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 30696
_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 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1
_Spectral_peak_list.Experiment_ID 4
_Spectral_peak_list.Experiment_name '3D 13C/15N-edited [1H,1H] 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 H
#INAME 2 h
#INAME 3 C
#SPECTRUM C13NOESY HC H C
1 7.172 7.263 130.252 3 U 1.977e+04 0.00e+00 - 0 2998 2995 2997 0
2 7.170 7.371 130.128 3 U 3.329e+03 0.00e+00 - 0 2998 3000 2997 0
3 7.173 0.524 130.244 3 U 1.766e+03 0.00e+00 - 0 2998 1706 2997 0
4 7.172 1.648 130.187 3 U 9.148e+02 0.00e+00 - 0 2998 2566 2997 0
5 7.170 1.729 130.244 3 U 1.020e+03 0.00e+00 - 0 2998 2689 2997 0
6 7.168 3.632 130.171 3 U 8.250e+02 0.00e+00 - 0 2998 2490 2997 0
7 7.169 3.821 130.111 3 U 8.317e+02 0.00e+00 - 0 2998 2546 2997 0
8 7.171 4.043 130.244 3 U 9.787e+02 0.00e+00 - 0 0 0 0 0
9 7.268 2.662 132.746 3 U 3.359e+03 0.00e+00 - 0 2995 2631 2996 0
10 7.269 2.828 132.746 3 U 4.503e+03 0.00e+00 - 0 2995 2637 2996 0
11 7.267 4.597 132.746 3 U 2.024e+03 0.00e+00 - 0 2995 2480 2996 0
12 7.271 4.930 132.746 3 U 1.323e+03 0.00e+00 - 0 2995 2458 2996 0
13 7.268 9.480 132.746 3 U 3.397e+03 0.00e+00 - 0 2995 9 2996 0
14 7.382 4.047 129.572 3 U 1.004e+03 0.00e+00 - 0 0 0 0 0
15 6.403 6.889 117.297 3 U 9.165e+03 0.00e+00 - 0 2991 2969 2992 0
16 6.400 7.313 117.297 3 U 1.445e+03 0.00e+00 - 0 2991 3001 2992 0
17 6.401 4.203 117.297 3 U 2.650e+03 0.00e+00 - 0 2991 2491 2992 0
18 6.405 2.803 117.297 3 U 1.186e+03 0.00e+00 - 0 0 0 0 0
19 6.889 6.404 133.315 3 U 8.399e+03 0.00e+00 - 0 2969 2991 2970 0
20 6.888 2.529 133.315 3 U 3.802e+03 0.00e+00 - 0 2969 2853 2970 0
21 6.890 2.883 133.315 3 U 3.745e+03 0.00e+00 - 0 2969 2852 2970 0
22 6.889 4.034 133.315 3 U 2.654e+03 0.00e+00 - 0 2969 2496 2970 0
23 6.889 4.358 133.315 3 U 1.654e+03 0.00e+00 - 0 2969 2471 2970 0
26 6.961 7.127 129.539 3 U 4.880e+03 0.00e+00 - 0 0 0 0 0
27 6.960 7.215 129.465 3 U 1.039e+03 0.00e+00 - 0 3011 3007 3012 0
29 7.126 6.962 130.882 3 U 5.158e+03 0.00e+00 - 0 0 0 0 0
30 7.130 4.285 130.882 3 U 1.090e+03 0.00e+00 - 0 3009 2499 3010 0
33 7.127 2.032 130.882 3 U 1.877e+03 0.00e+00 - 0 0 0 0 0
34 7.127 0.540 130.882 3 U 2.546e+03 0.00e+00 - 0 0 0 0 0
35 7.128 0.723 130.882 3 U 2.711e+03 0.00e+00 - 0 0 0 0 0
36 7.126 0.816 130.882 3 U 3.569e+03 0.00e+00 - 0 4454 1806 4462 0
37 7.226 3.183 130.834 3 U 1.301e+03 0.00e+00 - 0 3007 2881 3008 0
38 7.224 3.019 130.834 3 U 1.497e+03 0.00e+00 - 0 3007 2563 3008 0
39 7.225 4.285 130.834 3 U 2.454e+03 0.00e+00 - 0 3007 2499 3008 0
40 7.224 4.207 130.834 3 U 1.313e+03 0.00e+00 - 0 3007 2498 3008 0
41 7.224 0.543 130.834 3 U 2.239e+03 0.00e+00 - 0 4453 1805 4461 0
42 7.224 0.723 130.834 3 U 2.938e+03 0.00e+00 - 0 0 0 0 0
43 7.225 0.821 130.834 3 U 2.937e+03 0.00e+00 - 0 0 0 0 0
44 7.225 2.030 130.834 3 U 1.577e+03 0.00e+00 - 0 0 0 0 0
45 7.223 2.129 130.834 3 U 9.842e+02 0.00e+00 - 0 3007 2582 3008 0
47 7.223 6.959 130.834 3 U 2.724e+03 0.00e+00 - 0 3007 3011 3008 0
48 7.225 8.164 130.834 3 U 1.895e+03 0.00e+00 - 0 3007 291 3008 0
49 6.674 0.657 117.667 3 U 3.473e+03 0.00e+00 - 0 2993 1816 2994 0
50 6.674 0.818 117.667 3 U 3.873e+03 0.00e+00 - 0 2993 1704 2994 0
51 6.674 0.906 117.667 3 U 2.343e+03 0.00e+00 - 0 0 0 0 0
53 6.675 1.069 117.667 3 U 5.143e+03 0.00e+00 - 0 2993 1705 2994 0
54 6.673 1.189 117.667 3 U 1.401e+03 0.00e+00 - 0 2993 2617 2994 0
55 6.675 1.286 117.667 3 U 2.480e+03 0.00e+00 - 0 2993 2788 2994 0
56 6.675 2.050 117.667 3 U 3.171e+03 0.00e+00 - 0 0 0 0 0
57 6.676 1.940 117.667 3 U 1.059e+03 0.00e+00 - 0 2993 2898 2994 0
58 6.674 2.977 117.667 3 U 7.724e+02 0.00e+00 - 0 2993 2895 2994 0
59 6.681 3.504 117.667 3 U 8.253e+02 0.00e+00 - 0 2993 2896 2994 0
60 6.675 7.023 117.667 3 U 1.742e+04 0.00e+00 - 0 2993 2967 2994 0
61 7.024 0.657 133.392 3 U 3.372e+03 0.00e+00 - 0 2967 1816 2968 0
62 7.022 0.813 133.392 3 U 2.578e+03 0.00e+00 - 0 2967 1814 2968 0
63 7.022 0.915 133.392 3 U 1.422e+03 0.00e+00 - 0 2967 2728 2968 0
64 7.023 1.063 133.392 3 U 4.077e+03 0.00e+00 - 0 0 0 0 0
65 7.025 1.459 133.392 3 U 1.025e+03 0.00e+00 - 0 2967 2581 2968 0
66 7.021 1.944 133.392 3 U 3.634e+03 0.00e+00 - 0 2967 2898 2968 0
67 7.021 2.038 133.392 3 U 1.948e+03 0.00e+00 - 0 2967 2562 2968 0
68 7.021 2.972 133.392 3 U 4.283e+03 0.00e+00 - 0 2967 2895 2968 0
69 7.023 3.518 133.392 3 U 3.924e+03 0.00e+00 - 0 2967 2896 2968 0
70 7.024 4.387 133.392 3 U 5.747e+03 0.00e+00 - 0 2967 2509 2968 0
71 7.022 8.964 133.392 3 U 1.442e+03 0.00e+00 - 0 2967 293 2968 0
72 7.023 8.428 133.392 3 U 1.457e+03 0.00e+00 - 0 2967 109 2968 0
73 7.024 6.676 133.392 3 U 1.319e+04 0.00e+00 - 0 2967 2993 2968 0
74 7.023 6.495 133.392 3 U 1.226e+03 0.00e+00 - 0 2967 3021 2968 0
75 6.963 0.124 129.171 3 U 9.947e+02 0.00e+00 - 0 3006 1826 3005 0
76 6.965 0.885 129.266 3 U 1.721e+03 0.00e+00 - 0 0 0 0 0
77 6.962 0.725 129.252 3 U 1.024e+03 0.00e+00 - 0 3006 1831 3005 0
79 6.960 2.017 129.352 3 U 1.538e+03 0.00e+00 - 0 0 0 0 0
80 6.963 7.328 129.171 3 U 5.099e+03 0.00e+00 - 0 3006 3004 3005 0
81 7.306 3.138 132.705 3 U 1.510e+03 0.00e+00 - 0 3001 2855 3002 0
82 7.309 2.822 132.736 3 U 1.741e+03 0.00e+00 - 0 3001 2854 3002 0
83 7.305 0.724 132.657 3 U 8.412e+02 0.00e+00 - 0 3001 1831 3002 0
84 7.331 6.968 131.526 3 U 3.760e+03 0.00e+00 - 0 3004 3006 3003 0
85 7.330 0.123 131.526 3 U 1.771e+03 0.00e+00 - 0 3004 1826 3003 0
86 7.333 0.723 131.526 3 U 1.664e+03 0.00e+00 - 0 3004 1831 3003 0
87 7.333 0.889 131.507 3 U 1.270e+03 0.00e+00 - 0 0 0 0 0
88 6.309 0.123 118.006 3 U 9.105e+02 0.00e+00 - 0 2989 1826 2990 0
89 6.307 1.120 118.006 3 U 1.932e+03 0.00e+00 - 0 0 0 0 0
90 6.304 0.899 118.006 3 U 1.311e+03 0.00e+00 - 0 2989 2901 2990 0
91 6.304 0.818 118.109 3 U 6.071e+02 0.00e+00 - 0 2989 2634 2990 0
92 6.303 1.969 118.006 3 U 1.106e+03 0.00e+00 - 0 0 0 0 0
93 6.305 6.489 118.006 3 U 3.739e+03 0.00e+00 - 0 2989 2987 2990 0
94 6.103 2.184 119.515 3 U 6.401e+02 0.00e+00 - 0 3017 2965 3018 0
96 6.101 3.999 119.515 3 U 7.981e+02 0.00e+00 - 0 0 0 0 0
97 6.101 8.108 119.515 3 U 7.760e+02 0.00e+00 - 0 3017 263 3018 0
98 7.149 0.465 120.272 3 U 7.190e+02 0.00e+00 - 0 3013 2722 3014 0
99 7.143 0.746 120.272 3 U 1.977e+03 0.00e+00 - 0 3013 1694 3014 0
100 7.148 2.151 120.272 3 U 9.411e+02 0.00e+00 - 0 3013 2832 3014 0
101 7.144 2.254 120.272 3 U 1.524e+03 0.00e+00 - 0 0 0 0 0
102 7.143 3.089 120.272 3 U 1.685e+03 0.00e+00 - 0 3013 2611 3014 0
103 7.144 3.380 120.272 3 U 1.715e+03 0.00e+00 - 0 3013 2656 3014 0
104 8.205 2.255 137.304 3 U 1.125e+03 0.00e+00 - 0 3059 2719 3060 0
105 6.850 1.702 120.583 3 U 1.629e+03 0.00e+00 - 0 3019 2635 3020 0
106 6.849 1.807 120.583 3 U 1.882e+03 0.00e+00 - 0 3019 2657 3020 0
107 6.850 2.692 120.583 3 U 2.164e+03 0.00e+00 - 0 3019 2834 3020 0
108 6.848 2.965 120.583 3 U 1.216e+03 0.00e+00 - 0 3019 2835 3020 0
109 6.852 3.988 120.583 3 U 1.346e+03 0.00e+00 - 0 3019 2544 3020 0
110 7.267 0.834 132.746 3 U 2.133e+03 0.00e+00 - 0 2995 1690 2996 0
111 7.266 1.751 132.746 3 U 1.288e+03 0.00e+00 - 0 0 0 0 0
112 7.268 0.507 132.746 3 U 4.233e+03 0.00e+00 - 0 2995 1706 2996 0
113 7.268 0.567 132.746 3 U 3.808e+03 0.00e+00 - 0 2995 1708 2996 0
114 7.268 5.627 132.746 3 U 7.300e+02 0.00e+00 - 0 0 0 0 0
115 7.268 8.669 132.669 3 U 7.500e+02 0.00e+00 - 0 2995 75 2996 0
116 7.268 9.055 132.746 3 U 8.647e+02 0.00e+00 - 0 2995 159 2996 0
117 7.172 2.334 130.178 3 U 1.041e+03 0.00e+00 - 0 0 0 0 0
118 7.172 2.433 130.149 3 U 6.400e+02 0.00e+00 - 0 2998 2808 2997 0
119 6.309 2.185 117.960 3 U 5.491e+02 0.00e+00 - 0 2989 2965 2990 0
120 6.492 6.303 133.059 3 U 1.063e+03 0.00e+00 - 0 2987 2989 2988 0
121 6.889 7.649 133.315 3 U 7.076e+02 0.00e+00 - 0 2969 167 2970 0
122 6.889 8.158 133.315 3 U 8.849e+02 0.00e+00 - 0 2969 1903 2970 0
123 6.403 2.527 117.297 3 U 7.054e+02 0.00e+00 - 0 2991 2853 2992 0
124 6.403 2.600 117.297 3 U 8.133e+02 0.00e+00 - 0 2991 2828 2992 0
125 6.403 2.410 117.297 3 U 5.273e+02 0.00e+00 - 0 2991 2571 2992 0
126 6.402 3.134 117.357 3 U 5.130e+02 0.00e+00 - 0 2991 2598 2992 0
127 6.965 1.553 129.205 3 U 5.522e+02 0.00e+00 - 0 0 0 0 0
128 7.298 0.126 132.748 3 U 6.177e+02 0.00e+00 - 0 3001 1826 3002 0
129 7.303 3.861 132.736 3 U 1.266e+03 0.00e+00 - 0 3001 2497 3002 0
130 7.309 8.437 132.743 3 U 7.046e+02 0.00e+00 - 0 3001 61 3002 0
131 7.332 8.313 131.526 3 U 6.040e+02 0.00e+00 - 0 3004 93 3003 0
132 7.328 1.554 131.526 3 U 5.689e+02 0.00e+00 - 0 0 0 0 0
133 7.327 2.006 131.428 3 U 7.097e+02 0.00e+00 - 0 3004 2633 3003 0
134 7.328 2.790 131.449 3 U 6.190e+02 0.00e+00 - 0 0 0 0 0
135 7.327 3.100 131.495 3 U 8.027e+02 0.00e+00 - 0 3004 2598 3003 0
136 7.224 1.569 130.785 3 U 6.104e+02 0.00e+00 - 0 0 0 0 0
137 7.128 8.171 130.882 3 U 8.408e+02 0.00e+00 - 0 3009 291 3010 0
138 7.128 3.018 130.882 3 U 5.303e+02 0.00e+00 - 0 3009 2563 3010 0
139 7.128 3.185 130.882 3 U 5.304e+02 0.00e+00 - 0 3009 2881 3010 0
140 6.676 2.440 117.667 3 U 5.784e+02 0.00e+00 - 0 2993 2668 2994 0
141 6.676 4.384 117.667 3 U 9.275e+02 0.00e+00 - 0 2993 2509 2994 0
142 6.676 5.126 117.667 3 U 7.591e+02 0.00e+00 - 0 2993 2785 2994 0
143 6.676 7.579 117.667 3 U 6.245e+02 0.00e+00 - 0 2993 235 2994 0
144 8.209 1.905 137.304 3 U 8.483e+02 0.00e+00 - 0 3059 2588 3060 0
145 7.144 4.339 120.318 3 U 8.511e+02 0.00e+00 - 0 3013 2529 3014 0
146 7.145 8.224 120.272 3 U 6.134e+02 0.00e+00 - 0 3013 3059 3014 0
147 6.304 0.653 117.941 3 U 4.114e+02 0.00e+00 - 0 2989 1828 2990 0
148 6.304 2.285 118.006 3 U 4.804e+02 0.00e+00 - 0 0 0 0 0
149 6.403 4.011 117.285 3 U 5.302e+02 0.00e+00 - 0 2991 2496 2992 0
150 6.400 4.362 117.316 3 U 5.811e+02 0.00e+00 - 0 2991 2471 2992 0
151 6.403 6.096 117.297 4 U 8.472e+02 0.00e+00 - 0 0 0 0 0
152 7.023 1.187 133.392 3 U 5.980e+02 0.00e+00 - 0 2967 2617 2968 0
153 7.021 1.286 133.499 3 U 4.984e+02 0.00e+00 - 0 2967 2788 2968 0
154 6.676 1.782 117.667 3 U 4.250e+02 0.00e+00 - 0 2993 2786 2994 0
155 6.672 3.636 117.656 3 U 4.537e+02 0.00e+00 - 0 2993 2535 2994 0
156 6.665 3.817 117.659 3 U 5.364e+02 0.00e+00 - 0 2993 2793 2994 0
157 7.265 1.421 132.789 3 U 3.999e+02 0.00e+00 - 0 2995 2615 2996 0
158 7.271 1.542 132.772 3 U 5.900e+02 0.00e+00 - 0 2995 2695 2996 0
159 7.268 3.833 132.746 3 U 4.626e+02 0.00e+00 - 0 2995 2546 2996 0
160 7.267 9.138 132.653 3 U 4.846e+02 0.00e+00 - 0 2995 71 2996 0
161 7.173 0.864 130.252 4 U 5.493e+02 0.00e+00 - 0 0 0 0 0
162 7.171 1.260 130.135 3 U 4.711e+02 0.00e+00 - 0 0 0 0 0
163 7.174 1.542 130.145 3 U 4.436e+02 0.00e+00 - 0 2998 2695 2997 0
164 7.172 2.117 130.101 3 U 4.508e+02 0.00e+00 - 0 2998 2603 2997 0
165 7.174 4.628 130.115 3 U 7.124e+02 0.00e+00 - 0 0 0 0 0
166 7.384 1.553 129.555 3 U 5.570e+02 0.00e+00 - 0 3000 2695 2999 0
167 7.383 2.331 129.552 3 U 5.971e+02 0.00e+00 - 0 0 0 0 0
168 7.304 1.117 132.634 3 U 4.842e+02 0.00e+00 - 0 3001 1788 3002 0
169 7.306 6.420 132.736 3 U 4.554e+02 0.00e+00 - 0 3001 2991 3002 0
170 7.345 1.206 131.440 3 U 6.716e+02 0.00e+00 - 0 3004 2929 3003 0
171 7.329 1.130 131.567 3 U 4.877e+02 0.00e+00 - 0 0 0 0 0
172 6.959 0.540 129.533 3 U 8.574e+02 0.00e+00 - 0 0 0 0 0
173 6.951 0.642 129.265 3 U 6.317e+02 0.00e+00 - 0 3006 1828 3005 0
174 6.958 0.816 129.524 3 U 1.037e+03 0.00e+00 - 0 4455 1806 4464 0
175 6.968 2.123 129.263 3 U 5.315e+02 0.00e+00 - 0 3006 2639 3005 0
176 6.961 3.490 129.194 3 U 6.481e+02 0.00e+00 - 0 3006 2541 3005 0
177 7.225 0.907 130.834 3 U 1.274e+03 0.00e+00 - 0 4453 2949 4461 0
178 7.220 1.308 130.864 3 U 4.696e+02 0.00e+00 - 0 4453 2951 4461 0
179 7.225 1.500 130.785 3 U 5.437e+02 0.00e+00 - 0 4453 2574 4461 0
180 7.226 2.295 130.806 3 U 4.341e+02 0.00e+00 - 0 3007 2869 3008 0
181 7.224 3.931 130.862 3 U 5.062e+02 0.00e+00 - 0 4453 2538 4461 0
182 7.123 1.325 131.009 3 U 3.833e+02 0.00e+00 - 0 4454 2951 4462 0
183 7.128 1.551 130.868 3 U 3.726e+02 0.00e+00 - 0 3009 2583 3010 0
184 7.128 2.124 130.882 3 U 6.173e+02 0.00e+00 - 0 3009 2582 3010 0
185 7.134 2.302 130.859 3 U 3.569e+02 0.00e+00 - 0 3009 2869 3010 0
186 7.123 3.940 130.884 3 U 4.323e+02 0.00e+00 - 0 4454 2538 4462 0
187 7.128 4.195 130.882 3 U 5.636e+02 0.00e+00 - 0 0 0 0 0
188 6.152 2.585 119.774 3 U 4.473e+02 0.00e+00 - 0 3015 2828 3016 0
189 6.096 2.429 119.540 3 U 4.946e+02 0.00e+00 - 0 3017 2571 3018 0
190 6.104 2.576 119.540 3 U 8.196e+02 0.00e+00 - 0 3017 2829 3018 0
191 6.096 3.074 119.540 3 U 4.209e+02 0.00e+00 - 0 3017 2554 3018 0
192 8.440 0.919 137.242 4 U 6.387e+02 0.00e+00 - 0 0 0 0 0
193 8.436 2.060 137.161 4 U 4.747e+02 0.00e+00 - 0 0 0 0 0
194 7.145 1.217 120.272 3 U 5.577e+02 0.00e+00 - 0 3013 2721 3014 0
195 7.142 1.906 120.409 3 U 4.893e+02 0.00e+00 - 0 3013 2588 3014 0
196 7.146 3.926 120.213 3 U 5.475e+02 0.00e+00 - 0 3013 2530 3014 0
197 6.851 4.854 120.613 3 U 6.007e+02 0.00e+00 - 0 3019 2833 3020 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-aromatic . . 11.3678 ppm . . . 4.6831 . . 30696 3
2 . . H 1 H . aliased 11.3678 ppm . . . 4.6831 . . 30696 3
3 . . C 13 C-aromatic . aliased 48.2814 ppm . . . 119.9300 . . 30696 3
stop_
save_