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 31003
_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 5
_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 'modified for non-standard amino acids and cyclic peptide analysis'
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
# Number of dimensions 2
# Number of peaks 405
#FORMAT xeasy2D
#INAME 1 H1
#INAME 2 H2
#SPECTRUM NOESY H1 H2
1 3.995 2.090 1 U 1.92e+06 0 e 0 0 0 0
2 1.359 2.081 1 U 3.97e+07 0 e 0 0 0 0
3 1.453 2.079 1 U 1.44e+07 0 e 0 0 0 0
4 0.918 2.080 1 U 1.68e+07 0 e 0 0 0 0
5 2.574 2.092 1 U 4.96e+06 0 e 0 0 0 0
6 3.482 2.092 1 U 1.02e+07 0 e 0 0 0 0
7 4.002 0.999 1 U 6.05e+06 0 e 0 0 0 0
8 4.011 0.977 1 U 2.13e+06 0 e 0 0 0 0
9 3.479 1.042 1 U 1.48e+06 0 e 0 0 0 0
10 3.354 1.041 1 U 3.66e+06 0 e 0 0 0 0
11 3.001 0.986 1 U 6.54e+06 0 e 0 0 0 0
12 4.876 0.801 1 U 3.61e+06 0 e 0 0 0 0
13 4.881 0.887 1 U 5.93e+06 0 e 0 0 0 0
14 4.872 0.921 1 U 3.82e+06 0 e 0 0 0 0
15 4.723 0.897 1 U 7.52e+06 0 e 0 0 0 0
16 4.727 0.969 1 U 1.41e+07 0 e 0 0 0 0
17 4.289 0.989 1 U 1.45e+07 0 e 0 0 0 0
18 4.385 0.900 1 U 3.09e+07 0 e 0 0 0 0
19 4.606 0.944 1 U 1.45e+07 0 e 0 0 0 0
20 6.699 0.966 1 U 4.11e+06 0 e 0 0 0 0
21 6.694 0.897 1 U 1.34e+07 0 e 0 0 0 0
22 7.167 0.903 1 U 1.79e+06 0 e 0 0 0 0
23 7.375 0.997 1 U 1.06e+07 0 e 0 0 0 0
24 7.413 1.183 1 U 7.51e+06 0 e 0 0 0 0
25 8.651 0.885 1 U 5.07e+06 0 e 0 0 0 0
26 7.136 1.501 1 U 8.68e+06 0 e 0 0 0 0
27 7.136 1.612 1 U 4.86e+06 0 e 0 0 0 0
28 7.410 1.581 1 U 7.06e+05 0 e 0 0 0 0
29 7.416 1.723 1 U 3.86e+06 0 e 0 0 0 0
30 7.374 2.303 1 U 4.15e+06 0 e 0 0 0 0
31 6.695 2.010 1 U 5.87e+06 0 e 0 0 0 0
32 8.650 2.172 1 U 4.29e+06 0 e 0 0 0 0
33 8.647 1.182 1 U 1.22e+06 0 e 0 0 0 0
34 7.386 1.953 1 U 1.08e+06 0 e 0 0 0 0
35 7.136 2.023 1 U 1.39e+06 0 e 0 0 0 0
36 6.698 2.360 1 U 9.86e+05 0 e 0 0 0 0
37 6.698 1.612 1 U 7.97e+05 0 e 0 0 0 0
38 6.696 1.502 1 U 3.02e+06 0 e 0 0 0 0
39 5.262 2.007 1 U 3.98e+06 0 e 0 0 0 0
40 5.299 1.714 1 U 3.68e+06 0 e 0 0 0 0
41 5.310 1.632 1 U 4.74e+06 0 e 0 0 0 0
42 5.258 1.509 1 U 2.18e+06 0 e 0 0 0 0
43 5.300 1.463 1 U 2.99e+06 0 e 0 0 0 0
44 5.257 1.141 1 U 4.16e+06 0 e 0 0 0 0
45 5.295 0.970 1 U 7.68e+06 0 e 0 0 0 0
46 5.301 0.934 1 U 1.59e+07 0 e 0 0 0 0
47 5.258 0.872 1 U 1.39e+07 0 e 0 0 0 0
48 4.510 0.799 1 U 3.57e+06 0 e 0 0 0 0
49 4.883 1.369 1 U 7.81e+05 0 e 0 0 0 0
50 4.883 1.466 1 U 6.78e+05 0 e 0 0 0 0
51 4.878 2.078 1 U 1.94e+06 0 e 0 0 0 0
52 4.881 2.167 1 U 1.24e+06 0 e 0 0 0 0
53 4.709 2.570 1 U 2.72e+06 0 e 0 0 0 0
54 4.727 2.004 1 U 7.56e+06 0 e 0 0 0 0
55 4.643 1.942 1 U 7.35e+06 0 e 0 0 0 0
56 4.640 2.018 1 U 2.27e+06 0 e 0 0 0 0
57 4.510 1.982 1 U 2.53e+06 0 e 0 0 0 0
58 4.717 1.952 1 U 4.08e+06 0 e 0 0 0 0
59 4.729 1.500 1 U 8.45e+05 0 e 0 0 0 0
60 4.605 1.721 1 U 2.05e+06 0 e 0 0 0 0
61 4.606 1.582 1 U 7.13e+06 0 e 0 0 0 0
62 4.508 1.626 1 U 2.21e+06 0 e 0 0 0 0
63 4.385 1.613 1 U 4.28e+06 0 e 0 0 0 0
64 4.384 1.494 1 U 1.12e+07 0 e 0 0 0 0
65 4.292 1.582 1 U 2.24e+06 0 e 0 0 0 0
66 4.509 1.395 1 U 6.63e+06 0 e 0 0 0 0
67 4.608 1.184 1 U 1.65e+06 0 e 0 0 0 0
68 4.510 1.043 1 U 2.24e+06 0 e 0 0 0 0
69 4.508 0.965 1 U 1.6e+07 0 e 0 0 0 0
70 4.637 2.358 1 U 6.73e+06 0 e 0 0 0 0
71 4.293 2.394 1 U 1.13e+07 0 e 0 0 0 0
72 4.290 2.298 1 U 5.66e+06 0 e 0 0 0 0
73 3.986 2.572 1 U 6.68e+05 0 e 0 0 0 0
74 3.549 2.383 1 U 1.78e+06 0 e 0 0 0 0
75 4.004 1.956 1 U 5.12e+06 0 e 0 0 0 0
76 3.996 1.985 1 U 2.17e+06 0 e 0 0 0 0
77 3.728 1.862 1 U 2.89e+06 0 e 0 0 0 0
78 3.635 2.022 1 U 1.01e+07 0 e 0 0 0 0
79 3.610 1.936 1 U 6e+06 0 e 0 0 0 0
80 3.545 2.023 1 U 5.41e+06 0 e 0 0 0 0
81 3.537 1.927 1 U 8.24e+06 0 e 0 0 0 0
82 3.547 1.854 1 U 5.78e+06 0 e 0 0 0 0
83 3.519 1.942 1 U 8.58e+06 0 e 0 0 0 0
84 3.728 1.770 1 U 6.11e+06 0 e 0 0 0 0
85 3.560 1.758 1 U 1.1e+06 0 e 0 0 0 0
86 3.357 1.968 1 U 8.49e+06 0 e 0 0 0 0
87 3.137 2.006 1 U 1.42e+07 0 e 0 0 0 0
88 3.004 2.006 1 U 3.39e+06 0 e 0 0 0 0
89 2.995 2.307 1 U 3.5e+06 0 e 0 0 0 0
90 3.136 1.707 1 U 1.62e+07 0 e 0 0 0 0
91 3.136 1.640 1 U 1.06e+07 0 e 0 0 0 0
92 3.357 1.623 1 U 9.02e+06 0 e 0 0 0 0
93 3.529 1.626 1 U 1.47e+06 0 e 0 0 0 0
94 3.611 1.631 1 U 1.16e+06 0 e 0 0 0 0
95 3.482 1.415 1 U 4.55e+06 0 e 0 0 0 0
96 3.359 1.412 1 U 1.33e+06 0 e 0 0 0 0
97 3.135 1.463 1 U 8.49e+06 0 e 0 0 0 0
98 2.992 1.138 1 U 3.34e+06 0 e 0 0 0 0
99 3.136 0.904 1 U 1.06e+07 0 e 0 0 0 0
100 3.544 0.934 1 U 1.77e+06 0 e 0 0 0 0
101 3.357 0.798 1 U 4.43e+06 0 e 0 0 0 0
102 2.575 1.949 1 U 4.94e+07 0 e 0 0 0 0
103 2.378 2.010 1 U 7.41e+06 0 e 0 0 0 0
104 2.383 1.946 1 U 7.57e+07 0 e 0 0 0 0
105 2.388 1.868 1 U 4.06e+06 0 e 0 0 0 0
106 2.418 1.754 1 U 1.7e+06 0 e 0 0 0 0
107 1.953 2.366 1 U 6.34e+07 0 e 0 0 0 0
108 1.953 2.366 1 U 6.34e+07 0 e 0 0 0 0
109 1.763 2.399 1 U 2.28e+06 0 e 0 0 0 0
110 1.946 2.578 1 U 5.14e+07 0 e 0 0 0 0
111 2.108 2.573 1 U 3.45e+06 0 e 0 0 0 0
112 0.985 2.305 1 U 2.1e+07 0 e 0 0 0 0
113 0.893 2.369 1 U 1.46e+06 0 e 0 0 0 0
114 1.577 2.404 1 U 1.3e+06 0 e 0 0 0 0
115 1.605 2.379 1 U 1.28e+06 0 e 0 0 0 0
116 0.796 2.176 1 U 1.01e+07 0 e 0 0 0 0
117 0.888 2.171 1 U 1.19e+07 0 e 0 0 0 0
118 1.002 2.175 1 U 3.17e+06 0 e 0 0 0 0
119 0.955 2.017 1 U 1.95e+07 0 e 0 0 0 0
120 1.139 2.016 1 U 4.82e+07 0 e 0 0 0 0
121 1.607 1.981 1 U 1.15e+07 0 e 0 0 0 0
122 1.202 1.944 1 U 1.35e+06 0 e 0 0 0 0
123 0.919 1.916 1 U 3.87e+06 0 e 0 0 0 0
124 1.190 1.726 1 U 5.53e+06 0 e 0 0 0 0
125 0.916 1.627 1 U 3.75e+07 0 e 0 0 0 0
126 0.949 1.710 1 U 2.33e+07 0 e 0 0 0 0
127 0.894 1.507 1 U 3.8e+07 0 e 0 0 0 0
128 1.180 1.582 1 U 4.11e+07 0 e 0 0 0 0
129 2.389 1.582 1 U 3.15e+06 0 e 0 0 0 0
130 2.168 1.616 1 U 1.08e+06 0 e 0 0 0 0
131 1.954 1.469 1 U 5.87e+06 0 e 0 0 0 0
132 2.086 1.450 1 U 3.4e+06 0 e 0 0 0 0
133 1.981 1.394 1 U 5.11e+07 0 e 0 0 0 0
134 2.079 1.365 1 U 4.64e+07 0 e 0 0 0 0
135 2.012 1.138 1 U 4.83e+07 0 e 0 0 0 0
136 2.307 0.978 1 U 1.79e+07 0 e 0 0 0 0
137 2.170 0.883 1 U 3.05e+07 0 e 0 0 0 0
138 2.073 0.917 1 U 1.87e+07 0 e 0 0 0 0
139 2.013 0.961 1 U 6.5e+07 0 e 0 0 0 0
140 1.955 0.905 1 U 5.68e+06 0 e 0 0 0 0
141 1.604 0.905 1 U 3.74e+07 0 e 0 0 0 0
142 1.608 0.797 1 U 1.95e+06 0 e 0 0 0 0
143 1.458 0.960 1 U 5.83e+07 0 e 0 0 0 0
144 2.385 3.542 1 U 3.98e+06 0 e 0 0 0 0
145 2.359 3.621 1 U 2.38e+06 0 e 0 0 0 0
146 2.019 3.629 1 U 9.09e+06 0 e 0 0 0 0
147 2.096 3.488 1 U 6.9e+06 0 e 0 0 0 0
148 1.949 3.490 1 U 4.58e+06 0 e 0 0 0 0
149 1.785 3.556 1 U 2.9e+06 0 e 0 0 0 0
150 1.771 4.289 1 U 8.08e+05 0 e 0 0 0 0
151 1.956 4.286 1 U 3.79e+06 0 e 0 0 0 0
152 2.297 4.286 1 U 7.67e+06 0 e 0 0 0 0
153 2.102 4.000 1 U 3.12e+06 0 e 0 0 0 0
154 1.956 4.000 1 U 8.06e+06 0 e 0 0 0 0
155 1.952 3.725 1 U 1.3e+06 0 e 0 0 0 0
156 1.855 3.726 1 U 3.09e+06 0 e 0 0 0 0
157 1.764 3.727 1 U 6.06e+06 0 e 0 0 0 0
158 0.959 7.420 1 U 1.16e+06 0 e 0 0 0 0
159 1.173 7.379 1 U 1.5e+06 0 e 0 0 0 0
160 0.995 7.372 1 U 1.07e+07 0 e 0 0 0 0
161 1.729 7.420 1 U 4.65e+06 0 e 0 0 0 0
162 2.299 7.371 1 U 7.42e+06 0 e 0 0 0 0
163 1.491 7.137 1 U 9.23e+06 0 e 0 0 0 0
164 1.606 7.137 1 U 4.58e+06 0 e 0 0 0 0
165 0.910 7.138 1 U 1.62e+06 0 e 0 0 0 0
166 0.896 6.690 1 U 9.82e+06 0 e 0 0 0 0
167 2.011 6.691 1 U 8.31e+06 0 e 0 0 0 0
168 1.502 6.690 1 U 3.44e+06 0 e 0 0 0 0
169 3.136 7.137 1 U 3.84e+06 0 e 0 0 0 0
170 3.633 7.137 1 U 2.69e+06 0 e 0 0 0 0
171 3.633 6.697 1 U 8.67e+05 0 e 0 0 0 0
172 2.355 6.689 1 U 1.22e+06 0 e 0 0 0 0
173 4.384 6.695 1 U 2.07e+07 0 e 0 0 0 0
174 4.727 6.694 1 U 4.35e+06 0 e 0 0 0 0
175 4.384 7.140 1 U 5.82e+06 0 e 0 0 0 0
176 4.636 7.138 1 U 8.51e+06 0 e 0 0 0 0
177 4.289 7.372 1 U 4.92e+06 0 e 0 0 0 0
178 4.004 7.370 1 U 1.43e+06 0 e 0 0 0 0
179 4.005 7.409 1 U 1.47e+06 0 e 0 0 0 0
180 4.600 7.421 1 U 2.48e+06 0 e 0 0 0 0
181 4.718 7.411 1 U 2.41e+06 0 e 0 0 0 0
182 4.607 7.369 1 U 1.39e+06 0 e 0 0 0 0
183 7.136 6.694 1 U 2.94e+06 0 e 0 0 0 0
184 6.698 7.134 1 U 3.25e+06 0 e 0 0 0 0
185 8.654 7.372 1 U 1.39e+06 0 e 0 0 0 0
186 7.383 8.657 1 U 1.8e+06 0 e 0 0 0 0
187 5.253 8.658 1 U 1.49e+06 0 e 0 0 0 0
188 5.005 8.659 1 U 1.34e+06 0 e 0 0 0 0
189 4.843 8.647 1 U 1.57e+06 0 e 0 0 0 0
190 4.292 8.643 1 U 1.39e+06 0 e 0 0 0 0
191 2.172 8.644 1 U 7.21e+06 0 e 0 0 0 0
192 0.887 8.645 1 U 5.45e+06 0 e 0 0 0 0
193 1.180 8.658 1 U 1.08e+06 0 e 0 0 0 0
194 1.181 7.410 1 U 5.79e+06 0 e 0 0 0 0
195 1.964 7.372 1 U 6.86e+05 0 e 0 0 0 0
196 5.321 7.129 1 U 6.61e+05 0 e 0 0 0 0
197 7.135 5.307 1 U 1.12e+06 0 e 0 0 0 0
198 6.697 5.314 1 U 5.87e+05 0 e 0 0 0 0
199 6.698 4.719 1 U 7.44e+06 0 e 0 0 0 0
200 6.695 4.380 1 U 2e+07 0 e 0 0 0 0
201 7.136 4.638 1 U 1.31e+07 0 e 0 0 0 0
202 7.415 4.709 1 U 6.84e+06 0 e 0 0 0 0
203 7.391 4.618 1 U 1.32e+06 0 e 0 0 0 0
204 7.136 4.384 1 U 5.56e+06 0 e 0 0 0 0
205 7.381 4.282 1 U 4.51e+06 0 e 0 0 0 0
206 7.409 4.505 1 U 6.02e+05 0 e 0 0 0 0
207 7.394 3.999 1 U 1.83e+06 0 e 0 0 0 0
208 7.135 3.629 1 U 2.81e+06 0 e 0 0 0 0
209 6.696 3.628 1 U 9.11e+05 0 e 0 0 0 0
210 5.304 3.629 1 U 1.22e+07 0 e 0 0 0 0
211 5.306 3.545 1 U 1.67e+07 0 e 0 0 0 0
212 5.256 4.288 1 U 6.59e+06 0 e 0 0 0 0
213 4.292 5.253 1 U 1.1e+07 0 e 0 0 0 0
214 4.292 5.009 1 U 1.43e+07 0 e 0 0 0 0
215 4.853 5.011 1 U 4.63e+06 0 e 0 0 0 0
216 4.509 4.000 1 U 2.14e+07 0 e 0 0 0 0
217 4.509 4.000 1 U 2.14e+07 0 e 0 0 0 0
218 4.667 3.535 1 U 1.17e+06 0 e 0 0 0 0
219 4.293 3.535 1 U 1.24e+06 0 e 0 0 0 0
220 4.006 3.478 1 U 4.48e+07 0 e 0 0 0 0
221 3.543 3.732 1 U 4.59e+07 0 e 0 0 0 0
222 3.699 3.536 1 U 4.39e+07 0 e 0 0 0 0
223 3.481 4.000 1 U 6.56e+07 0 e 0 0 0 0
224 3.539 4.286 1 U 1.61e+06 0 e 0 0 0 0
225 3.603 4.634 1 U 1.99e+06 0 e 0 0 0 0
226 3.516 4.637 1 U 1.65e+06 0 e 0 0 0 0
227 3.480 4.708 1 U 1.37e+06 0 e 0 0 0 0
228 0.947 5.308 1 U 2.42e+07 0 e 0 0 0 0
229 0.874 5.253 1 U 1.36e+07 0 e 0 0 0 0
230 1.141 5.254 1 U 7.92e+06 0 e 0 0 0 0
231 1.452 5.296 1 U 5.42e+06 0 e 0 0 0 0
232 1.511 5.253 1 U 4.09e+06 0 e 0 0 0 0
233 1.637 5.295 1 U 1.05e+07 0 e 0 0 0 0
234 1.692 5.309 1 U 1.29e+07 0 e 0 0 0 0
235 2.011 5.256 1 U 7.63e+06 0 e 0 0 0 0
236 0.918 4.993 1 U 3.81e+06 0 e 0 0 0 0
237 1.360 4.993 1 U 6.05e+06 0 e 0 0 0 0
238 1.460 4.993 1 U 2.23e+06 0 e 0 0 0 0
239 1.363 4.870 1 U 2.43e+06 0 e 0 0 0 0
240 1.474 4.870 1 U 2.56e+06 0 e 0 0 0 0
241 0.913 4.870 1 U 2.06e+07 0 e 0 0 0 0
242 0.803 4.870 1 U 7.57e+06 0 e 0 0 0 0
243 0.955 4.721 1 U 1.63e+07 0 e 0 0 0 0
244 0.897 4.721 1 U 1.19e+07 0 e 0 0 0 0
245 0.947 4.606 1 U 1.31e+07 0 e 0 0 0 0
246 1.040 4.503 1 U 1.28e+06 0 e 0 0 0 0
247 0.897 4.381 1 U 1.92e+07 0 e 0 0 0 0
248 0.986 4.284 1 U 1.8e+07 0 e 0 0 0 0
249 1.171 4.618 1 U 2.23e+06 0 e 0 0 0 0
250 1.579 4.608 1 U 8.59e+06 0 e 0 0 0 0
251 1.726 4.608 1 U 2.87e+06 0 e 0 0 0 0
252 1.954 4.643 1 U 2.04e+07 0 e 0 0 0 0
253 1.954 4.643 1 U 2.04e+07 0 e 0 0 0 0
254 2.006 4.723 1 U 1.44e+07 0 e 0 0 0 0
255 2.078 4.870 1 U 8.1e+06 0 e 0 0 0 0
256 2.170 4.870 1 U 3.63e+06 0 e 0 0 0 0
257 1.616 4.511 1 U 2.65e+06 0 e 0 0 0 0
258 1.974 4.512 1 U 4.05e+06 0 e 0 0 0 0
259 2.358 4.634 1 U 1.13e+07 0 e 0 0 0 0
260 2.573 4.709 1 U 8.29e+06 0 e 0 0 0 0
261 2.390 4.289 1 U 1.13e+07 0 e 0 0 0 0
262 1.607 4.382 1 U 5.21e+06 0 e 0 0 0 0
263 1.519 4.379 1 U 1.02e+06 0 e 0 0 0 0
264 5.244 2.997 1 U 2.67e+06 0 e 0 0 0 0
265 7.135 3.135 1 U 7.75e+06 0 e 0 0 0 0
266 8.650 4.867 1 U 4.98e+06 0 e 0 0 0 0
267 8.642 4.287 1 U 1.09e+06 0 e 0 0 0 0
268 8.654 5.008 1 U 5.41e+06 0 e 0 0 0 0
269 8.660 5.253 1 U 1.73e+06 0 e 0 0 0 0
270 3.357 4.870 1 U 3.4e+07 0 e 0 0 0 0
271 3.542 5.307 1 U 3.27e+07 0 e 0 0 0 0
272 3.633 5.307 1 U 2.23e+07 0 e 0 0 0 0
273 3.137 5.308 1 U 4.62e+06 0 e 0 0 0 0
274 2.986 5.254 1 U 2.4e+06 0 e 0 0 0 0
275 4.003 4.495 1 U 1.78e+07 0 e 0 0 0 0
276 3.487 4.508 1 U 1.08e+07 0 e 0 0 0 0
277 3.374 4.504 1 U 8.07e+05 0 e 0 0 0 0
278 3.136 4.721 1 U 6.2e+07 0 e 0 0 0 0
279 3.106 4.630 1 U 6.84e+06 0 e 0 0 0 0
280 2.998 4.284 1 U 2.61e+07 0 e 0 0 0 0
281 1.578 4.290 1 U 1.93e+06 0 e 0 0 0 0
282 0.991 4.000 1 U 5.91e+06 0 e 0 0 0 0
283 0.797 4.501 1 U 3.11e+06 0 e 0 0 0 0
284 1.482 4.641 1 U 1.15e+06 0 e 0 0 0 0
285 1.725 4.711 1 U 1.67e+06 0 e 0 0 0 0
286 1.486 4.718 1 U 2.17e+06 0 e 0 0 0 0
287 1.184 5.009 1 U 4.56e+06 0 e 0 0 0 0
288 1.579 4.993 1 U 5.49e+06 0 e 0 0 0 0
289 1.951 4.993 1 U 6.54e+06 0 e 0 0 0 0
290 2.391 4.993 1 U 1.13e+06 0 e 0 0 0 0
291 2.025 5.315 1 U 9.1e+05 0 e 0 0 0 0
292 0.916 3.630 1 U 1.84e+06 0 e 0 0 0 0
293 0.952 3.547 1 U 2.71e+06 0 e 0 0 0 0
294 0.965 3.478 1 U 1.83e+06 0 e 0 0 0 0
295 1.037 3.478 1 U 8.97e+05 0 e 0 0 0 0
296 1.392 3.478 1 U 6.23e+06 0 e 0 0 0 0
297 1.613 3.479 1 U 1.4e+06 0 e 0 0 0 0
298 1.639 3.535 1 U 2.87e+06 0 e 0 0 0 0
299 1.450 3.546 1 U 1.01e+06 0 e 0 0 0 0
300 1.635 3.620 1 U 1.68e+06 0 e 0 0 0 0
301 1.933 3.627 1 U 6.24e+06 0 e 0 0 0 0
302 1.969 3.547 1 U 1.08e+07 0 e 0 0 0 0
303 0.897 3.134 1 U 1.71e+07 0 e 0 0 0 0
304 0.953 3.133 1 U 2.14e+07 0 e 0 0 0 0
305 1.707 3.133 1 U 3.29e+07 0 e 0 0 0 0
306 2.009 3.135 1 U 3.19e+07 0 e 0 0 0 0
307 2.013 2.996 1 U 1.91e+07 0 e 0 0 0 0
308 1.143 2.996 1 U 1.58e+07 0 e 0 0 0 0
309 0.983 2.996 1 U 2.06e+07 0 e 0 0 0 0
310 2.295 2.997 1 U 2.16e+07 0 e 0 0 0 0
311 1.979 3.358 1 U 3.8e+07 0 e 0 0 0 0
312 1.615 3.358 1 U 1.85e+07 0 e 0 0 0 0
313 1.406 3.358 1 U 2.96e+06 0 e 0 0 0 0
314 1.040 3.358 1 U 5.22e+06 0 e 0 0 0 0
315 0.800 3.358 1 U 5.75e+06 0 e 0 0 0 0
316 4.289 2.996 1 U 6.94e+07 0 e 0 0 0 0
317 4.724 3.134 1 U 5.59e+07 0 e 0 0 0 0
318 4.873 3.358 1 U 1.88e+07 0 e 0 0 0 0
319 5.298 3.133 1 U 4.71e+06 0 e 0 0 0 0
320 4.508 3.488 1 U 7.64e+06 0 e 0 0 0 0
321 4.509 3.358 1 U 4.06e+06 0 e 0 0 0 0
322 1.186 0.917 1 U 1.07e+07 0 e 0 0 0 0
323 1.733 0.906 1 U 1.65e+07 0 e 0 0 0 0
324 1.729 0.937 1 U 3.76e+07 0 e 0 0 0 0
325 1.665 0.925 1 U 1.41e+07 0 e 0 0 0 0
326 1.636 0.961 1 U 3.98e+07 0 e 0 0 0 0
327 1.458 0.924 1 U 6.25e+07 0 e 0 0 0 0
328 1.485 0.904 1 U 6.96e+07 0 e 0 0 0 0
329 1.630 1.033 1 U 2.22e+07 0 e 0 0 0 0
330 1.417 1.036 1 U 7.87e+06 0 e 0 0 0 0
331 1.539 1.125 1 U 2.75e+06 0 e 0 0 0 0
332 1.579 1.163 1 U 2.86e+07 0 e 0 0 0 0
333 1.579 1.183 1 U 5.08e+07 0 e 0 0 0 0
334 1.578 1.204 1 U 2.05e+07 0 e 0 0 0 0
335 1.731 1.199 1 U 5.87e+06 0 e 0 0 0 0
336 1.730 1.183 1 U 8.19e+06 0 e 0 0 0 0
337 1.730 1.183 1 U 8.19e+06 0 e 0 0 0 0
338 2.013 0.889 1 U 7.24e+07 0 e 0 0 0 0
339 1.979 1.040 1 U 1.24e+07 0 e 0 0 0 0
340 1.979 1.040 1 U 1.24e+07 0 e 0 0 0 0
341 1.963 1.001 1 U 4.09e+06 0 e 0 0 0 0
342 2.176 1.002 1 U 3.61e+06 0 e 0 0 0 0
343 2.304 0.993 1 U 2.24e+07 0 e 0 0 0 0
344 3.137 0.969 1 U 1.51e+07 0 e 0 0 0 0
345 4.629 0.907 1 U 1.32e+06 0 e 0 0 0 0
346 1.515 0.860 1 U 3.21e+07 0 e 0 0 0 0
347 2.175 0.794 1 U 2.28e+07 0 e 0 0 0 0
348 1.603 2.006 1 U 6.4e+06 0 e 0 0 0 0
349 1.482 2.012 1 U 7.65e+06 0 e 0 0 0 0
350 1.887 1.752 1 U 1.22e+07 0 e 0 0 0 0
351 1.398 4.501 1 U 5.66e+06 0 e 0 0 0 0
352 0.967 4.502 1 U 7.83e+06 0 e 0 0 0 0
353 1.940 4.708 1 U 1.25e+07 0 e 0 0 0 0
354 1.636 3.135 1 U 2.52e+07 0 e 0 0 0 0
355 0.890 2.016 1 U 2.61e+07 0 e 0 0 0 0
356 1.384 1.977 1 U 4.33e+07 0 e 0 0 0 0
357 0.963 1.977 1 U 3.86e+06 0 e 0 0 0 0
358 0.967 1.624 1 U 1.17e+07 0 e 0 0 0 0
359 1.033 1.977 1 U 4.94e+06 0 e 0 0 0 0
360 1.029 1.622 1 U 3.38e+06 0 e 0 0 0 0
361 0.916 1.365 1 U 1.9e+07 0 e 0 0 0 0
362 3.487 0.961 1 U 2.77e+06 0 e 0 0 0 0
363 3.521 0.972 1 U 5.43e+06 0 e 0 0 0 0
364 1.900 3.546 1 U 9.27e+06 0 e 0 0 0 0
365 7.362 4.992 1 U 3e+05 0 e 0 0 0 0
366 3.356 7.416 1 U 5.27e+05 0 e 0 0 0 0
367 2.027 7.138 1 U 8.98e+05 0 e 0 0 0 0
368 1.954 7.422 1 U 8.34e+05 0 e 0 0 0 0
369 2.357 7.133 1 U 8.24e+05 0 e 0 0 0 0
370 2.727 7.122 1 U 4.85e+05 0 e 0 0 0 0
371 2.586 7.420 1 U 3.6e+05 0 e 0 0 0 0
372 3.137 6.686 1 U 7.57e+05 0 e 0 0 0 0
373 5.312 6.687 1 U 5e+05 0 e 0 0 0 0
374 1.588 6.689 1 U 5.75e+05 0 e 0 0 0 0
375 0.973 6.693 1 U 2.38e+06 0 e 0 0 0 0
376 0.969 8.654 1 U 5.53e+05 0 e 0 0 0 0
377 4.199 2.157 1 U 3.09e+06 0 e 0 0 0 0
378 4.292 1.959 1 U 4.33e+06 0 e 0 0 0 0
379 4.293 1.858 1 U 6.83e+05 0 e 0 0 0 0
380 4.296 1.759 1 U 5.7e+05 0 e 0 0 0 0
381 4.719 1.728 1 U 5.55e+05 0 e 0 0 0 0
382 4.702 1.611 1 U 3.39e+05 0 e 0 0 0 0
383 7.134 2.357 1 U 8.5e+05 0 e 0 0 0 0
384 7.364 2.168 1 U 4.36e+05 0 e 0 0 0 0
385 3.632 2.357 1 U 2.04e+06 0 e 0 0 0 0
386 1.479 3.133 1 U 2.17e+07 0 e 0 0 0 0
387 2.075 4.993 1 U 8.18e+05 0 e 0 0 0 0
388 4.513 7.420 1 U 6.03e+05 0 e 0 0 0 0
389 4.521 7.366 1 U 3.23e+05 0 e 0 0 0 0
390 1.697 0.957 1 U 1.57e+07 0 e 0 0 0 0
391 3.360 1.990 1 U 6.46e+06 0 e 0 0 0 0
392 3.483 1.382 1 U 4.25e+06 0 e 0 0 0 0
393 0.923 3.357 1 U 4.42e+06 0 e 0 0 0 0
394 1.190 7.371 1 U 1.45e+06 0 e 0 0 0 0
395 1.724 7.365 1 U 2.75e+05 0 e 0 0 0 0
396 7.417 4.594 1 U 2.74e+06 0 e 0 0 0 0
397 2.389 1.599 1 U 1.7e+06 0 e 0 0 0 0
398 7.357 2.993 1 U 5.08e+05 0 e 0 0 0 0
399 1.513 2.299 1 U 7.1e+05 0 e 0 0 0 0
400 0.796 2.310 1 U 4.96e+05 0 e 0 0 0 0
401 2.386 2.997 1 U 5.25e+06 0 e 0 0 0 0
402 2.983 1.501 1 U 7.15e+05 0 e 0 0 0 0
403 1.954 0.963 1 U 4.66e+06 0 e 0 0 0 0
404 2.578 0.950 1 U 6.86e+05 0 e 0 0 0 0
405 1.720 0.966 1 U 1.37e+07 0 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 . . 7211.5 Hz . . . 4.97 . . 31003 1
2 . . H 1 H . . 7204.6 Hz . . . 4.97 . . 31003 1
stop_
save_