######################### # Spectral peak lists # ######################### 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 30583 _Spectral_peak_list.ID 1 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 5 _Spectral_peak_list.Sample_label $sample_5 _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 . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 14 _Spectral_peak_list.Experiment_name '2D 1H-15N HSQC' _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 ; H N C Ca Cb 156 G 8.236 111.6962 172.49 44.82 - 157 C 7.946 116.8762 175.09 60.36 28.56 158 L 8.196 123.0562 175.1 51.59 44.02 160 A 9.036 119.8462 180.71 54.99 18.37 161 Y 7.146 117.7162 176.87 62.44 35.21 162 D 8.626 124.1762 179.97 58.23 40.65 163 A 7.636 122.4862 180.84 54.91 17.66 164 L 7.106 119.2362 178.5 58.01 41.95 165 A 8.616 122.6562 179 56.01 17.7 166 G 7.636 103.7562 176.72 47.25 - 167 Q 7.746 120.9662 178.79 58.96 28.73 168 F 9.126 121.5662 177.36 62.54 40.44 169 I 8.516 118.5662 177.59 61.58 37.58 170 E 7.536 119.2662 176.62 57.12 30.51 171 A 7.286 123.7962 177.93 52.72 18.89 172 S 8.376 113.2062 174.4 58.62 64.67 173 S 7.446 114.5862 174.37 56.31 66.68 174 R 9.016 125.3562 178.36 60.33 29.55 175 E 9.006 119.1762 179.69 60.37 28.77 176 A 7.946 123.8962 181.15 54.92 18.88 177 R 7.746 118.8062 178.59 61.4 30.78 178 Q 8.896 119.7062 178.78 59.43 28.5 179 A 7.776 123.0462 180.63 55.02 17.71 180 I 7.776 123.0262 177.51 64.93 38.51 181 L 8.376 123.2262 178.69 59.25 41.83 182 K 8.006 120.0562 178.56 59.33 31.95 183 Q 7.926 119.9862 180.66 59.32 28.59 184 G 8.716 108.8062 176.3 48.25 - 185 Q 8.946 125.9962 179.62 59.29 28.52 186 D 9.076 123.2062 178.9 57.1 39.7 187 G 7.916 105.7362 176.07 45.92 - 188 L 7.436 123.3062 178.9 58.08 42.72 189 S 7.686 111.5562 175.62 60.53 62.75 190 G 7.836 108.7662 174.21 45 - 191 V 7.366 122.8962 175.88 61.52 32.95 192 K 8.846 127.4562 178.6 57.09 32.98 193 E 8.856 123.7062 179.22 61.09 29.69 194 T 7.886 107.7262 174.93 64.06 68.87 195 D 7.746 119.5762 178.17 54.92 42.94 196 K 7.596 124.4862 178.42 61.49 32.82 197 K 8.336 117.9962 177.79 58.53 30.9 198 W 6.826 122.0162 178.55 58.18 29.75 199 A 7.956 123.1962 179.74 55.97 18.18 200 S 8.476 110.5262 176.59 62.52 - 201 Q 7.606 122.4162 179.08 60.28 27.65 202 Y 7.736 117.1062 178.43 63.65 38.68 203 L 7.376 116.4962 180.27 57.14 39.7 204 K 8.306 122.9962 179.52 59.25 32 205 I 7.896 121.4262 177.32 65.78 37.47 206 M 7.786 118.0762 177.86 60.36 33.95 207 G 7.886 104.3162 176.08 47.26 - 208 K 7.826 122.0562 179.37 58.12 30.86 209 I 8.326 122.2462 179.67 64.72 38.23 210 L 7.796 120.5462 178.44 58.21 41.41 211 D 7.806 117.6562 177.31 56.28 42.68 212 Q 8.896 117.1162 176.92 56.67 30.8 213 G 8.046 109.6262 174.75 45.05 - 214 E 8.516 116.4162 176.99 58.33 29.94 215 D 8.606 116.8962 176.77 54.83 40.65 216 F 7.786 120.6062 173.22 63.7 37.29 218 A 7.616 119.0862 181.08 55.19 18.41 219 S 7.996 116.7662 177.17 61.46 62.77 220 E 8.176 126.2062 178.31 57.96 29.84 221 L 8.386 122.0462 180 58.3 41.95 222 A 7.466 122.3362 179.72 54.96 17.72 223 R 7.856 120.2262 179.76 59.83 31.61 224 I 8.706 119.7562 177.89 64.85 37.53 225 S 8.206 115.9962 176.22 62.66 - 226 K 7.236 119.9462 178.76 58.21 32.03 227 L 7.526 120.4362 179.44 57.32 42.75 228 I 7.766 116.9262 175.96 63.91 38.53 229 E 7.346 119.7462 177.09 57.06 30.09 230 N 7.736 118.5262 175.11 53.6 39.61 231 K 8.346 121.3062 176.7 57.09 31.78 232 M 8.176 120.8862 175.41 55.3 34.41 233 S 8.416 116.6162 174.95 58.2 64.01 234 E 8.806 123.3462 178.88 59.14 29.69 235 G 8.716 108.4462 176.26 46.59 - 236 K 7.696 122.5062 178.25 57.29 32.1 237 K 8.116 121.8862 178.29 60.46 32.06 238 E 8.376 119.0662 179.12 59.82 29.46 239 E 7.696 119.9562 179.56 59.87 29.7 240 L 8.036 121.0662 179.03 58.21 41.75 241 Q 8.646 120.0462 178.48 58.64 28.63 242 R 7.946 119.5862 178.48 60.08 29.56 243 S 7.846 115.2362 176.51 63.61 - 244 L 8.146 123.4162 179.09 58.31 41.71 245 N 8.206 121.3662 178.18 56.02 37.39 246 I 7.966 124.0262 177.82 66.05 38.35 247 L 7.886 119.0762 180.41 59.09 42.84 248 T 7.986 114.0162 175.7 66.21 69.13 249 A 7.756 124.7362 178.15 54.06 18.78 250 F 7.796 114.8262 173.92 58.15 38.44 251 R 7.326 120.1462 175.6 55.96 31.51 252 K 8.566 125.1262 176.89 56.31 32.97 253 K 8.806 125.4462 177.47 57.03 33.04 254 G 8.546 111.3862 173.93 45.1 - 255 A 8.156 124.4262 177.95 52.68 19.65 256 E 8.516 120.7662 176.53 57.03 29.87 257 K 8.256 122.2562 176.31 56.28 33.08 258 E 8.396 123.1662 176.19 56.49 30.73 259 E 8.346 123.3562 175.28 56.17 30.73 260 L 7.876 129.9662 182.49 56.77 43.64 ; 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 2 . 31 ppm . . . 116.1182 . . 30583 1 2 . . H 1 HN 1 . 12 ppm . . . 4.667 . . 30583 1 stop_ save_