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 30491
_Spectral_peak_list.ID 1
_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.Experiment_ID 10
_Spectral_peak_list.Experiment_name '3D 1H-15N NOESY'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 3
_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 3
# FORMAT xeasy3D
# INAME 1 HC
# INAME 2 C
# INAME 3 H
# SPECTRUM C13NOESY HC C H
1 5.883 131.884 4.393 1 T 2.984e+05 0.00e+00 a 0 1334 1345 1279 0
3 7.004 131.691 4.407 1 T 1.201e+06 0.00e+00 a 0 1386 1390 1381 0
5 7.717 120.829 0.982 1 T 4.495e+05 0.00e+00 a 0 163 159 221 0
6 7.713 120.677 0.955 1 T 4.549e+05 0.00e+00 a 0 163 159 221 0
7 7.720 120.755 3.430 1 T 4.081e+05 0.00e+00 a 0 163 159 153 0
8 7.718 120.753 4.281 1 T 4.827e+05 0.00e+00 a 0 163 159 151 0
9 7.718 120.568 7.715 1 T 3.391e+06 0.00e+00 a 0 163 159 163 0
10 7.192 120.142 7.187 1 T 7.602e+06 0.00e+00 a 0 1290 1286 1290 0
13 7.723 120.504 6.635 1 T 6.881e+05 0.00e+00 a 0 163 159 167 0
14 7.436 127.652 4.290 1 T 3.245e+05 0.00e+00 a 0 162 157 151 0
15 7.440 127.659 4.729 1 T 3.101e+05 0.00e+00 a 0 162 157 112 0
16 7.434 127.508 3.231 1 T 4.245e+05 0.00e+00 a 0 162 157 154 0
18 7.448 127.034 2.411 1 T 2.451e+05 0.00e+00 a 0 162 157 1212 0
19 7.440 127.472 2.765 1 T 2.705e+05 0.00e+00 a 0 162 157 116 0
23 7.329 132.023 5.049 1 T 3.703e+05 0.00e+00 a 0 254 258 249 0
24 7.349 132.149 4.484 1 T 3.506e+05 0.00e+00 a 0 254 258 204 0
26 7.193 133.135 6.657 1 T 2.333e+06 0.00e+00 a 0 1518 1529 1519 0
27 7.196 133.315 4.413 1 T 1.151e+06 0.00e+00 a 0 1518 1529 1513 0
30 7.188 133.258 2.597 1 T 1.821e+06 0.00e+00 a 0 1518 1529 1517 0
32 7.192 133.375 0.217 1 T 5.851e+05 0.00e+00 a 0 1518 1529 1494 0
33 7.192 133.351 1.017 1 T 1.325e+06 0.00e+00 a 0 1518 1529 486 0
39 7.198 120.233 1.741 1 T 3.268e+05 0.00e+00 a 0 1290 1286 142 0
40 7.191 119.965 2.281 1 T 3.095e+05 0.00e+00 a 0 1290 1286 143 0
41 7.120 133.219 4.554 1 T 6.052e+05 0.00e+00 a 0 50 61 45 0
44 7.123 133.358 6.845 1 T 3.274e+06 0.00e+00 a 0 50 61 51 0
47 7.119 133.165 2.988 1 T 1.185e+06 0.00e+00 a 0 50 61 48 0
49 7.063 133.508 6.769 1 T 1.289e+06 0.00e+00 a 0 1542 1553 1543 0
50 7.065 133.757 4.945 1 T 5.068e+05 0.00e+00 a 0 1542 1553 1537 0
51 7.051 133.545 3.325 1 T 5.584e+05 0.00e+00 a 0 1542 1553 1540 0
54 7.059 133.508 2.572 1 T 8.331e+05 0.00e+00 a 0 1542 1553 1517 0
55 7.058 133.477 0.971 1 T 6.021e+05 0.00e+00 a 0 1542 1553 381 0
60 7.008 132.494 4.160 1 T 1.249e+06 0.00e+00 a 0 539 543 534 0
69 6.999 131.990 0.453 1 T 1.236e+06 0.00e+00 a 0 539 543 1499 0
72 7.003 132.020 1.039 1 T 2.246e+06 0.00e+00 a 0 539 543 486 0
75 7.039 130.112 1.021 1 T 1.469e+06 0.00e+00 a 0 1387 1392 495 0
76 7.033 130.048 0.470 1 T 7.973e+05 0.00e+00 a 0 1387 1392 1461 0
79 6.973 128.783 0.736 1 T 7.091e+05 0.00e+00 a 0 1395 1394 408 0
81 6.972 128.928 0.437 1 T 5.197e+05 0.00e+00 a 0 1395 1394 1143 0
1395 1394 1460
84 6.893 132.620 6.617 1 T 3.243e+06 0.00e+00 a 0 1623 1634 1624 0
85 6.894 132.603 4.125 1 T 8.374e+05 0.00e+00 a 0 1623 1634 1561 0
87 6.884 132.624 3.622 1 T 1.028e+06 0.00e+00 a 0 1623 1634 1618 0
88 6.892 132.654 3.051 1 T 1.429e+06 0.00e+00 a 0 1623 1634 1621 0
89 6.892 132.586 2.543 1 T 1.150e+06 0.00e+00 a 0 1623 1634 1620 0
90 6.895 132.687 2.004 1 T 8.945e+05 0.00e+00 a 0 1623 1634 1455 0
96 5.888 132.109 6.437 1 T 2.109e+06 0.00e+00 a 0 1334 1345 1335 0
98 5.892 132.006 2.839 1 T 8.291e+05 0.00e+00 a 0 1334 1345 1332 0
99 5.897 132.075 2.019 1 T 8.507e+05 0.00e+00 a 0 1334 1345 1331 0
100 5.888 132.092 0.943 1 T 1.190e+06 0.00e+00 a 0 1334 1345 221 0
101 5.874 131.903 0.452 1 T 4.606e+05 0.00e+00 a 0 1334 1345 1411 0
102 6.554 124.747 7.019 1 T 1.071e+06 0.00e+00 a 0 170 168 169 0
170 168 0
103 6.546 124.747 1.585 1 T 5.392e+05 0.00e+00 a 0 170 168 1193 0
104 6.559 124.572 0.715 1 T 5.333e+05 0.00e+00 a 0 170 168 1197 0
105 6.636 122.141 7.710 1 T 5.718e+05 0.00e+00 a 0 167 164 163 0
107 6.641 121.891 6.624 1 T 3.543e+06 0.00e+00 a 0 167 164 167 0
108 6.631 122.090 0.978 1 T 5.579e+05 0.00e+00 a 0 167 164 221 0
111 7.028 114.530 3.590 1 T 6.184e+05 0.00e+00 a 0 169 165 1329 0
112 7.026 114.779 3.911 1 T 4.544e+05 0.00e+00 a 0 169 165 1323 0
113 7.025 114.563 1.613 1 T 4.918e+05 0.00e+00 a 0 169 165 1193 0
114 7.022 114.575 1.260 1 T 6.769e+05 0.00e+00 a 0 169 165 1192 0
116 7.003 114.799 0.901 1 T 3.690e+05 0.00e+00 a 0 169 165 1198 0
118 7.022 114.343 4.559 1 T 4.442e+05 0.00e+00 a 0 169 165 1322 0
119 6.873 119.281 2.579 1 T 1.542e+06 0.00e+00 a 0 540 545 1428 0
123 6.753 118.440 7.041 1 T 1.998e+06 0.00e+00 a 0 1543 1551 1542 0
124 6.665 118.164 7.181 1 T 2.740e+06 0.00e+00 a 0 1519 1524 1518 0
125 6.750 118.342 1.035 1 T 1.216e+06 0.00e+00 a 0 1543 1551 486 0
129 6.761 118.803 1.934 1 T 5.439e+05 0.00e+00 a 0 1543 1551 460 0
131 6.754 118.351 2.619 1 T 6.043e+05 0.00e+00 a 0 1543 1551 1517 0
132 6.748 118.564 3.094 1 T 5.614e+05 0.00e+00 a 0 1543 1551 396 0
137 6.869 118.228 3.063 1 T 5.743e+05 0.00e+00 a 0 51 56 47 0
139 6.658 118.406 3.574 1 T 7.226e+05 0.00e+00 a 0 1519 1524 537 0
141 6.656 118.188 2.604 1 T 5.525e+05 0.00e+00 a 0 1519 1524 1517 0
142 6.664 118.381 0.998 1 T 6.367e+05 0.00e+00 a 0 1519 1524 1493 0
143 6.662 118.088 0.204 1 T 9.670e+05 0.00e+00 a 0 1519 1524 1498 0
1519 1524 1494
144 6.651 118.495 4.478 1 T 5.421e+05 0.00e+00 a 0 1519 1524 1513 0
146 6.616 119.168 6.885 1 T 3.177e+06 0.00e+00 a 0 1624 1632 1623 0
148 6.612 119.003 1.664 1 T 1.015e+06 0.00e+00 a 0 1624 1632 1406 0
149 6.613 119.044 1.438 1 T 1.518e+06 0.00e+00 a 0 1624 1632 1407 0
151 6.614 118.998 0.621 1 T 1.169e+06 0.00e+00 a 0 1624 1632 1477 0
152 6.614 119.219 0.501 1 T 1.240e+06 0.00e+00 a 0 1624 1632 1411 0
154 6.443 118.522 5.886 1 T 2.520e+06 0.00e+00 a 0 1335 1340 1334 0
158 6.440 118.779 2.022 1 T 9.583e+05 0.00e+00 a 0 1335 1340 1331 0
159 6.446 118.633 0.978 1 T 1.448e+06 0.00e+00 a 0 1335 1340 221 0
161 6.439 118.463 0.449 1 T 9.099e+05 0.00e+00 a 0 1335 1340 1411 0
276 6.869 118.098 2.553 1 T 4.188e+05 0.00e+00 a 0 51 56 35 0
279 7.707 120.494 2.130 1 T 2.625e+05 0.00e+00 a 0 163 159 207 0
280 7.024 114.679 6.567 1 T 9.876e+05 0.00e+00 a 0 169 165 170 0
282 6.561 124.725 1.254 1 T 3.739e+05 0.00e+00 a 0 170 168 1192 0
290 7.004 132.051 3.956 1 T 8.019e+05 0.00e+00 a 0 539 543 1444 0
292 6.874 118.987 4.169 1 T 6.568e+05 0.00e+00 a 0 540 545 1442 0
295 6.875 119.016 4.443 1 T 8.000e+05 0.00e+00 a 0 540 545 1371 0
298 6.881 119.020 3.567 1 T 5.042e+05 0.00e+00 a 0 540 545 537 0
300 6.861 119.388 0.218 1 T 5.445e+05 0.00e+00 a 0 540 545 1498 0
301 8.170 137.557 0.918 1 T 3.318e+05 0.00e+00 a 0 1291 1288 1356 0
302 8.162 137.689 1.763 1 T 2.811e+05 0.00e+00 a 0 1291 1288 142 0
304 8.181 137.551 7.230 1 T 3.182e+05 0.00e+00 a 0 1291 1288 1290 0
306 7.196 120.014 3.268 1 T 3.090e+05 0.00e+00 a 0 1290 1286 1281 0
307 7.188 120.036 3.361 1 T 3.227e+05 0.00e+00 a 0 1290 1286 1282 0
310 5.887 132.049 3.620 1 T 3.637e+05 0.00e+00 a 0 1334 1345 1329 0
311 5.886 131.810 3.294 1 T 3.357e+05 0.00e+00 a 0 1334 1345 1353 0
316 7.003 131.546 3.160 1 T 1.240e+06 0.00e+00 a 0 1386 1390 1384 0
319 7.194 133.578 3.961 1 T 4.785e+05 0.00e+00 a 0 1518 1529 1444 0
333 7.187 133.156 3.123 1 T 3.324e+05 0.00e+00 a 0 50 61 47 0
340 6.752 118.548 0.831 1 T 6.701e+05 0.00e+00 a 0 1543 1551 382 0
342 6.754 118.674 0.520 1 T 8.505e+05 0.00e+00 a 0 1543 1551 399 0
343 6.895 132.644 0.486 1 T 1.326e+06 0.00e+00 a 0 1623 1634 1461 0
347 6.609 119.278 3.585 1 T 4.723e+05 0.00e+00 a 0 1624 1632 1404 0
348 7.033 130.450 0.715 1 T 7.165e+05 0.00e+00 a 0 1387 1392 1142 0
1387 1392 408
;
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 . aliased 13.0204 ppm . . . 4.701 . . 30491 1
2 . . N 15 N . aliased 28.0324 ppm . . . 119.016 . . 30491 1
3 . . H 1 H . aliased 13.0204 ppm . . . 4.701 . . 30491 1
stop_
save_