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 30919
_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 2
_Spectral_peak_list.Experiment_name '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
;
# Number of dimensions 2
#INAME 1 H1
#INAME 2 H1
12 3.887 8.598 1 U 3.097e+05 0.00e+00 e 0 6 9 0
16 4.097 8.598 1 U 2.562e+05 0.00e+00 e 0 11 9 0
17 4.075 8.598 1 U 1.327e+05 0.00e+00 e 0 12 9 0
26 4.097 8.710 1 U 2.815e+05 0.00e+00 e 0 11 16 0
27 4.075 8.710 1 U 5.026e+05 0.00e+00 e 0 12 16 0
31 4.653 8.710 1 U 2.885e+05 0.00e+00 e 0 18 16 0
32 3.310 8.710 1 U 3.870e+05 0.00e+00 e 0 20 16 0
33 3.025 8.710 1 U 2.758e+05 0.00e+00 e 0 21 16 0
36 3.310 3.025 1 U 5.251e+06 0.00e+00 e 0 20 21 0
40 4.653 3.310 1 U 6.680e+05 0.00e+00 e 0 18 20 0
41 4.653 3.025 1 U 2.707e+05 0.00e+00 e 0 18 21 0
48 4.653 8.712 1 U 2.760e+05 0.00e+00 e 0 18 25 0
49 3.310 8.712 1 U 2.696e+05 0.00e+00 e 0 20 25 0
50 3.025 8.712 1 U 3.389e+05 0.00e+00 e 0 21 25 0
55 4.455 8.712 1 U 3.693e+05 0.00e+00 e 0 27 25 0
56 3.288 8.712 1 U 2.724e+05 0.00e+00 e 0 29 25 0
57 2.929 8.712 1 U 4.800e+05 0.00e+00 e 0 30 25 0
60 3.288 2.929 1 U 5.338e+06 0.00e+00 e 0 29 30 0
64 4.455 3.288 1 U 9.021e+05 0.00e+00 e 0 27 29 0
65 4.455 2.929 1 U 3.797e+05 0.00e+00 e 0 27 30 0
72 4.455 8.123 1 U 2.848e+05 0.00e+00 e 0 27 34 0
73 3.288 8.123 1 U 1.594e+05 0.00e+00 e 0 29 34 0
74 2.929 8.123 1 U 1.468e+05 0.00e+00 e 0 30 34 0
75 8.123 8.712 1 U 3.290e+05 0.00e+00 e 0 34 25 0
79 4.347 8.123 1 U 3.873e+05 0.00e+00 e 0 36 34 0
81 3.850 8.123 1 U 2.142e+05 0.00e+00 e 0 40 34 0
88 4.347 3.850 1 U 1.375e+06 0.00e+00 e 0 36 40 0
96 4.347 8.111 1 U 1.163e+05 0.00e+00 e 0 36 44 0
98 3.850 8.111 1 U 2.004e+05 0.00e+00 e 0 40 44 0
103 5.175 8.111 1 U 3.135e+05 0.00e+00 e 0 46 44 0
104 3.330 8.111 1 U 3.674e+05 0.00e+00 e 0 50 44 0
106 3.330 7.316 1 U 2.614e+05 0.00e+00 e 0 50 57 0
108 3.330 8.605 1 U 2.575e+04 0.00e+00 e 0 50 58 0
110 7.316 8.605 1 U 4.351e+04 0.00e+00 e 0 57 58 0
122 5.175 3.330 1 U 9.090e+05 0.00e+00 e 0 46 50 0
138 3.961 2.384 1 U 1.144e+05 0.00e+00 e 0 72 65 0
139 3.879 2.384 1 U 6.316e+04 0.00e+00 e 0 73 65 0
140 2.143 1.977 1 U 1.119e+06 0.00e+00 e 0 69 66 0
141 2.040 1.977 1 U 1.078e+06 0.00e+00 e 0 70 66 0
142 3.961 1.977 1 U 2.134e+05 0.00e+00 e 0 72 66 0
143 3.879 1.977 1 U 3.246e+05 0.00e+00 e 0 73 66 0
145 3.961 2.143 1 U 3.802e+05 0.00e+00 e 0 72 69 0
146 3.879 2.143 1 U 5.139e+05 0.00e+00 e 0 73 69 0
147 3.961 2.040 1 U 3.336e+05 0.00e+00 e 0 72 70 0
148 3.879 2.040 1 U 4.091e+05 0.00e+00 e 0 73 70 0
150 4.290 2.384 1 U 9.274e+05 0.00e+00 e 0 63 65 0
151 4.290 1.977 1 U 1.798e+05 0.00e+00 e 0 63 66 0
152 4.290 2.143 1 U 1.091e+05 0.00e+00 e 0 63 69 0
153 4.290 2.040 1 U 3.335e+05 0.00e+00 e 0 63 70 0
154 4.290 3.961 1 U 7.662e+04 0.00e+00 e 0 63 72 0
155 4.290 3.879 1 U 2.205e+04 0.00e+00 e 0 63 73 0
156 2.384 1.977 1 U 1.300e+06 0.00e+00 e 0 65 66 0
157 2.384 2.143 1 U 4.215e+05 0.00e+00 e 0 65 69 0
158 2.384 2.040 1 U 4.611e+05 0.00e+00 e 0 65 70 0
165 2.143 2.040 1 U 2.550e+06 0.00e+00 e 0 69 70 0
170 3.961 3.879 1 U 1.759e+06 0.00e+00 e 0 72 73 0
178 4.290 8.462 1 U 4.771e+04 0.00e+00 e 0 63 77 0
179 2.384 8.462 1 U 3.293e+03 0.00e+00 e 0 65 77 0
180 1.977 8.462 1 U 1.162e+05 0.00e+00 e 0 66 77 0
184 4.245 8.462 1 U 1.013e+05 0.00e+00 e 0 79 77 0
185 1.381 8.462 1 U 2.774e+05 0.00e+00 e 0 80 77 0
189 4.245 1.381 1 U 3.203e+06 0.00e+00 e 0 79 80 0
194 4.245 7.836 1 U 1.597e+05 0.00e+00 e 0 79 87 0
195 1.381 7.836 1 U 1.366e+05 0.00e+00 e 0 80 87 0
196 7.836 8.462 1 U 1.059e+05 0.00e+00 e 0 87 77 0
199 4.488 7.836 1 U 7.720e+04 0.00e+00 e 0 89 87 0
200 3.791 7.836 1 U 5.331e+04 0.00e+00 e 0 91 87 0
201 3.218 7.836 1 U 2.280e+05 0.00e+00 e 0 92 87 0
204 3.791 3.218 1 U 3.692e+06 0.00e+00 e 0 91 92 0
208 4.488 3.791 1 U 4.311e+05 0.00e+00 e 0 89 91 0
209 4.488 3.218 1 U 5.432e+05 0.00e+00 e 0 89 92 0
215 7.836 8.517 1 U 6.635e+05 0.00e+00 e 0 87 96 0
216 4.488 8.517 1 U 4.606e+05 0.00e+00 e 0 89 96 0
217 3.791 8.517 1 U 2.930e+05 0.00e+00 e 0 91 96 0
218 3.218 8.517 1 U 1.692e+05 0.00e+00 e 0 92 96 0
223 4.143 8.517 1 U 2.952e+05 0.00e+00 e 0 98 96 0
224 1.451 8.517 1 U 7.656e+05 0.00e+00 e 0 99 96 0
228 4.143 1.451 1 U 1.283e+06 0.00e+00 e 0 98 99 0
233 4.143 8.028 1 U 2.045e+05 0.00e+00 e 0 98 106 0
234 1.451 8.028 1 U 3.357e+05 0.00e+00 e 0 99 106 0
235 8.028 8.517 1 U 3.631e+05 0.00e+00 e 0 106 96 0
238 4.180 8.028 1 U 3.339e+05 0.00e+00 e 0 108 106 0
239 1.412 8.028 1 U 5.834e+05 0.00e+00 e 0 109 106 0
243 4.180 1.412 1 U 1.629e+06 0.00e+00 e 0 108 109 0
248 4.180 7.727 1 U 9.297e+04 0.00e+00 e 0 108 116 0
249 1.412 7.727 1 U 7.822e+04 0.00e+00 e 0 109 116 0
250 7.727 8.028 1 U 1.980e+05 0.00e+00 e 0 116 106 0
253 4.767 7.727 1 U 3.248e+03 0.00e+00 e 0 118 116 0
254 2.937 7.727 1 U 6.284e+04 0.00e+00 e 0 120 116 0
255 2.783 7.727 1 U 1.480e+05 0.00e+00 e 0 121 116 0
256 2.937 7.571 1 U 4.973e+04 0.00e+00 e 0 120 125 0
257 2.783 7.571 1 U 1.312e+05 0.00e+00 e 0 121 125 0
258 2.937 6.900 1 U 5.196e+04 0.00e+00 e 0 120 126 0
259 2.783 6.900 1 U 1.089e+05 0.00e+00 e 0 121 126 0
263 2.937 2.783 1 U 6.836e+06 0.00e+00 e 0 120 121 0
271 6.900 7.571 1 U 2.286e+07 0.00e+00 e 0 126 125 0
272 4.767 2.937 1 U 1.731e+05 0.00e+00 e 0 118 120 0
273 4.767 2.783 1 U 6.248e+03 0.00e+00 e 0 118 121 0
281 7.727 7.995 1 U 4.139e+05 0.00e+00 e 0 116 130 0
282 4.767 7.995 1 U 1.803e+04 0.00e+00 e 0 118 130 0
283 2.937 7.995 1 U 6.619e+04 0.00e+00 e 0 120 130 0
284 2.783 7.995 1 U 5.670e+04 0.00e+00 e 0 121 130 0
289 4.877 7.995 1 U 2.495e+05 0.00e+00 e 0 132 130 0
290 2.831 7.995 1 U 1.448e+05 0.00e+00 e 0 134 130 0
291 2.649 7.995 1 U 3.780e+05 0.00e+00 e 0 135 130 0
292 2.831 7.540 1 U 1.378e+05 0.00e+00 e 0 134 139 0
293 2.649 7.540 1 U 3.645e+05 0.00e+00 e 0 135 139 0
294 2.831 7.038 1 U 3.591e+04 0.00e+00 e 0 134 140 0
295 2.649 7.038 1 U 1.279e+05 0.00e+00 e 0 135 140 0
299 2.831 2.649 1 U 4.133e+06 0.00e+00 e 0 134 135 0
307 7.038 7.540 1 U 9.702e+06 0.00e+00 e 0 140 139 0
308 4.877 2.831 1 U 4.485e+05 0.00e+00 e 0 132 134 0
309 4.877 2.649 1 U 2.911e+05 0.00e+00 e 0 132 135 0
317 7.995 8.382 1 U 3.369e+05 0.00e+00 e 0 130 144 0
318 4.877 8.382 1 U 2.770e+05 0.00e+00 e 0 132 144 0
319 2.831 8.382 1 U 5.469e+04 0.00e+00 e 0 134 144 0
320 2.649 8.382 1 U 3.649e+04 0.00e+00 e 0 135 144 0
325 4.153 8.382 1 U 4.054e+05 0.00e+00 e 0 146 144 0
326 2.093 8.382 1 U 2.036e+05 0.00e+00 e 0 148 144 0
327 1.974 8.382 1 U 4.500e+05 0.00e+00 e 0 149 144 0
328 2.360 8.382 1 U 2.160e+05 0.00e+00 e 0 154 144 0
338 2.360 2.093 1 U 2.844e+05 0.00e+00 e 0 154 148 0
339 2.360 1.974 1 U 1.451e+06 0.00e+00 e 0 154 149 0
348 6.837 7.435 1 U 5.170e+06 0.00e+00 e 0 158 157 0
349 4.153 2.093 1 U 4.101e+05 0.00e+00 e 0 146 148 0
350 4.153 1.974 1 U 1.704e+05 0.00e+00 e 0 146 149 0
351 4.153 2.360 1 U 2.404e+05 0.00e+00 e 0 146 154 0
352 2.093 1.974 1 U 2.429e+06 0.00e+00 e 0 148 149 0
363 4.153 8.399 1 U 3.070e+05 0.00e+00 e 0 146 162 0
364 2.093 8.399 1 U 9.147e+04 0.00e+00 e 0 148 162 0
365 1.974 8.399 1 U 1.507e+05 0.00e+00 e 0 149 162 0
366 2.360 8.399 1 U 2.301e+04 0.00e+00 e 0 154 162 0
372 4.584 8.399 1 U 6.704e+05 0.00e+00 e 0 164 162 0
373 2.761 8.399 1 U 2.272e+05 0.00e+00 e 0 166 162 0
374 2.667 8.399 1 U 3.431e+05 0.00e+00 e 0 167 162 0
377 2.761 2.667 1 U 1.036e+07 0.00e+00 e 0 166 167 0
381 4.584 2.761 1 U 5.252e+05 0.00e+00 e 0 164 166 0
382 4.584 2.667 1 U 4.981e+05 0.00e+00 e 0 164 167 0
388 7.828 8.399 1 U 4.094e+05 0.00e+00 e 0 173 162 0
393 4.584 7.828 1 U 4.104e+05 0.00e+00 e 0 164 173 0
394 2.761 7.828 1 U 9.376e+04 0.00e+00 e 0 166 173 0
395 2.667 7.828 1 U 1.099e+05 0.00e+00 e 0 167 173 0
396 4.672 7.828 1 U 3.203e+05 0.00e+00 e 0 175 173 0
397 3.125 7.828 1 U 2.809e+05 0.00e+00 e 0 177 173 0
398 2.935 7.828 1 U 5.491e+05 0.00e+00 e 0 178 173 0
399 3.125 7.087 1 U 7.828e+05 0.00e+00 e 0 177 180 0
400 2.935 7.087 1 U 8.196e+05 0.00e+00 e 0 178 180 0
401 3.125 6.819 1 U 5.711e+04 0.00e+00 e 0 177 181 0
402 2.935 6.819 1 U 7.052e+04 0.00e+00 e 0 178 181 0
406 3.125 2.935 1 U 9.879e+06 0.00e+00 e 0 177 178 0
414 6.819 7.087 1 U 2.360e+06 0.00e+00 e 0 181 180 0
415 4.672 3.125 1 U 7.175e+05 0.00e+00 e 0 175 177 0
416 4.672 2.935 1 U 4.104e+05 0.00e+00 e 0 175 178 0
422 7.828 7.937 1 U 4.023e+05 0.00e+00 e 0 173 196 0
423 4.672 7.937 1 U 1.683e+05 0.00e+00 e 0 175 196 0
424 3.125 7.937 1 U 7.191e+04 0.00e+00 e 0 177 196 0
425 2.935 7.937 1 U 1.682e+05 0.00e+00 e 0 178 196 0
430 4.735 7.937 1 U 1.391e+05 0.00e+00 e 0 198 196 0
431 3.311 7.937 1 U 8.478e+04 0.00e+00 e 0 200 196 0
432 2.839 7.937 1 U 5.696e+05 0.00e+00 e 0 201 196 0
435 3.311 2.839 1 U 4.940e+06 0.00e+00 e 0 200 201 0
439 4.735 3.311 1 U 4.249e+05 0.00e+00 e 0 198 200 0
440 4.735 2.839 1 U 1.057e+05 0.00e+00 e 0 198 201 0
446 5.175 3.961 1 U 1.297e+06 0.00e+00 e 0 46 72 0
447 5.175 3.879 1 U 9.705e+05 0.00e+00 e 0 46 73 0
451 4.280 8.517 3 U 5.783e+04 0.00e+00 e 0 63 96 0
452 3.311 8.516 3 U 8.817e+04 0.00e+00 e 0 50 96 0
453 2.844 7.828 3 U 6.987e+04 0.00e+00 e 0 134 173 0
454 4.157 7.827 3 U 4.871e+04 0.00e+00 e 0 98 87 0
455 3.320 7.836 3 U 1.199e+05 0.00e+00 e 0 50 87 0
456 4.870 8.399 3 U 6.148e+04 0.00e+00 e 0 132 144 0
457 4.491 7.542 4 U 3.208e+04 0.00e+00 e 0 89 139 0
458 1.382 7.319 4 U 2.695e+04 0.00e+00 e 0 80 57 0
459 1.386 8.516 3 U 4.177e+04 0.00e+00 e 0 80 96 0
460 4.271 8.028 3 U 9.364e+04 0.00e+00 e 0 63 106 0
461 2.948 8.029 3 U 4.722e+04 0.00e+00 e 0 120 106 0
462 2.782 8.028 4 U 1.836e+04 0.00e+00 e 0 0 0 0
463 4.156 7.995 3 U 7.384e+04 0.00e+00 e 0 98 130 0
464 4.156 7.937 3 U 6.477e+04 0.00e+00 e 0 146 196 0
465 7.082 7.828 3 U 1.235e+05 0.00e+00 e 0 180 173 0
466 2.845 7.573 4 U 1.749e+05 0.00e+00 e 0 0 0 0
467 1.383 7.572 3 U 4.101e+04 0.00e+00 e 0 80 125 0
468 2.776 7.539 3 U 6.506e+04 0.00e+00 e 0 121 139 0
469 2.933 7.541 3 U 2.813e+04 0.00e+00 e 0 120 139 0
470 4.875 7.540 3 U 1.302e+04 0.00e+00 e 0 132 139 0
471 2.785 7.037 3 U 3.589e+04 0.00e+00 e 0 121 140 0
472 2.936 7.037 3 U 2.264e+04 0.00e+00 e 0 120 140 0
473 2.664 7.084 3 U 6.947e+04 0.00e+00 e 0 0 0 0
474 2.830 7.084 3 U 7.733e+04 0.00e+00 e 0 134 180 0
475 2.785 7.085 4 U 4.738e+04 0.00e+00 e 0 0 0 0
477 4.678 7.087 3 U 3.182e+05 0.00e+00 e 0 175 180 0
479 1.395 6.899 3 U 2.515e+04 0.00e+00 e 0 80 126 0
480 2.794 6.819 4 U 3.411e+04 0.00e+00 e 0 0 0 0
481 2.842 6.819 3 U 2.343e+04 0.00e+00 e 0 134 181 0
482 3.316 6.817 4 U 1.800e+04 0.00e+00 e 0 0 0 0
483 4.672 6.819 3 U 5.905e+04 0.00e+00 e 0 175 181 0
484 4.456 4.146 3 U 5.850e+04 0.00e+00 e 0 27 98 0
486 4.151 2.839 3 U 2.743e+05 0.00e+00 e 0 146 201 0
487 4.154 2.651 4 U 1.254e+05 0.00e+00 e 0 98 135 0
488 4.291 1.451 3 U 2.955e+05 0.00e+00 e 0 63 99 0
489 4.456 1.447 3 U 4.774e+05 0.00e+00 e 0 27 99 0
491 3.855 7.318 4 U 4.242e+04 0.00e+00 e 0 40 57 0
492 4.656 7.319 4 U 1.109e+05 0.00e+00 e 0 18 57 0
493 5.174 7.318 3 U 2.530e+04 0.00e+00 e 0 46 57 0
494 2.647 6.818 1 U 2.240e+04 0.00e+00 e 0 0 0 0
495 4.148 3.314 1 U 9.401e+04 0.00e+00 e 0 146 200 0
496 3.316 7.085 1 U 3.046e+04 0.00e+00 e 0 0 0 0
;
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 . . 9.9972 ppm . . . 4.695 . . 30919 1
2 . . H 1 H . . 9.9972 ppm . . . 4.695 . . 30919 1
stop_
save_