######################### # 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 30176 _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 NOESY' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 1 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 Data Height ?-? 4.763 7.776 447154 ?-? 4.129 8.309 835295 ?-? 7.787 8.780 1944191 ?-? 1.558 6.848 1359380 ?-? 0.798 1.551 1955153 ?-? 0.776 1.603 1583168 ?-? 1.624 2.894 1676340 ?-? 7.685 1.460 1345309 ?-? 2.472 4.012 1115885 ?-? 4.131 3.734 2294993 ?-? 0.886 4.015 917922 ?-? 1.919 3.774 1161389 ?-? 0.875 1.556 1493697 ?-? 4.794 8.431 590996 ?-? 8.775 7.290 245294 ?-? 8.596 7.656 896628 ?-? 6.847 6.360 778956 ?-? 0.875 1.742 1410754 ?-? 4.128 3.838 1747938 ?-? 4.038 3.747 6802704 ?-? 1.906 4.416 1778803 ?-? 2.290 3.945 1264585 ?-? 7.296 6.848 1141779 ?-? 4.223 7.366 519764 ?-? 4.015 7.594 345218 ?-? 1.507 4.068 1500208 ?-? 2.438 7.747 361726 ?-? 3.184 8.064 640255 ?-? 4.022 8.162 295254 ?-? 7.370 6.852 1119785 ?-? 1.557 4.220 1170448 ?-? 3.005 3.366 8025899 ?-? 3.733 8.310 835570 ?-? 3.715 8.161 561461 ?-? 4.073 6.848 581734 ?-? 2.894 1.624 1325386 ?-? 3.363 3.008 8346067 ?-? 1.447 3.356 1461837 ?-? 7.388 8.311 303720 ?-? 1.548 0.769 2759652 ?-? 3.948 3.223 4834947 ?-? 2.162 3.570 1106325 ?-? 2.168 3.507 1286535 ?-? 1.685 3.356 1605843 ?-? 1.886 3.519 1799582 ?-? 2.369 4.014 1120794 ?-? 2.038 2.891 715944 ?-? 2.139 3.682 1689700 ?-? 2.014 4.334 606300 ?-? 2.288 8.309 1180754 ?-? 2.475 4.471 672138 ?-? 2.015 3.642 3134244 ?-? 7.923 8.310 436785 ?-? 8.243 8.783 246836 ?-? 4.222 4.442 4970146 ?-? 3.683 7.654 374492 ?-? 2.472 3.722 1789585 ?-? 2.290 3.945 1264585 ?-? 2.226 4.030 1879278 ?-? 1.875 8.967 221721 ?-? 4.224 7.295 522330 ?-? 3.054 6.844 353869 ?-? 2.166 8.958 236014 ?-? 1.472 6.846 541237 ?-? 4.758 9.125 299708 Gla7HN-? 8.099 8.309 4674374 Ala13HB#-? 1.472 6.845 548926 Glu2HB#-HA 2.089 4.015 4303953 Gly1HA1-Glu2HN 4.016 8.943 245955 Gly1HA2-Glu2HN 3.948 8.942 167263 Glu2HB#-HN 2.092 8.945 299617 Gly1HA1-Gla3HA 4.018 4.449 3585803 Glu2HG1-Gla3HA 2.389 4.413 3472070 Gla3HB1-HA 2.171 4.413 2482768 Gla3HB1-HB2 2.171 1.892 8150262 Gly1HA-Gla3HN 4.019 9.125 220649 Glu2HB#-Gla3HN 2.089 9.126 464963 Gla3HN-Glu2HN 9.125 8.968 333411 Glu2HN-Gla3HN 8.964 9.125 689522 Gla3HA-HN 4.419 9.120 286338 Gla3HB1-HN 2.172 9.126 829170 Gla3HB2-HN 1.885 9.126 768754 Gla3HN-Gla4HN 9.124 7.864 500011 Gla4HN-Gla3HN 7.864 9.125 466625 Gla4HB1-HA 2.431 3.958 1132359 Gla4HB2-HA 2.039 3.957 2112421 Gla4HG-HA 3.227 3.950 2872025 Gla4HG-HB1 3.225 2.422 1078409 Gla4HB1-HG 2.427 3.222 2366154 Gla4HG-HB2 3.227 2.049 3316825 Gla4HB2-HG 2.038 3.223 5095810 Glu2HN-Gla4HN 8.972 7.861 313516 Gla3HA-Gla4HN 4.426 7.863 431093 Gla3HB1-Gla4HN 2.172 7.862 620774 Gla3HG-Gla4HN 3.508 7.864 273733 Gla4HA-HN 3.949 7.863 1562345 Gla4HB1-HN 2.428 7.864 2174390 Gla4HB2-HN 2.038 7.863 1539210 Gla4HG-HN 3.228 7.864 867145 Gla4HN-Leu5HN 7.861 7.493 1742325 Leu5HN-Gla4HN 7.491 7.863 2405489 Leu5HB1-HA 1.824 4.014 1095146 Leu5HB1-HA 1.821 4.095 1103258 Leu5HB2-HA 1.552 4.093 3605274 Leu5HD2#-HA 0.868 4.097 1369344 Leu5HB2-HB1 1.559 1.821 5774578 Leu5HD2#-HG 0.877 1.744 1457387 Gly1HA1-Leu5HN 4.013 7.493 628918 Gly1HA2-Leu5HN 3.951 7.492 615787 Gla4HB1-Leu5HN 2.429 7.492 907700 Gla4HB2-Leu5HN 2.038 7.493 759944 Leu5HA-HN 4.100 7.494 1092513 Leu5HB1-HN 1.823 7.493 1463451 Leu5HB2-HN 1.557 7.492 1236872 Leu5HG-HN 1.758 7.493 1001006 Ala6HB#-HA 1.475 4.087 3476551 Gla3HA-Ala6HN 4.419 7.922 1133881 Gla4HA-Ala6HN 3.947 7.921 370390 Leu5HB1-Ala6HN 1.823 7.922 978097 Leu5HB2-Ala6HN 1.548 7.922 2463508 Leu5HN-Ala6HN 7.493 7.922 1699111 Ala6HA-HN 4.096 7.922 2325155 Ala6HB#-HN 1.476 7.922 3900758 Gla7HB#-HA 2.288 4.124 5157366 Gla7HG-HA 3.739 4.131 2360271 Ala6HB#-Gla7HG 1.467 3.747 2000143 Gla7HB#-HG 2.288 3.740 1854682 Gla7HB#-HG 2.288 3.835 1250643 ?-Gla7HN 3.832 8.098 1539175 ?-Gla7HN 8.309 8.098 8024707 Gla3HA-Gla7HN 4.419 8.097 368449 Gla4HA-Gla7HN 3.948 8.098 616353 Gla4HB1-Gla7HN 2.463 8.098 758669 Leu5HB2-Gla7HN 1.544 8.098 801603 Ala6HB#-Gla7HN 1.476 8.099 1583924 Gla7HN-Ala6HN 8.098 7.922 2745363 Ala6HN-Gla7HN 7.924 8.100 1470411 Gla7HA-HN 4.128 8.098 2600008 Gla7HB#-HN 2.289 8.098 3761006 Gla7HG-HN 3.738 8.098 2399636 Gla7HN-Lys8HN 8.098 7.385 678353 Lys8HN-Gla7HN 7.386 8.099 1113924 Ala9HN-Gla7HN 7.686 8.099 504085 Lys8HB1-HA 1.646 4.333 2002640 Lys8HD1-HA 1.716 4.333 1874310 Lys8HG1-HA 1.555 4.333 1121991 Lys8HG2-HA 1.447 4.333 1429221 Phe12HE#-Lys8HB1 7.378 1.648 1216480 Phe12HZ-Lys8HB1 7.298 1.644 789499 Phe12HZ-Lys8HG2 7.298 1.464 747971 Ala6HA-Lys8HN 4.113 7.381 610267 Gla7HB#-Lys8HN 2.288 7.383 668023 Lys8HA-HN 4.335 7.380 666373 ?-Ala9HN 4.445 7.656 617796 Lys8HA-Ala9HN 4.335 7.658 313150 Lys8HG1-Ala9HN 1.555 7.657 1546095 Lys8HN-Ala9HN 7.388 7.743 4330811 Ala9HA-HN 4.161 7.661 800851 Pro10HD1-Ala9HN 3.774 7.660 452638 Lys8HG2-Pro10HA 1.471 4.415 2508245 Ala9HA-Pro10HA 4.154 4.415 5203123 Pro10HB2-HA 1.908 4.414 1778803 Pro10HG2-HA 2.005 4.415 1698141 Pro10HB1-HB2 2.388 1.916 9876989 Lys8HG1-Pro10HD1 1.555 3.773 2352891 Pro10HB1-HD1 2.390 3.773 718336 Pro10HG1-HD1 2.140 3.771 1455619 Pro10HG2-HD1 2.010 3.772 2612517 Lys8HG1-Pro10HD2 1.555 3.684 1285743 Pro10HG2-HD2 2.011 3.682 2266948 Gla11HB1-HG 2.170 3.643 1801315 Gla11HB2-HG 2.012 3.623 2672577 Pro10HA-Gla11HN 4.419 7.974 360628 Pro10HB1-Gla11HN 2.390 7.975 363107 Pro10HB2-Gla11HN 1.919 7.973 636312 Pro10HD2-Gla11HN 3.685 7.973 518855 Gla11HA-HN 4.570 7.975 743656 Gla11HB1-HN 2.164 7.973 1239190 Gla11HB2-HN 2.013 7.973 1696015 Gla15HN-Gla11HN 8.351 7.975 1015219 Phe12HB#-HA 3.187 4.472 1516589 ?-Phe12HD# 2.471 7.365 441891 Lys8HE#-Phe12HD# 2.895 7.301 468773 Lys8HG2-Phe12HD# 1.461 7.301 663183 Phe12HA-HD# 4.468 7.301 2767703 Phe12HB#-HD# 3.188 7.301 3490367 Phe12HN-HD# 8.243 7.302 611203 ?-Phe12HE# 4.458 7.367 1171998 Phe12HE#-Lys8HD1 7.379 1.709 1144895 Lys8HD1-Phe12HE# 1.713 7.372 1344628 Lys8HD2-Phe12HE# 1.644 7.369 1320870 Lys8HE#-Phe12HE# 2.896 7.368 307805 Phe12HE#-Lys8HG1 7.377 1.556 1695566 Lys8HG1-Phe12HE# 1.555 7.369 1295031 Phe12HE#-Lys8HG2 7.380 1.465 1154348 Lys8HG2-Phe12HE# 1.456 7.372 764651 Phe12HB#-HE# 3.188 7.366 1202205 ?-Phe12HN 2.438 8.250 1236193 ?-Phe12HN 4.221 8.248 458476 ?-Phe12HN 4.005 8.251 660317 ?-Phe12HN 8.781 8.247 793481 Lys8HA-Phe12HN 4.334 8.247 327284 Lys8HB1-Phe12HN 1.647 8.245 385519 Lys8HG1-Phe12HN 1.557 8.247 439998 Pro10HB2-Phe12HN 1.918 8.248 700706 Pro10HD2-Phe12HN 3.689 8.250 1362114 Ala11HA-Phe12HN 4.567 8.247 699182 Gla11HB1-Phe12HN 2.176 8.248 837261 Gla11HB2-Phe12HN 2.016 8.247 1440716 Phe12HN-Gla11HN 8.247 7.973 1942881 Gla11HN-Phe12HN 7.974 8.247 1713977 Phe12HA-HN 4.470 8.247 2134818 Phe12HB#-HN 3.187 8.247 4515833 Phe12HB#-HN 3.187 8.247 4515833 Phe12HZ-HN 7.302 8.247 560856 Ala13HB#-Phe12HN 1.466 8.247 659342 Phe12HN-Ala13HN 8.247 7.787 1584915 Ala13HN-Phe12HN 7.790 8.248 2052489 ?-Phe12HZ 2.468 7.299 650908 Phe12HZ-Lys8HD1 7.298 1.706 532621 Lys8HD1-Phe12HZ 1.710 7.300 931011 Lys8HD2-Phe12HZ 1.640 7.300 1193825 Phe12HZ-Lys8HG1 7.293 1.556 1436346 Lys8HG1-Phe12HZ 1.558 7.299 1181494 Ala13HA-Phe12HZ 4.047 7.301 518361 Ala13HB#-HA 1.466 4.042 3372033 ?-Ala13HN 3.747 7.787 538858 Phe12HB#-Ala13HN 3.189 7.785 1048532 Ala13HA-HN 4.043 7.784 1665752 Ala13HB#-HN 1.465 7.787 2841008 Arg14HB2-HA 1.916 3.907 2851364 Arg14HG1-HA 1.689 3.910 1461637 Arg14HG2-HA 1.434 3.908 2716881 Arg14HD#-HB1 3.009 1.914 1419450 ?-Arg14HB2 3.361 1.915 1043712 Arg14HG1-HB2 1.687 1.914 3592440 Arg14HB2-HG2 1.913 1.445 3323362 Arg14HG2-HB2 1.450 1.916 3213626 ?-Arg14HG1 3.363 1.685 1516791 Arg14HD#-HG1 3.009 1.681 1273220 ?-Arg14HG2 3.363 1.440 1430861 Arg14HD#-HG2 3.009 1.447 1000238 Arg14HG1-HG2 1.672 1.458 11618050 ?-Arg14HN 3.798 7.839 639600 Gla11HA-Arg14HN 4.569 7.840 1008433 Phe12HE#-Arg14HN 7.377 7.840 4096088 Ala13HA-Arg14HN 4.039 7.839 732248 Arg14HA-HN 3.913 7.839 1691180 Arg14HB2-HN 1.917 7.840 4352010 Arg14HG1-HN 1.684 7.838 908171 Arg14HG2-HN 1.462 7.839 2484754 Gla15HN-Arg14HN 8.358 7.840 1668615 Gla15HB1-HA 2.475 4.028 1374095 Gla15HB2-HA 2.223 4.011 2054782 Gla15HG-HA 3.748 4.041 7501443 Gla11HA-Gla15HN 4.572 8.360 356426 Phe12HA-Gla15HN 4.474 8.360 588566 Arg14HA-Gla15HN 3.911 8.359 624428 Arg14HB2-Gla15HN 1.923 8.359 1989136 Arg14HD#-Gla15HN 3.009 8.484 291120 Arg14HG2-Gla15HN 1.454 8.359 472014 Gla15HA-HN 4.022 8.359 1727666 Gla15HB1-HN 2.476 8.359 2183801 Gla15HB2-HN 2.231 8.358 1082098 Gla15HG-HN 3.715 8.359 3532916 Gla15HN-Leu16HN 8.363 7.810 1585986 Leu16HN-Gla15HN 7.828 8.359 2142805 Leu16HB1-HA 1.654 4.053 1762843 Leu16HD1#-HA 0.807 4.054 1695608 Phe12HN-Leu16HN 8.248 7.809 1184405 Gla15HB1-Leu16HN 2.475 7.809 1149024 Gla15HB2-Leu16HN 2.229 7.809 646217 Gla15HG-Leu16HN 3.736 7.808 539994 Leu16HA-HN 4.051 7.808 1753277 Leu16HB1-HN 1.659 7.809 2003234 Leu16HB2-HN 1.546 7.809 1509063 Leu16HD1#-HN 0.804 7.810 354753 Leu16HN-Asn18HD21 7.813 7.594 4133557 Asn18HD21-Leu16HN 7.595 7.815 1643372 Asn18HD22-Leu16HN 6.830 7.816 1355479 Ala17HB#-HA 1.420 4.160 4819017 Arg14HA-Ala17HN 3.911 7.684 697417 Leu16HA-Ala17HN 4.049 7.684 852299 Leu16HB1-Ala17HN 1.658 7.684 909759 Leu16HB2-Ala17HN 1.549 7.683 1261363 Ala17HA-HN 4.167 7.683 1533451 Ala17HB#-HN 1.424 7.685 5288271 Asn18HB1-HD21 2.757 7.594 421811 Asn18HB2-HD21 2.654 7.594 849593 Asn18HD21-HD22 7.593 6.826 17320728 Asn18HD22-HD21 6.826 7.592 16264878 Asn18HB1-HD22 2.754 6.828 323094 Asn18HB2-HD22 2.657 6.828 634117 Tyr19HE#-Asn18HD22 7.191 6.843 12528806 Gla15HA-Asn18HN 4.035 7.744 905143 Ala17HA-Asn18HN 4.167 7.742 624635 Ala17HB#-Asn18HN 1.423 7.742 1471407 Asn18HA-HN 4.628 7.742 1598292 Asn18HB1-HN 2.757 7.742 800891 Asn18HB2-HN 2.655 7.741 1811035 Asn18HB2-Tyr19H1 2.654 7.388 361958 Tyr19HA-H1 4.449 7.397 930957 Tyr19H1-H2 7.054 7.397 9354626 Tyr19H1-H2 7.396 7.054 8901744 Tyr19HE#-H2 7.194 6.973 5225779 Tyr19HN-H2 7.776 7.052 322369 Leu16HB2-Tyr19HA 1.555 4.450 1781700 Ala13HB#-Tyr19HE# 1.469 7.195 413995 Leu16HA-Tyr19HE# 4.059 7.193 1725317 Leu16HB1-Tyr19HE# 1.555 7.194 800094 Tyr19HA-HE# 4.450 7.193 1210485 Tyr19HB1-HE# 3.122 7.193 2205585 Tyr19HB2-HE# 3.055 7.192 2070038 Tyr19HB2-HE# 2.946 7.193 1125458 Asn18HA-Tyr19HN 4.627 7.776 946861 Asn18HB1-Tyr19HN 2.756 7.778 476077 Asn18HB2-Tyr19HN 2.651 7.779 571123 Tyr19H1-HN 7.392 7.779 1470723 Tyr19HA-HN 4.452 7.780 1949654 Tyr19HB1-HN 3.123 7.778 1581554 Tyr19HB2-HN 3.055 7.777 1978460 Tyr19HB2-HN 2.949 7.778 809904 Tyr19HN-HE# 7.780 7.193 1032391 Tyr19HE#-HN 7.194 7.778 805568 ; 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' 20 ppm . . . 4.76 . . 30176 1 stop_ save_