A6QB 2.382 1.457 1.18E+06 bx
A6QB-E31HG2 1.456 2.385 1.52E+06 bx
K7HA-A6QB 4.187 1.457 3.89E+05 bx
K7HA-Y10HB3 4.185 2.975 1.54E+06 bx
A6QB-K7HA 1.455 4.185 4.49E+05 bx
?-A6QB 4.380 1.458 5.63E+05 bx
Y8QD-E11HB3 7.170 2.274 5.60E+05 bx
?-Y8QE 4.384 6.799 5.13E+05 bx
Q12QG-Y8QE 2.070 6.799 8.50E+05 bx
Q12QG-Y8QD 2.062 7.161 4.33E+05 bx
N16HB3-C13HA 2.671 4.085 1.14E+06 bx
C13HA-N16HB3 4.084 2.672 1.03E+06 bx
C13HA-N16HB2 4.087 2.962 5.42E+05 bx
N16HB2-C13HA 2.969 4.084 4.77E+05 bx
C13HA-V18QG1 4.082 0.972 5.01E+06 bx
Y10HA-C13HB3 4.216 3.719 1.74E+06 bx
C13HB2-Y10HA 3.469 4.214 7.60E+05 bx
C13HB3-Y10HA 3.718 4.216 1.26E+06 bx
Y10QE-P29HB2 6.544 2.386 9.24E+05 bx
Y10QE-? 6.545 4.379 9.72E+05 bx
Y10QE-Y10HA 6.548 4.211 6.90E+05 bx
E11HG2-Q12HA 2.495 3.971 5.32E+05 bx
E11HG3-Q12HA 2.276 3.963 3.14E+05 bx
Q12HA-E11HG2 3.971 2.496 5.01E+05 bx
E11HB2-E11HG2 2.092 2.499 3.96E+06 bx
V15QG2-Q12HA 1.080 3.966 5.02E+06 bx
V15QG1-Q12HA 0.963 3.966 1.61E+06 bx
V18QG2-C13HB2 1.063 3.467 8.26E+05 bx
V18QG1-C13HB2 0.973 3.470 1.02E+06 bx
V18QG1-C13HA 0.973 4.081 5.30E+06 bx
N14HB2-V15QG2 3.019 1.079 4.96E+05 bx
V18QG2-N14HB2 1.078 3.011 6.46E+05 bx
N14HA-K17HA 4.651 4.025 1.09E+06 bx
N16HB3-V18QG1 2.671 0.972 3.66E+06 bx
V18QG1-N16HB3 0.972 2.671 4.16E+06 bx
V18QG1-N16HB2 0.972 2.958 2.79E+06 bx
N16HB2-V18QG1 2.958 0.973 2.57E+06 bx
K17HB2-K17HD2 1.913 1.771 2.03E+06 bx
C23HA-V18QG2 4.056 1.063 2.81E+06 bx
C23HB2-V18QG2 3.194 1.063 9.51E+05 bx
C23HB3-V18QG2 2.817 1.063 2.20E+06 bx
Q22HG2-V18QG2 2.364 1.065 6.99E+05 bx
P19HD2-V18HB 3.677 1.942 6.49E+05 bx
P19HD2-Q22QB 3.678 2.021 2.33E+06 bx
V18QG2-P19HD2 1.063 3.677 5.02E+06 bx
V18QG1-P19HD2 0.973 3.677 8.47E+05 bx
V18QG2-C23HB2 1.062 3.195 1.14E+06 bx
V18QG2-P19HD3 1.063 4.118 2.38E+06 bx
V18QG2-C23HA 1.063 4.057 3.12E+06 bx
V18QG2-C23HB3 1.063 2.813 2.62E+06 bx
V18QG2-Q22QB 1.063 2.022 8.25E+06 bx
Q22QB-V18QG2 2.022 1.063 6.69E+06 bx
Q22QB-V18QG1 2.019 0.969 4.92E+05 bx
V18QG1-Q22QB 0.970 2.021 5.65E+05 bx
P19HA-V18QG2 4.510 1.060 5.18E+05 bx
P19HA-F20HB2 4.505 3.361 5.12E+05 bx
Q22QB-P19HD2 2.022 3.678 2.17E+06 bx
P19HB2-V18QG2 2.504 1.074 6.18E+05 bx
C27HA-L30QD1 4.750 0.938 7.42E+05 bx
P19HB3-V18QG2 2.146 1.057 6.49E+05 bx
M26QE-V18QG2 2.067 1.061 2.66E+06 bx
V18QG2-P19HB3 1.063 2.151 9.74E+05 bx
F20HB2-F20HA 3.367 4.193 4.07E+06 bx
F20HB3-F20HA 3.047 4.193 2.59E+06 bx
Y24QD-D21HA 7.152 4.275 6.10E+05 bx
F20QD-C23HB3 7.320 2.811 5.05E+05 bx
F20QD-C23HB2 7.322 3.193 4.90E+05 bx
Q22HA-Q25QB 4.092 2.171 4.71E+06 bx
Q22HA-Q25HG3 4.091 2.590 6.63E+05 bx
Q25HG3-Q22HA 2.592 4.090 5.65E+05 bx
Q25QB-Q22HA 2.172 4.090 3.58E+06 bx
Q22HG3-V18QG2 2.430 1.061 3.83E+05 bx
V18QG2-Q22HG2 1.062 2.360 8.10E+05 bx
V18QG2-Q22HG3 1.062 2.435 5.54E+05 bx
C23HA-Q25HG3 4.051 2.584 4.59E+05 bx
V18HB-C23HB2 1.938 3.196 3.72E+05 bx
M26HB3-Y24HA 2.067 4.056 2.37E+06 bx
C27HB2-Y10QE 1.787 6.545 9.12E+05 bx
C27HB3-Y10QE 2.245 6.545 1.11E+06 bx
A6QB-Y10QE 1.457 6.545 2.46E+06 bx
A6QB-Y10QD 1.457 7.267 1.76E+06 bx
C27HB2-Y10QD 1.779 7.266 4.08E+05 bx
C27HB3-Y10QD 2.243 7.267 5.33E+05 bx
Y24HB3-Y24QD 2.907 7.150 4.48E+06 bx
Y24HB2-Y24QD 2.709 7.150 4.28E+06 bx
Y24HA-Y24QD 4.059 7.150 2.95E+06 bx
Q25HA-Y24QD 3.875 7.150 1.19E+06 bx
S28HB2-Y24QD 3.571 7.149 5.30E+05 bx
S28HB2-Y24QE 3.567 6.875 8.03E+05 bx
S28HB3-Y24QE 3.283 6.873 7.72E+05 bx
S28HB3-Y24QD 3.280 7.151 5.58E+05 bx
Y24HB3-Y24QE 2.910 6.875 4.25E+05 bx
Y24HB2-Y10QE 2.704 6.546 5.07E+05 bx
Y24HA-Y10QE 4.060 6.545 3.11E+06 bx
Y10HA-Y10QE 4.218 6.547 5.56E+05 bx
?-Y10QE 4.381 6.545 8.93E+05 bx
Y10HA-Y10QD 4.220 7.267 5.24E+06 bx
K7HA-Y10QD 4.184 7.268 2.40E+06 bx
A6HA-Y10QD 4.048 7.267 5.51E+05 bx
F20QD-Y24HB3 7.321 2.905 5.17E+05 bx
Y10HB3-Y10QD 2.972 7.267 4.52E+06 bx
Y10HB2-Y10QD 3.120 7.267 4.41E+06 bx
S28HA-P29HD3 4.378 3.778 2.39E+06 bx
E31HB2-L30QD2 2.219 0.871 7.08E+05 bx
E31HB2-L30QD1 2.221 0.938 8.39E+05 bx
L30QD1-E31HB2 0.941 2.227 1.73E+06 bx
L30QD2-E31HB2 0.873 2.218 1.13E+06 bx
E31HG2-E31HB2 2.367 2.170 9.92E+05 bx
E31HB2-E31HG2 2.173 2.366 4.60E+05 bx
C13HA-V18QG2 4.088 1.064 9.78E+05 bx
M26QE-V18QG1 2.066 0.971 2.40E+06 bx
;
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 . . 6.259 ppm . . . 768 . . 30597 3
2 . . C 13 C-methyl . . 60 ppm . . . 0 . . 30597 3
stop_
save_