######################### # Spectral peak lists # ######################### save_spectral_peak_list_GTPgS_hsqc _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_GTPgS_hsqc _Spectral_peak_list.Entry_ID 16669 _Spectral_peak_list.ID 1 _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.Experiment_ID 1 _Spectral_peak_list.Experiment_name '2D 1H-15N HSQC' _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; loop_ _Peak_list_number _Intensity_height _Intensity_volume _Intensity_volume2 _Peak_status _flag _comment _Dim_1_label _Dim_1_chem_shift _Dim_1_line_width _Dim_1_bounds _Dim_1_error _Dim_1_j _Dim_1_link0 _Dim_1_link1 _Dim_1_thread _Dim_1_user _Dim_2_label _Dim_2_chem_shift _Dim_2_line_width _Dim_2_bounds _Dim_2_error _Dim_2_j _Dim_2_link0 _Dim_2_link1 _Dim_2_thread _Dim_2_user 0 0.033 0.000 0.000 0 2 {?} {?} 11.62913036 0.04479000 0.08143000 {++} 0.00000000 0 0 0 {?} {?} 132.69013977 0.24792001 0.47490001 {++} 0.00000000 0 0 0 {?} 1 0.034 0.000 0.000 0 2 {?} {?} 10.61452961 0.04193000 0.07567000 {++} 0.00000000 0 0 0 {?} {?} 124.77760315 0.31676999 0.58078003 {++} 0.00000000 0 0 0 {?} 2 0.013 0.000 0.000 0 2 {?} {?} 10.19151020 0.04074000 0.04069000 {++} 0.00000000 0 0 0 {?} {?} 117.36636353 0.48967001 0.48921999 {++} 0.00000000 0 0 0 {?} 3 0.036 0.000 0.000 0 2 {?} {?} 10.05430984 0.04785000 0.08592000 {+P} 0.00000000 0 0 0 {?} {?} 129.39167786 0.32661000 0.57086003 {++} 0.00000000 0 0 0 {?} 4 0.039 0.000 0.000 0 2 {?} {?} 9.77530956 0.04391000 0.08984000 {++} 0.00000000 0 0 0 {?} {?} 125.02604675 0.27366000 0.49101001 {++} 0.00000000 0 0 0 {?} 5 0.011 0.000 0.000 0 2 {?} {?} 9.64451027 0.04512000 0.04512000 {++} 0.00000000 0 0 0 {?} {?} 127.79904938 0.39658001 0.35275000 {++} 0.00000000 0 0 0 {?} 6 0.020 0.000 0.000 0 2 {?} {?} 9.59125042 0.04532000 0.08592000 {P+} 0.00000000 0 0 0 {?} {?} 134.27070618 0.21760000 0.29075000 {++} 0.00000000 0 0 0 {?} 7 0.012 0.000 0.000 0 2 {?} {?} 9.56398010 0.04341000 0.03928000 {++} 0.00000000 0 0 0 {?} {?} 118.88327789 0.35122001 0.32820001 {++} 0.00000000 0 0 0 {?} 8 0.087 0.000 0.000 0 2 {?} {?} 9.57161045 0.03123000 0.08479000 {++} 0.00000000 0 0 0 {?} {?} 115.15823364 0.24571000 0.55322999 {++} 0.00000000 0 0 0 {?} 9 0.031 0.000 0.000 0 2 {?} {?} 9.51144981 0.05490000 0.13999000 {++} 0.00000000 0 0 0 {?} {?} 133.99143982 0.32912999 0.56545001 {++} 0.00000000 0 0 0 {?} 10 0.087 0.000 0.000 0 2 {?} {?} 9.43041039 0.03978000 0.09519000 {++} 0.00000000 0 0 0 {?} {?} 118.32858276 0.31703001 0.57088000 {++} 0.00000000 0 0 0 {?} 11 0.030 0.000 0.000 0 2 {?} {?} 9.37528992 0.05543000 0.07751000 {++} 0.00000000 0 0 0 {?} {?} 113.48004913 0.29683000 0.49210000 {++} 0.00000000 0 0 0 {?} 12 0.026 0.000 0.000 0 2 {?} {?} 9.28522015 0.05376000 0.07559000 {++} 0.00000000 0 0 0 {?} {?} 129.19110107 0.40746999 0.64946997 {++} 0.00000000 0 0 0 {?} 13 0.071 0.000 0.000 0 2 {?} {?} 9.27318954 0.03744000 0.08241000 {++} 0.00000000 0 0 0 {?} {?} 125.45813751 0.36155999 0.66956002 {++} 0.00000000 0 0 0 {?} 14 0.062 0.000 0.000 0 2 {?} {?} 9.21533966 0.03507000 0.07084000 {++} 0.00000000 0 0 0 {?} {?} 129.98725891 0.29602000 0.73885000 {+P} 0.00000000 0 0 0 {?} 15 0.048 0.000 0.000 0 2 {?} {?} 9.19425964 0.03816000 0.09132000 {++} 0.00000000 0 0 0 {?} {?} 130.50273132 0.42578000 0.74212998 {P+} 0.00000000 0 0 0 {?} 16 0.094 0.000 0.000 0 2 {?} {?} 9.17389011 0.04072000 0.10156000 {++} 0.00000000 0 0 0 {?} {?} 127.68290710 0.35644999 0.67408001 {+P} 0.00000000 0 0 0 {?} 17 0.077 0.000 0.000 0 2 {?} {?} 9.17055035 0.03971000 0.08104000 {++} 0.00000000 0 0 0 {?} {?} 115.46961975 0.27941000 0.74212998 {P+} 0.00000000 0 0 0 {?} 18 0.056 0.000 0.000 0 2 {?} {?} 9.16213989 0.04747000 0.09716000 {++} 0.00000000 0 0 0 {?} {?} 114.84374237 0.22544999 0.74212003 {+P} 0.00000000 0 0 0 {?} 19 0.043 0.000 0.000 0 2 {?} {?} 9.15266991 0.05424000 0.14841001 {P+} 0.00000000 0 0 0 {?} {?} 128.36706543 0.37362999 1.03898001 {P+} 0.00000000 0 0 0 {?} 20 0.054 0.000 0.000 0 2 {?} {?} 9.15694046 0.04229000 0.08413000 {++} 0.00000000 0 0 0 {?} {?} 126.92595673 0.38988999 0.57476002 {++} 0.00000000 0 0 0 {?} 21 0.029 0.000 0.000 0 2 {?} {?} 9.10789013 0.04776000 0.07042000 {++} 0.00000000 0 0 0 {?} {?} 120.74434662 0.33715999 0.50563997 {++} 0.00000000 0 0 0 {?} 22 0.008 0.000 0.000 0 2 {?} {?} 9.07612991 0.02226000 0.02226000 {++} 0.00000000 0 0 0 {?} {?} 129.28369141 0.15385000 0.15386000 {++} 0.00000000 0 0 0 {?} 23 0.021 0.000 0.000 0 2 {?} {?} 9.07402992 0.03994000 0.05224000 {++} 0.00000000 0 0 0 {?} {?} 119.84877014 0.41582000 0.53865999 {++} 0.00000000 0 0 0 {?} 24 0.104 0.000 0.000 0 2 {?} {?} 9.07944012 0.03129000 0.07917000 {++} 0.00000000 0 0 0 {?} {?} 118.75666809 0.36021999 0.57981002 {++} 0.00000000 0 0 0 {?} 25 0.011 0.000 0.000 0 2 {?} {?} 9.06229019 0.02343000 0.05468000 {PP} 0.00000000 0 0 0 {?} {?} 128.39297485 0.43996000 0.37858000 {++} 0.00000000 0 0 0 {?} 26 0.045 0.000 0.000 0 2 {?} {?} 9.03810978 0.04700000 0.08043000 {++} 0.00000000 0 0 0 {?} {?} 124.52365112 0.31564000 0.56436998 {++} 0.00000000 0 0 0 {?} 27 0.012 0.000 0.000 0 2 {?} {?} 9.01138020 0.04522000 0.04324000 {++} 0.00000000 0 0 0 {?} {?} 122.77516937 0.59233999 0.57506001 {++} 0.00000000 0 0 0 {?} 28 0.020 0.000 0.000 0 2 {?} {?} 9.00827026 0.03905000 0.05669000 {+P} 0.00000000 0 0 0 {?} {?} 128.50689697 0.32813999 0.44837999 {++} 0.00000000 0 0 0 {?} 29 0.039 0.000 0.000 0 2 {?} {?} 8.98651981 0.04072000 0.08202000 {++} 0.00000000 0 0 0 {?} {?} 114.78943634 0.26657000 0.46957001 {++} 0.00000000 0 0 0 {?} 30 0.028 0.000 0.000 0 2 {?} {?} 8.97492027 0.06023000 0.08323000 {++} 0.00000000 0 0 0 {?} {?} 123.78687286 0.39003000 0.74212998 {P+} 0.00000000 0 0 0 {?} 31 0.028 0.000 0.000 0 2 {?} {?} 8.96115971 0.04479000 0.16403000 {P+} 0.00000000 0 0 0 {?} {?} 123.32784271 0.44527999 0.44527000 {+P} 0.00000000 0 0 0 {?} 32 0.028 0.000 0.000 0 2 {?} {?} 8.92486954 0.07565000 0.10456000 {++} 0.00000000 0 0 0 {?} {?} 122.50244904 0.31162000 0.48117000 {++} 0.00000000 0 0 0 {?} 33 0.012 0.000 0.000 0 2 {?} {?} 8.92082977 0.03513000 0.03240000 {++} 0.00000000 0 0 0 {?} {?} 121.73681641 0.40910000 0.38213000 {++} 0.00000000 0 0 0 {?} 34 0.049 0.000 0.000 0 2 {?} {?} 8.91040993 0.03644000 0.06716000 {++} 0.00000000 0 0 0 {?} {?} 117.42334747 0.35093999 0.56721002 {++} 0.00000000 0 0 0 {?} 35 0.009 0.000 0.000 0 2 {?} {?} 8.90561008 0.04431000 0.03194000 {++} 0.00000000 0 0 0 {?} {?} 120.65247345 0.45436001 0.34997001 {++} 0.00000000 0 0 0 {?} 36 0.052 0.000 0.000 0 2 {?} {?} 8.83215046 0.04029000 0.10374000 {P+} 0.00000000 0 0 0 {?} {?} 123.52065277 0.35095999 0.58156002 {++} 0.00000000 0 0 0 {?} 37 0.051 0.000 0.000 0 2 {?} {?} 8.83041000 0.04274000 0.09160000 {++} 0.00000000 0 0 0 {?} {?} 111.76838684 0.34373000 0.55707002 {++} 0.00000000 0 0 0 {?} 38 0.039 0.000 0.000 0 2 {?} {?} 8.81599998 0.05107000 0.10650000 {++} 0.00000000 0 0 0 {?} {?} 126.14125824 0.27833000 0.57964998 {++} 0.00000000 0 0 0 {?} 39 0.046 0.000 0.000 0 2 {?} {?} 8.81772041 0.04682000 0.08156000 {++} 0.00000000 0 0 0 {?} {?} 115.52069855 0.37502000 0.63911003 {++} 0.00000000 0 0 0 {?} 40 0.019 0.000 0.000 0 2 {?} {?} 8.79967976 0.04888000 0.06160000 {++} 0.00000000 0 0 0 {?} {?} 126.76438141 0.42118001 0.74212998 {P+} 0.00000000 0 0 0 {?} 41 0.066 0.000 0.000 0 2 {?} {?} 8.80290031 0.04030000 0.08655000 {++} 0.00000000 0 0 0 {?} {?} 113.76141357 0.27004999 0.50932002 {++} 0.00000000 0 0 0 {?} 42 0.078 0.000 0.000 0 2 {?} {?} 8.79047012 0.03133000 0.08007000 {++} 0.00000000 0 0 0 {?} {?} 103.69535828 0.21854000 0.48743999 {++} 0.00000000 0 0 0 {?} 43 0.048 0.000 0.000 0 2 {?} {?} 8.78252029 0.05438000 0.08892000 {++} 0.00000000 0 0 0 {?} {?} 116.23068237 0.35815001 0.57308000 {++} 0.00000000 0 0 0 {?} 44 0.025 0.000 0.000 0 2 {?} {?} 8.76930046 0.05468000 0.05468000 {+P} 0.00000000 0 0 0 {?} {?} 123.39900970 0.36063001 0.50209999 {++} 0.00000000 0 0 0 {?} 45 0.032 0.000 0.000 0 2 {?} {?} 8.74040031 0.04204000 0.06386000 {++} 0.00000000 0 0 0 {?} {?} 119.51757812 0.41496000 0.67391998 {++} 0.00000000 0 0 0 {?} 46 0.067 0.000 0.000 0 2 {?} {?} 8.73130989 0.04091000 0.08511000 {++} 0.00000000 0 0 0 {?} {?} 117.68920898 0.33182001 0.74212003 {P+} 0.00000000 0 0 0 {?} 47 0.060 0.000 0.000 0 2 {?} {?} 8.72500992 0.04861000 0.10378000 {++} 0.00000000 0 0 0 {?} {?} 117.16635132 0.35005999 0.58421999 {+P} 0.00000000 0 0 0 {?} 48 0.028 0.000 0.000 0 2 {?} {?} 8.68033981 0.05468000 0.05468000 {+P} 0.00000000 0 0 0 {?} {?} 117.41108704 0.48805001 0.71780998 {++} 0.00000000 0 0 0 {?} 49 0.019 0.000 0.000 0 2 {?} {?} 8.66623974 0.03564000 0.04760000 {++} 0.00000000 0 0 0 {?} {?} 106.64694977 0.30864000 0.45392999 {++} 0.00000000 0 0 0 {?} 50 0.084 0.000 0.000 0 2 {?} {?} 8.66569042 0.03057000 0.10174000 {++} 0.00000000 0 0 0 {?} {?} 119.08283234 0.27796999 0.55557001 {++} 0.00000000 0 0 0 {?} 51 0.030 0.000 0.000 0 2 {?} {?} 8.62405968 0.03969000 0.05853000 {++} 0.00000000 0 0 0 {?} {?} 118.15601349 0.46595001 0.81713998 {++} 0.00000000 0 0 0 {?} 52 0.012 0.000 0.000 0 2 {?} {?} 8.60902977 0.02343000 0.04620000 {P+} 0.00000000 0 0 0 {?} {?} 124.81005096 0.49017000 0.47029001 {++} 0.00000000 0 0 0 {?} 53 0.010 0.000 0.000 0 2 {?} {?} 8.59885025 0.04310000 0.03356000 {++} 0.00000000 0 0 0 {?} {?} 114.46817017 0.48144999 0.39111999 {++} 0.00000000 0 0 0 {?} 54 0.037 0.000 0.000 0 2 {?} {?} 8.58979988 0.04240000 0.07690000 {P+} 0.00000000 0 0 0 {?} {?} 123.86728668 0.34246001 0.57284999 {++} 0.00000000 0 0 0 {?} 55 0.017 0.000 0.000 0 2 {?} {?} 8.58446026 0.04516000 0.05495000 {++} 0.00000000 0 0 0 {?} {?} 120.85059357 0.42071000 0.49362999 {++} 0.00000000 0 0 0 {?} 56 0.017 0.000 0.000 0 2 {?} {?} 8.56869030 0.04496000 0.05343000 {++} 0.00000000 0 0 0 {?} {?} 124.96684265 0.45776001 0.54070997 {++} 0.00000000 0 0 0 {?} 57 0.065 0.000 0.000 0 2 {?} {?} 8.56258965 0.03690000 0.08136000 {++} 0.00000000 0 0 0 {?} {?} 122.10099030 0.22215000 0.46597001 {++} 0.00000000 0 0 0 {?} 58 0.050 0.000 0.000 0 2 {?} {?} 8.56196976 0.04231000 0.09102000 {++} 0.00000000 0 0 0 {?} {?} 116.46385193 0.27871001 0.75085998 {++} 0.00000000 0 0 0 {?} 59 0.063 0.000 0.000 0 2 {?} {?} 8.55414963 0.04024000 0.08878000 {++} 0.00000000 0 0 0 {?} {?} 127.84677887 0.37467000 0.67422998 {++} 0.00000000 0 0 0 {?} 60 0.029 0.000 0.000 0 2 {?} {?} 8.53814030 0.05468000 0.14841001 {PP} 0.00000000 0 0 0 {?} {?} 123.95046234 0.45910001 0.69297999 {++} 0.00000000 0 0 0 {?} 61 0.025 0.000 0.000 0 2 {?} {?} 8.52645016 0.03905000 0.03905000 {+P} 0.00000000 0 0 0 {?} {?} 116.71658325 0.50573999 0.78671002 {++} 0.00000000 0 0 0 {?} 62 0.103 0.000 0.000 0 2 {?} {?} 8.50957012 0.03132000 0.16403000 {P+} 0.00000000 0 0 0 {?} {?} 119.74738312 0.25417000 0.57955003 {++} 0.00000000 0 0 0 {?} 63 0.015 0.000 0.000 0 2 {?} {?} 8.48196983 0.06846000 0.07540000 {++} 0.00000000 0 0 0 {?} {?} 121.43620300 0.43584999 0.47417000 {++} 0.00000000 0 0 0 {?} 64 0.033 0.000 0.000 0 2 {?} {?} 8.45549011 0.04476000 0.07118000 {++} 0.00000000 0 0 0 {?} {?} 122.88191223 0.28681999 0.47079000 {++} 0.00000000 0 0 0 {?} 65 0.037 0.000 0.000 0 2 {?} {?} 8.45928001 0.04884000 0.08407000 {++} 0.00000000 0 0 0 {?} {?} 111.97863770 0.24515000 0.46057001 {++} 0.00000000 0 0 0 {?} 66 0.053 0.000 0.000 0 2 {?} {?} 8.42555046 0.03763000 0.07183000 {++} 0.00000000 0 0 0 {?} {?} 130.45455933 0.28000000 0.54174000 {++} 0.00000000 0 0 0 {?} 67 0.070 0.000 0.000 0 2 {?} {?} 8.42586040 0.03709000 0.07706000 {++} 0.00000000 0 0 0 {?} {?} 123.67318726 0.34944001 0.56260002 {++} 0.00000000 0 0 0 {?} 68 0.103 0.000 0.000 0 2 {?} {?} 8.41983986 0.03891000 0.07494000 {++} 0.00000000 0 0 0 {?} {?} 125.46101379 0.28588000 0.52686000 {++} 0.00000000 0 0 0 {?} 69 0.078 0.000 0.000 0 2 {?} {?} 8.39888000 0.03397000 0.11716000 {P+} 0.00000000 0 0 0 {?} {?} 120.05713654 0.27757001 0.48684001 {++} 0.00000000 0 0 0 {?} 70 0.092 0.000 0.000 0 2 {?} {?} 8.38012981 0.03705000 0.09501000 {++} 0.00000000 0 0 0 {?} {?} 120.90222931 0.22251000 0.45534000 {++} 0.00000000 0 0 0 {?} 71 0.072 0.000 0.000 0 2 {?} {?} 8.34687996 0.03954000 0.08983000 {++} 0.00000000 0 0 0 {?} {?} 117.85575104 0.44801000 0.77595001 {++} 0.00000000 0 0 0 {?} 72 0.047 0.000 0.000 0 2 {?} {?} 8.33127975 0.03094000 0.07030000 {P+} 0.00000000 0 0 0 {?} {?} 122.21893311 0.32308000 0.51756001 {++} 0.00000000 0 0 0 {?} 73 0.033 0.000 0.000 0 2 {?} {?} 8.30879974 0.05318000 0.08187000 {++} 0.00000000 0 0 0 {?} {?} 123.27491760 0.33221999 0.52522999 {++} 0.00000000 0 0 0 {?} 74 0.134 0.000 0.000 0 2 {?} {?} 8.28635025 0.04634000 0.13279000 {PP} 0.00000000 0 0 0 {?} {?} 119.95139313 0.35797000 0.78309000 {P+} 0.00000000 0 0 0 {?} 75 0.068 0.000 0.000 0 2 {?} {?} 8.28258038 0.07030000 0.08592000 {PP} 0.00000000 0 0 0 {?} {?} 122.38706970 0.29898000 0.53735000 {++} 0.00000000 0 0 0 {?} 76 0.083 0.000 0.000 0 2 {?} {?} 8.27976990 0.03801000 0.07404000 {++} 0.00000000 0 0 0 {?} {?} 119.32097626 0.22105999 0.74212998 {PP} 0.00000000 0 0 0 {?} 77 0.074 0.000 0.000 0 2 {?} {?} 8.27359009 0.03553000 0.08592000 {P+} 0.00000000 0 0 0 {?} {?} 118.76410675 0.38033000 0.59671003 {+P} 0.00000000 0 0 0 {?} 78 0.072 0.000 0.000 0 2 {?} {?} 8.24851990 0.03926000 0.08821000 {++} 0.00000000 0 0 0 {?} {?} 125.80774689 0.26354000 0.55497998 {++} 0.00000000 0 0 0 {?} 79 0.146 0.000 0.000 0 2 {?} {?} 8.23853016 0.03098000 0.09021000 {++} 0.00000000 0 0 0 {?} {?} 123.59043121 0.20612000 0.49485001 {++} 0.00000000 0 0 0 {?} 80 0.041 0.000 0.000 0 2 {?} {?} 8.22673988 0.07561000 0.14841001 {P+} 0.00000000 0 0 0 {?} {?} 127.07125092 0.33230999 0.51292998 {++} 0.00000000 0 0 0 {?} 81 0.027 0.000 0.000 0 2 {?} {?} 8.21903038 0.05544000 0.09649000 {++} 0.00000000 0 0 0 {?} {?} 124.45092010 0.26997000 0.38450000 {++} 0.00000000 0 0 0 {?} 82 0.099 0.000 0.000 0 2 {?} {?} 8.21776962 0.03740000 0.13279000 {PP} 0.00000000 0 0 0 {?} {?} 122.48703766 0.33853999 0.55166000 {++} 0.00000000 0 0 0 {?} 83 0.036 0.000 0.000 0 2 {?} {?} 8.21453953 0.05468000 0.05468000 {+P} 0.00000000 0 0 0 {?} {?} 119.88938141 0.37393999 0.53880000 {++} 0.00000000 0 0 0 {?} 84 0.064 0.000 0.000 0 2 {?} {?} 8.20197964 0.04460000 0.08623000 {++} 0.00000000 0 0 0 {?} {?} 120.80306244 0.29339999 0.49509001 {++} 0.00000000 0 0 0 {?} 85 0.062 0.000 0.000 0 2 {?} {?} 8.20011997 0.04328000 0.10154000 {+P} 0.00000000 0 0 0 {?} {?} 118.98993683 0.23966999 0.48096001 {++} 0.00000000 0 0 0 {?} 86 0.154 0.000 0.000 0 2 {?} {?} 8.19009972 0.05777000 0.15620001 {++} 0.00000000 0 0 0 {?} {?} 121.72383881 0.39014000 0.77187002 {++} 0.00000000 0 0 0 {?} 87 0.053 0.000 0.000 0 2 {?} {?} 8.15830994 0.03589000 0.06931000 {++} 0.00000000 0 0 0 {?} {?} 118.34718323 0.30368000 0.51214999 {+P} 0.00000000 0 0 0 {?} 88 0.040 0.000 0.000 0 2 {?} {?} 8.15443039 0.05547000 0.11072000 {++} 0.00000000 0 0 0 {?} {?} 115.29965973 0.28362000 0.50348002 {++} 0.00000000 0 0 0 {?} 89 0.013 0.000 0.000 0 2 {?} {?} 8.13809967 0.05795000 0.05731000 {++} 0.00000000 0 0 0 {?} {?} 111.16018677 0.41047999 0.40720999 {++} 0.00000000 0 0 0 {?} 90 0.106 0.000 0.000 0 2 {?} {?} 8.11168957 0.02982000 0.09589000 {+P} 0.00000000 0 0 0 {?} {?} 122.26255035 0.24295001 0.56563997 {++} 0.00000000 0 0 0 {?} 91 0.038 0.000 0.000 0 2 {?} {?} 8.10945034 0.05673000 0.12162000 {++} 0.00000000 0 0 0 {?} {?} 125.75801086 0.40685999 0.62101001 {++} 0.00000000 0 0 0 {?} 92 0.048 0.000 0.000 0 2 {?} {?} 8.09918976 0.05443000 0.11716000 {+P} 0.00000000 0 0 0 {?} {?} 127.07885742 0.36824000 0.55286002 {++} 0.00000000 0 0 0 {?} 93 0.011 0.000 0.000 0 2 {?} {?} 8.10035992 0.04359000 0.03708000 {++} 0.00000000 0 0 0 {?} {?} 123.18061066 0.45511001 0.39623001 {++} 0.00000000 0 0 0 {?} 94 0.023 0.000 0.000 0 2 {?} {?} 8.08104992 0.04719000 0.07092000 {++} 0.00000000 0 0 0 {?} {?} 127.96057892 0.48991999 0.62390000 {++} 0.00000000 0 0 0 {?} 95 0.032 0.000 0.000 0 2 {?} {?} 8.08753967 0.03432000 0.07558000 {++} 0.00000000 0 0 0 {?} {?} 112.05371857 0.38216999 0.59171999 {++} 0.00000000 0 0 0 {?} 96 0.024 0.000 0.000 0 2 {?} {?} 8.02731037 0.04671000 0.08505000 {++} 0.00000000 0 0 0 {?} {?} 109.40477753 0.42309001 0.53772998 {++} 0.00000000 0 0 0 {?} 97 0.013 0.000 0.000 0 2 {?} {?} 8.00454044 0.04723000 0.04808000 {++} 0.00000000 0 0 0 {?} {?} 132.23956299 0.33691999 0.34106001 {++} 0.00000000 0 0 0 {?} 98 0.090 0.000 0.000 0 2 {?} {?} 8.00611973 0.04411000 0.09238000 {++} 0.00000000 0 0 0 {?} {?} 114.71705627 0.30535001 0.73027998 {++} 0.00000000 0 0 0 {?} 99 0.069 0.000 0.000 0 2 {?} {?} 7.97673988 0.03751000 0.09519000 {++} 0.00000000 0 0 0 {?} {?} 120.48632050 0.24705000 0.51012999 {++} 0.00000000 0 0 0 {?} 100 0.034 0.000 0.000 0 2 {?} {?} 7.97504997 0.05403000 0.08892000 {++} 0.00000000 0 0 0 {?} {?} 115.63549805 0.49608999 0.73193997 {++} 0.00000000 0 0 0 {?} 101 0.108 0.000 0.000 0 2 {?} {?} 7.94001007 0.03134000 0.07565000 {++} 0.00000000 0 0 0 {?} {?} 118.79782867 0.26848999 0.55167001 {++} 0.00000000 0 0 0 {?} 102 0.010 0.000 0.000 0 2 {?} {?} 7.93320990 0.02439000 0.05468000 {P+} 0.00000000 0 0 0 {?} {?} 119.38912201 0.44527000 0.64958000 {P+} 0.00000000 0 0 0 {?} 103 0.115 0.000 0.000 0 2 {?} {?} 7.92363977 0.02922000 0.08967000 {++} 0.00000000 0 0 0 {?} {?} 122.06256866 0.27302000 0.57780999 {++} 0.00000000 0 0 0 {?} 104 0.091 0.000 0.000 0 2 {?} {?} 7.92298985 0.03373000 0.09724000 {++} 0.00000000 0 0 0 {?} {?} 110.10894775 0.24812999 0.54105997 {++} 0.00000000 0 0 0 {?} 105 0.034 0.000 0.000 0 2 {?} {?} 7.91328001 0.05084000 0.11716000 {P+} 0.00000000 0 0 0 {?} {?} 114.27411652 0.31005999 0.51721001 {++} 0.00000000 0 0 0 {?} 106 0.044 0.000 0.000 0 2 {?} {?} 7.91203022 0.05017000 0.09908000 {++} 0.00000000 0 0 0 {?} {?} 106.12254333 0.29020000 0.52490997 {++} 0.00000000 0 0 0 {?} 107 0.067 0.000 0.000 0 2 {?} {?} 7.89022017 0.03946000 0.08243000 {++} 0.00000000 0 0 0 {?} {?} 108.95504761 0.34522000 0.59619999 {++} 0.00000000 0 0 0 {?} 108 0.035 0.000 0.000 0 2 {?} {?} 7.86790991 0.05643000 0.09543000 {++} 0.00000000 0 0 0 {?} {?} 118.04812622 0.38444999 0.54345000 {++} 0.00000000 0 0 0 {?} 109 0.069 0.000 0.000 0 2 {?} {?} 7.86463022 0.05152000 0.11392000 {++} 0.00000000 0 0 0 {?} {?} 116.64164734 0.26468000 0.74212998 {P+} 0.00000000 0 0 0 {?} 110 0.113 0.000 0.000 0 2 {?} {?} 7.86288977 0.02343000 0.10701000 {P+} 0.00000000 0 0 0 {?} {?} 116.13739014 0.26254001 0.57420999 {+P} 0.00000000 0 0 0 {?} 111 0.114 0.000 0.000 0 2 {?} {?} 7.83620977 0.05468000 0.07030000 {PP} 0.00000000 0 0 0 {?} {?} 116.16040802 0.29398000 0.59298003 {++} 0.00000000 0 0 0 {?} 112 0.011 0.000 0.000 0 2 {?} {?} 7.83151007 0.05468000 0.05026000 {+P} 0.00000000 0 0 0 {?} {?} 114.34314728 0.36722001 0.32308999 {++} 0.00000000 0 0 0 {?} 113 0.075 0.000 0.000 0 2 {?} {?} 7.82917023 0.03508000 0.09460000 {++} 0.00000000 0 0 0 {?} {?} 119.80609131 0.41453001 0.79957002 {P+} 0.00000000 0 0 0 {?} 114 0.133 0.000 0.000 0 2 {?} {?} 7.81687021 0.02841000 0.06243000 {++} 0.00000000 0 0 0 {?} {?} 112.86757660 0.23194000 0.74212998 {P+} 0.00000000 0 0 0 {?} 115 0.096 0.000 0.000 0 2 {?} {?} 7.79023981 0.03768000 0.22652000 {PP} 0.00000000 0 0 0 {?} {?} 119.09896088 0.34018999 0.58897001 {++} 0.00000000 0 0 0 {?} 116 0.064 0.000 0.000 0 2 {?} {?} 7.78104019 0.04095000 0.08962000 {++} 0.00000000 0 0 0 {?} {?} 121.07984161 0.24089999 0.55251998 {++} 0.00000000 0 0 0 {?} 117 0.114 0.000 0.000 0 2 {?} {?} 7.77900982 0.03997000 0.14841001 {PP} 0.00000000 0 0 0 {?} {?} 115.99224091 0.23217000 0.52179003 {+P} 0.00000000 0 0 0 {?} 118 0.080 0.000 0.000 0 2 {?} {?} 7.77311993 0.04597000 0.11716000 {P+} 0.00000000 0 0 0 {?} {?} 111.73473358 0.21788999 0.51991999 {++} 0.00000000 0 0 0 {?} 119 0.382 0.000 0.000 0 2 {?} {?} 7.71002007 0.02754000 0.05970000 {++} 0.00000000 0 0 0 {?} {?} 129.99447632 0.19433001 0.51626998 {++} 0.00000000 0 0 0 {?} 120 0.045 0.000 0.000 0 2 {?} {?} 7.68874979 0.03097000 0.07452000 {P+} 0.00000000 0 0 0 {?} {?} 122.33661652 0.39862001 0.58831000 {++} 0.00000000 0 0 0 {?} 121 0.271 0.000 0.000 0 2 {?} {?} 7.68454981 0.02787000 0.06094000 {++} 0.00000000 0 0 0 {?} {?} 111.95554352 0.24741000 0.56757998 {++} 0.00000000 0 0 0 {?} 122 0.119 0.000 0.000 0 2 {?} {?} 7.65936995 0.02691000 0.06044000 {++} 0.00000000 0 0 0 {?} {?} 114.28424835 0.25543001 1.03898001 {P+} 0.00000000 0 0 0 {?} 123 0.080 0.000 0.000 0 2 {?} {?} 7.65795994 0.02919000 0.11716000 {P+} 0.00000000 0 0 0 {?} {?} 121.18952179 0.23035000 0.48798999 {++} 0.00000000 0 0 0 {?} 124 0.017 0.000 0.000 0 2 {?} {?} 7.64488983 0.05116000 0.06227000 {++} 0.00000000 0 0 0 {?} {?} 119.21913147 0.48416001 0.54899001 {++} 0.00000000 0 0 0 {?} 125 0.076 0.000 0.000 0 2 {?} {?} 7.63647985 0.03655000 0.07383000 {++} 0.00000000 0 0 0 {?} {?} 110.58168793 0.29012001 0.58112001 {++} 0.00000000 0 0 0 {?} 126 0.051 0.000 0.000 0 2 {?} {?} 7.63299990 0.02872000 0.06046000 {+P} 0.00000000 0 0 0 {?} {?} 122.31163788 0.34492999 0.58973002 {++} 0.00000000 0 0 0 {?} 127 0.116 0.000 0.000 0 2 {?} {?} 7.60082006 0.02880000 0.06893000 {++} 0.00000000 0 0 0 {?} {?} 112.74240112 0.21319000 0.56378001 {+P} 0.00000000 0 0 0 {?} 128 0.062 0.000 0.000 0 2 {?} {?} 7.59600019 0.03667000 0.07325000 {P+} 0.00000000 0 0 0 {?} {?} 112.08483124 0.37825999 0.56854999 {++} 0.00000000 0 0 0 {?} 129 0.078 0.000 0.000 0 2 {?} {?} 7.59168005 0.04196000 0.12372000 {P+} 0.00000000 0 0 0 {?} {?} 120.47145081 0.24133000 0.58583999 {++} 0.00000000 0 0 0 {?} 130 0.010 0.000 0.000 0 2 {?} {?} 7.59217978 0.04007000 0.03435000 {++} 0.00000000 0 0 0 {?} {?} 118.49476624 0.40586999 0.33515999 {++} 0.00000000 0 0 0 {?} 131 0.073 0.000 0.000 0 2 {?} {?} 7.56899977 0.03887000 0.08929000 {++} 0.00000000 0 0 0 {?} {?} 113.17603302 0.23255000 0.50026000 {++} 0.00000000 0 0 0 {?} 132 0.014 0.000 0.000 0 2 {?} {?} 7.56336021 0.02765000 0.03047000 {+P} 0.00000000 0 0 0 {?} {?} 112.57707214 0.08950000 0.09794000 {N+} 0.00000000 0 0 0 {?} 133 0.112 0.000 0.000 0 2 {?} {?} 7.56378984 0.02965000 0.07362000 {++} 0.00000000 0 0 0 {?} {?} 111.95867157 0.30838001 0.60839999 {++} 0.00000000 0 0 0 {?} 134 0.009 0.000 0.000 0 2 {?} {?} 7.55337000 0.01987000 0.01987000 {++} 0.00000000 0 0 0 {?} {?} 115.73932648 0.28731000 0.28731000 {++} 0.00000000 0 0 0 {?} 135 0.016 0.000 0.000 0 2 {?} {?} 7.55341005 0.07461000 0.08289000 {++} 0.00000000 0 0 0 {?} {?} 111.18615723 0.46373001 0.52023000 {++} 0.00000000 0 0 0 {?} 136 0.050 0.000 0.000 0 2 {?} {?} 7.53483009 0.04818000 0.05468000 {+P} 0.00000000 0 0 0 {?} {?} 120.61028290 0.26271999 0.48480001 {++} 0.00000000 0 0 0 {?} 137 0.047 0.000 0.000 0 2 {?} {?} 7.50721979 0.03964000 0.09295000 {P+} 0.00000000 0 0 0 {?} {?} 116.81124878 0.32414001 0.56163001 {++} 0.00000000 0 0 0 {?} 138 0.023 0.000 0.000 0 2 {?} {?} 7.47169018 0.04238000 0.06207000 {P+} 0.00000000 0 0 0 {?} {?} 121.83750153 0.32451999 0.45300999 {++} 0.00000000 0 0 0 {?} 139 0.099 0.000 0.000 0 2 {?} {?} 7.47609997 0.03320000 0.07579000 {++} 0.00000000 0 0 0 {?} {?} 119.60140228 0.25848001 0.55805999 {++} 0.00000000 0 0 0 {?} 140 0.064 0.000 0.000 0 2 {?} {?} 7.43861008 0.05132000 0.12446000 {++} 0.00000000 0 0 0 {?} {?} 116.54441833 0.49568999 1.08117998 {P+} 0.00000000 0 0 0 {?} 141 0.023 0.000 0.000 0 2 {?} {?} 7.42959976 0.04075000 0.05468000 {+P} 0.00000000 0 0 0 {?} {?} 121.82862091 0.29200000 0.42462999 {++} 0.00000000 0 0 0 {?} 142 0.032 0.000 0.000 0 2 {?} {?} 7.41245985 0.05225000 0.10267000 {++} 0.00000000 0 0 0 {?} {?} 113.31770325 0.37788999 0.56540000 {++} 0.00000000 0 0 0 {?} 143 0.060 0.000 0.000 0 2 {?} {?} 7.41304016 0.03960000 0.08664000 {++} 0.00000000 0 0 0 {?} {?} 108.34221649 0.24741000 0.53959000 {++} 0.00000000 0 0 0 {?} 144 0.221 0.000 0.000 0 2 {?} {?} 7.40110016 0.02917000 0.09772000 {++} 0.00000000 0 0 0 {?} {?} 118.17514801 0.35451999 0.84536999 {++} 0.00000000 0 0 0 {?} 145 0.026 0.000 0.000 0 2 {?} {?} 7.40603018 0.04686000 0.07549000 {++} 0.00000000 0 0 0 {?} {?} 116.97888947 0.39438000 0.74212998 {P+} 0.00000000 0 0 0 {?} 146 0.124 0.000 0.000 0 2 {?} {?} 7.40754986 0.04023000 0.19527000 {P+} 0.00000000 0 0 0 {?} {?} 116.12361908 0.37531999 0.61923999 {+P} 0.00000000 0 0 0 {?} 147 0.063 0.000 0.000 0 2 {?} {?} 7.39592981 0.03555000 0.07429000 {++} 0.00000000 0 0 0 {?} {?} 111.55667114 0.33074000 0.79591000 {++} 0.00000000 0 0 0 {?} 148 0.087 0.000 0.000 0 2 {?} {?} 7.35832024 0.04036000 0.10146000 {++} 0.00000000 0 0 0 {?} {?} 119.92883301 0.27529001 0.58060998 {++} 0.00000000 0 0 0 {?} 149 0.009 0.000 0.000 0 2 {?} {?} 7.34241009 0.02205000 0.02205000 {++} 0.00000000 0 0 0 {?} {?} 122.07758331 0.18825001 0.18825001 {++} 0.00000000 0 0 0 {?} 150 0.014 0.000 0.000 0 2 {?} {?} 7.29853010 0.03149000 0.03417000 {++} 0.00000000 0 0 0 {?} {?} 112.27043915 0.29628000 0.32751000 {++} 0.00000000 0 0 0 {?} 151 0.073 0.000 0.000 0 2 {?} {?} 7.29853010 0.03188000 0.06641000 {++} 0.00000000 0 0 0 {?} {?} 99.90215302 0.33442000 0.60668999 {++} 0.00000000 0 0 0 {?} 152 0.015 0.000 0.000 0 2 {?} {?} 7.25656986 0.07310000 0.07816000 {++} 0.00000000 0 0 0 {?} {?} 123.37146759 0.45230001 0.49380001 {++} 0.00000000 0 0 0 {?} 153 0.029 0.000 0.000 0 2 {?} {?} 7.25699997 0.05468000 0.10500000 {P+} 0.00000000 0 0 0 {?} {?} 122.11892700 0.27245000 0.46195999 {++} 0.00000000 0 0 0 {?} 154 0.061 0.000 0.000 0 2 {?} {?} 7.25499010 0.04322000 0.07692000 {++} 0.00000000 0 0 0 {?} {?} 118.87946320 0.25835001 0.51672000 {++} 0.00000000 0 0 0 {?} 155 0.062 0.000 0.000 0 2 {?} {?} 7.25256014 0.02981000 0.05918000 {++} 0.00000000 0 0 0 {?} {?} 109.41586304 0.35773000 0.74212998 {P+} 0.00000000 0 0 0 {?} 156 0.036 0.000 0.000 0 2 {?} {?} 7.20282984 0.03937000 0.07030000 {+P} 0.00000000 0 0 0 {?} {?} 122.14833069 0.26865000 0.49294999 {++} 0.00000000 0 0 0 {?} 157 0.060 0.000 0.000 0 2 {?} {?} 7.15799999 0.03602000 0.07567000 {++} 0.00000000 0 0 0 {?} {?} 124.59234619 0.24829000 0.50958002 {++} 0.00000000 0 0 0 {?} 158 0.108 0.000 0.000 0 2 {?} {?} 7.10200977 0.03328000 0.07760000 {++} 0.00000000 0 0 0 {?} {?} 121.29873657 0.28959000 0.55466002 {++} 0.00000000 0 0 0 {?} 159 0.012 0.000 0.000 0 2 {?} {?} 7.08515978 0.03102000 0.03102000 {++} 0.00000000 0 0 0 {?} {?} 113.41272736 0.51080000 0.46746999 {++} 0.00000000 0 0 0 {?} 160 0.057 0.000 0.000 0 2 {?} {?} 7.08311987 0.03451000 0.06392000 {++} 0.00000000 0 0 0 {?} {?} 111.07150269 0.36837000 0.78763998 {++} 0.00000000 0 0 0 {?} 161 0.104 0.000 0.000 0 2 {?} {?} 7.06606007 0.03267000 0.11041000 {++} 0.00000000 0 0 0 {?} {?} 121.98676300 0.23470999 0.56619000 {++} 0.00000000 0 0 0 {?} 162 0.231 0.000 0.000 0 2 {?} {?} 7.00230980 0.02600000 0.05954000 {++} 0.00000000 0 0 0 {?} {?} 111.96074677 0.23773000 0.56208003 {++} 0.00000000 0 0 0 {?} 163 0.063 0.000 0.000 0 2 {?} {?} 6.98186016 0.04768000 0.09240000 {++} 0.00000000 0 0 0 {?} {?} 116.69972229 0.38938999 0.75615001 {++} 0.00000000 0 0 0 {?} 164 0.118 0.000 0.000 0 2 {?} {?} 6.97740984 0.02784000 0.06242000 {++} 0.00000000 0 0 0 {?} {?} 114.28914642 0.25237000 1.03898001 {P+} 0.00000000 0 0 0 {?} 165 0.045 0.000 0.000 0 2 {?} {?} 6.94825983 0.04288000 0.12067000 {++} 0.00000000 0 0 0 {?} {?} 116.37777710 0.44916001 0.65894997 {++} 0.00000000 0 0 0 {?} 166 0.113 0.000 0.000 0 2 {?} {?} 6.92364979 0.03855000 0.07815000 {P+} 0.00000000 0 0 0 {?} {?} 112.74288177 0.21718000 0.58090001 {++} 0.00000000 0 0 0 {?} 167 0.157 0.000 0.000 0 2 {?} {?} 6.88015985 0.03658000 0.05468000 {+P} 0.00000000 0 0 0 {?} {?} 112.85703278 0.24023999 0.74212998 {P+} 0.00000000 0 0 0 {?} 168 0.057 0.000 0.000 0 2 {?} {?} 6.76773977 0.03415000 0.07223000 {++} 0.00000000 0 0 0 {?} {?} 109.39920044 0.30996001 0.74212998 {P+} 0.00000000 0 0 0 {?} 169 0.024 0.000 0.000 0 2 {?} {?} 6.76249981 0.04589000 0.06563000 {++} 0.00000000 0 0 0 {?} {?} 117.41477203 0.43112999 0.58424002 {++} 0.00000000 0 0 0 {?} 170 0.075 0.000 0.000 0 2 {?} {?} 6.76338005 0.03969000 0.12415000 {P+} 0.00000000 0 0 0 {?} {?} 111.54160309 0.28996000 0.72551000 {+P} 0.00000000 0 0 0 {?} 171 0.020 0.000 0.000 0 2 {?} {?} 6.71824980 0.05397000 0.06661000 {++} 0.00000000 0 0 0 {?} {?} 119.68673706 0.45320001 0.61105001 {++} 0.00000000 0 0 0 {?} 172 0.018 0.000 0.000 0 2 {?} {?} 6.71492004 0.03788000 0.03905000 {+P} 0.00000000 0 0 0 {?} {?} 111.38577271 0.24659000 0.32400000 {++} 0.00000000 0 0 0 {?} 173 0.186 0.000 0.000 0 2 {?} {?} 6.70755005 0.03075000 0.06890000 {+P} 0.00000000 0 0 0 {?} {?} 111.95716095 0.25158000 0.56826001 {++} 0.00000000 0 0 0 {?} 174 0.037 0.000 0.000 0 2 {?} {?} 6.66259003 0.04336000 0.10154000 {P+} 0.00000000 0 0 0 {?} {?} 113.98639679 0.38521001 0.58822000 {++} 0.00000000 0 0 0 {?} 175 0.071 0.000 0.000 0 2 {?} {?} 6.52921009 0.04400000 0.08558000 {++} 0.00000000 0 0 0 {?} {?} 115.65345001 0.36008999 0.61123002 {++} 0.00000000 0 0 0 {?} 176 0.018 0.000 0.000 0 2 {?} {?} 6.35503006 0.05859000 0.07234000 {++} 0.00000000 0 0 0 {?} {?} 120.23181915 0.35025999 0.45297000 {++} 0.00000000 0 0 0 {?} 177 0.020 0.000 0.000 0 2 {?} {?} 6.20161009 0.04460000 0.06079000 {++} 0.00000000 0 0 0 {?} {?} 108.81668854 0.35619000 0.44850001 {++} 0.00000000 0 0 0 {?} stop_ ; loop_ _Spectral_dim.ID _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 2 H 1 H . 7682 . . . 16669 1 2 N 15 N . 2293 . . . 16669 1 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $NMRView . . 16669 1 stop_ save_