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 36321
_Spectral_peak_list.ID 3
_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 .
_Spectral_peak_list.Chem_shift_reference_label .
_Spectral_peak_list.Experiment_ID 3
_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 'd8=500.000 ms'
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
Assignment w1 w2 Height Volume
G7HN-W6HA 8.051 4.733 6.21E+04 4.72E+05 bx
A3HN-G2QA 8.242 4.011 4.16E+04 3.17E+05 bx
I4HN-A3HA 8.138 4.322 2.48E+05 1.97E+06 bx
C5HN-I4HA 8.279 4.051 1.98E+05 1.44E+06 bx
W6HN-C5HA 8.287 4.504 1.74E+05 1.24E+06 bx
G7QA-P8HD3 4.006 3.578 9.44E+04 7.64E+05 bx
G7QA-P8HD2 4.007 3.527 1.00E+05 7.93E+05 bx
C9HN-P8HA 8.472 4.414 2.55E+05 1.86E+06 bx
P10HD2-C9QB 3.818 2.915 1.14E+04 8.69E+04 bx
P10HD3-C9QB 3.771 2.912 1.43E+04 1.08E+05 bx
T11HN-P10HA 8.066 4.482 2.24E+05 1.71E+06 bx
A12HN-T11HA 8.134 4.231 3.74E+05 2.82E+06 bx
F13HN-A12HA 8.077 4.272 2.14E+05 1.65E+06 bx
F13QD-F13HA 7.232 4.579 5.47E+04 3.83E+05 bx
F13QD-F13HB2 7.231 3.036 7.35E+04 6.02E+05 bx
F13QD-F13HB3 7.231 3.111 7.17E+04 5.71E+05 bx
F13QE-F13HA 7.342 4.575 7.84E+03 4.47E+04 bx
F13QE-F13HB3 7.343 3.114 1.30E+04 9.29E+04 bx
R14HN-F13HA 8.053 4.579 2.44E+05 1.87E+06 bx
Q15HN-R14HA 8.303 4.261 3.16E+05 2.37E+06 bx
I16HN-Q15HA 8.212 4.333 2.68E+05 2.01E+06 bx
G17HN-I16HA 8.457 4.193 2.78E+05 2.14E+06 bx
N18HN-G17QA 8.418 3.965 3.48E+05 2.47E+06 bx
N18HD21-N18HB3 7.599 2.866 1.34E+04 8.64E+04 bx
N18HD21-N18HB2 7.600 2.786 1.26E+04 9.06E+04 bx
N18HD22-N18HB3 6.918 2.866 8.21E+03 4.11E+04 bx
N18HD22-N18HB2 6.918 2.794 6.53E+03 3.64E+04 bx
C19HN-N18HA 8.440 4.757 1.24E+04 8.83E+04 bx
G20HN-C19HA 8.489 4.511 1.07E+05 8.45E+05 bx
R21HN-G20HA1 8.048 3.937 2.39E+05 1.75E+06 bx
F22HN-R21HA 8.125 4.221 2.97E+05 2.34E+06 bx
F22QE-F22HB2 7.343 3.005 1.74E+04 1.27E+05 bx
F22QE-F22HB3 7.343 3.180 1.52E+04 1.03E+05 bx
F22QD-F22HB2 7.246 3.004 1.11E+05 8.61E+05 bx
F22QD-R23HD2 7.247 3.170 9.34E+04 7.05E+05 bx
F22QD-F22HA 7.248 4.661 6.25E+04 4.69E+05 bx
F22HN-F22HA 8.137 4.667 3.45E+05 2.54E+06 bx
V24HN-R23HA 8.115 4.332 3.66E+05 2.77E+06 bx
R25HN-V24HA 8.477 4.089 4.40E+05 3.30E+06 bx
C26HN-R25HA 8.463 4.349 3.38E+05 2.60E+06 bx
R28HN-C27HA 8.403 4.538 2.14E+05 1.58E+06 bx
C27HN-C26HA 8.512 4.537 3.41E+05 2.41E+06 bx
I29HN-R28HA 8.279 4.391 1.19E+05 9.18E+05 bx
?-I29HA 7.982 4.173 1.12E+05 8.76E+05 bx
W6HE1-W6HD1 10.104 7.267 1.20E+05 8.08E+05 bx
W6HE1-W6HZ2 10.104 7.492 2.19E+04 1.53E+05 bx
G17HN-I16QG2 8.457 0.914 3.33E+04 2.40E+05 bx
R25HN-V24QQG 8.476 0.955 5.90E+04 4.27E+05 bx
I16HN-I16QG2 8.211 0.917 2.22E+04 1.69E+05 bx
I16HN-I16QD1 8.210 0.853 6.72E+03 4.75E+04 bx
V24HN-V24QQG 8.116 0.960 1.11E+05 8.03E+05 bx
I16HN-I16HG13 8.211 1.183 3.40E+04 2.73E+05 bx
A12HN-T11QG2 8.134 1.192 2.28E+04 1.33E+05 bx
T11HN-T11QG2 8.068 1.192 3.13E+04 2.17E+05 bx
A12HN-A12QB 8.134 1.305 1.51E+05 1.08E+06 bx
F13HN-A12QB 8.078 1.306 5.61E+04 3.88E+05 bx
R23HN-R21QG 8.133 1.415 2.47E+04 1.70E+05 bx
R21HN-R21QG 8.049 1.406 4.42E+04 3.44E+05 bx
I16HN-I16HG12 8.210 1.476 2.61E+04 2.12E+05 bx
R25HN-R25HG3 8.475 1.666 1.93E+04 1.59E+05 bx
R25HN-R25HG2 8.476 1.617 1.69E+04 1.31E+05 bx
R28HN-R28HG3 8.405 1.599 3.85E+03 3.34E+04 bx
R23HN-R23QG 8.137 1.569 3.05E+04 2.47E+05 bx
R14HN-R14HG3 8.054 1.553 2.29E+04 1.69E+05 bx
R14HN-R14HG2 8.050 1.509 1.48E+04 1.16E+05 bx
R21HN-R21QB 8.048 1.635 1.22E+05 1.01E+06 bx
F22HN-R21QB 8.129 1.641 4.55E+04 3.60E+05 bx
R14HN-R14HB2 8.053 1.686 6.25E+04 5.43E+05 bx
R14HN-R14HB3 8.054 1.771 3.70E+04 2.79E+05 bx
R30HN-R30HB2 7.985 1.739 9.53E+03 6.21E+04 bx
R23HN-R23HB2 8.139 1.711 1.24E+05 9.59E+05 bx
F22HN-R23HB3 8.136 1.796 5.03E+04 3.95E+05 bx
V24HN-R23HB2 8.119 1.718 2.91E+04 2.38E+05 bx
V24HN-R23HB3 8.114 1.785 3.08E+04 2.36E+05 bx
Q15HN-R14HB2 8.300 1.691 1.41E+04 1.05E+05 bx
Q15HN-R14HB3 8.302 1.770 1.71E+04 1.35E+05 bx
R28HN-R28HB2 8.402 1.764 4.45E+04 3.60E+05 bx
R25HN-R25HB2 8.476 1.776 9.70E+04 7.47E+05 bx
R25HN-R25HB3 8.473 1.848 6.19E+04 5.06E+05 bx
G17HN-I16HB 8.459 1.866 4.67E+04 3.79E+05 bx
C9HN-P8HB3 8.475 1.929 1.76E+04 1.27E+05 bx
R28HN-R28HB3 8.404 1.850 3.16E+04 2.48E+05 bx
I29HN-I29HB 8.278 1.882 2.34E+04 1.81E+05 bx
I16HN-I16HB 8.212 1.873 8.25E+04 6.45E+05 bx
R30HN-R30HB3 7.983 1.863 7.29E+03 5.34E+04 bx
T11HN-P10HB3 8.068 1.946 1.26E+04 8.76E+04 bx
G7HN-P10QG 8.054 2.038 6.69E+03 3.63E+04 bx
T11HN-P10QG 8.068 2.030 8.41E+03 5.23E+04 bx
A12HN-P10HB3 8.134 1.950 2.44E+03 4.74E+03 bx
I16HN-Q15HB3 8.212 1.965 1.53E+04 1.12E+05 bx
Q15HN-Q15HB3 8.302 1.971 8.21E+04 6.48E+05 bx
Q15HN-Q15HB2 8.303 2.085 4.18E+04 3.21E+05 bx
I16HN-Q15HB2 8.212 2.081 2.06E+04 1.59E+05 bx
V24HN-V24HB 8.117 2.063 9.70E+04 7.58E+05 bx
R25HN-V24HB 8.475 2.064 3.37E+04 2.54E+05 bx
C9HN-P8QG 8.475 1.997 1.10E+04 6.65E+04 bx
Q15HN-Q15QG 8.301 2.339 2.22E+04 1.62E+05 bx
C9HN-P8HB2 8.470 2.247 1.00E+04 6.53E+04 bx
I16HN-Q15QG 8.208 2.337 9.22E+03 6.58E+04 bx
T11HN-P10HB2 8.067 2.333 4.63E+03 1.84E+04 bx
A12HN-P10HB2 8.134 2.324 2.66E+03 5.02E+03 bx
N18HN-N18HB2 8.418 2.790 6.20E+04 4.89E+05 bx
N18HN-N18HB3 8.417 2.862 4.77E+04 3.59E+05 bx
R28HN-C26QB 8.402 2.921 2.75E+04 2.12E+05 bx
C9HN-C9QB 8.468 2.918 1.83E+05 1.29E+06 bx
C27HN-C26QB 8.512 2.923 9.73E+04 7.31E+05 bx
G20HN-C19QB 8.490 2.983 2.53E+04 1.81E+05 bx
C19HN-C19QB 8.441 2.981 8.26E+04 6.02E+05 bx
W6HN-W6HB2 8.287 3.209 4.95E+04 3.82E+05 bx
W6HN-W6HB3 8.285 3.348 2.09E+04 1.48E+05 bx
F22HN-F22HB2 8.129 3.002 1.24E+05 9.50E+05 bx
F13HN-F13HB2 8.078 3.039 1.02E+05 7.48E+05 bx
F13HN-F13HB3 8.079 3.111 6.84E+04 5.30E+05 bx
F22HN-F22HB3 8.130 3.171 7.96E+04 6.17E+05 bx
R14HN-F13HB2 8.055 3.033 1.93E+04 1.37E+05 bx
R14HN-F13HB3 8.051 3.106 2.53E+04 1.97E+05 bx
G7HN-W6HB2 8.053 3.217 5.24E+03 3.32E+04 bx
W6HE3-W6HB3 7.630 3.351 2.09E+04 1.58E+05 bx
W6HE3-W6HB2 7.632 3.206 5.56E+03 4.71E+04 bx
N1HD21-N1HB3 7.702 2.952 -1.22E+04 -9.10E+04 bx
N1HD21-N1HB2 7.701 3.017 -1.23E+04 -8.71E+04 bx
N1HD22-N1HB3 7.041 2.941 -5.99E+03 -3.86E+04 bx
N1HD22-N1HB2 7.041 3.016 -6.38E+03 -4.22E+04 bx
G2HN-N1HA 8.665 4.392 -2.06E+04 -1.53E+05 bx
G20HN-G20QA 8.488 3.935 2.68E+05 2.01E+06 bx
G17HN-G17QA 8.455 3.966 2.80E+05 2.13E+06 bx
G2HN-G2QA 8.666 3.994 -8.24E+04 -5.40E+05 bx
V24HN-V24HA 8.115 4.090 6.63E+04 5.03E+05 bx
I16HN-I16HA 8.208 4.192 7.02E+04 5.32E+05 bx
R21HN-R14HA 8.052 4.239 1.28E+05 1.08E+06 bx
Q15HN-Q15HA 8.299 4.327 1.01E+05 7.36E+05 bx
R28HN-R28HA 8.399 4.390 6.85E+04 5.03E+05 bx
W6HN-W6HA 8.283 4.731 2.37E+04 1.65E+05 bx
N18HN-N18HA 8.413 4.754 1.73E+04 1.27E+05 bx
Q15HN-I16HA 8.286 4.190 1.72E+04 1.19E+05 bx
I29HN-I29HA 8.272 4.165 2.19E+04 1.49E+05 bx
I4HN-I4HA 8.145 4.063 1.25E+04 7.86E+04 bx
W6HE3-W6HA 7.632 4.738 8.42E+03 6.13E+04 bx
F22HN-F22QD 8.132 7.243 2.48E+04 1.85E+05 bx
F13HN-F13QD 8.077 7.233 6.68E+03 3.51E+04 bx
G7HN-W6HH2 8.052 7.229 4.56E+03 2.72E+04 bx
C5HN-W6HD1 8.284 7.264 7.91E+03 3.85E+04 bx
G20HN-R21HN 8.488 8.050 4.42E+04 3.35E+05 bx
R25HN-F22HN 8.478 8.123 4.40E+04 3.39E+05 bx
C19HN-R21HN 8.444 8.049 1.06E+04 7.95E+04 bx
W6HN-G7HN 8.296 8.055 6.44E+04 5.14E+05 bx
I29HN-R30HN 8.286 7.985 2.92E+04 2.21E+05 bx
G17HN-I16HN 8.459 8.217 4.93E+04 3.80E+05 bx
R28HN-I29HN 8.402 8.279 4.59E+04 3.51E+05 bx
I16HN-G17HN 8.212 8.459 4.76E+04 3.68E+05 bx
F22HN-R25HN 8.116 8.479 3.86E+04 2.90E+05 bx
R21HN-G20HN 8.048 8.489 5.01E+04 3.83E+05 bx
G7HN-W6HN 8.053 8.296 5.89E+04 4.45E+05 bx
R30HN-I29HN 7.985 8.280 2.99E+04 2.18E+05 bx
I4HN-C5HN 8.133 8.295 2.63E+04 1.58E+05 bx
W6HZ2-W6HE1 7.488 10.107 2.37E+04 1.80E+05 bx
W6HD1-W6HE1 7.265 10.107 1.56E+05 1.08E+06 bx
A12HN-T11HN 8.134 8.063 3.39E+05 2.32E+06 bx
T11HN-A12HN 8.056 8.130 1.90E+05 1.29E+06 bx
Q15HN-I16HN 8.299 8.221 1.15E+05 9.07E+05 bx
I16HN-Q15HN 8.217 8.290 8.02E+04 5.50E+05 bx
?-? 8.149 8.223 6.45E+04 4.01E+05 bx
N1HD21-N1HD22 7.701 7.043 1.41E+06 1.00E+07 bx
N18HD21-N18HD22 7.600 6.919 2.60E+06 1.78E+07 bx
Q15HE21-Q15HE22 7.506 6.863 1.98E+06 1.37E+07 bx
W6HE3-W6HZ3 7.637 7.155 3.72E+05 2.23E+06 bx
W6HZ2-W6HH2 7.482 7.235 2.94E+05 2.00E+06 bx
W6HD1-C5HN 7.266 8.286 1.16E+04 7.96E+04 bx
F22QD-F22HN 7.248 8.128 3.74E+04 2.80E+05 bx
W6HH2-T11HN 7.233 8.066 2.06E+04 1.47E+05 bx
N1HD22-N1HD21 7.042 7.703 1.44E+06 1.03E+07 bx
N18HD22-N18HD21 6.917 7.603 2.74E+06 1.87E+07 bx
Q15HE22-Q15HE21 6.862 7.509 1.96E+06 1.38E+07 bx
W6HZ3-W6HE3 7.150 7.636 2.48E+05 1.65E+06 bx
W6HH2-W6HZ2 7.246 7.487 1.48E+05 1.14E+06 bx
F22QD-F22QE 7.246 7.349 1.81E+06 1.36E+07 bx
F13QD-F13QE 7.232 7.347 9.69E+05 6.93E+06 bx
F13QE-F13QD 7.344 7.243 2.69E+06 1.95E+07 bx
F22HZ-F22QD 7.304 7.254 4.01E+05 2.85E+06 bx
W6HH2-W6HZ3 7.233 7.155 5.78E+05 4.32E+06 bx
W6HZ3-W6HH2 7.157 7.232 4.87E+05 3.68E+06 bx
F13HZ-F13QE 7.307 7.346 3.20E+06 2.48E+07 bx
F13QE-F13HZ 7.344 7.306 3.09E+06 2.66E+07 bx
W6HD1-W6HB3 7.265 3.350 2.10E+04 1.49E+05 bx
W6HD1-W6HB2 7.266 3.214 5.62E+04 4.23E+05 bx
?-? 7.177 3.177 6.53E+04 4.78E+05 bx
R14HE-R14QD 7.145 3.148 4.44E+04 3.28E+05 bx
R21HE-R21QD 7.096 3.092 4.42E+04 3.12E+05 bx
W6HD1-C5QB 7.262 2.827 9.41E+03 6.48E+04 bx
R30HE-R30QG 7.202 1.595 -2.27E+04 -1.68E+05 bx
W6HH2-A12QB 7.234 1.317 5.32E+03 2.65E+04 bx
I4HA-I4QG2 4.047 0.620 1.46E+04 1.02E+05 bx
I16HA-I16QD1 4.189 0.855 2.33E+04 1.71E+05 bx
I16HA-I16QG2 4.190 0.918 8.80E+04 6.74E+05 bx
V24HA-V24QQG 4.086 0.957 1.48E+05 1.07E+06 bx
G17QA-I16QG2 3.966 0.916 1.41E+04 9.36E+04 bx
R23HA-V24QQG 4.336 0.962 9.75E+03 7.04E+04 bx
I29HA-I29QG2 4.168 0.927 2.65E+04 2.16E+05 bx
T11HA-T11QG2 4.228 1.197 1.14E+05 8.38E+05 bx
T11HB-T11QG2 4.195 1.194 1.69E+05 1.29E+06 bx
R14HA-A12QB 4.266 1.307 1.37E+05 9.99E+05 bx
R21HA-R21QG 4.223 1.408 3.63E+04 2.83E+05 bx
I16HA-I16HG12 4.191 1.476 1.77E+04 1.31E+05 bx
R14HA-R14HG2 4.256 1.525 2.45E+04 1.96E+05 bx
R23HA-R23QG 4.334 1.565 2.78E+04 2.26E+05 bx
R21HA-R21QB 4.223 1.645 1.44E+05 1.11E+06 bx
?-? 4.330 1.717 5.30E+04 4.12E+05 bx
?-? 4.339 1.786 6.98E+04 5.53E+05 bx
R14HA-R14HB3 4.256 1.765 5.60E+04 4.45E+05 bx
?-? 4.346 1.850 3.93E+04 3.17E+05 bx
Q15HA-Q15HB3 4.330 1.972 1.71E+04 1.51E+05 bx
A3HA-A3QB 4.314 1.350 1.30E+05 8.07E+05 bx
P10HD2-P10QG 3.822 2.034 4.52E+04 3.77E+05 bx
P10HD3-P10QG 3.772 2.032 5.36E+04 3.95E+05 bx
P10HD2-P10HB2 3.821 2.330 7.91E+03 6.03E+04 bx
V24HA-V24HB 4.089 2.067 7.25E+04 5.60E+05 bx
Q15HA-Q15HB2 4.329 2.085 7.26E+04 5.46E+05 bx
Q15HA-Q15QG 4.337 2.338 2.26E+04 1.68E+05 bx
P8HA-P8HB2 4.418 2.260 4.10E+04 2.97E+05 bx
P10HA-P10HB2 4.479 2.323 6.11E+04 4.13E+05 bx
I4HA-I4HB 4.042 1.715 1.39E+04 1.05E+05 bx
P10HD2-P10HD3 3.820 3.778 7.23E+05 5.71E+06 bx
P10HD3-P10HD2 3.774 3.820 7.09E+05 5.76E+06 bx
G20QA-R21HN 3.931 8.050 2.55E+05 1.79E+06 bx
G7QA-G7HN 4.008 8.055 8.24E+04 6.11E+05 bx
I29HA-R30HN 4.168 7.985 1.24E+05 8.95E+05 bx
T11HB-T11HN 4.202 8.064 5.44E+04 4.22E+05 bx
T11HA-R21HN 4.230 8.065 1.44E+05 1.16E+06 bx
A12HA-F13HN 4.269 8.076 1.85E+05 1.38E+06 bx
A12HA-A12HN 4.271 8.133 6.20E+04 4.91E+05 bx
T11HA-F22HN 4.228 8.130 3.53E+05 2.62E+06 bx
A3HA-F22HN 4.329 8.128 2.85E+05 2.22E+06 bx
V24HA-V24HN 4.085 8.118 6.86E+04 5.23E+05 bx
Q15HA-I16HN 4.330 8.216 1.62E+05 1.30E+06 bx
I16HA-I16HN 4.192 8.209 6.80E+04 5.22E+05 bx
R14HA-Q15HN 4.256 8.304 2.42E+05 1.79E+06 bx
Q15HA-Q15HN 4.334 8.299 5.50E+04 4.20E+05 bx
R28HA-I29HN 4.386 8.279 5.93E+04 4.31E+05 bx
I4HA-C5HN 4.048 8.280 1.82E+05 1.32E+06 bx
P8HA-C9HN 4.409 8.473 9.54E+04 6.68E+05 bx
R25HA-C26HN 4.347 8.465 2.14E+05 1.58E+06 bx
V24HA-R25HN 4.086 8.478 4.74E+05 3.33E+06 bx
I16HA-G17HN 4.190 8.459 3.06E+05 2.26E+06 bx
G20QA-G20HN 3.932 8.490 2.68E+05 1.93E+06 bx
G17QA-G17HN 3.965 8.454 2.72E+05 2.21E+06 bx
G17QA-N18HN 3.963 8.428 2.83E+05 2.25E+06 bx
C27HA-C27HN 4.536 8.518 2.56E+04 1.77E+05 bx
G2QA-G2HN 4.006 8.667 -1.83E+04 -1.20E+05 bx
G20QA-F22HN 3.931 8.131 1.51E+04 8.87E+04 bx
I4HA-I4HN 4.041 8.139 1.52E+04 1.10E+05 bx
W6HB3-W6HN 3.340 8.290 3.16E+04 2.27E+05 bx
W6HB2-W6HN 3.224 8.286 2.04E+04 1.38E+05 bx
F22HB3-F22HN 3.161 8.132 7.90E+04 5.84E+05 bx
F13HB3-F13HN 3.106 8.079 6.86E+04 5.47E+05 bx
F13HB2-F13HN 3.042 8.080 6.68E+04 5.06E+05 bx
F22HB2-F22HN 3.006 8.130 8.11E+04 5.95E+05 bx
C5QB-C5HN 2.824 8.287 5.12E+04 3.69E+05 bx
C19QB-C19HN 2.982 8.441 6.81E+04 5.13E+05 bx
C19QB-G20HN 2.982 8.486 2.31E+04 1.72E+05 bx
C9QB-C9HN 2.917 8.467 1.45E+05 1.07E+06 bx
C27QB-C27HN 2.922 8.508 6.19E+04 4.77E+05 bx
N18HB3-N18HN 2.856 8.424 4.82E+04 3.54E+05 bx
N18HB2-N18HN 2.792 8.423 4.87E+04 3.61E+05 bx
N1HB2-N1HD21 3.006 7.703 -1.21E+04 -9.15E+04 bx
N1HB3-N1HD21 2.958 7.699 -8.22E+03 -5.65E+04 bx
W6HB3-W6HE3 3.353 7.631 8.15E+03 5.39E+04 bx
N18HB3-N18HD21 2.856 7.605 4.95E+03 3.03E+04 bx
N18HB2-N18HD21 2.791 7.606 1.00E+04 7.45E+04 bx
W6HB3-W6HD1 3.342 7.269 1.14E+04 8.00E+04 bx
F22HB3-F22QD 3.161 7.248 5.52E+04 3.94E+05 bx
F13HB3-F13QD 3.105 7.229 4.94E+04 3.59E+05 bx
F22HB2-F22QD 3.008 7.244 5.26E+04 3.95E+05 bx
F13HB2-F13QD 3.039 7.230 4.26E+04 3.14E+05 bx
R14QD-R14HE 3.148 7.153 1.67E+04 1.21E+05 bx
R21QD-R21HE 3.095 7.107 2.15E+04 1.48E+05 bx
N18HB2-N18HD22 2.791 6.917 4.13E+03 2.94E+04 bx
F22HB3-F22HA 3.160 4.667 6.82E+04 5.25E+05 bx
F22HB2-F22HA 3.005 4.662 4.16E+04 3.37E+05 bx
F13HB3-F13HA 3.113 4.578 1.32E+05 8.36E+05 bx
C26QB-C26HA 2.912 4.536 7.96E+04 5.91E+05 bx
C19QB-C19HA 2.983 4.511 9.47E+04 6.72E+05 bx
C5QB-C5HA 2.810 4.503 3.26E+04 2.13E+05 bx
N1HB2-N1HA 3.020 4.389 1.04E+05 5.30E+05 bx
C19QB-G20QA 2.984 3.941 7.61E+03 5.04E+04 bx
C9QB-P10HD3 2.916 3.782 1.94E+04 1.39E+05 bx
P8HD3-G7QA 3.573 4.009 1.14E+05 9.28E+05 bx
P8HD2-G7QA 3.527 4.011 1.11E+05 8.86E+05 bx
P8HD2-P8HD3 3.528 3.570 9.79E+05 7.88E+06 bx
P8HD3-P8HD2 3.570 3.540 9.53E+05 8.14E+06 bx
W6HB2-W6HB3 3.218 3.346 7.43E+05 5.96E+06 bx
W6HB3-W6HB2 3.342 3.212 8.51E+05 6.64E+06 bx
F22HB2-F22HB3 3.002 3.171 1.11E+06 8.32E+06 bx
F22HB3-F22HB2 3.164 3.001 1.10E+06 8.57E+06 bx
F13HB3-F13HB2 3.107 3.039 1.28E+06 9.64E+06 bx
F13HB2-F13HB3 3.039 3.110 1.20E+06 9.32E+06 bx
N1HB3-N1HB2 2.950 3.016 2.25E+06 1.69E+07 bx
N1HB2-N1HB3 3.011 2.954 2.40E+06 1.92E+07 bx
N18HB2-N18HB3 2.785 2.866 2.07E+06 1.48E+07 bx
N18HB3-N18HB2 2.862 2.784 2.16E+06 1.53E+07 bx
P8HD3-P8QG 3.575 2.003 1.22E+05 9.22E+05 bx
P8HD2-P8QG 3.527 2.002 1.22E+05 9.38E+05 bx
R28QD-R28HG2 3.191 1.640 6.59E+04 5.10E+05 bx
R28QD-R28HG3 3.194 1.592 1.09E+05 8.14E+05 bx
R23QD-R23QG 3.166 1.561 8.70E+04 7.04E+05 bx
R14QD-R14QG 3.146 1.533 6.16E+04 5.48E+05 bx
R21QD-R21QG 3.094 1.412 5.79E+04 4.48E+05 bx
R21QD-R21QB 3.092 1.637 3.53E+04 2.72E+05 bx
P8HD3-P8HB2 3.571 2.253 6.81E+03 4.58E+04 bx
P8HD2-P8HB2 3.527 2.253 1.15E+04 8.55E+04 bx
?-? 3.163 1.781 2.33E+04 1.79E+05 bx
R14QD-R14HB3 3.142 1.770 2.34E+04 1.84E+05 bx
R14QD-R14HB2 3.147 1.688 1.56E+04 1.25E+05 bx
R23QD-R23HB2 3.166 1.713 1.56E+04 1.19E+05 bx
R30QD-T11QG2 3.203 1.198 2.87E+04 2.03E+05 bx
Q15QG-Q15HN 2.335 8.308 2.44E+04 1.81E+05 bx
V24HB-R25HN 2.065 8.476 2.33E+04 1.77E+05 bx
P8HB2-C9HN 2.243 8.477 3.77E+03 2.28E+04 bx
Q15QG-I16HN 2.340 8.217 5.53E+03 2.60E+04 bx
V24HB-V24HN 2.060 8.120 6.46E+04 4.83E+05 bx
Q15HB2-I16HN 2.076 8.219 1.06E+04 8.67E+04 bx
Q15HB2-Q15HN 2.078 8.303 3.42E+04 2.63E+05 bx
Q15HB3-Q15HN 1.967 8.306 4.58E+04 3.46E+05 bx
Q15HB3-I16HN 1.970 8.215 1.04E+04 8.09E+04 bx
P10QG-T11HN 2.025 8.072 1.03E+04 7.60E+04 bx
P10HB3-T11HN 1.954 8.071 1.10E+04 8.65E+04 bx
I16HB-I16HN 1.872 8.217 5.97E+04 4.52E+05 bx
I29HB-I29HN 1.878 8.277 2.98E+04 2.10E+05 bx
R28HB3-R28HN 1.851 8.404 2.30E+04 1.66E+05 bx
R25HB3-R25HN 1.846 8.470 4.54E+04 3.56E+05 bx
P8HB3-C9HN 1.924 8.473 8.98E+03 6.42E+04 bx
R25HB2-R25HN 1.775 8.474 5.39E+04 4.11E+05 bx
R28HB2-R28HN 1.768 8.410 2.77E+04 2.04E+05 bx
R25HG3-R25HN 1.656 8.475 1.23E+04 9.35E+04 bx
R25HG2-R25HN 1.611 8.478 1.52E+04 1.17E+05 bx
R28HG2-R28HN 1.637 8.402 5.20E+03 3.76E+04 bx
R14HB2-Q15HN 1.690 8.302 1.10E+04 8.49E+04 bx
R14HB3-Q15HN 1.765 8.298 1.36E+04 1.11E+05 bx
R23HB3-R23HN 1.786 8.133 4.88E+04 3.81E+05 bx
R14HB3-R14HN 1.761 8.056 3.22E+04 2.46E+05 bx
R30HB3-R30HN 1.867 7.981 7.43E+03 5.10E+04 bx
R30HB2-R30HN 1.743 7.977 5.17E+03 3.84E+04 bx
R23HB2-R23HN 1.714 8.138 8.32E+04 6.44E+05 bx
R14HB2-R14HN 1.676 8.058 3.71E+04 2.80E+05 bx
R21QB-R21HN 1.634 8.051 8.43E+04 6.26E+05 bx
R21QB-F22HN 1.636 8.129 2.77E+04 2.19E+05 bx
?-? 1.592 8.128 2.19E+04 1.66E+05 bx
R23QG-R23HN 1.560 8.134 2.33E+04 1.86E+05 bx
R14HG2-R14HN 1.511 8.057 1.56E+04 1.17E+05 bx
R14HG3-R14HN 1.543 8.055 1.62E+04 1.33E+05 bx
I16HG12-I16HN 1.464 8.212 2.00E+04 1.50E+05 bx
R21QG-F22HN 1.410 8.130 1.73E+04 1.31E+05 bx
R21QG-R21HN 1.413 8.051 3.73E+04 2.76E+05 bx
R14QG-Q15HN 1.532 8.310 5.88E+03 4.41E+04 bx
A12QB-A12HN 1.304 8.133 1.32E+05 8.93E+05 bx
A12QB-F13HN 1.308 8.077 7.12E+04 5.01E+05 bx
T11QG2-T11HN 1.194 8.066 4.49E+04 3.12E+05 bx
T11QG2-A12HN 1.193 8.130 1.82E+04 9.29E+04 bx
V24QQG-V24HN 0.963 8.122 1.01E+05 7.23E+05 bx
V24QQG-R25HN 0.952 8.476 4.62E+04 3.20E+05 bx
I16QG2-G17HN 0.920 8.454 2.38E+04 1.31E+05 bx
R30QG-R30HE 1.592 7.205 -7.48E+03 -4.92E+04 bx
P10HB2-P10HA 2.322 4.484 6.23E+04 4.65E+05 bx
P8HB2-P8HA 2.253 4.414 4.75E+04 3.55E+05 bx
Q15QG-Q15HA 2.343 4.340 2.38E+04 1.73E+05 bx
P10QG-P10HA 2.029 4.482 1.83E+04 1.42E+05 bx
V24HB-R23HA 2.076 4.332 5.80E+04 4.36E+05 bx
Q15HB3-Q15HA 1.970 4.331 3.29E+04 2.64E+05 bx
P8QG-P8HA 2.001 4.416 2.55E+04 1.82E+05 bx
P10HB3-P10HA 1.952 4.486 1.36E+04 1.09E+05 bx
P8HB3-P8HA 1.917 4.415 2.32E+04 1.70E+05 bx
Q15HB2-F13HA 2.088 4.574 3.85E+03 2.42E+04 bx
R28HB3-R25HA 1.844 4.349 3.56E+04 2.71E+05 bx
?-? 1.782 4.339 7.93E+04 6.07E+05 bx
?-? 1.771 4.358 2.80E+04 2.69E+05 bx
R28HB3-R28HA 1.851 4.376 2.31E+04 2.08E+05 bx
R23HB2-R23HA 1.715 4.334 5.56E+04 4.22E+05 bx
R23QG-R23HA 1.563 4.334 2.48E+04 1.84E+05 bx
?-? 1.594 4.338 2.38E+04 1.86E+05 bx
R25HG3-R25HA 1.653 4.343 1.60E+04 1.28E+05 bx
R14HB3-R14HA 1.763 4.262 4.64E+04 3.57E+05 bx
R14HB2-R14HA 1.687 4.260 4.81E+04 3.79E+05 bx
R21QB-R21HA 1.637 4.225 9.95E+04 7.43E+05 bx
I29HB-R30HA 1.880 4.197 4.59E+04 3.34E+05 bx
?-I29HA 1.849 4.168 2.23E+04 1.64E+05 bx
V24HB-V24HA 2.057 4.089 3.92E+04 2.99E+05 bx
P8QG-G7QA 2.003 4.012 7.29E+03 5.22E+04 bx
I4HB-I4HA 1.718 4.052 1.28E+04 8.94E+04 bx
R14HG3-R14HA 1.541 4.263 2.51E+04 1.90E+05 bx
R14HG2-R14HA 1.515 4.258 1.97E+04 1.55E+05 bx
R21QG-R21HA 1.409 4.224 3.51E+04 2.52E+05 bx
I16HG12-I16HA 1.483 4.196 7.52E+03 5.45E+04 bx
A12QB-R14HA 1.308 4.275 1.75E+05 1.26E+06 bx
T11QG2-T11HA 1.196 4.218 1.46E+05 1.17E+06 bx
T11QG2-T11HB 1.193 4.197 1.52E+05 1.25E+06 bx
V24QQG-V24HA 0.954 4.088 7.70E+04 6.29E+05 bx
I16QG2-I16HA 0.919 4.198 6.55E+04 4.39E+05 bx
I16QD1-I16HA 0.857 4.198 1.29E+04 9.07E+04 bx
I4QG2-I4HA 0.619 4.051 9.00E+03 4.80E+04 bx
A3QB-A3HA 1.351 4.322 1.67E+05 9.43E+05 bx
P10QG-P10HD2 2.036 3.824 6.00E+04 4.73E+05 bx
P10QG-P10HD3 2.026 3.773 6.63E+04 5.11E+05 bx
P10HB3-P10HD2 1.951 3.824 1.74E+04 1.38E+05 bx
P10HB3-P10HD3 1.950 3.773 2.26E+04 1.82E+05 bx
P10HB2-P10HD2 2.322 3.826 9.01E+03 6.83E+04 bx
P8HB2-P8HD2 2.248 3.528 1.31E+04 9.81E+04 bx
P8QG-P8HD3 1.998 3.576 1.15E+05 9.19E+05 bx
P8QG-P8HD2 1.999 3.528 1.38E+05 1.08E+06 bx
P8HB3-P8HD3 1.930 3.579 3.02E+04 2.35E+05 bx
P8HB3-P8HD2 1.931 3.534 2.91E+04 2.44E+05 bx
P8HB2-P8HD3 2.248 3.569 1.36E+03 2.02E+04 bx
R25HB3-R23QD 1.849 3.173 5.32E+03 3.17E+04 bx
?-? 1.781 3.174 3.48E+04 2.79E+05 bx
?-? 1.701 3.161 2.50E+04 1.96E+05 bx
R14HB2-R14QD 1.694 3.154 2.97E+04 2.21E+05 bx
?-? 1.647 3.186 5.66E+04 4.33E+05 bx
R21QB-R21QD 1.635 3.095 3.98E+04 3.09E+05 bx
R14HG2-R14QD 1.515 3.145 3.92E+04 3.22E+05 bx
?-? 1.587 3.184 1.28E+05 9.36E+05 bx
R14HG3-R14QD 1.544 3.151 8.40E+04 6.73E+05 bx
V24QQG-V24HB 0.963 2.064 3.25E+05 2.31E+06 bx
I16QG2-I16HB 0.909 1.871 8.00E+04 6.43E+05 bx
I16QD1-I16HB 0.855 1.868 2.00E+04 1.42E+05 bx
I4QG2-I4HB 0.624 1.718 1.38E+05 9.86E+05 bx
I4HG13-I4HB 1.092 1.710 2.78E+04 2.11E+05 bx
I16HG12-I16HB 1.469 1.875 3.77E+04 2.76E+05 bx
I29QD1-I29HG12 0.857 1.480 3.02E+05 2.22E+06 bx
I16QG2-I16HG12 0.916 1.484 2.18E+04 1.51E+05 bx
I16QD1-I16HG12 0.850 1.459 1.61E+05 1.30E+06 bx
I4QD1-I4HG12 0.798 1.416 1.14E+05 8.44E+05 bx
I4QG2-I4HG13 0.620 1.110 8.83E+03 4.83E+04 bx
I4QG2-I4QD1 0.617 0.792 2.23E+04 1.65E+05 bx
I16QG2-I16HG13 0.918 1.188 6.04E+04 4.72E+05 bx
I29QD1-I29HG13 0.868 1.192 2.88E+05 2.21E+06 bx
I16QD1-I16HG13 0.861 1.166 1.29E+05 1.02E+06 bx
I4QD1-I4HG13 0.811 1.104 2.30E+05 1.81E+06 bx
P10QG-P10HB2 2.032 2.318 9.97E+04 8.02E+05 bx
P8QG-P8HB2 2.007 2.249 2.03E+05 1.61E+06 bx
Q15HB2-Q15QG 2.090 2.340 2.25E+05 1.78E+06 bx
Q15HB3-Q15QG 1.968 2.327 1.41E+05 1.14E+06 bx
P10HB3-P10HB2 1.937 2.322 1.42E+05 1.18E+06 bx
P8HB3-P8HB2 1.931 2.252 1.66E+05 1.29E+06 bx
Q15QG-Q15HB2 2.335 2.086 4.18E+05 3.17E+06 bx
Q15QG-Q15HB3 2.337 1.966 2.14E+05 1.61E+06 bx
P10HB2-P10HB3 2.324 1.952 1.43E+05 1.15E+06 bx
P8HB2-P8HB3 2.246 1.926 1.46E+05 1.15E+06 bx
P8HB2-P8QG 2.239 2.004 1.33E+05 1.05E+06 bx
Q15HB2-Q15HB3 2.078 1.973 8.81E+05 6.96E+06 bx
Q15HB3-Q15HB2 1.971 2.082 8.79E+05 6.94E+06 bx
?-? 1.655 1.851 3.58E+05 2.86E+06 bx
?-? 1.841 1.651 4.63E+05 3.87E+06 bx
?-? 1.836 1.609 3.55E+05 2.99E+06 bx
?-? 1.599 1.833 3.29E+05 2.67E+06 bx
R21QG-R21QB 1.415 1.637 4.99E+05 4.00E+06 bx
R14HG2-R14HB2 1.522 1.682 1.98E+05 1.56E+06 bx
R14QG-R14HB2 1.555 1.703 3.37E+05 2.66E+06 bx
?-? 1.596 1.740 8.25E+05 7.04E+06 bx
?-? 1.597 1.762 7.35E+05 6.27E+06 bx
?-? 1.844 1.768 1.64E+06 1.36E+07 bx
?-? 1.768 1.851 1.53E+06 1.23E+07 bx
?-? 1.703 1.772 1.06E+06 9.07E+06 bx
R30HB2-R30QG 1.742 1.594 7.13E+05 5.71E+06 bx
R14HB3-R14HB2 1.763 1.688 8.51E+05 7.44E+06 bx
I16HG13-I16HG12 1.195 1.472 3.35E+05 2.61E+06 bx
R21QB-R21QG 1.628 1.412 5.14E+05 3.98E+06 bx
I16HG12-I16HG13 1.465 1.188 4.38E+05 3.51E+06 bx
I29HG12-I29QD1 1.487 0.866 1.90E+05 1.38E+06 bx
I16HG13-I16QD1 1.194 0.874 1.29E+05 1.00E+06 bx
V24HB-V24QQG 2.055 0.958 2.16E+05 1.61E+06 bx
I4HG13-I4HG12 1.111 1.417 1.02E+05 8.08E+05 bx
I4HG12-I4HG13 1.403 1.105 1.13E+05 9.16E+05 bx
I16HG12-I16QG2 1.472 0.918 1.45E+04 1.22E+05 bx
I29HB-I29QG2 1.889 0.922 3.86E+04 3.05E+05 bx
I16HB-I16QG2 1.862 0.917 5.47E+04 4.26E+05 bx
I16HB-I16QD1 1.869 0.853 2.90E+04 2.08E+05 bx
I4HB-I4QG2 1.701 0.622 5.97E+04 4.41E+05 bx
I4HG13-I4QD1 1.093 0.810 1.03E+05 8.02E+05 bx
I4HG12-I4QG2 1.411 0.623 5.98E+03 4.05E+04 bx
I4HG13-I4QG2 1.103 0.626 5.83E+03 4.47E+04 bx
I4QD1-I4QG2 0.800 0.623 1.40E+04 1.03E+05 bx
R21QG-R21QD 1.406 3.088 6.13E+04 4.55E+05 bx
V24HA-R23HA 4.089 4.334 2.76E+04 2.17E+05 bx
G2HN-N1HB2 8.663 3.013 -1.12E+04 -8.01E+04 bx
G2HN-N1HB3 8.665 2.940 -5.64E+03 -3.38E+04 bx
P10HB3-A12HN 1.950 8.133 5.30E+03 3.86E+04 bx
C26HN-V24HB 8.464 2.068 1.90E+04 1.45E+05 bx
C19HN-N18HB2 8.438 2.786 1.87E+04 1.50E+05 bx
C26QB-C26HN 2.922 8.404 2.24E+04 1.37E+05 bx
R28HA-R28HN 4.394 8.407 2.10E+04 1.53E+05 bx
I29HA-I29HN 4.170 8.278 2.55E+04 1.77E+05 bx
I16HA-Q15HN 4.193 8.302 9.67E+03 7.01E+04 bx
?-? 3.172 7.174 3.05E+04 1.95E+05 bx
R30HA-R30HN 4.193 7.980 2.56E+04 2.08E+05 bx
F22HN-G20QA 8.126 3.940 7.70E+03 5.01E+04 bx
C5HN-C5QB 8.281 2.828 4.09E+04 3.08E+05 bx
W6HB2-W6HA 3.218 4.743 1.65E+04 1.11E+05 bx
W6HB3-W6HA 3.336 4.741 1.49E+04 1.24E+05 bx
C19QB-F22HA 2.988 4.660 2.35E+04 2.02E+05 bx
I16HB-G17HN 1.870 8.458 2.83E+04 2.33E+05 bx
?-? 4.391 1.863 1.79E+04 9.71E+04 bx
P10HD2-P10HB3 3.822 1.951 8.72E+03 7.44E+04 bx
P10HD3-P10HB3 3.771 1.952 1.31E+04 1.10E+05 bx
P8HD3-P8HB3 3.569 1.931 2.26E+04 1.76E+05 bx
P8HD2-P8HB3 3.521 1.936 2.37E+04 1.87E+05 bx
?-? 4.335 3.177 6.81E+03 5.07E+04 bx
I16HB-I16HG12 1.869 1.474 6.10E+04 4.68E+05 bx
I4HB-I4HG13 1.719 1.110 3.60E+04 2.80E+05 bx
?-? 1.904 1.489 9.53E+03 6.67E+04 bx
?-? 1.871 1.201 2.16E+04 1.76E+05 bx
?-? 3.338 8.051 6.44E+03 4.04E+04 bx
?-? 0.871 1.114 3.75E+04 2.40E+05 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 . . 11.4995 ppm . . . 4.704 . . 36321 3
2 . . H 1 H . . 12.984 ppm . . . 4.704 . . 36321 3
stop_
save_