######################### # 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 31147 _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 3 _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 . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 2 #INAME 1 H #INAME 2 H #CYANAFORMAT HH 1 8.523 4.006 1 T 3.355e+04 0.00e+00 a 0 H.2 HA2.2 2 8.519 3.937 1 T 5.560e+04 0.00e+00 a 0 H.2 HA3.2 3 8.517 4.261 1 T 4.842e+04 0.00e+00 a 0 H.2 HA.1 4 2.313 4.262 1 T 3.334e+04 0.00e+00 a 0 HG2.1 HA.1 5 1.996 4.262 1 T 3.908e+04 0.00e+00 a 0 HB3.1 HA.1 6 2.437 4.264 1 T -1.006e+04 0.00e+00 a 0 HB2.1 HA.1 7 4.262 2.004 1 T 2.332e+04 0.00e+00 a 0 HA.1 HB3.1 8 4.260 2.313 1 T -5.165e+04 0.00e+00 a 0 HA.1 HG2.1 9 4.260 2.439 1 T 3.150e+04 0.00e+00 a 0 HA.1 HB2.1 10 8.351 4.004 1 T 1.181e+05 0.00e+00 a 0 H.3 HA2.2 11 8.352 3.934 1 T 1.098e+05 0.00e+00 a 0 H.3 HA3.2 12 8.271 3.928 1 T 2.405e+04 0.00e+00 a 0 H.4 HA3.2 13 8.272 4.015 1 T 1.712e+04 0.00e+00 a 0 H.4 HA2.2 14 4.003 3.943 1 T 2.515e+06 0.00e+00 a 0 HA2.2 HA3.2 15 3.935 4.008 1 T 2.527e+06 0.00e+00 a 0 HA3.2 HA2.2 16 8.350 4.814 1 T 5.741e+04 0.00e+00 a 0 H.3 HA.3 17 8.352 3.550 1 T 5.616e+04 0.00e+00 a 0 H.3 HB2.3 18 8.352 2.963 1 T 7.727e+04 0.00e+00 a 0 H.3 HB3.3 19 3.550 2.961 1 T 2.772e+05 0.00e+00 a 0 HB2.3 HB3.3 20 2.964 3.549 1 T 3.944e+05 0.00e+00 a 0 HB3.3 HB2.3 21 3.550 4.814 1 T 4.197e+04 0.00e+00 a 0 HB2.3 HA.3 22 2.961 4.814 1 T 8.668e+04 0.00e+00 a 0 HB3.3 HA.3 23 8.269 3.552 1 T 2.024e+04 0.00e+00 a 0 H.4 HB2.3 24 8.269 2.959 1 T 2.446e+05 0.00e+00 a 0 H.4 HB3.4 25 8.269 3.169 1 T 6.956e+04 0.00e+00 a 0 H.4 HB2.4 26 7.826 3.176 1 T 2.691e+04 0.00e+00 a 0 H.5 HB2.4 27 7.823 2.951 1 T 3.467e+04 0.00e+00 a 0 H.5 HB3.4 28 8.269 4.404 1 T 1.078e+05 0.00e+00 a 0 H.4 HA.4 29 8.269 4.814 1 T 6.323e+04 0.00e+00 a 0 H.4 HA.3 30 3.172 4.404 1 T 1.253e+05 0.00e+00 a 0 HB2.4 HA.4 31 2.957 4.406 1 T 1.034e+05 0.00e+00 a 0 HB3.4 HA.4 32 3.453 4.404 1 T 2.635e+04 0.00e+00 a 0 HB2.9 HA.4 33 3.090 4.404 1 T 2.717e+04 0.00e+00 a 0 HB3.9 HA.4 34 3.453 4.573 1 T 7.422e+04 0.00e+00 a 0 HB2.9 HA.9 35 3.171 3.451 1 T 1.026e+05 0.00e+00 a 0 HB2.4 - 36 2.958 3.453 1 T 7.214e+04 0.00e+00 a 0 HB3.4 - 37 7.820 1.117 1 T 6.966e+04 0.00e+00 a 0 H.5 QG2.5 39 7.824 4.307 1 T 1.195e+05 0.00e+00 a 0 H.5 HA.5 40 7.822 4.398 1 T 7.977e+04 0.00e+00 a 0 H.5 HB.5 41 8.269 7.827 1 T 1.115e+05 0.00e+00 a 0 H.4 H.5 43 8.069 4.402 1 T 3.924e+04 0.00e+00 a 0 H.6 HB.5 44 8.069 4.308 1 T 3.002e+04 0.00e+00 a 0 H.6 HA.5 45 8.072 7.820 1 T 1.697e+05 0.00e+00 a 0 H.6 H.5 46 4.309 4.405 1 T 9.933e+04 0.00e+00 a 0 HA.5 HB.5 47 1.121 4.399 1 T 1.511e+05 0.00e+00 a 0 QG2.5 HB.5 48 1.117 4.308 1 T 1.276e+05 0.00e+00 a 0 QG2.5 HA.5 49 4.399 1.116 1 T -5.359e+04 0.00e+00 a 0 HB.5 QG2.5 50 4.306 1.118 1 T 2.721e+04 0.00e+00 a 0 HA.5 QG2.5 52 8.069 5.056 1 T 5.752e+04 0.00e+00 a 0 H.6 HA.6 53 3.141 5.062 1 T 5.142e+04 0.00e+00 a 0 HB2.6 HA.6 54 2.722 5.062 1 T 5.513e+04 0.00e+00 a 0 HB3.6 HA.6 55 8.069 3.139 1 T 8.255e+04 0.00e+00 a 0 H.6 HB2.6 56 8.067 2.725 1 T 8.221e+04 0.00e+00 a 0 H.6 HB3.6 57 8.066 3.441 1 T 2.527e+04 0.00e+00 a 0 H.10 HB2.9 58 3.057 5.061 1 T 1.849e+04 0.00e+00 a 0 - - 59 3.142 4.815 1 T 3.275e+04 0.00e+00 a 0 HB2.6 HA.3 60 2.727 4.815 1 T 1.634e+04 0.00e+00 a 0 HB3.6 HA.3 61 2.722 3.144 1 T 4.132e+05 0.00e+00 a 0 HB3.6 HB2.6 62 5.053 2.728 1 T 1.912e+04 0.00e+00 a 0 - - 63 5.053 3.136 1 T 2.416e+04 0.00e+00 a 0 HA.6 HB2.6 64 3.910 5.055 1 T 1.937e+05 0.00e+00 a 0 HD2.7 HA.6 65 3.863 5.055 1 T 1.767e+05 0.00e+00 a 0 HD2.7 HA.6 66 1.995 3.915 1 T 2.012e+05 0.00e+00 a 0 HG2.7 HD3.7 67 2.333 3.920 1 T 2.198e+04 0.00e+00 a 0 HB2.7 HD2.7 68 2.330 3.859 1 T 1.557e+04 0.00e+00 a 0 HB2.7 HD2.7 69 1.997 3.859 1 T 1.031e+05 0.00e+00 a 0 HG2.7 HD2.7 70 1.879 3.861 1 T 3.791e+04 0.00e+00 a 0 HB3.7 HD2.7 71 1.882 3.915 1 T 3.548e+04 0.00e+00 a 0 HB3.7 HD2.7 72 1.878 4.238 1 T 7.693e+04 0.00e+00 a 0 HB3.7 HA.7 73 1.994 4.238 1 T 7.256e+04 0.00e+00 a 0 HG2.7 HA.7 74 2.329 4.238 1 T 8.311e+04 0.00e+00 a 0 HB2.7 HA.7 75 3.908 2.314 1 T 1.147e+04 0.00e+00 a 0 HD3.7 HB2.7 76 3.911 1.991 1 T 1.580e+05 0.00e+00 a 0 HD2.7 HG2.7 77 3.854 1.991 1 T 1.080e+05 0.00e+00 a 0 - - 78 3.919 1.880 1 T 2.153e+04 0.00e+00 a 0 HD3.7 HB3.7 79 3.854 1.886 1 T 1.693e+04 0.00e+00 a 0 HD3.7 HB3.7 80 2.329 1.883 1 T 2.505e+05 0.00e+00 a 0 HB2.7 HB3.7 81 1.879 2.330 1 T 3.111e+05 0.00e+00 a 0 HB3.7 HB2.7 82 1.998 2.330 1 T 5.658e+05 0.00e+00 a 0 HG3.7 HB2.7 83 3.918 3.858 1 T 1.847e+06 0.00e+00 a 0 HD3.7 HD2.7 84 3.141 3.915 1 T 2.611e+04 0.00e+00 a 0 HB2.6 HD2.7 85 3.139 3.860 1 T 2.822e+04 0.00e+00 a 0 HB2.6 HD3.7 86 2.723 3.863 1 T 2.277e+04 0.00e+00 a 0 HB3.6 HD2.7 87 2.724 3.918 1 T 2.052e+04 0.00e+00 a 0 HB3.6 HD2.7 88 2.327 1.997 1 T 3.643e+05 0.00e+00 a 0 HB2.7 HG2.7 89 1.883 1.997 1 T 1.531e+06 0.00e+00 a 0 HB3.7 HG2.7 90 1.996 1.880 1 T 1.496e+06 0.00e+00 a 0 HG3.7 HB3.7 91 4.235 1.883 1 T 6.189e+04 0.00e+00 a 0 HA.7 HB3.7 92 4.237 1.998 1 T 1.093e+04 0.00e+00 a 0 HA.7 HG3.7 93 4.234 2.329 1 T 3.611e+04 0.00e+00 a 0 HA.7 HB2.7 94 8.138 2.323 1 T 1.733e+04 0.00e+00 a 0 H.8 HB2.7 95 8.142 1.990 1 T 3.879e+04 0.00e+00 a 0 H.8 HG2.7 96 8.142 4.191 1 T 1.987e+05 0.00e+00 a 0 H.8 HA.8 97 7.290 3.136 1 T -3.381e+04 0.00e+00 a 0 HE.8 HD2.8 98 8.146 3.136 1 T 4.016e+04 0.00e+00 a 0 H.8 HD2.8 99 7.285 1.696 1 T 2.054e+04 0.00e+00 a 0 HE.8 HB3.8 100 8.142 1.554 1 T 9.000e+04 0.00e+00 a 0 H.8 HG3.8 101 8.135 1.692 1 T 9.767e+04 0.00e+00 a 0 H.8 HB3.8 102 8.146 1.827 1 T 4.605e+04 0.00e+00 a 0 H.8 HB2.8 103 7.933 1.547 1 T 1.358e+04 0.00e+00 a 0 H.9 HG2.8 104 7.926 1.692 1 T 2.242e+04 0.00e+00 a 0 H.9 HB3.8 105 7.926 1.823 1 T 1.491e+04 0.00e+00 a 0 H.9 HB2.8 106 8.139 1.898 1 T 3.432e+04 0.00e+00 a 0 H.8 HB3.7 107 7.922 1.898 1 T 9.625e+03 0.00e+00 a 0 H.9 HB3.7 108 4.199 1.550 1 T 2.367e+04 0.00e+00 a 0 HA.8 HG2.8 109 4.195 1.692 1 T 5.397e+04 0.00e+00 a 0 HA.8 HB3.8 110 4.192 1.823 1 T 4.031e+04 0.00e+00 a 0 HA.8 HB2.8 111 3.132 1.830 1 T 2.176e+04 0.00e+00 a 0 HD3.8 HB2.8 112 3.132 1.689 1 T 1.694e+04 0.00e+00 a 0 HD2.8 HB3.8 113 3.132 1.554 1 T 6.470e+04 0.00e+00 a 0 HD2.8 HG3.8 114 1.821 3.131 1 T 3.980e+04 0.00e+00 a 0 HB2.8 HD2.8 115 1.690 3.135 1 T 4.670e+04 0.00e+00 a 0 HB3.8 HD3.8 116 1.545 3.142 1 T 5.073e+04 0.00e+00 a 0 HG2.8 HD3.8 117 1.828 4.194 1 T 8.192e+04 0.00e+00 a 0 HB2.8 HA.8 118 1.692 4.201 1 T 6.513e+04 0.00e+00 a 0 HB3.8 HA.8 119 1.549 4.196 1 T 7.435e+04 0.00e+00 a 0 HG2.8 HA.8 120 1.547 1.828 1 T 6.009e+05 0.00e+00 a 0 - - 121 1.694 1.830 1 T 1.427e+06 0.00e+00 a 0 HB3.8 HB2.8 122 1.826 1.551 1 T 6.094e+05 0.00e+00 a 0 HB2.8 HG2.8 123 1.824 1.692 1 T 1.246e+06 0.00e+00 a 0 HB2.8 HB3.8 124 1.694 1.551 1 T 8.715e+05 0.00e+00 a 0 HB3.8 HG3.8 125 8.141 3.861 1 T 4.433e+04 0.00e+00 a 0 H.8 HD2.7 126 7.927 4.201 1 T 9.117e+04 0.00e+00 a 0 H.9 HA.8 127 7.925 4.575 1 T 1.045e+05 0.00e+00 a 0 H.9 HA.9 128 7.927 3.448 1 T 1.673e+05 0.00e+00 a 0 H.9 HB2.9 129 7.927 3.081 1 T 1.008e+05 0.00e+00 a 0 H.9 HB3.9 130 3.448 3.082 1 T 7.327e+05 0.00e+00 a 0 HB2.9 HB3.9 131 3.080 3.457 1 T 6.316e+05 0.00e+00 a 0 HB3.9 HB2.9 132 3.080 4.575 1 T 3.235e+04 0.00e+00 a 0 HB3.9 HA.9 133 8.067 7.925 1 T 1.719e+05 0.00e+00 a 0 H.10 H.9 134 8.063 4.575 1 T 2.048e+05 0.00e+00 a 0 H.10 HA.9 135 8.070 4.146 1 T 1.004e+05 0.00e+00 a 0 H.10 HA.10 136 8.068 3.027 1 T 2.972e+04 0.00e+00 a 0 H.10 HD3.10 138 8.067 1.434 1 T 5.069e+04 0.00e+00 a 0 H.10 HG2.10 139 8.069 1.238 1 T 9.471e+03 0.00e+00 a 0 H.10 HG3.10 140 8.069 1.712 1 T 1.012e+05 0.00e+00 a 0 H.10 HB2.10 141 7.002 4.145 1 T 7.887e+03 0.00e+00 a 0 HE.10 HA.10 142 4.150 1.713 1 T 1.324e+05 0.00e+00 a 0 HA.10 HB3.10 143 4.144 1.239 1 T 5.522e+03 0.00e+00 a 0 HA.10 HG3.10 144 4.144 1.439 1 T 1.164e+04 0.00e+00 a 0 HA.10 HG2.10 145 1.713 3.028 1 T 5.619e+04 0.00e+00 a 0 HB2.10 HD3.10 146 1.441 3.027 1 T 6.531e+04 0.00e+00 a 0 HG2.10 HD2.10 147 1.238 3.028 1 T 5.720e+04 0.00e+00 a 0 HG3.10 HD3.10 148 1.239 4.146 1 T 1.647e+04 0.00e+00 a 0 HG3.10 HA.10 149 1.442 4.146 1 T 2.813e+04 0.00e+00 a 0 HG2.10 HA.10 150 1.713 4.146 1 T 1.612e+05 0.00e+00 a 0 HB2.10 HA.10 151 3.028 4.149 1 T 1.402e+04 0.00e+00 a 0 HD3.10 HA.10 152 1.239 1.711 1 T 7.604e+04 0.00e+00 a 0 HG3.10 HB2.10 153 1.441 1.712 1 T 4.051e+05 0.00e+00 a 0 HG2.10 HB3.10 154 1.242 1.438 1 T 6.839e+05 0.00e+00 a 0 HG3.10 HG2.10 155 3.029 1.712 1 T 4.090e+04 0.00e+00 a 0 HD3.10 HB2.10 156 3.031 1.441 1 T 3.038e+04 0.00e+00 a 0 HD3.10 HG2.10 157 3.030 1.236 1 T 6.219e+04 0.00e+00 a 0 HD2.10 HG3.10 158 7.609 4.146 1 T 3.099e+04 0.00e+00 a 0 HN.11 HA.10 159 7.610 3.004 1 T 4.592e+04 0.00e+00 a 0 HN.11 HB2.11 160 7.607 4.529 1 T 5.752e+04 0.00e+00 a 0 HN.11 HA.11 161 7.606 2.845 1 T 5.203e+04 0.00e+00 a 0 HN.11 HB3.11 162 7.531 2.997 1 T 1.335e+05 0.00e+00 a 0 HD1.11 HB2.11 163 7.530 2.846 1 T 1.731e+05 0.00e+00 a 0 HD1.11 HB3.11 164 7.528 4.531 1 T 7.294e+04 0.00e+00 a 0 HD1.11 HA.11 165 7.067 4.533 1 T 1.320e+05 0.00e+00 a 0 HH.11 HA.11 166 6.858 4.531 1 T 3.315e+04 0.00e+00 a 0 HG.11 HA.11 167 7.530 7.069 1 T -1.446e+04 0.00e+00 a 0 HD1.11 HH.11 168 2.847 4.531 1 T 1.644e+05 0.00e+00 a 0 HB3.11 HA.11 169 2.999 4.531 1 T 1.386e+05 0.00e+00 a 0 HB2.11 HA.11 170 2.846 3.000 1 T 3.196e+06 0.00e+00 a 0 HB3.11 HB2.11 171 2.998 2.846 1 T 2.948e+06 0.00e+00 a 0 HB2.11 HB3.11 172 7.069 3.007 1 T 1.187e+05 0.00e+00 a 0 HH.11 HB2.11 173 7.073 2.837 1 T 9.569e+04 0.00e+00 a 0 HH.11 HB3.11 174 7.073 6.854 1 T 9.265e+05 0.00e+00 a 0 HH.11 HG.11 175 6.860 2.996 1 T 1.732e+04 0.00e+00 a 0 HG.11 HB2.11 176 6.860 2.852 1 T 1.704e+04 0.00e+00 a 0 HG.11 HB3.11 178 2.997 7.070 1 T 9.993e+04 0.00e+00 a 0 HB2.11 HH.11 179 2.988 7.528 1 T 9.201e+04 0.00e+00 a 0 HB2.11 HD1.11 180 8.034 2.845 1 T 5.899e+04 0.00e+00 a 0 H.12 HB3.11 181 8.034 3.001 1 T 7.291e+04 0.00e+00 a 0 H.12 HB2.11 182 7.530 1.232 1 T 1.825e+04 0.00e+00 a 0 HD1.11 HG3.10 183 7.531 1.434 1 T 2.140e+04 0.00e+00 a 0 HD1.11 HG2.10 184 7.531 1.713 1 T 1.841e+04 0.00e+00 a 0 HD1.11 HB3.10 185 8.039 4.104 1 T 1.246e+05 0.00e+00 a 0 H.12 HA.12 186 8.037 4.532 1 T 2.191e+05 0.00e+00 a 0 H.12 HA.11 187 8.035 2.143 1 T 2.069e+04 0.00e+00 a 0 H.12 HG2.12 188 8.037 2.078 1 T 2.438e+04 0.00e+00 a 0 H.12 HG3.12 189 8.037 1.883 1 T 1.351e+05 0.00e+00 a 0 H.12 HB2.12 190 7.041 4.104 1 T 2.176e+04 0.00e+00 a 0 - - 191 7.268 6.773 1 T 1.607e+06 0.00e+00 a 0 - - 192 4.105 1.878 1 T 1.703e+05 0.00e+00 a 0 HA.12 HB2.12 193 2.135 4.106 1 T 3.802e+04 0.00e+00 a 0 HG2.12 HA.12 194 2.074 4.106 1 T 2.443e+04 0.00e+00 a 0 HG3.12 HA.12 195 1.878 4.104 1 T 2.018e+05 0.00e+00 a 0 HB2.12 HA.12 196 1.876 2.133 1 T 5.912e+05 0.00e+00 a 0 HB2.12 HG2.12 197 1.879 2.075 1 T 6.151e+05 0.00e+00 a 0 HB2.12 HG3.12 198 2.074 1.878 1 T 6.906e+05 0.00e+00 a 0 HG3.12 HB2.12 199 2.135 1.882 1 T 2.861e+05 0.00e+00 a 0 HG2.12 HB3.12 200 8.099 1.880 1 T 4.420e+04 0.00e+00 a 0 H.13 HB3.12 201 6.739 4.103 1 T 1.585e+04 0.00e+00 a 0 - - 202 6.732 4.422 1 T 2.198e+04 0.00e+00 a 0 - - 203 8.099 4.103 1 T 2.252e+05 0.00e+00 a 0 H.13 HA.12 204 7.759 4.262 1 T 3.787e+04 0.00e+00 a 0 - HA.1 205 4.192 4.195 1 T 5.046e+06 0.00e+00 a 0 HA.15 HA.15 206 8.138 1.641 1 T 4.410e+04 0.00e+00 a 0 H.15 HB3.15 207 8.139 1.578 1 T 4.796e+04 0.00e+00 a 0 H.15 HD3.15 208 8.138 1.285 1 T -1.712e+04 0.00e+00 a 0 - - 210 8.104 3.037 1 T 5.279e+04 0.00e+00 a 0 H.14 HB2.14 211 8.100 2.839 1 T 7.627e+04 0.00e+00 a 0 H.14 HB3.14 212 8.136 3.036 1 T 2.307e+04 0.00e+00 a 0 H.15 HB2.14 213 8.136 2.838 1 T 1.896e+04 0.00e+00 a 0 H.15 HB3.14 214 7.923 1.989 1 T 1.128e+04 0.00e+00 a 0 - - 215 8.099 2.924 1 T 1.958e+05 0.00e+00 a 0 H.13 HB2.13 216 2.923 4.551 1 T 1.718e+05 0.00e+00 a 0 HB2.13 HA.13 217 2.811 4.542 1 T 2.916e+04 0.00e+00 a 0 HB3.13 HA.13 218 8.099 2.811 1 T 4.543e+04 0.00e+00 a 0 H.13 HB3.13 219 8.099 4.551 1 T 3.527e+05 0.00e+00 a 0 H.13 HA.13 220 3.038 2.841 1 T 1.097e+06 0.00e+00 a 0 HB2.14 HB3.14 221 3.034 4.543 1 T 6.511e+04 0.00e+00 a 0 HB2.14 HA.14 222 2.839 4.543 1 T 1.159e+05 0.00e+00 a 0 HB3.14 HA.14 223 8.102 4.544 1 T 3.795e+05 0.00e+00 a 0 H.14 HA.14 224 6.741 4.549 1 T 3.813e+04 0.00e+00 a 0 QE.14 HA.14 225 6.739 2.839 1 T 2.063e+04 0.00e+00 a 0 QE.14 HB3.14 226 7.054 3.039 1 T 9.808e+04 0.00e+00 a 0 QD.14 HB2.14 227 7.054 2.839 1 T 1.362e+05 0.00e+00 a 0 QD.14 HB3.14 228 7.053 6.740 1 T 1.126e+06 0.00e+00 a 0 QD.14 QE.14 229 2.925 4.403 1 T 7.548e+04 0.00e+00 a 0 HB2.13 HA.4 230 8.136 4.187 1 T 1.987e+05 0.00e+00 a 0 H.15 HA.15 231 1.769 4.188 1 T 1.818e+04 0.00e+00 a 0 HB2.15 HA.15 232 1.641 4.188 1 T 2.949e+04 0.00e+00 a 0 HB3.15 HA.15 233 1.640 2.903 1 T 2.062e+04 0.00e+00 a 0 HB3.15 HE2.15 234 1.770 2.902 1 T 2.703e+04 0.00e+00 a 0 HB2.15 HE2.15 235 4.186 8.137 1 T 6.277e+04 0.00e+00 a 0 HA.15 - 236 2.902 8.139 1 T 4.033e+04 0.00e+00 a 0 HE2.15 - 237 1.288 1.639 1 T 2.532e+05 0.00e+00 a 0 HG3.15 HB3.15 238 1.287 1.770 1 T 6.634e+03 0.00e+00 a 0 HG2.15 HB2.15 239 2.903 1.639 1 T -9.864e+03 0.00e+00 a 0 HE2.15 HB3.15 240 4.187 1.774 1 T 2.357e+04 0.00e+00 a 0 HA.15 HB2.15 241 4.188 1.641 1 T 4.760e+04 0.00e+00 a 0 HA.15 HB3.15 242 8.145 7.930 1 T 2.012e+05 0.00e+00 a 0 H.8 H.9 243 8.270 8.063 1 T 2.316e+04 0.00e+00 a 0 H.4 H.6 244 1.706 1.221 1 T 6.150e+04 0.00e+00 a 0 HB3.10 HG3.10 245 7.934 7.814 1 T 6.988e+04 0.00e+00 a 0 H.9 H.5 246 8.064 7.608 1 T 8.467e+04 0.00e+00 a 0 H.10 HN.11 ; 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 . 'not observed' 11.1082 ppm . . . 4.76 . . 31147 1 2 . . H 1 H . 'not observed' 11.1082 ppm . . . 4.76 . . 31147 1 stop_ save_