Content for NMR-STAR saveframe, "spectral_peak_list_5"
save_spectral_peak_list_5
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_5
_Spectral_peak_list.Entry_ID 30765
_Spectral_peak_list.ID 5
_Spectral_peak_list.Name .
_Spectral_peak_list.Sample_ID 2
_Spectral_peak_list.Sample_label $sample_2
_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 13
_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
# Number of peaks 419
#FORMAT xeasy3D
#INAME 1 N
#INAME 2 H
#INAME 3 HN
#SPECTRUM N15NOESY N H HN
1 123.652 2.781 8.329 1 U 8.560000E+06 0.000000E+00 e 0 0 0 0
2 123.628 2.044 8.312 1 U 1.670000E+07 0.000000E+00 e 0 0 0 0
3 123.625 1.914 8.311 1 U 1.630000E+07 0.000000E+00 e 0 0 0 0
4 123.613 4.441 8.311 1 U 8.700000E+07 0.000000E+00 e 0 0 0 0
5 123.614 2.781 8.311 1 U 3.950000E+07 0.000000E+00 e 0 0 0 0
6 121.116 8.002 8.387 1 U 5.980000E+07 0.000000E+00 e 0 0 0 0
7 121.136 7.999 8.382 1 U 5.820000E+07 0.000000E+00 e 0 0 0 0
8 121.130 3.790 8.387 1 U 2.880000E+07 0.000000E+00 e 0 0 0 0
9 121.123 3.794 8.382 1 U 2.840000E+07 0.000000E+00 e 0 0 0 0
10 121.093 2.806 8.381 1 U 9.240000E+06 0.000000E+00 e 0 0 0 0
11 121.084 1.714 8.382 1 U 1.230000E+08 0.000000E+00 e 0 0 0 0
12 121.079 8.386 8.387 1 U 4.800000E+09 0.000000E+00 e 0 0 0 0
13 121.034 2.297 8.388 1 U 1.730000E+07 0.000000E+00 e 0 0 0 0
14 121.078 1.716 8.387 1 U 1.320000E+08 0.000000E+00 e 0 0 0 0
15 121.026 0.897 8.388 1 U 1.590000E+07 0.000000E+00 e 0 0 0 0
16 121.071 0.912 8.381 1 U 1.680000E+07 0.000000E+00 e 0 0 0 0
17 116.597 1.991 7.982 1 U 9.740000E+06 0.000000E+00 e 0 0 0 0
18 116.466 8.366 7.981 1 U 6.800000E+07 0.000000E+00 e 0 0 0 0
19 116.424 8.368 7.976 1 U 6.530000E+07 0.000000E+00 e 0 0 0 0
20 116.438 7.980 7.982 1 U 3.850000E+09 0.000000E+00 e 0 0 0 0
21 116.419 7.979 7.977 1 U 3.580000E+09 0.000000E+00 e 0 0 0 0
22 116.433 4.196 7.981 1 U 7.570000E+07 0.000000E+00 e 0 0 0 0
23 116.426 4.197 7.976 1 U 7.600000E+07 0.000000E+00 e 0 0 0 0
24 116.436 3.787 7.982 1 U 1.310000E+07 0.000000E+00 e 0 0 0 0
25 116.495 2.782 7.981 1 U 8.750000E+06 0.000000E+00 e 0 0 0 0
26 116.500 1.725 7.980 1 U 2.230000E+07 0.000000E+00 e 0 0 0 0
27 116.444 1.587 7.976 1 U 3.330000E+07 0.000000E+00 e 0 0 0 0
28 116.350 3.818 7.973 1 U 1.300000E+07 0.000000E+00 e 0 0 0 0
29 116.346 2.773 7.976 1 U 9.970000E+06 0.000000E+00 e 0 0 0 0
30 120.242 2.290 8.413 1 U 2.680000E+07 0.000000E+00 e 0 0 0 0
31 125.439 4.549 8.306 1 U 9.200000E+07 0.000000E+00 e 0 0 0 0
32 125.410 0.923 8.316 1 U 8.250000E+06 0.000000E+00 e 0 0 0 0
33 125.199 8.315 8.315 1 U 3.380000E+09 0.000000E+00 e 0 0 0 0
34 125.202 1.211 8.314 1 U 8.650000E+06 0.000000E+00 e 0 0 0 0
35 125.195 0.907 8.316 1 U 9.310000E+06 0.000000E+00 e 0 0 0 0
36 125.126 4.260 8.317 1 U 3.380000E+08 0.000000E+00 e 0 0 0 0
37 125.128 4.105 8.314 1 U 1.460000E+07 0.000000E+00 e 0 0 0 0
38 125.115 2.263 8.317 1 U 2.730000E+07 0.000000E+00 e 0 0 0 0
39 125.126 2.031 8.317 1 U 5.870000E+07 0.000000E+00 e 0 0 0 0
40 125.139 1.913 8.317 1 U 3.890000E+07 0.000000E+00 e 0 0 0 0
41 125.127 1.370 8.317 1 U 2.360000E+08 0.000000E+00 e 0 0 0 0
42 115.011 4.342 8.371 1 U 1.420000E+08 0.000000E+00 e 0 0 0 0
43 114.996 3.912 8.371 1 U 7.770000E+07 0.000000E+00 e 0 0 0 0
44 114.840 2.123 8.376 1 U 1.190000E+07 0.000000E+00 e 0 0 0 0
45 122.335 4.342 8.327 1 U 1.570000E+08 0.000000E+00 e 0 0 0 0
46 122.376 3.913 8.326 1 U 3.540000E+07 0.000000E+00 e 0 0 0 0
47 122.312 2.112 8.327 1 U 4.640000E+07 0.000000E+00 e 0 0 0 0
48 122.330 1.990 8.327 1 U 9.640000E+07 0.000000E+00 e 0 0 0 0
49 116.335 2.807 8.234 1 U 8.270000E+06 0.000000E+00 e 0 0 0 0
50 116.192 8.235 8.235 1 U 7.000000E+08 0.000000E+00 e 0 0 0 0
51 116.191 3.903 8.235 1 U 6.970000E+07 0.000000E+00 e 0 0 0 0
52 116.146 2.287 8.235 1 U 1.220000E+07 0.000000E+00 e 0 0 0 0
53 116.184 2.109 8.234 1 U 2.130000E+07 0.000000E+00 e 0 0 0 0
54 116.173 1.994 8.238 1 U 1.380000E+07 0.000000E+00 e 0 0 0 0
55 116.115 0.951 8.233 1 U 9.120000E+06 0.000000E+00 e 0 0 0 0
56 121.451 4.439 8.069 1 U 1.150000E+08 0.000000E+00 e 0 0 0 0
57 121.391 3.904 8.069 1 U 6.180000E+07 0.000000E+00 e 0 0 0 0
58 121.395 2.121 8.069 1 U 1.410000E+08 0.000000E+00 e 0 0 0 0
59 121.367 4.054 8.068 1 U 8.260000E+07 0.000000E+00 e 0 0 0 0
60 121.374 0.950 8.069 1 U 1.600000E+08 0.000000E+00 e 0 0 0 0
61 121.113 7.601 8.063 1 U 1.360000E+07 0.000000E+00 e 0 0 0 0
62 120.624 8.343 8.342 1 U 5.510000E+08 0.000000E+00 e 0 0 0 0
63 120.572 4.217 8.341 1 U 2.280000E+07 0.000000E+00 e 0 0 0 0
64 120.568 4.052 8.341 1 U 7.140000E+07 0.000000E+00 e 0 0 0 0
65 120.549 2.772 8.341 1 U 7.080000E+07 0.000000E+00 e 0 0 0 0
66 120.550 2.120 8.340 1 U 3.470000E+07 0.000000E+00 e 0 0 0 0
67 120.528 0.945 8.344 1 U 3.240000E+07 0.000000E+00 e 0 0 0 0
68 112.788 4.305 7.610 1 U 1.320000E+07 0.000000E+00 e 0 0 0 0
69 112.763 0.925 7.612 1 U 1.370000E+07 0.000000E+00 e 0 0 0 0
70 112.717 7.612 7.611 1 U 1.900000E+09 0.000000E+00 e 0 0 0 0
71 112.750 6.912 7.611 1 U 1.070000E+09 0.000000E+00 e 0 0 0 0
72 112.715 2.775 7.612 1 U 7.940000E+07 0.000000E+00 e 0 0 0 0
73 112.764 7.611 6.911 1 U 1.210000E+09 0.000000E+00 e 0 0 0 0
74 112.767 4.780 6.911 1 U 1.480000E+08 0.000000E+00 e 0 0 0 0
75 112.806 4.282 6.910 1 U 8.500000E+06 0.000000E+00 e 0 0 0 0
76 112.758 2.776 6.911 1 U 4.040000E+07 0.000000E+00 e 0 0 0 0
77 112.767 0.896 6.930 1 U 9.440000E+06 0.000000E+00 e 0 0 0 0
78 112.746 6.912 6.911 1 U 2.850000E+09 0.000000E+00 e 0 0 0 0
79 112.673 2.815 6.927 1 U 4.320000E+07 0.000000E+00 e 0 0 0 0
80 112.744 0.934 6.911 1 U 1.330000E+07 0.000000E+00 e 0 0 0 0
81 112.636 7.638 6.928 1 U 9.520000E+08 0.000000E+00 e 0 0 0 0
82 112.594 6.927 6.928 1 U 2.310000E+09 0.000000E+00 e 0 0 0 0
83 112.640 4.782 6.927 1 U 1.010000E+08 0.000000E+00 e 0 0 0 0
84 119.286 0.901 8.257 1 U 9.110000E+06 0.000000E+00 e 0 0 0 0
85 119.200 8.255 8.255 1 U 1.620000E+08 0.000000E+00 e 0 0 0 0
86 119.250 8.009 8.255 1 U 2.110000E+07 0.000000E+00 e 0 0 0 0
87 119.193 2.813 8.256 1 U 6.690000E+07 0.000000E+00 e 0 0 0 0
88 112.598 7.639 7.639 1 U 1.670000E+09 0.000000E+00 e 0 0 0 0
89 112.635 6.927 7.639 1 U 9.610000E+08 0.000000E+00 e 0 0 0 0
90 112.609 2.816 7.639 1 U 8.920000E+07 0.000000E+00 e 0 0 0 0
91 121.011 1.663 8.017 1 U 2.450000E+07 0.000000E+00 e 0 0 0 0
92 120.947 8.016 8.015 1 U 2.490000E+09 0.000000E+00 e 0 0 0 0
93 120.957 4.670 8.016 1 U 1.660000E+08 0.000000E+00 e 0 0 0 0
94 120.962 4.049 8.016 1 U 1.190000E+08 0.000000E+00 e 0 0 0 0
95 120.951 2.817 8.016 1 U 7.310000E+07 0.000000E+00 e 0 0 0 0
96 120.958 1.916 8.016 1 U 2.040000E+08 0.000000E+00 e 0 0 0 0
97 120.962 1.496 8.015 1 U 1.030000E+08 0.000000E+00 e 0 0 0 0
98 123.603 8.132 8.132 1 U 2.270000E+09 0.000000E+00 e 0 0 0 0
99 123.607 4.270 8.132 1 U 1.130000E+08 0.000000E+00 e 0 0 0 0
100 123.545 2.820 8.134 1 U 1.150000E+07 0.000000E+00 e 0 0 0 0
101 123.604 1.915 8.133 1 U 8.060000E+07 0.000000E+00 e 0 0 0 0
102 123.597 1.682 8.132 1 U 2.230000E+08 0.000000E+00 e 0 0 0 0
103 123.473 2.802 8.128 1 U 1.040000E+07 0.000000E+00 e 0 0 0 0
104 121.046 2.836 8.057 1 U 8.360000E+06 0.000000E+00 e 0 0 0 0
105 120.892 1.843 8.069 1 U 1.570000E+08 0.000000E+00 e 0 0 0 0
106 120.867 4.294 8.070 1 U 2.960000E+08 0.000000E+00 e 0 0 0 0
107 120.752 8.074 8.072 1 U 5.100000E+09 0.000000E+00 e 0 0 0 0
108 120.710 1.375 8.071 1 U 8.020000E+07 0.000000E+00 e 0 0 0 0
109 120.663 8.076 8.079 1 U 4.340000E+09 0.000000E+00 e 0 0 0 0
110 120.622 4.141 8.078 1 U 6.410000E+07 0.000000E+00 e 0 0 0 0
111 120.636 4.142 8.073 1 U 7.100000E+07 0.000000E+00 e 0 0 0 0
112 120.646 1.478 8.078 1 U 5.460000E+07 0.000000E+00 e 0 0 0 0
113 120.659 1.371 8.078 1 U 6.600000E+07 0.000000E+00 e 0 0 0 0
114 120.596 2.706 8.212 1 U 1.150000E+07 0.000000E+00 e 0 0 0 0
115 120.498 8.232 8.234 1 U 3.400000E+08 0.000000E+00 e 0 0 0 0
116 120.446 8.222 8.221 1 U 3.420000E+08 0.000000E+00 e 0 0 0 0
117 120.426 4.259 8.221 1 U 9.360000E+07 0.000000E+00 e 0 0 0 0
118 120.451 2.382 8.222 1 U 3.350000E+07 0.000000E+00 e 0 0 0 0
119 120.449 2.152 8.221 1 U 2.780000E+07 0.000000E+00 e 0 0 0 0
120 120.429 2.022 8.221 1 U 5.520000E+07 0.000000E+00 e 0 0 0 0
121 120.440 1.825 8.221 1 U 2.490000E+07 0.000000E+00 e 0 0 0 0
122 120.340 1.435 8.224 1 U 8.360000E+06 0.000000E+00 e 0 0 0 0
123 112.348 2.401 7.468 1 U 9.710000E+06 0.000000E+00 e 0 0 0 0
124 112.089 6.852 7.480 1 U 1.300000E+09 0.000000E+00 e 0 0 0 0
125 111.854 4.280 7.482 1 U 9.020000E+06 0.000000E+00 e 0 0 0 0
126 112.327 4.778 6.834 1 U 1.370000E+07 0.000000E+00 e 0 0 0 0
127 112.099 7.481 6.853 1 U 1.250000E+09 0.000000E+00 e 0 0 0 0
128 112.092 6.852 6.853 1 U 3.380000E+09 0.000000E+00 e 0 0 0 0
129 112.109 2.380 6.853 1 U 3.000000E+07 0.000000E+00 e 0 0 0 0
130 112.009 2.019 6.856 1 U 9.600000E+06 0.000000E+00 e 0 0 0 0
131 116.454 4.333 8.276 1 U 1.180000E+07 0.000000E+00 e 0 0 0 0
132 116.346 4.327 8.297 1 U 3.220000E+07 0.000000E+00 e 0 0 0 0
133 116.293 3.907 8.292 1 U 1.640000E+07 0.000000E+00 e 0 0 0 0
134 110.757 4.242 8.338 1 U 1.980000E+07 0.000000E+00 e 0 0 0 0
135 110.773 3.946 8.341 1 U 4.100000E+07 0.000000E+00 e 0 0 0 0
136 110.616 3.940 8.324 1 U 1.450000E+07 0.000000E+00 e 0 0 0 0
137 123.665 1.721 8.093 1 U 9.480000E+06 0.000000E+00 e 0 0 0 0
138 123.546 4.284 8.108 1 U 5.210000E+07 0.000000E+00 e 0 0 0 0
139 123.552 3.950 8.108 1 U 5.670000E+07 0.000000E+00 e 0 0 0 0
140 123.545 1.315 8.107 1 U 8.210000E+07 0.000000E+00 e 0 0 0 0
141 123.482 1.712 8.096 1 U 9.670000E+06 0.000000E+00 e 0 0 0 0
142 119.905 8.146 8.145 1 U 6.110000E+08 0.000000E+00 e 0 0 0 0
143 119.890 7.284 8.144 1 U 2.750000E+07 0.000000E+00 e 0 0 0 0
144 119.920 4.297 8.145 1 U 1.320000E+08 0.000000E+00 e 0 0 0 0
145 119.911 1.313 8.145 1 U 5.870000E+07 0.000000E+00 e 0 0 0 0
146 119.803 4.153 8.142 1 U 1.050000E+07 0.000000E+00 e 0 0 0 0
147 119.668 2.859 8.154 1 U 1.140000E+07 0.000000E+00 e 0 0 0 0
148 119.671 2.840 8.148 1 U 1.120000E+07 0.000000E+00 e 0 0 0 0
149 129.856 4.277 10.218 1 U 1.040000E+07 0.000000E+00 e 0 0 0 0
150 129.765 1.425 10.215 1 U 9.730000E+06 0.000000E+00 e 0 0 0 0
151 129.662 4.271 10.224 1 U 9.440000E+06 0.000000E+00 e 0 0 0 0
152 117.313 3.715 8.091 1 U 8.390000E+06 0.000000E+00 e 0 0 0 0
153 117.127 3.769 8.084 1 U 9.530000E+06 0.000000E+00 e 0 0 0 0
154 117.214 3.266 8.093 1 U 9.370000E+06 0.000000E+00 e 0 0 0 0
155 110.109 4.375 7.717 1 U 2.380000E+07 0.000000E+00 e 0 0 0 0
156 120.652 8.389 8.244 1 U 3.660000E+07 0.000000E+00 e 0 0 0 0
157 120.548 2.696 8.246 1 U 7.120000E+07 0.000000E+00 e 0 0 0 0
158 120.490 2.381 8.249 1 U 9.130000E+06 0.000000E+00 e 0 0 0 0
159 120.167 4.240 8.374 1 U 1.110000E+07 0.000000E+00 e 0 0 0 0
160 120.071 2.732 8.375 1 U 9.880000E+07 0.000000E+00 e 0 0 0 0
161 120.045 4.562 8.375 1 U 6.100000E+07 0.000000E+00 e 0 0 0 0
162 119.972 1.744 8.370 1 U 8.910000E+06 0.000000E+00 e 0 0 0 0
163 120.049 1.437 8.373 1 U 8.350000E+06 0.000000E+00 e 0 0 0 0
164 121.592 7.884 8.341 1 U 9.260000E+06 0.000000E+00 e 0 0 0 0
165 121.494 4.538 8.336 1 U 2.640000E+07 0.000000E+00 e 0 0 0 0
166 121.483 8.103 8.337 1 U 2.750000E+07 0.000000E+00 e 0 0 0 0
167 121.409 4.105 8.334 1 U 3.810000E+07 0.000000E+00 e 0 0 0 0
168 121.449 1.706 8.336 1 U 7.150000E+07 0.000000E+00 e 0 0 0 0
169 116.653 8.348 8.097 1 U 3.800000E+07 0.000000E+00 e 0 0 0 0
170 116.688 7.494 8.102 1 U 1.120000E+07 0.000000E+00 e 0 0 0 0
171 116.708 4.327 8.095 1 U 6.180000E+07 0.000000E+00 e 0 0 0 0
172 116.641 1.957 8.098 1 U 8.300000E+07 0.000000E+00 e 0 0 0 0
173 116.673 1.430 8.097 1 U 2.100000E+07 0.000000E+00 e 0 0 0 0
174 116.684 0.889 8.099 1 U 3.130000E+07 0.000000E+00 e 0 0 0 0
175 116.593 4.096 8.096 1 U 2.770000E+07 0.000000E+00 e 0 0 0 0
176 116.451 7.499 8.097 1 U 1.100000E+07 0.000000E+00 e 0 0 0 0
177 118.525 1.428 7.892 1 U 8.300000E+06 0.000000E+00 e 0 0 0 0
178 118.391 7.897 7.897 1 U 7.190000E+08 0.000000E+00 e 0 0 0 0
179 118.347 0.874 7.895 1 U 1.790000E+07 0.000000E+00 e 0 0 0 0
180 118.288 8.106 7.898 1 U 1.020000E+08 0.000000E+00 e 0 0 0 0
181 118.300 2.566 7.898 1 U 4.560000E+07 0.000000E+00 e 0 0 0 0
182 118.283 2.429 7.897 1 U 4.870000E+07 0.000000E+00 e 0 0 0 0
183 118.302 1.072 7.915 1 U 1.020000E+07 0.000000E+00 e 0 0 0 0
184 118.168 4.543 7.898 1 U 1.750000E+07 0.000000E+00 e 0 0 0 0
185 118.164 1.052 7.898 1 U 1.570000E+07 0.000000E+00 e 0 0 0 0
186 111.134 2.720 7.487 1 U 8.640000E+06 0.000000E+00 e 0 0 0 0
187 111.151 2.424 7.484 1 U 2.760000E+07 0.000000E+00 e 0 0 0 0
188 111.057 2.202 7.484 1 U 2.230000E+07 0.000000E+00 e 0 0 0 0
189 111.224 1.580 6.843 1 U 8.750000E+06 0.000000E+00 e 0 0 0 0
190 111.065 7.484 6.843 1 U 5.900000E+08 0.000000E+00 e 0 0 0 0
191 111.062 2.429 6.843 1 U 1.870000E+07 0.000000E+00 e 0 0 0 0
192 111.057 2.201 6.842 1 U 1.320000E+07 0.000000E+00 e 0 0 0 0
193 110.979 2.715 6.844 1 U 1.120000E+07 0.000000E+00 e 0 0 0 0
194 117.046 7.474 8.181 1 U 9.460000E+06 0.000000E+00 e 0 0 0 0
195 117.063 4.316 8.188 1 U 1.040000E+07 0.000000E+00 e 0 0 0 0
196 117.024 1.966 8.188 1 U 9.900000E+06 0.000000E+00 e 0 0 0 0
197 116.929 7.692 8.186 1 U 9.190000E+06 0.000000E+00 e 0 0 0 0
198 116.926 7.467 8.189 1 U 1.110000E+07 0.000000E+00 e 0 0 0 0
199 116.958 6.951 8.185 1 U 5.640000E+07 0.000000E+00 e 0 0 0 0
200 116.966 4.027 8.185 1 U 9.960000E+07 0.000000E+00 e 0 0 0 0
201 117.017 2.670 8.183 1 U 1.260000E+07 0.000000E+00 e 0 0 0 0
202 117.001 2.581 8.186 1 U 1.460000E+07 0.000000E+00 e 0 0 0 0
203 116.959 2.197 8.185 1 U 7.580000E+07 0.000000E+00 e 0 0 0 0
204 116.962 1.978 8.182 1 U 1.160000E+07 0.000000E+00 e 0 0 0 0
205 116.952 1.637 8.185 1 U 1.160000E+08 0.000000E+00 e 0 0 0 0
206 116.955 1.386 8.185 1 U 2.610000E+07 0.000000E+00 e 0 0 0 0
207 116.934 1.090 8.185 1 U 7.430000E+07 0.000000E+00 e 0 0 0 0
208 116.919 0.889 8.186 1 U 8.310000E+06 0.000000E+00 e 0 0 0 0
209 116.801 2.654 8.193 1 U 1.160000E+07 0.000000E+00 e 0 0 0 0
210 120.195 2.674 6.955 1 U 9.200000E+06 0.000000E+00 e 0 0 0 0
211 120.075 8.556 6.967 1 U 8.450000E+06 0.000000E+00 e 0 0 0 0
212 120.075 8.556 6.953 1 U 1.730000E+07 0.000000E+00 e 0 0 0 0
213 120.096 8.183 6.953 1 U 6.140000E+07 0.000000E+00 e 0 0 0 0
214 120.097 7.667 6.953 1 U 9.840000E+07 0.000000E+00 e 0 0 0 0
215 120.102 7.471 6.953 1 U 8.020000E+07 0.000000E+00 e 0 0 0 0
216 120.081 4.338 6.955 1 U 3.010000E+07 0.000000E+00 e 0 0 0 0
217 120.091 3.988 6.953 1 U 8.480000E+07 0.000000E+00 e 0 0 0 0
218 120.089 3.270 6.953 1 U 8.540000E+07 0.000000E+00 e 0 0 0 0
219 120.075 3.110 6.954 1 U 6.140000E+07 0.000000E+00 e 0 0 0 0
220 120.108 1.638 6.953 1 U 4.930000E+07 0.000000E+00 e 0 0 0 0
221 120.163 0.859 6.935 1 U 1.340000E+07 0.000000E+00 e 0 0 0 0
222 120.061 1.402 6.938 1 U 9.480000E+06 0.000000E+00 e 0 0 0 0
223 120.023 1.373 6.953 1 U 1.770000E+07 0.000000E+00 e 0 0 0 0
224 130.122 3.275 10.555 1 U 1.090000E+07 0.000000E+00 e 0 0 0 0
225 130.088 3.276 10.563 1 U 9.710000E+06 0.000000E+00 e 0 0 0 0
226 129.993 7.599 10.556 1 U 6.780000E+07 0.000000E+00 e 0 0 0 0
227 129.991 7.467 10.557 1 U 1.360000E+08 0.000000E+00 e 0 0 0 0
228 129.991 6.949 10.556 1 U 2.360000E+07 0.000000E+00 e 0 0 0 0
229 129.999 3.117 10.557 1 U 8.310000E+06 0.000000E+00 e 0 0 0 0
230 129.991 2.624 10.556 1 U 3.410000E+07 0.000000E+00 e 0 0 0 0
231 129.912 7.069 10.558 1 U 8.330000E+06 0.000000E+00 e 0 0 0 0
232 117.160 1.068 7.678 1 U 1.370000E+07 0.000000E+00 e 0 0 0 0
233 117.020 3.524 7.666 1 U 4.470000E+07 0.000000E+00 e 0 0 0 0
234 117.038 3.269 7.667 1 U 4.740000E+07 0.000000E+00 e 0 0 0 0
235 117.028 1.618 7.670 1 U 1.150000E+07 0.000000E+00 e 0 0 0 0
236 117.005 8.552 7.668 1 U 6.760000E+07 0.000000E+00 e 0 0 0 0
237 117.008 8.178 7.663 1 U 1.050000E+07 0.000000E+00 e 0 0 0 0
238 116.992 8.173 7.679 1 U 8.260000E+06 0.000000E+00 e 0 0 0 0
239 117.003 6.954 7.666 1 U 7.810000E+07 0.000000E+00 e 0 0 0 0
240 116.946 4.295 7.663 1 U 8.610000E+06 0.000000E+00 e 0 0 0 0
241 117.012 4.001 7.667 1 U 5.610000E+07 0.000000E+00 e 0 0 0 0
242 117.014 3.113 7.667 1 U 3.680000E+07 0.000000E+00 e 0 0 0 0
243 116.975 1.414 7.667 1 U 1.150000E+07 0.000000E+00 e 0 0 0 0
244 116.997 1.084 7.673 1 U 1.340000E+07 0.000000E+00 e 0 0 0 0
245 116.989 1.079 7.665 1 U 1.440000E+07 0.000000E+00 e 0 0 0 0
246 117.000 1.073 7.659 1 U 1.430000E+07 0.000000E+00 e 0 0 0 0
247 117.011 0.847 7.668 1 U 1.330000E+08 0.000000E+00 e 0 0 0 0
248 116.837 8.198 7.670 1 U 9.110000E+06 0.000000E+00 e 0 0 0 0
249 118.517 6.763 8.552 1 U 8.430000E+06 0.000000E+00 e 0 0 0 0
250 118.348 8.183 8.560 1 U 1.170000E+07 0.000000E+00 e 0 0 0 0
251 118.397 7.693 8.556 1 U 8.210000E+07 0.000000E+00 e 0 0 0 0
252 118.382 6.956 8.555 1 U 1.140000E+07 0.000000E+00 e 0 0 0 0
253 118.379 4.018 8.556 1 U 1.050000E+08 0.000000E+00 e 0 0 0 0
254 118.414 3.527 8.557 1 U 2.250000E+07 0.000000E+00 e 0 0 0 0
255 118.391 3.234 8.537 1 U 9.070000E+06 0.000000E+00 e 0 0 0 0
256 118.387 1.975 8.556 1 U 1.580000E+08 0.000000E+00 e 0 0 0 0
257 118.412 0.828 8.556 1 U 5.460000E+07 0.000000E+00 e 0 0 0 0
258 117.249 3.511 7.744 1 U 8.780000E+06 0.000000E+00 e 0 0 0 0
259 117.228 0.951 7.741 1 U 4.630000E+07 0.000000E+00 e 0 0 0 0
260 117.228 0.821 7.736 1 U 1.380000E+07 0.000000E+00 e 0 0 0 0
261 117.211 4.008 7.742 1 U 5.570000E+07 0.000000E+00 e 0 0 0 0
262 117.219 3.793 7.742 1 U 7.490000E+07 0.000000E+00 e 0 0 0 0
263 117.207 3.515 7.758 1 U 8.830000E+06 0.000000E+00 e 0 0 0 0
264 117.151 3.233 7.742 1 U 1.100000E+07 0.000000E+00 e 0 0 0 0
265 117.214 2.175 7.741 1 U 1.540000E+08 0.000000E+00 e 0 0 0 0
266 117.216 1.976 7.742 1 U 9.010000E+07 0.000000E+00 e 0 0 0 0
267 117.211 1.084 7.741 1 U 1.360000E+08 0.000000E+00 e 0 0 0 0
268 117.206 0.811 7.743 1 U 1.220000E+07 0.000000E+00 e 0 0 0 0
269 117.105 8.194 7.744 1 U 1.110000E+07 0.000000E+00 e 0 0 0 0
270 117.071 6.963 7.738 1 U 8.650000E+06 0.000000E+00 e 0 0 0 0
271 118.746 8.552 7.804 1 U 8.200000E+06 0.000000E+00 e 0 0 0 0
272 118.554 7.814 7.816 1 U 5.340000E+08 0.000000E+00 e 0 0 0 0
273 118.552 7.519 7.816 1 U 3.160000E+07 0.000000E+00 e 0 0 0 0
274 118.553 3.790 7.815 1 U 2.710000E+07 0.000000E+00 e 0 0 0 0
275 118.545 1.081 7.817 1 U 3.220000E+07 0.000000E+00 e 0 0 0 0
276 118.557 0.956 7.816 1 U 4.190000E+07 0.000000E+00 e 0 0 0 0
277 118.571 0.758 7.817 1 U 3.740000E+07 0.000000E+00 e 0 0 0 0
278 118.534 8.761 7.816 1 U 6.720000E+07 0.000000E+00 e 0 0 0 0
279 118.523 8.181 7.816 1 U 2.230000E+07 0.000000E+00 e 0 0 0 0
280 118.445 8.089 7.817 1 U 8.840000E+06 0.000000E+00 e 0 0 0 0
281 118.534 8.076 7.812 1 U 1.010000E+07 0.000000E+00 e 0 0 0 0
282 118.540 7.385 7.836 1 U 8.340000E+06 0.000000E+00 e 0 0 0 0
283 118.535 7.398 7.817 1 U 2.800000E+07 0.000000E+00 e 0 0 0 0
284 118.535 7.030 7.815 1 U 3.440000E+07 0.000000E+00 e 0 0 0 0
285 118.541 4.109 7.815 1 U 6.430000E+07 0.000000E+00 e 0 0 0 0
286 118.538 3.427 7.816 1 U 1.450000E+08 0.000000E+00 e 0 0 0 0
287 118.529 2.181 7.816 1 U 7.610000E+07 0.000000E+00 e 0 0 0 0
288 118.514 1.600 7.819 1 U 8.890000E+06 0.000000E+00 e 0 0 0 0
289 118.541 1.307 7.818 1 U 2.090000E+07 0.000000E+00 e 0 0 0 0
290 119.268 7.647 8.765 1 U 1.010000E+07 0.000000E+00 e 0 0 0 0
291 119.270 1.308 8.762 1 U 1.450000E+07 0.000000E+00 e 0 0 0 0
292 119.225 8.763 8.764 1 U 3.570000E+08 0.000000E+00 e 0 0 0 0
293 119.228 8.182 8.764 1 U 6.190000E+07 0.000000E+00 e 0 0 0 0
294 119.239 7.025 8.763 1 U 3.150000E+07 0.000000E+00 e 0 0 0 0
295 119.226 4.028 8.764 1 U 7.670000E+07 0.000000E+00 e 0 0 0 0
296 119.167 3.797 8.763 1 U 8.180000E+06 0.000000E+00 e 0 0 0 0
297 119.236 3.423 8.763 1 U 5.210000E+07 0.000000E+00 e 0 0 0 0
298 119.224 2.033 8.764 1 U 6.850000E+07 0.000000E+00 e 0 0 0 0
299 119.225 1.045 8.764 1 U 4.210000E+07 0.000000E+00 e 0 0 0 0
300 119.237 0.788 8.762 1 U 2.430000E+07 0.000000E+00 e 0 0 0 0
301 119.539 1.427 8.170 1 U 8.580000E+06 0.000000E+00 e 0 0 0 0
302 119.376 8.451 8.181 1 U 1.530000E+07 0.000000E+00 e 0 0 0 0
303 119.357 8.181 8.180 1 U 7.940000E+08 0.000000E+00 e 0 0 0 0
304 119.369 7.641 8.181 1 U 8.350000E+07 0.000000E+00 e 0 0 0 0
305 119.356 4.686 8.181 1 U 8.470000E+07 0.000000E+00 e 0 0 0 0
306 119.357 4.018 8.179 1 U 5.180000E+07 0.000000E+00 e 0 0 0 0
307 119.337 7.806 8.182 1 U 1.940000E+07 0.000000E+00 e 0 0 0 0
308 119.302 2.989 8.177 1 U 1.080000E+07 0.000000E+00 e 0 0 0 0
309 119.334 2.812 8.180 1 U 9.050000E+07 0.000000E+00 e 0 0 0 0
310 119.349 2.725 8.180 1 U 1.220000E+08 0.000000E+00 e 0 0 0 0
311 119.332 2.025 8.180 1 U 4.780000E+07 0.000000E+00 e 0 0 0 0
312 119.337 1.565 8.180 1 U 3.550000E+07 0.000000E+00 e 0 0 0 0
313 119.352 0.927 8.181 1 U 2.140000E+07 0.000000E+00 e 0 0 0 0
314 119.673 4.118 7.625 1 U 8.690000E+06 0.000000E+00 e 0 0 0 0
315 119.605 8.467 7.642 1 U 5.400000E+07 0.000000E+00 e 0 0 0 0
316 119.631 4.115 7.643 1 U 2.270000E+07 0.000000E+00 e 0 0 0 0
317 119.586 3.977 7.642 1 U 2.010000E+08 0.000000E+00 e 0 0 0 0
318 119.567 3.796 7.642 1 U 1.810000E+07 0.000000E+00 e 0 0 0 0
319 119.587 3.049 7.641 1 U 2.550000E+07 0.000000E+00 e 0 0 0 0
320 119.586 1.571 7.642 1 U 7.400000E+07 0.000000E+00 e 0 0 0 0
321 119.439 0.895 7.637 1 U 1.080000E+07 0.000000E+00 e 0 0 0 0
322 107.682 7.642 8.468 1 U 5.240000E+07 0.000000E+00 e 0 0 0 0
323 107.776 2.363 8.471 1 U 8.790000E+06 0.000000E+00 e 0 0 0 0
324 107.692 1.577 8.470 1 U 1.900000E+07 0.000000E+00 e 0 0 0 0
325 107.694 0.960 8.470 1 U 1.980000E+07 0.000000E+00 e 0 0 0 0
326 107.670 7.891 8.467 1 U 4.410000E+07 0.000000E+00 e 0 0 0 0
327 107.645 4.114 8.469 1 U 1.230000E+07 0.000000E+00 e 0 0 0 0
328 107.661 3.960 8.469 1 U 1.840000E+08 0.000000E+00 e 0 0 0 0
329 107.658 3.755 8.469 1 U 1.280000E+08 0.000000E+00 e 0 0 0 0
330 107.600 3.012 8.470 1 U 1.090000E+07 0.000000E+00 e 0 0 0 0
331 107.667 1.835 8.468 1 U 4.120000E+07 0.000000E+00 e 0 0 0 0
332 119.287 1.462 7.893 1 U 8.860000E+06 0.000000E+00 e 0 0 0 0
333 119.196 8.470 7.888 1 U 9.170000E+07 0.000000E+00 e 0 0 0 0
334 119.190 7.889 7.887 1 U 1.050000E+09 0.000000E+00 e 0 0 0 0
335 119.175 4.304 7.888 1 U 9.590000E+07 0.000000E+00 e 0 0 0 0
336 119.193 3.754 7.888 1 U 6.850000E+07 0.000000E+00 e 0 0 0 0
337 119.175 2.345 7.888 1 U 7.440000E+07 0.000000E+00 e 0 0 0 0
338 119.175 1.996 7.888 1 U 1.260000E+08 0.000000E+00 e 0 0 0 0
339 119.150 3.951 7.889 1 U 6.920000E+07 0.000000E+00 e 0 0 0 0
340 119.089 2.138 7.889 1 U 6.750000E+07 0.000000E+00 e 0 0 0 0
341 119.078 0.950 7.893 1 U 9.860000E+06 0.000000E+00 e 0 0 0 0
342 119.042 4.149 7.892 1 U 1.170000E+07 0.000000E+00 e 0 0 0 0
343 112.491 4.289 7.545 1 U 1.450000E+07 0.000000E+00 e 0 0 0 0
344 112.468 1.822 7.542 1 U 8.380000E+06 0.000000E+00 e 0 0 0 0
345 112.430 6.822 7.544 1 U 1.480000E+09 0.000000E+00 e 0 0 0 0
346 112.388 2.344 7.544 1 U 7.380000E+07 0.000000E+00 e 0 0 0 0
347 112.368 2.143 7.548 1 U 8.280000E+06 0.000000E+00 e 0 0 0 0
348 112.354 1.990 7.544 1 U 1.150000E+07 0.000000E+00 e 0 0 0 0
349 112.447 7.543 6.822 1 U 1.560000E+09 0.000000E+00 e 0 0 0 0
350 112.435 6.822 6.822 1 U 3.800000E+09 0.000000E+00 e 0 0 0 0
351 112.438 4.780 6.821 1 U 6.410000E+07 0.000000E+00 e 0 0 0 0
352 112.427 2.349 6.822 1 U 3.390000E+07 0.000000E+00 e 0 0 0 0
353 112.316 2.130 6.827 1 U 8.930000E+06 0.000000E+00 e 0 0 0 0
354 121.773 7.894 8.476 1 U 4.550000E+07 0.000000E+00 e 0 0 0 0
355 121.768 2.266 8.476 1 U 6.830000E+07 0.000000E+00 e 0 0 0 0
356 121.770 2.137 8.476 1 U 5.680000E+07 0.000000E+00 e 0 0 0 0
357 130.579 1.846 7.907 1 U 3.430000E+07 0.000000E+00 e 0 0 0 0
358 130.557 1.849 7.899 1 U 3.420000E+07 0.000000E+00 e 0 0 0 0
359 130.570 1.378 7.907 1 U 4.660000E+07 0.000000E+00 e 0 0 0 0
360 130.550 1.378 7.898 1 U 5.110000E+07 0.000000E+00 e 0 0 0 0
361 130.572 0.910 7.907 1 U 4.000000E+07 0.000000E+00 e 0 0 0 0
362 130.543 0.912 7.898 1 U 4.310000E+07 0.000000E+00 e 0 0 0 0
363 130.387 1.398 7.887 1 U 9.740000E+06 0.000000E+00 e 0 0 0 0
364 123.477 6.973 8.476 1 U 4.230000E+06 0.000000E+00 e 0 0 0 0
365 117.694 3.205 8.441 1 U 1.730000E+06 0.000000E+00 e 0 0 0 0
366 117.010 0.819 7.981 1 U 3.980000E+06 0.000000E+00 e 0 0 0 0
367 122.376 2.166 8.521 1 U 5.500000E+06 0.000000E+00 e 0 0 0 0
368 122.380 0.831 8.523 1 U 9.640000E+06 0.000000E+00 e 0 0 0 0
369 109.391 3.912 7.340 1 U 1.820000E+06 0.000000E+00 e 0 0 0 0
370 118.862 2.307 8.585 1 U 2.330000E+06 0.000000E+00 e 0 0 0 0
371 119.520 2.271 8.286 1 U 1.870000E+06 0.000000E+00 e 0 0 0 0
372 122.561 3.184 9.520 1 U 5.460000E+06 0.000000E+00 e 0 0 0 0
373 122.511 3.432 9.521 1 U 6.090000E+06 0.000000E+00 e 0 0 0 0
374 112.168 1.949 7.611 1 U 1.520000E+07 0.000000E+00 e 0 0 0 0
375 112.709 2.550 7.475 1 U 2.200000E+06 0.000000E+00 e 0 0 0 0
376 121.600 7.584 8.527 1 U 2.760000E+06 0.000000E+00 e 0 0 0 0
377 120.638 1.318 8.953 1 U 2.450000E+06 0.000000E+00 e 0 0 0 0
378 120.724 1.528 7.641 1 U 4.640000E+06 0.000000E+00 e 0 0 0 0
379 116.027 -0.532 8.408 1 U 1.790000E+06 0.000000E+00 e 0 0 0 0
380 121.012 7.255 8.366 1 U 1.660000E+06 0.000000E+00 e 0 0 0 0
381 119.647 1.201 7.460 1 U 4.140000E+06 0.000000E+00 e 0 0 0 0
382 120.272 2.369 9.244 1 U 6.880000E+06 0.000000E+00 e 0 0 0 0
383 122.581 2.002 7.401 1 U 5.050000E+06 0.000000E+00 e 0 0 0 0
384 112.801 7.847 7.023 1 U 3.320000E+06 0.000000E+00 e 0 0 0 0
385 119.110 2.602 8.469 1 U 1.900000E+06 0.000000E+00 e 0 0 0 0
386 118.909 1.353 8.476 1 U 2.250000E+06 0.000000E+00 e 0 0 0 0
387 118.652 2.592 8.752 1 U 1.760000E+07 0.000000E+00 e 0 0 0 0
388 118.656 0.980 8.753 1 U 5.030000E+06 0.000000E+00 e 0 0 0 0
389 114.145 8.506 6.988 1 U 1.620000E+06 0.000000E+00 e 0 0 0 0
390 129.829 1.692 10.217 1 U 2.180000E+07 0.000000E+00 e 0 0 0 0
391 116.648 2.200 8.095 1 U 1.850000E+07 0.000000E+00 e 0 0 0 0
392 116.648 1.832 8.099 1 U 6.860000E+07 0.000000E+00 e 0 0 0 0
393 116.515 4.572 8.102 1 U 1.050000E+07 0.000000E+00 e 0 0 0 0
394 118.334 2.728 7.899 1 U 1.640000E+07 0.000000E+00 e 0 0 0 0
395 118.283 2.205 7.898 1 U 2.040000E+08 0.000000E+00 e 0 0 0 0
396 118.295 1.827 7.892 1 U 1.750000E+07 0.000000E+00 e 0 0 0 0
397 118.145 6.945 7.898 1 U 1.140000E+07 0.000000E+00 e 0 0 0 0
398 111.279 1.948 7.484 1 U 8.790000E+06 0.000000E+00 e 0 0 0 0
399 111.085 1.948 6.843 1 U 8.310000E+06 0.000000E+00 e 0 0 0 0
400 111.114 1.721 6.844 1 U 9.560000E+06 0.000000E+00 e 0 0 0 0
401 120.181 1.988 6.953 1 U 1.120000E+07 0.000000E+00 e 0 0 0 0
402 120.096 1.086 6.953 1 U 5.290000E+07 0.000000E+00 e 0 0 0 0
403 130.107 4.341 10.576 1 U 9.910000E+06 0.000000E+00 e 0 0 0 0
404 130.020 1.079 10.558 1 U 1.540000E+07 0.000000E+00 e 0 0 0 0
405 116.972 1.972 7.666 1 U 2.320000E+07 0.000000E+00 e 0 0 0 0
406 118.406 1.087 8.563 1 U 1.270000E+07 0.000000E+00 e 0 0 0 0
407 118.350 1.081 8.553 1 U 1.410000E+07 0.000000E+00 e 0 0 0 0
408 117.240 7.495 7.743 1 U 1.960000E+07 0.000000E+00 e 0 0 0 0
409 117.239 3.418 7.743 1 U 1.090000E+07 0.000000E+00 e 0 0 0 0
410 117.135 7.381 7.737 1 U 8.380000E+06 0.000000E+00 e 0 0 0 0
411 117.076 3.432 7.738 1 U 1.150000E+07 0.000000E+00 e 0 0 0 0
412 118.579 7.963 7.816 1 U 1.970000E+07 0.000000E+00 e 0 0 0 0
413 118.522 8.575 7.819 1 U 1.310000E+07 0.000000E+00 e 0 0 0 0
414 118.469 1.504 7.818 1 U 9.770000E+06 0.000000E+00 e 0 0 0 0
415 119.116 1.572 8.745 1 U 1.250000E+07 0.000000E+00 e 0 0 0 0
416 119.370 1.058 8.182 1 U 2.050000E+07 0.000000E+00 e 0 0 0 0
417 119.592 1.840 7.643 1 U 1.560000E+08 0.000000E+00 e 0 0 0 0
418 119.149 1.467 7.891 1 U 9.010000E+06 0.000000E+00 e 0 0 0 0
419 121.770 1.915 8.477 1 U 1.360000E+08 0.000000E+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 . . N 15 N . . 2240.29 Hz . . . 119.000 . . 30765 5
2 . . H 1 HN . . 13586.957 Hz . . . 4.780 . . 30765 5
3 . . H 1 H . . 11235.955 Hz . . . 4.780 . . 30765 5
stop_
save_