data_nef_c18115_2lmg save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 536 GLY start . false 2 A 537 SER middle . . 3 A 538 ALA middle . . 4 A 539 LYS middle . . 5 A 540 ASN middle . . 6 A 541 ALA middle . . 7 A 542 LEU middle . . 8 A 543 GLU middle . . 9 A 544 SER middle . . 10 A 545 TYR middle . . 11 A 546 ALA middle . . 12 A 547 PHE middle . . 13 A 548 ASN middle . . 14 A 549 MET middle . . 15 A 550 LYS middle . . 16 A 551 SER middle . . 17 A 552 ALA middle . . 18 A 553 VAL middle . . 19 A 554 GLU middle . . 20 A 555 ASP middle . . 21 A 556 GLU middle . . 22 A 557 GLY middle . false 23 A 558 LEU middle . . 24 A 559 LYS middle . . 25 A 560 GLY middle . false 26 A 561 LYS middle . . 27 A 562 ILE middle . . 28 A 563 SER middle . . 29 A 564 GLU middle . . 30 A 565 ALA middle . . 31 A 566 ASP middle . . 32 A 567 LYS middle . . 33 A 568 LYS middle . . 34 A 569 LYS middle . . 35 A 570 VAL middle . . 36 A 571 LEU middle . . 37 A 572 ASP middle . . 38 A 573 LYS middle . . 39 A 574 CYS middle . . 40 A 575 GLN middle . . 41 A 576 GLU middle . . 42 A 577 VAL middle . . 43 A 578 ILE middle . . 44 A 579 SER middle . . 45 A 580 TRP middle . . 46 A 581 LEU middle . . 47 A 582 ASP middle . . 48 A 583 ALA middle . . 49 A 584 ASN middle . . 50 A 585 THR middle . . 51 A 586 LEU middle . . 52 A 587 ALA middle . . 53 A 588 GLU middle . . 54 A 589 LYS middle . . 55 A 590 ASP middle . . 56 A 591 GLU middle . . 57 A 592 PHE middle . . 58 A 593 GLU middle . . 59 A 594 HIS middle . . 60 A 595 LYS middle . . 61 A 596 ARG middle . . 62 A 597 LYS middle . . 63 A 598 GLU middle . . 64 A 599 LEU middle . . 65 A 600 GLU middle . . 66 A 601 GLN middle . . 67 A 602 VAL middle . . 68 A 603 CYS middle . . 69 A 604 ASN middle . . 70 A 605 PRO middle . false 71 A 606 ILE middle . . 72 A 607 ILE middle . . 73 A 608 SER middle . . 74 A 609 GLY middle . false 75 A 610 LEU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 537 SER HA H 1 4.401 0.012 A 537 SER HBy H 1 4.034 0.010 A 537 SER HBx H 1 3.831 0.007 A 537 SER C C 13 175.450 0.000 A 537 SER CA C 13 58.387 0.103 A 537 SER CB C 13 64.163 0.147 A 538 ALA H H 1 8.781 0.004 A 538 ALA HA H 1 4.107 0.008 A 538 ALA HB% H 1 1.347 0.012 A 538 ALA C C 13 179.658 0.000 A 538 ALA CA C 13 54.791 0.056 A 538 ALA CB C 13 18.607 0.103 A 538 ALA N N 15 127.340 0.042 A 539 LYS H H 1 8.006 0.005 A 539 LYS HA H 1 3.265 0.010 A 539 LYS HBy H 1 1.327 0.010 A 539 LYS HBx H 1 1.145 0.008 A 539 LYS HDy H 1 1.572 0.007 A 539 LYS HDx H 1 1.520 0.003 A 539 LYS HEy H 1 2.878 0.007 A 539 LYS HEx H 1 2.813 0.007 A 539 LYS HGy H 1 1.154 0.005 A 539 LYS HGx H 1 1.069 0.012 A 539 LYS C C 13 177.428 0.000 A 539 LYS CA C 13 59.741 0.082 A 539 LYS CB C 13 32.242 0.085 A 539 LYS CD C 13 29.585 0.000 A 539 LYS CE C 13 42.263 0.030 A 539 LYS CG C 13 24.981 0.074 A 539 LYS N N 15 120.439 0.056 A 540 ASN H H 1 7.789 0.004 A 540 ASN HA H 1 4.381 0.009 A 540 ASN HBx H 1 2.735 0.012 A 540 ASN HD2y H 1 7.730 0.006 A 540 ASN HD2x H 1 6.871 0.006 A 540 ASN C C 13 177.598 0.000 A 540 ASN CA C 13 55.758 0.071 A 540 ASN CB C 13 38.286 0.037 A 540 ASN N N 15 117.109 0.065 A 540 ASN ND2 N 15 111.787 0.060 A 541 ALA H H 1 8.209 0.006 A 541 ALA HA H 1 4.104 0.010 A 541 ALA HB% H 1 1.401 0.009 A 541 ALA C C 13 180.393 0.000 A 541 ALA CA C 13 55.036 0.054 A 541 ALA CB C 13 18.155 0.053 A 541 ALA N N 15 122.489 0.026 A 542 LEU H H 1 7.775 0.006 A 542 LEU HA H 1 4.193 0.009 A 542 LEU HBy H 1 2.135 0.007 A 542 LEU HBx H 1 1.664 0.010 A 542 LEU HDx% H 1 1.585 0.011 A 542 LEU HDy% H 1 1.007 0.014 A 542 LEU HG H 1 1.279 0.009 A 542 LEU C C 13 177.015 0.000 A 542 LEU CA C 13 57.955 0.066 A 542 LEU CB C 13 41.223 0.073 A 542 LEU CDy C 13 27.803 0.151 A 542 LEU CDx C 13 22.547 0.095 A 542 LEU CG C 13 27.571 0.073 A 542 LEU N N 15 120.603 0.083 A 543 GLU H H 1 8.418 0.006 A 543 GLU HA H 1 3.555 0.011 A 543 GLU HBx H 1 2.056 0.008 A 543 GLU HGy H 1 2.116 0.005 A 543 GLU HGx H 1 2.043 0.012 A 543 GLU C C 13 177.949 0.000 A 543 GLU CA C 13 60.312 0.083 A 543 GLU CB C 13 30.425 0.107 A 543 GLU CG C 13 37.173 0.060 A 543 GLU N N 15 119.550 0.026 A 544 SER H H 1 8.313 0.005 A 544 SER HA H 1 4.192 0.014 A 544 SER HBx H 1 3.898 0.009 A 544 SER C C 13 176.285 0.000 A 544 SER CA C 13 61.890 0.273 A 544 SER CB C 13 63.000 0.162 A 544 SER N N 15 112.181 0.010 A 545 TYR H H 1 7.811 0.005 A 545 TYR HA H 1 4.389 0.009 A 545 TYR HBy H 1 3.292 0.009 A 545 TYR HBx H 1 2.990 0.005 A 545 TYR HDx H 1 7.037 0.005 A 545 TYR HEx H 1 6.609 0.004 A 545 TYR C C 13 177.193 0.000 A 545 TYR CA C 13 61.342 0.027 A 545 TYR CB C 13 38.887 0.073 A 545 TYR N N 15 122.309 0.042 A 546 ALA H H 1 8.456 0.007 A 546 ALA HA H 1 3.789 0.010 A 546 ALA HB% H 1 1.252 0.012 A 546 ALA C C 13 179.480 0.000 A 546 ALA CA C 13 55.688 0.088 A 546 ALA CB C 13 17.626 0.084 A 546 ALA N N 15 120.404 0.084 A 547 PHE H H 1 8.430 0.005 A 547 PHE HA H 1 4.145 0.015 A 547 PHE HBx H 1 3.137 0.005 A 547 PHE HDx H 1 7.280 0.011 A 547 PHE HEx H 1 7.260 0.007 A 547 PHE C C 13 179.133 0.000 A 547 PHE CA C 13 61.413 0.070 A 547 PHE CB C 13 38.280 0.097 A 547 PHE N N 15 116.158 0.013 A 548 ASN H H 1 8.654 0.006 A 548 ASN HA H 1 4.419 0.012 A 548 ASN HBy H 1 2.992 0.008 A 548 ASN HBx H 1 2.693 0.011 A 548 ASN HD2y H 1 7.507 0.006 A 548 ASN HD2x H 1 6.894 0.003 A 548 ASN C C 13 178.326 0.000 A 548 ASN CA C 13 55.952 0.144 A 548 ASN CB C 13 37.954 0.139 A 548 ASN N N 15 120.231 0.014 A 548 ASN ND2 N 15 111.605 0.026 A 549 MET H H 1 8.331 0.005 A 549 MET HA H 1 4.278 0.007 A 549 MET HBy H 1 1.873 0.007 A 549 MET HBx H 1 1.534 0.008 A 549 MET HE% H 1 1.775 0.014 A 549 MET HGy H 1 2.083 0.007 A 549 MET HGx H 1 1.911 0.009 A 549 MET C C 13 176.929 0.000 A 549 MET CA C 13 57.182 0.075 A 549 MET CB C 13 32.998 0.096 A 549 MET CE C 13 18.728 0.031 A 549 MET CG C 13 33.148 0.074 A 549 MET N N 15 121.990 0.040 A 550 LYS H H 1 7.731 0.005 A 550 LYS HA H 1 3.715 0.013 A 550 LYS HBy H 1 1.803 0.009 A 550 LYS HBx H 1 1.705 0.013 A 550 LYS HDx H 1 1.474 0.009 A 550 LYS HEx H 1 2.809 0.009 A 550 LYS HGy H 1 1.347 0.014 A 550 LYS HGx H 1 1.189 0.005 A 550 LYS C C 13 177.879 0.000 A 550 LYS CA C 13 59.971 0.100 A 550 LYS CB C 13 32.810 0.076 A 550 LYS CD C 13 30.102 0.070 A 550 LYS CE C 13 41.865 0.117 A 550 LYS CG C 13 24.962 0.011 A 550 LYS N N 15 119.946 0.052 A 551 SER H H 1 7.766 0.007 A 551 SER HA H 1 4.093 0.010 A 551 SER HBx H 1 3.824 0.006 A 551 SER C C 13 177.031 0.000 A 551 SER CA C 13 61.173 0.085 A 551 SER CB C 13 63.007 0.035 A 551 SER N N 15 111.477 0.011 A 552 ALA H H 1 8.089 0.005 A 552 ALA HA H 1 4.083 0.008 A 552 ALA HB% H 1 1.446 0.006 A 552 ALA C C 13 180.384 0.000 A 552 ALA CA C 13 55.288 0.123 A 552 ALA CB C 13 18.165 0.083 A 552 ALA N N 15 123.689 0.029 A 553 VAL H H 1 7.560 0.007 A 553 VAL HA H 1 4.016 0.009 A 553 VAL HB H 1 2.148 0.008 A 553 VAL HGx% H 1 0.920 0.005 A 553 VAL HGy% H 1 0.998 0.015 A 553 VAL C C 13 176.352 0.000 A 553 VAL CA C 13 63.758 0.056 A 553 VAL CB C 13 31.652 0.095 A 553 VAL CGy C 13 21.919 0.098 A 553 VAL CGx C 13 21.200 0.073 A 553 VAL N N 15 109.294 0.011 A 554 GLU H H 1 7.389 0.007 A 554 GLU HA H 1 4.215 0.013 A 554 GLU HBy H 1 2.058 0.009 A 554 GLU HBx H 1 1.910 0.012 A 554 GLU HGy H 1 2.496 0.006 A 554 GLU HGx H 1 2.057 0.008 A 554 GLU C C 13 176.794 0.000 A 554 GLU CA C 13 56.744 0.089 A 554 GLU CB C 13 30.159 0.086 A 554 GLU CG C 13 37.122 0.091 A 554 GLU N N 15 118.414 0.022 A 555 ASP H H 1 7.224 0.006 A 555 ASP HA H 1 4.367 0.011 A 555 ASP HBy H 1 2.747 0.010 A 555 ASP HBx H 1 2.675 0.011 A 555 ASP C C 13 178.171 0.000 A 555 ASP CA C 13 55.867 0.272 A 555 ASP CB C 13 42.874 0.074 A 555 ASP N N 15 120.735 0.029 A 556 GLU H H 1 9.007 0.005 A 556 GLU HA H 1 3.981 0.013 A 556 GLU HBx H 1 1.998 0.011 A 556 GLU HGx H 1 2.297 0.014 A 556 GLU C C 13 178.691 0.000 A 556 GLU CA C 13 59.144 0.114 A 556 GLU CB C 13 29.550 0.176 A 556 GLU CG C 13 36.276 0.161 A 556 GLU N N 15 126.927 0.021 A 557 GLY H H 1 9.031 0.005 A 557 GLY HAy H 1 3.913 0.005 A 557 GLY HAx H 1 3.767 0.009 A 557 GLY C C 13 175.344 0.000 A 557 GLY CA C 13 46.408 0.064 A 557 GLY N N 15 108.255 0.017 A 558 LEU H H 1 7.606 0.006 A 558 LEU HA H 1 4.346 0.007 A 558 LEU HBy H 1 1.751 0.012 A 558 LEU HBx H 1 1.649 0.004 A 558 LEU HDx% H 1 0.917 0.014 A 558 LEU HDy% H 1 0.816 0.008 A 558 LEU HG H 1 1.652 0.005 A 558 LEU C C 13 177.893 0.000 A 558 LEU CA C 13 54.920 0.059 A 558 LEU CB C 13 42.386 0.162 A 558 LEU CDy C 13 25.521 0.112 A 558 LEU CDx C 13 23.897 0.080 A 558 LEU CG C 13 27.402 0.089 A 558 LEU N N 15 119.463 0.022 A 559 LYS H H 1 7.572 0.006 A 559 LYS HA H 1 4.072 0.009 A 559 LYS HBx H 1 1.799 0.005 A 559 LYS HDx H 1 1.559 0.000 A 559 LYS HEx H 1 2.858 0.000 A 559 LYS HGy H 1 1.454 0.006 A 559 LYS HGx H 1 1.365 0.009 A 559 LYS C C 13 177.830 0.000 A 559 LYS CA C 13 58.477 0.073 A 559 LYS CB C 13 32.359 0.139 A 559 LYS CD C 13 29.267 0.150 A 559 LYS CE C 13 42.077 0.000 A 559 LYS CG C 13 25.262 0.124 A 559 LYS N N 15 120.994 0.047 A 560 GLY H H 1 8.770 0.005 A 560 GLY HAy H 1 4.056 0.005 A 560 GLY HAx H 1 3.827 0.008 A 560 GLY C C 13 174.451 0.000 A 560 GLY CA C 13 45.586 0.091 A 560 GLY N N 15 111.895 0.011 A 561 LYS H H 1 8.116 0.009 A 561 LYS HA H 1 4.336 0.008 A 561 LYS HBy H 1 1.909 0.007 A 561 LYS HBx H 1 1.692 0.007 A 561 LYS HDx H 1 1.651 0.004 A 561 LYS HEx H 1 2.919 0.013 A 561 LYS HGy H 1 1.361 0.012 A 561 LYS HGx H 1 1.292 0.006 A 561 LYS C C 13 175.860 0.000 A 561 LYS CA C 13 56.866 0.066 A 561 LYS CB C 13 34.201 0.101 A 561 LYS CD C 13 29.318 0.110 A 561 LYS CE C 13 42.433 0.143 A 561 LYS CG C 13 25.314 0.095 A 561 LYS N N 15 118.925 0.053 A 562 ILE H H 1 7.430 0.006 A 562 ILE HA H 1 4.498 0.008 A 562 ILE HB H 1 1.685 0.013 A 562 ILE HD1% H 1 0.703 0.007 A 562 ILE HG1y H 1 1.563 0.009 A 562 ILE HG1x H 1 1.277 0.010 A 562 ILE HG2% H 1 0.867 0.011 A 562 ILE C C 13 174.838 0.000 A 562 ILE CA C 13 59.388 0.041 A 562 ILE CB C 13 40.669 0.116 A 562 ILE CD1 C 13 14.443 0.054 A 562 ILE CG1 C 13 27.889 0.159 A 562 ILE CG2 C 13 16.937 0.065 A 562 ILE N N 15 116.463 0.028 A 563 SER H H 1 9.375 0.008 A 563 SER HA H 1 4.404 0.015 A 563 SER HBy H 1 4.254 0.007 A 563 SER HBx H 1 3.987 0.012 A 563 SER C C 13 174.870 0.000 A 563 SER CA C 13 57.432 0.044 A 563 SER CB C 13 64.793 0.049 A 563 SER N N 15 124.501 0.022 A 564 GLU H H 1 8.970 0.008 A 564 GLU HA H 1 3.900 0.011 A 564 GLU HBx H 1 1.989 0.008 A 564 GLU HGx H 1 2.303 0.010 A 564 GLU C C 13 179.396 0.000 A 564 GLU CA C 13 59.714 0.065 A 564 GLU CB C 13 29.218 0.202 A 564 GLU CG C 13 36.326 0.074 A 564 GLU N N 15 122.048 0.032 A 565 ALA H H 1 8.465 0.006 A 565 ALA HA H 1 4.046 0.014 A 565 ALA HB% H 1 1.321 0.006 A 565 ALA C C 13 180.524 0.000 A 565 ALA CA C 13 55.038 0.052 A 565 ALA CB C 13 18.463 0.094 A 565 ALA N N 15 120.829 0.030 A 566 ASP H H 1 7.835 0.005 A 566 ASP HA H 1 4.439 0.009 A 566 ASP HBy H 1 2.793 0.009 A 566 ASP HBx H 1 2.419 0.006 A 566 ASP C C 13 177.738 0.000 A 566 ASP CA C 13 57.306 0.090 A 566 ASP CB C 13 39.955 0.101 A 566 ASP N N 15 121.111 0.050 A 567 LYS H H 1 8.379 0.007 A 567 LYS HA H 1 3.593 0.010 A 567 LYS HBy H 1 1.866 0.011 A 567 LYS HBx H 1 1.675 0.011 A 567 LYS HDx H 1 1.621 0.013 A 567 LYS HEx H 1 2.796 0.010 A 567 LYS HGy H 1 1.251 0.015 A 567 LYS HGx H 1 1.211 0.010 A 567 LYS C C 13 177.700 0.000 A 567 LYS CA C 13 60.553 0.075 A 567 LYS CB C 13 32.596 0.106 A 567 LYS CD C 13 29.928 0.111 A 567 LYS CE C 13 41.945 0.064 A 567 LYS CG C 13 25.212 0.115 A 567 LYS N N 15 121.278 0.035 A 568 LYS H H 1 7.846 0.005 A 568 LYS HA H 1 3.839 0.016 A 568 LYS HBx H 1 1.815 0.005 A 568 LYS HDx H 1 1.644 0.004 A 568 LYS HEx H 1 2.891 0.000 A 568 LYS HGx H 1 1.399 0.005 A 568 LYS C C 13 177.391 0.000 A 568 LYS CA C 13 59.407 0.054 A 568 LYS CB C 13 32.481 0.138 A 568 LYS CD C 13 29.430 0.053 A 568 LYS CE C 13 42.445 0.000 A 568 LYS CG C 13 25.249 0.043 A 568 LYS N N 15 117.531 0.022 A 569 LYS H H 1 7.647 0.006 A 569 LYS HA H 1 3.999 0.009 A 569 LYS HBy H 1 1.971 0.010 A 569 LYS HBx H 1 1.792 0.008 A 569 LYS HDx H 1 1.685 0.005 A 569 LYS HEx H 1 2.901 0.005 A 569 LYS HGy H 1 1.564 0.012 A 569 LYS HGx H 1 1.294 0.008 A 569 LYS C C 13 180.064 0.000 A 569 LYS CA C 13 59.953 0.082 A 569 LYS CB C 13 32.854 0.133 A 569 LYS CD C 13 29.797 0.117 A 569 LYS CE C 13 42.254 0.189 A 569 LYS CG C 13 25.525 0.104 A 569 LYS N N 15 118.376 0.012 A 570 VAL H H 1 7.638 0.004 A 570 VAL HA H 1 3.474 0.008 A 570 VAL HB H 1 2.147 0.009 A 570 VAL HGx% H 1 1.008 0.011 A 570 VAL HGy% H 1 0.809 0.009 A 570 VAL C C 13 178.019 0.000 A 570 VAL CA C 13 66.952 0.082 A 570 VAL CB C 13 32.533 0.097 A 570 VAL CGy C 13 23.302 0.094 A 570 VAL CGx C 13 22.263 0.072 A 570 VAL N N 15 118.353 0.023 A 571 LEU H H 1 8.693 0.006 A 571 LEU HA H 1 3.790 0.014 A 571 LEU HBy H 1 1.844 0.011 A 571 LEU HBx H 1 1.422 0.009 A 571 LEU HDx% H 1 1.758 0.011 A 571 LEU HDy% H 1 0.807 0.008 A 571 LEU HG H 1 0.780 0.013 A 571 LEU C C 13 180.444 0.000 A 571 LEU CA C 13 58.913 0.071 A 571 LEU CB C 13 41.208 0.069 A 571 LEU CDy C 13 26.842 0.092 A 571 LEU CDx C 13 23.781 0.170 A 571 LEU CG C 13 25.854 0.092 A 571 LEU N N 15 120.671 0.024 A 572 ASP H H 1 9.265 0.005 A 572 ASP HA H 1 4.319 0.009 A 572 ASP HBy H 1 2.742 0.007 A 572 ASP HBx H 1 2.523 0.008 A 572 ASP C C 13 179.345 0.000 A 572 ASP CA C 13 57.283 0.089 A 572 ASP CB C 13 39.676 0.110 A 572 ASP N N 15 120.071 0.022 A 573 LYS H H 1 7.674 0.005 A 573 LYS HA H 1 4.260 0.012 A 573 LYS HBx H 1 1.945 0.009 A 573 LYS HDy H 1 1.919 0.008 A 573 LYS HDx H 1 1.592 0.009 A 573 LYS HEy H 1 2.647 0.010 A 573 LYS HEx H 1 2.459 0.010 A 573 LYS HGx H 1 1.373 0.010 A 573 LYS C C 13 178.856 0.000 A 573 LYS CA C 13 57.061 0.072 A 573 LYS CB C 13 30.986 0.093 A 573 LYS CD C 13 28.111 0.117 A 573 LYS CE C 13 42.139 0.082 A 573 LYS CG C 13 25.764 0.117 A 573 LYS N N 15 121.858 0.019 A 574 CYS H H 1 8.818 0.005 A 574 CYS HA H 1 3.863 0.008 A 574 CYS HBy H 1 3.071 0.008 A 574 CYS HBx H 1 2.393 0.006 A 574 CYS C C 13 176.479 0.000 A 574 CYS CA C 13 65.570 0.105 A 574 CYS CB C 13 26.680 0.067 A 574 CYS N N 15 117.635 0.022 A 575 GLN H H 1 8.203 0.007 A 575 GLN HA H 1 3.959 0.007 A 575 GLN HBy H 1 2.168 0.011 A 575 GLN HBx H 1 2.101 0.007 A 575 GLN HE2y H 1 7.434 0.007 A 575 GLN HE2x H 1 6.935 0.005 A 575 GLN HGx H 1 2.368 0.006 A 575 GLN C C 13 178.023 0.000 A 575 GLN CA C 13 58.669 0.100 A 575 GLN CB C 13 28.090 0.103 A 575 GLN CG C 13 33.881 0.198 A 575 GLN N N 15 118.089 0.019 A 575 GLN NE2 N 15 113.020 0.022 A 576 GLU H H 1 8.074 0.005 A 576 GLU HA H 1 3.992 0.011 A 576 GLU HBy H 1 2.334 0.008 A 576 GLU HBx H 1 2.202 0.006 A 576 GLU HGy H 1 2.398 0.010 A 576 GLU HGx H 1 2.061 0.005 A 576 GLU C C 13 179.586 0.000 A 576 GLU CA C 13 59.889 0.071 A 576 GLU CB C 13 30.013 0.113 A 576 GLU CG C 13 36.276 0.061 A 576 GLU N N 15 121.535 0.019 A 577 VAL H H 1 8.144 0.004 A 577 VAL HA H 1 3.711 0.007 A 577 VAL HB H 1 2.210 0.009 A 577 VAL HGx% H 1 1.044 0.015 A 577 VAL HGy% H 1 0.928 0.003 A 577 VAL C C 13 177.102 0.000 A 577 VAL CA C 13 67.120 0.099 A 577 VAL CB C 13 31.532 0.131 A 577 VAL CGy C 13 24.237 0.088 A 577 VAL CGx C 13 22.146 0.053 A 577 VAL N N 15 120.038 0.012 A 578 ILE H H 1 8.504 0.005 A 578 ILE HA H 1 3.697 0.007 A 578 ILE HB H 1 1.852 0.006 A 578 ILE HD1% H 1 0.453 0.006 A 578 ILE HG1y H 1 1.513 0.013 A 578 ILE HG1x H 1 0.977 0.011 A 578 ILE HG2% H 1 0.933 0.008 A 578 ILE C C 13 178.491 0.000 A 578 ILE CA C 13 65.618 0.084 A 578 ILE CB C 13 37.687 0.101 A 578 ILE CD1 C 13 12.537 0.042 A 578 ILE CG1 C 13 29.883 0.076 A 578 ILE CG2 C 13 17.506 0.048 A 578 ILE N N 15 122.306 0.021 A 579 SER H H 1 8.562 0.006 A 579 SER HA H 1 4.265 0.007 A 579 SER HBy H 1 3.986 0.005 A 579 SER HBx H 1 3.952 0.011 A 579 SER C C 13 177.129 0.000 A 579 SER CA C 13 62.208 0.038 A 579 SER CB C 13 62.906 0.074 A 579 SER N N 15 115.928 0.011 A 580 TRP H H 1 8.406 0.008 A 580 TRP HA H 1 4.041 0.010 A 580 TRP HBy H 1 3.678 0.005 A 580 TRP HBx H 1 3.335 0.006 A 580 TRP HD1 H 1 7.231 0.007 A 580 TRP HE1 H 1 10.173 0.000 A 580 TRP HE3 H 1 7.356 0.010 A 580 TRP HH2 H 1 6.074 0.002 A 580 TRP HZ2 H 1 7.156 0.003 A 580 TRP HZ3 H 1 6.760 0.006 A 580 TRP C C 13 179.278 0.000 A 580 TRP CA C 13 62.505 0.066 A 580 TRP CB C 13 28.518 0.062 A 580 TRP N N 15 124.917 0.020 A 580 TRP NE1 N 15 131.068 0.000 A 581 LEU H H 1 9.012 0.006 A 581 LEU HA H 1 3.656 0.010 A 581 LEU HBy H 1 2.184 0.008 A 581 LEU HBx H 1 1.675 0.011 A 581 LEU HDx% H 1 0.952 0.010 A 581 LEU HDy% H 1 1.190 0.006 A 581 LEU HG H 1 2.163 0.007 A 581 LEU C C 13 179.119 0.000 A 581 LEU CA C 13 58.434 0.095 A 581 LEU CB C 13 42.539 0.066 A 581 LEU CDy C 13 26.249 0.100 A 581 LEU CDx C 13 25.849 0.086 A 581 LEU CG C 13 27.481 0.162 A 581 LEU N N 15 122.211 0.028 A 582 ASP H H 1 7.665 0.007 A 582 ASP HA H 1 4.278 0.009 A 582 ASP HBy H 1 2.694 0.009 A 582 ASP HBx H 1 2.586 0.014 A 582 ASP C C 13 177.154 0.000 A 582 ASP CA C 13 56.794 0.071 A 582 ASP CB C 13 41.189 0.078 A 582 ASP N N 15 117.724 0.049 A 583 ALA H H 1 7.129 0.006 A 583 ALA HA H 1 4.288 0.007 A 583 ALA HB% H 1 1.246 0.010 A 583 ALA C C 13 177.776 0.000 A 583 ALA CA C 13 52.353 0.107 A 583 ALA CB C 13 19.893 0.063 A 583 ALA N N 15 118.604 0.020 A 584 ASN H H 1 7.284 0.010 A 584 ASN HA H 1 4.671 0.007 A 584 ASN HBy H 1 1.775 0.010 A 584 ASN HBx H 1 0.830 0.008 A 584 ASN C C 13 174.761 0.000 A 584 ASN CA C 13 52.848 0.131 A 584 ASN CB C 13 37.968 0.085 A 584 ASN N N 15 118.883 0.018 A 585 THR H H 1 7.615 0.006 A 585 THR HA H 1 3.967 0.007 A 585 THR HB H 1 4.082 0.008 A 585 THR HG2% H 1 1.210 0.005 A 585 THR C C 13 175.787 0.000 A 585 THR CA C 13 65.175 0.081 A 585 THR CB C 13 69.336 0.145 A 585 THR CG2 C 13 22.314 0.116 A 585 THR N N 15 112.258 0.022 A 586 LEU H H 1 8.254 0.005 A 586 LEU HA H 1 4.543 0.011 A 586 LEU HBy H 1 1.634 0.010 A 586 LEU HBx H 1 1.555 0.010 A 586 LEU HDx% H 1 1.485 0.014 A 586 LEU HDy% H 1 0.771 0.011 A 586 LEU HG H 1 0.819 0.010 A 586 LEU C C 13 176.635 0.000 A 586 LEU CA C 13 53.961 0.100 A 586 LEU CB C 13 41.072 0.124 A 586 LEU CDy C 13 26.652 0.212 A 586 LEU CDx C 13 22.946 0.080 A 586 LEU CG C 13 25.250 0.037 A 586 LEU N N 15 120.550 0.029 A 587 ALA H H 1 7.124 0.006 A 587 ALA HA H 1 4.076 0.006 A 587 ALA HB% H 1 1.001 0.013 A 587 ALA C C 13 176.356 0.000 A 587 ALA CA C 13 52.596 0.077 A 587 ALA CB C 13 19.431 0.063 A 587 ALA N N 15 123.048 0.019 A 588 GLU H H 1 8.429 0.005 A 588 GLU HA H 1 4.360 0.007 A 588 GLU HBy H 1 2.319 0.008 A 588 GLU HBx H 1 1.936 0.008 A 588 GLU HGx H 1 2.426 0.006 A 588 GLU C C 13 177.945 0.000 A 588 GLU CA C 13 55.737 0.097 A 588 GLU CB C 13 31.199 0.109 A 588 GLU CG C 13 36.750 0.134 A 588 GLU N N 15 118.471 0.022 A 589 LYS H H 1 8.763 0.005 A 589 LYS HA H 1 4.150 0.009 A 589 LYS HBy H 1 1.991 0.007 A 589 LYS HBx H 1 1.888 0.010 A 589 LYS HDx H 1 1.698 0.006 A 589 LYS HEy H 1 2.975 0.008 A 589 LYS HEx H 1 2.906 0.003 A 589 LYS HGy H 1 1.535 0.009 A 589 LYS HGx H 1 1.436 0.009 A 589 LYS C C 13 178.445 0.000 A 589 LYS CA C 13 60.707 0.070 A 589 LYS CB C 13 32.790 0.087 A 589 LYS CD C 13 29.780 0.054 A 589 LYS CE C 13 42.156 0.054 A 589 LYS CG C 13 24.667 0.057 A 589 LYS N N 15 121.635 0.020 A 590 ASP H H 1 8.814 0.005 A 590 ASP HA H 1 4.320 0.010 A 590 ASP HBx H 1 2.517 0.005 A 590 ASP C C 13 178.649 0.000 A 590 ASP CA C 13 57.012 0.085 A 590 ASP CB C 13 40.089 0.156 A 590 ASP N N 15 116.537 0.015 A 591 GLU H H 1 7.785 0.007 A 591 GLU HA H 1 4.065 0.011 A 591 GLU HBy H 1 2.202 0.006 A 591 GLU HBx H 1 2.080 0.006 A 591 GLU HGy H 1 2.311 0.005 A 591 GLU HGx H 1 2.210 0.004 A 591 GLU C C 13 179.582 0.000 A 591 GLU CA C 13 59.513 0.144 A 591 GLU CB C 13 29.813 0.122 A 591 GLU CG C 13 37.569 0.078 A 591 GLU N N 15 119.611 0.057 A 592 PHE H H 1 7.443 0.006 A 592 PHE HA H 1 4.225 0.009 A 592 PHE HBx H 1 3.123 0.011 A 592 PHE HDx H 1 7.332 0.007 A 592 PHE HEx H 1 7.343 0.008 A 592 PHE C C 13 178.436 0.000 A 592 PHE CA C 13 61.611 0.080 A 592 PHE CB C 13 38.834 0.075 A 592 PHE N N 15 117.509 0.036 A 593 GLU H H 1 7.952 0.008 A 593 GLU HA H 1 4.134 0.015 A 593 GLU HBy H 1 2.083 0.009 A 593 GLU HBx H 1 1.942 0.007 A 593 GLU HGx H 1 2.266 0.009 A 593 GLU C C 13 178.855 0.000 A 593 GLU CA C 13 58.984 0.046 A 593 GLU CB C 13 29.067 0.055 A 593 GLU CG C 13 36.139 0.097 A 593 GLU N N 15 118.501 0.025 A 594 HIS H H 1 8.126 0.007 A 594 HIS HA H 1 4.213 0.012 A 594 HIS HBx H 1 3.159 0.012 A 594 HIS HD2 H 1 6.973 0.008 A 594 HIS C C 13 177.856 0.000 A 594 HIS CA C 13 59.268 0.144 A 594 HIS CB C 13 29.037 0.222 A 594 HIS N N 15 118.563 0.078 A 595 LYS H H 1 7.733 0.005 A 595 LYS HA H 1 3.694 0.006 A 595 LYS HBy H 1 1.392 0.015 A 595 LYS HBx H 1 1.274 0.009 A 595 LYS HDy H 1 0.920 0.006 A 595 LYS HDx H 1 0.787 0.009 A 595 LYS HEy H 1 1.623 0.007 A 595 LYS HEx H 1 1.171 0.004 A 595 LYS HGy H 1 0.572 0.005 A 595 LYS HGx H 1 0.074 0.005 A 595 LYS C C 13 178.057 0.000 A 595 LYS CA C 13 57.147 0.037 A 595 LYS CB C 13 30.777 0.052 A 595 LYS CD C 13 26.938 0.060 A 595 LYS CE C 13 40.116 0.189 A 595 LYS CG C 13 23.221 0.053 A 595 LYS N N 15 119.034 0.065 A 596 ARG H H 1 8.167 0.006 A 596 ARG HA H 1 3.648 0.012 A 596 ARG HBy H 1 1.990 0.011 A 596 ARG HBx H 1 1.820 0.011 A 596 ARG HDy H 1 2.923 0.013 A 596 ARG HDx H 1 2.824 0.021 A 596 ARG HE H 1 7.474 0.005 A 596 ARG HGy H 1 1.369 0.006 A 596 ARG HGx H 1 1.195 0.007 A 596 ARG C C 13 177.921 0.000 A 596 ARG CA C 13 60.178 0.082 A 596 ARG CB C 13 29.805 0.195 A 596 ARG CD C 13 42.878 0.161 A 596 ARG CG C 13 27.632 0.079 A 596 ARG N N 15 120.071 0.023 A 597 LYS H H 1 7.948 0.004 A 597 LYS HA H 1 3.886 0.017 A 597 LYS HBx H 1 1.790 0.011 A 597 LYS HDx H 1 1.551 0.015 A 597 LYS HEx H 1 2.815 0.006 A 597 LYS HGx H 1 1.321 0.004 A 597 LYS C C 13 178.963 0.000 A 597 LYS CA C 13 59.237 0.102 A 597 LYS CB C 13 31.899 0.184 A 597 LYS CD C 13 29.074 0.146 A 597 LYS CE C 13 42.034 0.042 A 597 LYS CG C 13 25.237 0.030 A 597 LYS N N 15 118.731 0.065 A 598 GLU H H 1 7.794 0.005 A 598 GLU HA H 1 3.876 0.013 A 598 GLU HBy H 1 2.018 0.008 A 598 GLU HBx H 1 1.810 0.007 A 598 GLU HGy H 1 2.283 0.009 A 598 GLU HGx H 1 1.906 0.006 A 598 GLU C C 13 179.408 0.000 A 598 GLU CA C 13 59.385 0.107 A 598 GLU CB C 13 30.403 0.129 A 598 GLU CG C 13 36.367 0.055 A 598 GLU N N 15 118.881 0.069 A 599 LEU H H 1 7.800 0.007 A 599 LEU HA H 1 4.070 0.009 A 599 LEU HBy H 1 2.180 0.008 A 599 LEU HBx H 1 1.489 0.010 A 599 LEU HDx% H 1 1.708 0.012 A 599 LEU HDy% H 1 0.894 0.006 A 599 LEU HG H 1 0.880 0.009 A 599 LEU C C 13 178.814 0.000 A 599 LEU CA C 13 57.996 0.150 A 599 LEU CB C 13 42.020 0.095 A 599 LEU CDy C 13 27.396 0.082 A 599 LEU CDx C 13 25.085 0.115 A 599 LEU CG C 13 26.618 0.071 A 599 LEU N N 15 119.904 0.018 A 600 GLU H H 1 8.948 0.007 A 600 GLU HA H 1 4.166 0.012 A 600 GLU HBx H 1 2.090 0.011 A 600 GLU HGx H 1 2.236 0.009 A 600 GLU C C 13 178.550 0.000 A 600 GLU CA C 13 59.731 0.076 A 600 GLU CB C 13 30.269 0.146 A 600 GLU CG C 13 36.717 0.124 A 600 GLU N N 15 122.446 0.040 A 601 GLN H H 1 8.109 0.006 A 601 GLN HA H 1 3.951 0.011 A 601 GLN HBy H 1 2.135 0.005 A 601 GLN HBx H 1 2.058 0.006 A 601 GLN HE2y H 1 7.419 0.006 A 601 GLN HE2x H 1 6.800 0.005 A 601 GLN HGy H 1 2.486 0.007 A 601 GLN HGx H 1 2.368 0.012 A 601 GLN C C 13 178.277 0.000 A 601 GLN CA C 13 58.526 0.149 A 601 GLN CB C 13 28.622 0.185 A 601 GLN CG C 13 34.571 0.096 A 601 GLN N N 15 116.068 0.016 A 601 GLN NE2 N 15 111.747 0.007 A 602 VAL H H 1 7.171 0.006 A 602 VAL HA H 1 3.805 0.009 A 602 VAL HB H 1 2.142 0.006 A 602 VAL HGx% H 1 1.050 0.010 A 602 VAL HGy% H 1 0.843 0.009 A 602 VAL C C 13 177.423 0.000 A 602 VAL CA C 13 65.105 0.063 A 602 VAL CB C 13 33.177 0.097 A 602 VAL CGy C 13 23.083 0.100 A 602 VAL CGx C 13 21.439 0.136 A 602 VAL N N 15 116.121 0.021 A 603 CYS H H 1 8.138 0.006 A 603 CYS HA H 1 3.998 0.008 A 603 CYS HBy H 1 3.049 0.009 A 603 CYS HBx H 1 2.701 0.008 A 603 CYS C C 13 176.503 0.000 A 603 CYS CA C 13 63.325 0.097 A 603 CYS CB C 13 28.665 0.085 A 603 CYS N N 15 114.504 0.019 A 604 ASN H H 1 9.045 0.005 A 604 ASN HA H 1 4.574 0.010 A 604 ASN HBy H 1 2.947 0.012 A 604 ASN HBx H 1 2.736 0.005 A 604 ASN HD2y H 1 7.650 0.005 A 604 ASN HD2x H 1 6.993 0.006 A 604 ASN CA C 13 57.815 0.078 A 604 ASN CB C 13 35.815 0.081 A 604 ASN N N 15 119.915 0.018 A 604 ASN ND2 N 15 111.676 0.033 A 605 PRO HA H 1 4.271 0.007 A 605 PRO HBy H 1 2.291 0.007 A 605 PRO HBx H 1 1.699 0.006 A 605 PRO HDy H 1 3.522 0.007 A 605 PRO HDx H 1 3.427 0.011 A 605 PRO HGy H 1 2.003 0.012 A 605 PRO HGx H 1 1.907 0.009 A 605 PRO C C 13 177.471 0.000 A 605 PRO CA C 13 65.670 0.091 A 605 PRO CB C 13 31.588 0.066 A 605 PRO CD C 13 51.233 0.054 A 605 PRO CG C 13 28.558 0.101 A 606 ILE H H 1 6.851 0.007 A 606 ILE HA H 1 3.818 0.009 A 606 ILE HB H 1 1.686 0.009 A 606 ILE HD1% H 1 0.859 0.009 A 606 ILE HG1y H 1 1.572 0.007 A 606 ILE HG1x H 1 0.951 0.009 A 606 ILE HG2% H 1 0.796 0.008 A 606 ILE C C 13 177.032 0.000 A 606 ILE CA C 13 63.318 0.106 A 606 ILE CB C 13 39.624 0.126 A 606 ILE CD1 C 13 14.081 0.087 A 606 ILE CG1 C 13 29.509 0.056 A 606 ILE CG2 C 13 18.089 0.112 A 606 ILE N N 15 115.752 0.017 A 607 ILE H H 1 8.032 0.006 A 607 ILE HA H 1 4.006 0.008 A 607 ILE HB H 1 1.882 0.007 A 607 ILE HD1% H 1 0.741 0.012 A 607 ILE HG1y H 1 1.406 0.009 A 607 ILE HG1x H 1 1.233 0.008 A 607 ILE HG2% H 1 0.793 0.005 A 607 ILE C C 13 177.236 0.000 A 607 ILE CA C 13 61.726 0.083 A 607 ILE CB C 13 38.302 0.089 A 607 ILE CD1 C 13 12.970 0.057 A 607 ILE CG1 C 13 27.926 0.081 A 607 ILE CG2 C 13 18.075 0.048 A 607 ILE N N 15 116.042 0.031 A 608 SER H H 1 8.001 0.005 A 608 SER HA H 1 4.277 0.006 A 608 SER HBx H 1 3.824 0.011 A 608 SER C C 13 175.111 0.000 A 608 SER CA C 13 60.134 0.118 A 608 SER CB C 13 63.480 0.096 A 608 SER N N 15 115.855 0.024 A 609 GLY H H 1 7.924 0.004 A 609 GLY HAy H 1 3.982 0.006 A 609 GLY HAx H 1 3.784 0.011 A 609 GLY C C 13 173.508 0.000 A 609 GLY CA C 13 45.315 0.148 A 609 GLY N N 15 109.991 0.017 A 610 LEU H H 1 7.353 0.006 A 610 LEU HA H 1 4.087 0.009 A 610 LEU HBy H 1 1.600 0.007 A 610 LEU HBx H 1 1.456 0.008 A 610 LEU HDx% H 1 0.828 0.011 A 610 LEU HDy% H 1 0.764 0.011 A 610 LEU HG H 1 1.610 0.006 A 610 LEU CA C 13 56.615 0.050 A 610 LEU CB C 13 43.142 0.089 A 610 LEU CDy C 13 26.188 0.049 A 610 LEU CDx C 13 23.327 0.075 A 610 LEU CG C 13 27.237 0.020 A 610 LEU N N 15 126.041 0.019 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 570 VAL HA A 570 VAL HGx% 1.0 1.790 3.618 2 2 A 570 VAL HA A 570 VAL HGy% 1.0 1.624 2.908 3 3 A 570 VAL HA A 573 LYS HBy 1.0 1.798 3.658 4 4 A 570 VAL HA A 570 VAL HB 1.0 1.792 3.628 5 5 A 602 VAL HB A 602 VAL HA 1.0 1.745 3.399 6 6 A 569 LYS HBy A 566 ASP HA 1.0 1.781 3.569 7 7 A 566 ASP HA A 569 LYS HBx 1.0 1.961 4.913 8 8 A 593 GLU HBx A 590 ASP HA 1.0 1.808 3.714 9 9 A 590 ASP HA A 593 GLU HBy 1.0 1.261 1.877 10 10 A 593 GLU HBy A 593 GLU HA 1.0 1.651 3.007 11 11 A 593 GLU HA A 593 GLU HGy 1.0 1.726 3.310 12 12 A 593 GLU HBx A 593 GLU HA 1.0 1.756 3.452 13 13 A 591 GLU HGx A 591 GLU HA 1.0 1.819 3.775 14 14 A 591 GLU HA A 591 GLU HGy 1.0 1.837 3.877 15 15 A 591 GLU HA A 591 GLU HBy 1.0 1.609 2.851 16 16 A 543 GLU HBy A 540 ASN HA 1.0 1.751 3.427 17 17 A 579 SER HA A 582 ASP HBx 1.0 1.847 3.943 18 18 A 588 GLU HGy A 588 GLU HA 1.0 1.830 3.836 19 19 A 596 ARG HA A 599 LEU HBx 1.0 1.842 3.908 20 20 A 599 LEU HBx A 599 LEU HA 1.0 1.794 3.640 21 21 A 599 LEU HBx A 599 LEU HBy 1.0 1.601 2.825 22 22 A 599 LEU HG A 546 ALA HA 1.0 1.680 3.122 23 23 A 562 ILE HG1y A 562 ILE HA 1.0 1.835 3.867 24 24 A 542 LEU HG A 542 LEU HA 1.0 1.784 3.590 25 25 A 601 GLN HGx A 601 GLN HA 1.0 1.808 3.714 26 26 A 575 GLN HGy A 575 GLN HA 1.0 1.653 3.017 27 27 A 558 LEU HBx A 558 LEU HA 1.0 1.816 3.754 28 28 A 555 ASP HBy A 555 ASP HA 1.0 1.739 3.373 29 29 A 558 LEU HA A 558 LEU HG 1.0 1.843 3.919 30 30 A 558 LEU HA A 558 LEU HDy% 1.0 1.642 2.970 31 31 A 571 LEU HDy% A 571 LEU HA 1.0 1.605 2.841 32 32 A 558 LEU HA A 558 LEU HDx% 1.0 1.908 4.372 33 33 A 576 GLU HGy A 576 GLU HA 1.0 1.697 3.189 34 34 A 553 VAL HA A 553 VAL HB 1.0 1.660 3.042 35 35 A 603 CYS HA A 603 CYS HBy 1.0 1.720 3.288 36 36 A 603 CYS HA A 603 CYS HBx 1.0 1.773 3.529 37 37 A 603 CYS HA A 606 ILE HB 1.0 1.922 4.504 38 38 A 539 LYS HBy A 539 LYS HBx 1.0 1.481 2.445 39 39 A 539 LYS HGx A 539 LYS HA 1.0 1.805 3.701 40 40 A 586 LEU HA A 586 LEU HDy% 1.0 1.832 3.852 41 41 A 586 LEU HA A 586 LEU HG 1.0 1.957 4.865 42 42 A 562 ILE HA A 562 ILE HG1x 1.0 1.775 3.543 43 43 A 586 LEU HA A 586 LEU HDx% 1.0 1.936 4.630 44 44 A 586 LEU HA A 586 LEU HBy 1.0 1.633 2.943 45 45 A 586 LEU HA A 586 LEU HBx 1.0 1.714 3.262 46 46 A 571 LEU HA A 571 LEU HDx% 1.0 1.982 5.264 47 47 A 571 LEU HG A 550 LYS HEy 1.0 1.874 4.116 48 48 A 571 LEU HA A 571 LEU HBx 1.0 1.678 3.112 49 49 A 571 LEU HA A 571 LEU HBy 1.0 1.701 3.205 50 50 A 571 LEU HA A 574 CYS HBy 1.0 1.835 3.867 51 51 A 599 LEU HA A 599 LEU HDy% 1.0 1.599 2.821 52 52 A 567 LYS HBy A 567 LYS HA 1.0 1.671 3.083 53 53 A 549 MET HA A 552 ALA HB% 1.0 1.555 2.673 54 54 A 546 ALA HA A 549 MET HBx 1.0 1.825 3.805 55 55 A 546 ALA HA A 599 LEU HDy% 1.0 1.825 3.805 56 56 A 549 MET HA A 549 MET HBy 1.0 1.874 4.124 57 57 A 546 ALA HA A 549 MET HBy 1.0 1.973 5.097 58 58 A 549 MET HA A 549 MET HGx 1.0 1.956 4.858 59 59 A 549 MET HGx A 549 MET HGy 1.0 1.644 2.980 60 60 A 546 ALA HA A 549 MET HGx 1.0 1.848 3.946 61 61 A 549 MET HBx A 549 MET HBy 1.0 1.499 2.499 62 62 A 549 MET HBy A 549 MET HGx 1.0 1.722 3.294 63 63 A 561 LYS HGx A 561 LYS HA 1.0 1.847 3.939 64 64 A 561 LYS HGy A 561 LYS HEy 1.0 1.585 2.773 65 65 A 561 LYS HA A 561 LYS HBy 1.0 1.691 3.165 66 66 A 561 LYS HA A 561 LYS HGy 1.0 1.712 3.250 67 67 A 561 LYS HA A 561 LYS HBx 1.0 1.642 2.972 68 68 A 561 LYS HEy A 561 LYS HDy 1.0 1.483 2.449 69 69 A 572 ASP HA A 572 ASP HBx 1.0 1.675 3.101 70 70 A 590 ASP HA A 590 ASP HBy 1.0 1.553 2.667 71 71 A 572 ASP HA A 575 GLN HBy 1.0 1.569 2.715 72 72 A 572 ASP HA A 575 GLN HBx 1.0 1.902 4.326 73 73 A 575 GLN HGy A 572 ASP HA 1.0 1.939 4.659 74 74 A 576 GLU HBy A 573 LYS HA 1.0 1.874 4.116 75 75 A 576 GLU HA A 576 GLU HBx 1.0 1.638 2.956 76 76 A 556 GLU HA A 556 GLU HBy 1.0 1.611 2.859 77 77 A 567 LYS HGy A 567 LYS HEy 1.0 1.655 3.021 78 78 A 550 LYS HDy A 547 PHE HA 1.0 1.826 3.812 79 79 A 567 LYS HA A 567 LYS HDy 1.0 1.682 9.506 80 80 A 578 ILE HG1x A 578 ILE HA 1.0 1.756 3.452 81 81 A 550 LYS HA A 550 LYS HGy 1.0 1.899 4.309 82 82 A 550 LYS HEy A 550 LYS HGy 1.0 1.532 2.600 83 83 A 596 ARG HA A 596 ARG HBx 1.0 1.777 3.553 84 84 A 578 ILE HA A 578 ILE HG1y 1.0 1.783 3.585 85 85 A 559 LYS HA A 559 LYS HBy 1.0 1.483 2.449 86 86 A 539 LYS HA A 539 LYS HGy 1.0 1.788 3.606 87 87 A 599 LEU HBy A 577 VAL HGx% 1.0 1.772 3.524 88 88 A 542 LEU HG A 581 LEU HA 1.0 2.000 6.072 89 89 A 542 LEU HG A 592 PHE HBy 1.0 1.885 4.197 90 90 A 597 LYS HDy A 597 LYS HA 1.0 1.490 2.470 91 91 A 574 CYS HA A 599 LEU HDy% 1.0 1.747 3.407 92 92 A 597 LYS HA A 597 LYS HGy 1.0 1.763 3.487 93 93 A 573 LYS HBy A 573 LYS HGy 1.0 1.653 3.013 94 94 A 573 LYS HBy A 573 LYS HDy 1.0 1.847 3.939 95 95 A 610 LEU HA A 610 LEU HDy% 1.0 1.671 3.083 96 96 A 542 LEU HA A 542 LEU HDy% 1.0 1.647 2.993 97 97 A 603 CYS HA A 570 VAL HGx% 1.0 1.978 5.180 98 98 A 596 ARG HA A 542 LEU HDy% 1.0 1.646 2.990 99 99 A 577 VAL HGx% A 577 VAL HA 1.0 1.842 3.912 100 100 A 577 VAL HGx% A 577 VAL HB 1.0 1.512 2.536 101 101 A 581 LEU HA A 581 LEU HDx% 1.0 1.954 4.834 102 102 A 610 LEU HDx% A 607 ILE HA 1.0 1.788 3.606 103 103 A 567 LYS HEy A 567 LYS HBx 1.0 1.952 4.804 104 104 A 567 LYS HBy A 567 LYS HEy 1.0 1.886 4.206 105 105 A 567 LYS HEy A 567 LYS HDy 1.0 1.598 2.814 106 106 A 567 LYS HA A 567 LYS HBx 1.0 1.736 3.358 107 107 A 581 LEU HA A 581 LEU HDy% 1.0 1.662 3.048 108 108 A 599 LEU HBx A 599 LEU HDx% 1.0 1.733 3.345 109 109 A 599 LEU HA A 599 LEU HDx% 1.0 1.844 3.922 110 110 A 599 LEU HBy A 599 LEU HDx% 1.0 1.845 3.929 111 111 A 599 LEU HG A 599 LEU HDx% 1.0 1.686 3.146 112 112 A 581 LEU HDx% A 581 LEU HG 1.0 1.630 2.932 113 113 A 581 LEU HDx% A 539 LYS HEy 1.0 1.922 4.500 114 114 A 539 LYS HA A 581 LEU HDy% 1.0 1.928 4.556 115 115 A 581 LEU HDy% A 543 GLU HA 1.0 1.939 4.661 116 116 A 581 LEU HDy% A 539 LYS HEy 1.0 1.793 3.635 117 117 A 606 ILE HD1% A 606 ILE HA 1.0 1.874 8.132 118 118 A 569 LYS HBx A 606 ILE HD1% 1.0 1.719 9.275 119 119 A 606 ILE HD1% A 606 ILE HG1x 1.0 1.999 6.129 120 120 A 606 ILE HD1% A 569 LYS HGy 1.0 1.436 10.810 121 121 A 569 LYS HGx A 569 LYS HEy 1.0 1.874 4.122 122 122 A 569 LYS HGy A 569 LYS HGx 1.0 1.673 3.095 123 123 A 569 LYS HBx A 569 LYS HGx 1.0 1.783 3.585 124 124 A 566 ASP HA A 569 LYS HGx 1.0 1.950 4.778 125 125 A 542 LEU HA A 542 LEU HBx 1.0 1.776 3.548 126 126 A 566 ASP HA A 569 LYS HDy 1.0 1.767 3.505 127 127 A 569 LYS HBx A 569 LYS HDy 1.0 1.579 2.749 128 128 A 562 ILE HA A 562 ILE HD1% 1.0 1.905 4.349 129 129 A 553 VAL HA A 562 ILE HD1% 1.0 1.807 3.707 130 130 A 562 ILE HD1% A 566 ASP HBx 1.0 1.880 4.158 131 131 A 562 ILE HD1% A 566 ASP HBy 1.0 1.926 4.532 132 132 A 553 VAL HB A 562 ILE HD1% 1.0 1.834 3.856 133 133 A 562 ILE HG1y A 562 ILE HD1% 1.0 1.573 2.733 134 134 A 562 ILE HD1% A 562 ILE HG2% 1.0 1.503 2.509 135 135 A 607 ILE HA A 607 ILE HD1% 1.0 1.800 3.670 136 136 A 549 MET HA A 607 ILE HD1% 1.0 1.992 5.480 137 137 A 603 CYS HBy A 607 ILE HD1% 1.0 1.967 5.011 138 138 A 607 ILE HD1% A 606 ILE HG1y 1.0 1.749 3.415 139 139 A 606 ILE HG1x A 607 ILE HD1% 1.0 1.888 4.220 140 140 A 549 MET HGx A 607 ILE HD1% 1.0 1.956 4.862 141 141 A 547 PHE HA A 578 ILE HD1% 1.0 1.825 3.805 142 142 A 578 ILE HA A 578 ILE HD1% 1.0 1.908 4.376 143 143 A 578 ILE HD1% A 574 CYS HBx 1.0 1.910 4.388 144 144 A 575 GLN HGy A 578 ILE HD1% 1.0 1.931 4.591 145 145 A 578 ILE HD1% A 578 ILE HB 1.0 1.708 3.236 146 146 A 578 ILE HD1% A 550 LYS HBy 1.0 1.905 4.353 147 147 A 578 ILE HD1% A 546 ALA HB% 1.0 1.723 3.301 148 148 A 578 ILE HG1y A 578 ILE HD1% 1.0 1.670 3.080 149 149 A 578 ILE HD1% A 543 GLU HGy 1.0 1.959 4.893 150 150 A 550 LYS HEy A 578 ILE HD1% 1.0 1.933 4.603 151 151 A 585 THR HB A 585 THR HG2% 1.0 1.642 2.974 152 152 A 586 LEU HDx% A 585 THR HB 1.0 1.970 5.050 153 153 A 585 THR HB A 586 LEU HDy% 1.0 1.999 6.165 154 154 A 585 THR HB A 585 THR HA 1.0 1.723 3.297 155 155 A 577 VAL HA A 580 TRP HA 1.0 1.990 5.432 156 156 A 577 VAL HA A 580 TRP HBy 1.0 1.851 3.969 157 157 A 577 VAL HGx% A 577 VAL HA 1.0 1.782 3.574 158 158 A 577 VAL HA A 577 VAL HGy% 1.0 1.785 3.595 159 159 A 570 VAL HA A 599 LEU HA 1.0 1.999 5.809 160 160 A 574 CYS HA A 577 VAL HB 1.0 1.929 4.565 161 161 A 574 CYS HA A 546 ALA HB% 1.0 1.866 4.062 162 162 A 605 PRO HBy A 605 PRO HA 1.0 1.781 3.569 163 163 A 605 PRO HA A 605 PRO HGy 1.0 1.830 3.836 164 164 A 605 PRO HA A 605 PRO HDy 1.0 1.894 4.264 165 165 A 602 VAL HA A 602 VAL HGx% 1.0 1.884 4.192 166 166 A 563 SER HBy A 563 SER HA 1.0 1.596 2.810 167 167 A 585 THR HG2% A 585 THR HA 1.0 1.728 3.320 168 168 A 563 SER HBy A 563 SER HBx 1.0 1.523 2.571 169 169 A 563 SER HA A 563 SER HBx 1.0 1.700 3.202 170 170 A 537 SER HBy A 537 SER HBx 1.0 1.491 2.475 171 171 A 537 SER HBx A 537 SER HA 1.0 1.707 3.233 172 172 A 537 SER HBy A 537 SER HA 1.0 1.680 3.120 173 173 A 608 SER HBy A 608 SER HA 1.0 1.565 2.705 174 174 A 579 SER HA A 579 SER HBx 1.0 1.642 2.972 175 175 A 544 SER HBy A 544 SER HA 1.0 1.691 3.165 176 176 A 548 ASN HBx A 545 TYR HA 1.0 1.690 3.160 177 177 A 545 TYR HA A 548 ASN HBy 1.0 1.838 3.886 178 178 A 548 ASN HA A 551 SER HBy 1.0 1.886 4.202 179 179 A 579 SER HA A 579 SER HBy 1.0 1.901 4.321 180 180 A 551 SER HBy A 551 SER HA 1.0 1.570 2.722 181 181 A 537 SER HA A 540 ASN HBy 1.0 1.888 4.220 182 182 A 578 ILE HA A 581 LEU HBx 1.0 1.734 3.348 183 183 A 578 ILE HA A 581 LEU HBy 1.0 1.875 4.125 184 184 A 578 ILE HA A 546 ALA HB% 1.0 1.992 5.480 185 185 A 553 VAL HA A 553 VAL HGx% 1.0 1.431 2.301 186 186 A 553 VAL HA A 553 VAL HGy% 1.0 1.804 3.688 187 187 A 553 VAL HA A 552 ALA HB% 1.0 1.998 5.734 188 188 A 537 SER HBy A 540 ASN HBy 1.0 1.984 5.310 189 189 A 606 ILE HB A 606 ILE HA 1.0 1.740 3.376 190 190 A 606 ILE HA A 606 ILE HG1x 1.0 1.744 3.396 191 191 A 606 ILE HA A 607 ILE HB 1.0 1.996 5.620 192 192 A 606 ILE HA A 606 ILE HG2% 1.0 1.670 3.082 193 193 A 580 TRP HA A 580 TRP HBx 1.0 1.766 3.496 194 194 A 580 TRP HA A 580 TRP HBy 1.0 1.705 3.221 195 195 A 580 TRP HA A 583 ALA HB% 1.0 1.726 3.314 196 196 A 547 PHE HA A 547 PHE HBy 1.0 1.601 2.827 197 197 A 592 PHE HBy A 592 PHE HA 1.0 1.698 3.192 198 198 A 592 PHE HA A 592 PHE HDx 1.0 1.798 3.658 199 199 A 592 PHE HA A 587 ALA HB% 1.0 1.999 5.791 200 200 A 592 PHE HA A 595 LYS HBy 1.0 1.707 3.233 201 201 A 607 ILE HA A 607 ILE HG2% 1.0 1.659 3.039 202 202 A 607 ILE HA A 610 LEU HBx 1.0 1.804 3.688 203 203 A 607 ILE HA A 607 ILE HG1y 1.0 1.470 2.414 204 204 A 545 TYR HA A 545 TYR HBx 1.0 1.769 3.515 205 205 A 570 VAL HA A 603 CYS HA 1.0 1.987 5.363 206 206 A 603 CYS HA A 606 ILE HD1% 1.0 1.687 3.149 207 207 A 603 CYS HA A 606 ILE HG1y 1.0 1.731 3.333 208 208 A 547 PHE HA A 550 LYS HBx 1.0 1.834 3.860 209 209 A 547 PHE HA A 546 ALA HB% 1.0 1.939 4.657 210 210 A 579 SER HA A 582 ASP HBy 1.0 1.932 4.598 211 211 A 551 SER HA A 554 GLU HBx 1.0 1.818 3.768 212 212 A 551 SER HA A 554 GLU HBy 1.0 1.769 3.515 213 213 A 589 LYS HA A 589 LYS HDy 1.0 2.000 6.018 214 214 A 589 LYS HA A 538 ALA HB% 1.0 1.557 2.677 215 215 A 592 PHE HBy A 538 ALA HB% 1.0 1.716 3.268 216 216 A 603 CYS HBy A 600 GLU HA 1.0 1.943 4.705 217 217 A 562 ILE HA A 562 ILE HG2% 1.0 1.798 3.658 218 218 A 553 VAL HA A 562 ILE HG2% 1.0 1.881 4.167 219 219 A 566 ASP HBx A 562 ILE HG2% 1.0 1.853 3.981 220 220 A 566 ASP HBy A 562 ILE HG2% 1.0 1.984 5.310 221 221 A 553 VAL HB A 562 ILE HG2% 1.0 1.869 4.085 222 222 A 562 ILE HG1y A 562 ILE HG2% 1.0 1.691 3.163 223 223 A 578 ILE HA A 578 ILE HG2% 1.0 1.729 3.327 224 224 A 579 SER HA A 578 ILE HG2% 1.0 1.915 4.435 225 225 A 578 ILE HD1% A 578 ILE HG2% 1.0 1.832 3.844 226 226 A 581 LEU HBx A 578 ILE HG2% 1.0 1.949 4.769 227 227 A 578 ILE HG1x A 578 ILE HG2% 1.0 1.801 3.675 228 228 A 546 ALA HA A 546 ALA HB% 1.0 1.608 2.848 229 229 A 543 GLU HA A 546 ALA HB% 1.0 1.865 4.059 230 230 A 574 CYS HBx A 546 ALA HB% 1.0 1.791 3.623 231 231 A 574 CYS HBy A 546 ALA HB% 1.0 1.868 4.078 232 232 A 599 LEU HBx A 546 ALA HB% 1.0 1.994 5.544 233 233 A 578 ILE HB A 546 ALA HB% 1.0 1.984 5.304 234 234 A 543 GLU HGy A 546 ALA HB% 1.0 1.978 5.166 235 235 A 546 ALA HB% A 599 LEU HDy% 1.0 1.837 3.877 236 236 A 577 VAL HGx% A 546 ALA HB% 1.0 1.875 4.129 237 237 A 566 ASP HA A 606 ILE HG2% 1.0 1.830 3.836 238 238 A 605 PRO HA A 606 ILE HG2% 1.0 1.964 4.954 239 239 A 607 ILE HB A 607 ILE HG2% 1.0 1.632 2.938 240 240 A 606 ILE HB A 606 ILE HG2% 1.0 1.691 3.163 241 241 A 607 ILE HG2% A 607 ILE HG1x 1.0 1.765 3.491 242 242 A 607 ILE HG2% A 607 ILE HG1y 1.0 1.675 3.097 243 243 A 606 ILE HG1x A 606 ILE HG2% 1.0 1.910 4.390 244 244 A 607 ILE HG2% A 604 ASN HA 1.0 1.953 4.821 245 245 A 570 VAL HB A 606 ILE HG2% 1.0 1.870 4.086 246 246 A 541 ALA HB% A 541 ALA HA 1.0 1.467 2.405 247 247 A 552 ALA HB% A 552 ALA HA 1.0 1.627 2.917 248 248 A 555 ASP HBy A 552 ALA HB% 1.0 1.999 5.799 249 249 A 552 ALA HB% A 607 ILE HD1% 1.0 1.854 3.986 250 250 A 552 ALA HB% A 549 MET HE% 1.0 1.909 4.381 251 251 A 552 ALA HB% A 553 VAL HGx% 1.0 1.869 4.081 252 252 A 541 ALA HB% A 596 ARG HDx 1.0 1.920 4.480 253 253 A 541 ALA HB% A 596 ARG HDy 1.0 1.832 3.852 254 254 A 566 ASP HA A 565 ALA HB% 1.0 1.943 4.715 255 255 A 569 LYS HBy A 565 ALA HB% 1.0 1.918 4.462 256 256 A 538 ALA HA A 538 ALA HB% 1.0 1.663 3.055 257 257 A 593 GLU HGy A 538 ALA HB% 1.0 1.903 4.333 258 258 A 589 LYS HBx A 538 ALA HB% 1.0 1.878 4.150 259 259 A 591 GLU HBx A 587 ALA HB% 1.0 1.678 3.112 260 260 A 584 ASN HA A 587 ALA HB% 1.0 1.924 4.518 261 261 A 550 LYS HA A 553 VAL HGy% 1.0 1.774 3.534 262 262 A 567 LYS HEy A 553 VAL HGy% 1.0 1.851 3.969 263 263 A 553 VAL HB A 553 VAL HGy% 1.0 1.541 2.625 264 264 A 571 LEU HDx% A 553 VAL HGy% 1.0 1.669 3.077 265 265 A 571 LEU HDy% A 553 VAL HGy% 1.0 1.838 3.886 266 266 A 602 VAL HA A 602 VAL HGy% 1.0 1.816 3.754 267 267 A 603 CYS HA A 602 VAL HGy% 1.0 1.914 4.426 268 268 A 569 LYS HGy A 602 VAL HGy% 1.0 1.838 3.886 269 269 A 602 VAL HGy% A 573 LYS HEy 1.0 1.991 5.467 270 270 A 603 CYS HBy A 602 VAL HGy% 1.0 2.000 5.986 271 271 A 602 VAL HB A 602 VAL HGy% 1.0 1.592 2.796 272 272 A 570 VAL HA A 602 VAL HGy% 1.0 1.790 3.618 273 273 A 573 LYS HA A 602 VAL HGy% 1.0 2.000 6.072 274 274 A 566 ASP HBx A 553 VAL HGx% 1.0 1.967 5.011 275 275 A 566 ASP HBy A 553 VAL HGx% 1.0 1.936 4.630 276 276 A 542 LEU HDx% A 577 VAL HGy% 1.0 1.910 4.390 277 277 A 553 VAL HB A 553 VAL HGx% 1.0 1.658 3.032 278 278 A 546 ALA HB% A 577 VAL HGy% 1.0 1.835 3.869 279 279 A 585 THR HG2% A 539 LYS HEx 1.0 1.845 3.929 280 280 A 570 VAL HGy% A 549 MET HBx 1.0 1.726 3.314 281 281 A 570 VAL HGy% A 571 LEU HA 1.0 1.842 3.906 282 282 A 570 VAL HGy% A 599 LEU HDx% 1.0 1.951 4.789 283 283 A 570 VAL HGy% A 570 VAL HB 1.0 1.640 2.968 284 284 A 605 PRO HDx A 604 ASN HBx 1.0 1.832 3.844 285 285 A 605 PRO HBy A 605 PRO HDx 1.0 1.879 4.155 286 286 A 605 PRO HDx A 605 PRO HGx 1.0 1.738 3.366 287 287 A 605 PRO HGy A 605 PRO HDx 1.0 1.744 3.396 288 288 A 605 PRO HDy A 605 PRO HGx 1.0 1.714 3.262 289 289 A 605 PRO HGy A 605 PRO HDy 1.0 1.739 3.369 290 290 A 602 VAL HA A 605 PRO HDx 1.0 1.788 3.606 291 291 A 601 GLN HA A 605 PRO HDx 1.0 1.989 5.419 292 292 A 602 VAL HA A 605 PRO HDy 1.0 1.963 4.947 293 293 A 605 PRO HDx A 605 PRO HBx 1.0 1.897 4.291 294 294 A 605 PRO HDy A 605 PRO HBx 1.0 1.895 4.275 295 295 A 605 PRO HA A 605 PRO HDx 1.0 1.927 4.549 296 296 A 605 PRO HBy A 605 PRO HGx 1.0 1.644 2.980 297 297 A 605 PRO HBy A 605 PRO HGy 1.0 1.558 2.680 298 298 A 605 PRO HA A 605 PRO HGx 1.0 1.614 2.870 299 299 A 605 PRO HA A 605 PRO HBx 1.0 1.675 3.099 300 300 A 605 PRO HBy A 605 PRO HDy 1.0 1.890 4.228 301 301 A 606 ILE HA A 605 PRO HBx 1.0 1.900 4.310 302 302 A 605 PRO HBy A 605 PRO HBx 1.0 1.549 2.651 303 303 A 584 ASN HA A 584 ASN HBx 1.0 1.805 3.701 304 304 A 584 ASN HBx A 584 ASN HBy 1.0 1.516 2.546 305 305 A 584 ASN HBx A 587 ALA HB% 1.0 1.640 2.968 306 306 A 584 ASN HA A 584 ASN HBy 1.0 1.843 3.915 307 307 A 584 ASN HBy A 587 ALA HB% 1.0 1.826 3.812 308 308 A 604 ASN HA A 604 ASN HBx 1.0 1.811 3.727 309 309 A 604 ASN HA A 604 ASN HBy 1.0 1.771 3.519 310 310 A 605 PRO HDy A 604 ASN HBx 1.0 1.796 3.646 311 311 A 605 PRO HDy A 604 ASN HBy 1.0 1.801 3.675 312 312 A 605 PRO HDx A 604 ASN HBy 1.0 1.937 4.635 313 313 A 604 ASN HBx A 604 ASN HBy 1.0 1.511 2.535 314 314 A 594 HIS HA A 594 HIS HBy 1.0 1.633 2.943 315 315 A 585 THR HG2% A 586 LEU HDy% 1.0 1.986 5.346 316 316 A 566 ASP HA A 606 ILE HB 1.0 1.903 4.339 317 317 A 566 ASP HA A 606 ILE HD1% 1.0 1.970 5.038 318 318 A 566 ASP HA A 566 ASP HBy 1.0 1.781 3.569 319 319 A 566 ASP HA A 566 ASP HBx 1.0 1.779 3.559 320 320 A 566 ASP HBx A 566 ASP HBy 1.0 1.538 2.620 321 321 A 562 ILE HG1x A 566 ASP HBx 1.0 1.840 3.900 322 322 A 562 ILE HG1x A 566 ASP HBy 1.0 1.877 4.137 323 323 A 606 ILE HD1% A 566 ASP HBx 1.0 1.927 4.543 324 324 A 566 ASP HBx A 606 ILE HG2% 1.0 1.864 4.048 325 325 A 606 ILE HD1% A 566 ASP HBy 1.0 1.927 4.543 326 326 A 566 ASP HBy A 606 ILE HG2% 1.0 1.646 2.990 327 327 A 562 ILE HG1y A 566 ASP HBy 1.0 1.866 4.064 328 328 A 566 ASP HBy A 562 ILE HB 1.0 2.000 6.050 329 329 A 566 ASP HBx A 562 ILE HB 1.0 1.939 4.667 330 330 A 544 SER HBy A 547 PHE HBy 1.0 1.974 5.114 331 331 A 571 LEU HA A 574 CYS HBx 1.0 1.858 4.006 332 332 A 574 CYS HA A 574 CYS HBx 1.0 1.754 3.440 333 333 A 574 CYS HBy A 574 CYS HA 1.0 1.716 3.268 334 334 A 574 CYS HBy A 574 CYS HBx 1.0 1.542 2.630 335 335 A 574 CYS HBy A 578 ILE HD1% 1.0 1.922 4.492 336 336 A 570 VAL HGy% A 574 CYS HBx 1.0 1.970 5.038 337 337 A 574 CYS HBx A 550 LYS HBy 1.0 1.828 3.828 338 338 A 570 VAL HGy% A 574 CYS HBy 1.0 1.860 4.026 339 339 A 550 LYS HDy A 574 CYS HBx 1.0 1.890 4.238 340 340 A 603 CYS HBy A 603 CYS HBx 1.0 1.566 2.708 341 341 A 603 CYS HBx A 549 MET HE% 1.0 1.982 5.274 342 342 A 603 CYS HBy A 549 MET HE% 1.0 1.985 5.331 343 343 A 570 VAL HGy% A 603 CYS HBx 1.0 1.927 4.539 344 344 A 570 VAL HGy% A 603 CYS HBy 1.0 1.720 3.288 345 345 A 603 CYS HBx A 570 VAL HGx% 1.0 2.000 6.040 346 346 A 603 CYS HBy A 607 ILE HG1y 1.0 1.998 6.292 347 347 A 603 CYS HBy A 607 ILE HG1x 1.0 1.995 5.627 348 348 A 603 CYS HBx A 607 ILE HG1y 1.0 1.954 4.834 349 349 A 603 CYS HBx A 607 ILE HG1x 1.0 1.961 4.919 350 350 A 548 ASN HBx A 548 ASN HA 1.0 1.747 3.407 351 351 A 540 ASN HA A 540 ASN HBy 1.0 1.639 2.963 352 352 A 540 ASN HA A 539 LYS HBy 1.0 1.998 5.750 353 353 A 548 ASN HBx A 548 ASN HBy 1.0 1.491 2.473 354 354 A 548 ASN HBy A 551 SER HBx 1.0 1.990 5.432 355 355 A 548 ASN HBy A 548 ASN HA 1.0 1.819 3.775 356 356 A 592 PHE HBy A 589 LYS HA 1.0 1.802 3.682 357 357 A 593 GLU HBy A 590 ASP HBy 1.0 1.861 4.033 358 358 A 593 GLU HBx A 590 ASP HBy 1.0 1.961 4.919 359 359 A 590 ASP HA A 593 GLU HGy 1.0 1.669 3.073 360 360 A 587 ALA HA A 587 ALA HB% 1.0 1.588 2.782 361 361 A 583 ALA HB% A 583 ALA HA 1.0 1.548 2.650 362 362 A 580 TRP HBy A 580 TRP HBx 1.0 1.575 2.737 363 363 A 572 ASP HBx A 569 LYS HA 1.0 1.775 3.539 364 364 A 569 LYS HA A 572 ASP HBy 1.0 1.805 3.701 365 365 A 572 ASP HBx A 572 ASP HBy 1.0 1.492 2.474 366 366 A 565 ALA HB% A 565 ALA HA 1.0 1.481 2.445 367 367 A 565 ALA HA A 568 LYS HBy 1.0 1.727 3.317 368 368 A 544 SER HBy A 541 ALA HA 1.0 1.697 3.189 369 369 A 544 SER HBy A 541 ALA HB% 1.0 1.994 5.544 370 370 A 570 VAL HGy% A 549 MET HBy 1.0 1.935 4.621 371 371 A 542 LEU HA A 545 TYR HBx 1.0 1.853 3.975 372 372 A 542 LEU HA A 545 TYR HBy 1.0 1.720 3.288 373 373 A 545 TYR HA A 545 TYR HBy 1.0 1.679 3.117 374 374 A 545 TYR HBx A 545 TYR HBy 1.0 1.577 2.743 375 375 A 542 LEU HDy% A 545 TYR HBy 1.0 1.881 4.171 376 376 A 562 ILE HA A 562 ILE HD1% 1.0 1.926 4.530 377 377 A 562 ILE HA A 562 ILE HB 1.0 1.747 3.411 378 378 A 562 ILE HG1y A 562 ILE HB 1.0 1.627 2.921 379 379 A 562 ILE HG2% A 562 ILE HB 1.0 1.656 3.026 380 380 A 562 ILE HD1% A 562 ILE HB 1.0 1.708 3.236 381 381 A 562 ILE HG1x A 562 ILE HD1% 1.0 1.657 3.031 382 382 A 562 ILE HG1y A 562 ILE HG1x 1.0 1.441 2.331 383 383 A 562 ILE HG1x A 562 ILE HG2% 1.0 1.804 3.688 384 384 A 562 ILE HG1y A 566 ASP HBx 1.0 1.507 2.521 385 385 A 578 ILE HA A 578 ILE HB 1.0 1.784 3.590 386 386 A 575 GLN HA A 578 ILE HB 1.0 1.552 2.662 387 387 A 578 ILE HG1x A 578 ILE HB 1.0 1.698 3.192 388 388 A 578 ILE HB A 578 ILE HG2% 1.0 1.575 2.735 389 389 A 578 ILE HG1x A 578 ILE HD1% 1.0 1.623 2.905 390 390 A 578 ILE HG1y A 546 ALA HB% 1.0 1.843 3.915 391 391 A 578 ILE HG1y A 578 ILE HB 1.0 1.800 3.670 392 392 A 578 ILE HG1x A 578 ILE HG1y 1.0 1.390 2.194 393 393 A 606 ILE HB A 606 ILE HD1% 1.0 1.690 3.160 394 394 A 606 ILE HB A 606 ILE HG1y 1.0 1.662 3.050 395 395 A 606 ILE HA A 606 ILE HG1y 1.0 1.775 3.539 396 396 A 607 ILE HB A 604 ASN HA 1.0 1.939 4.665 397 397 A 607 ILE HA A 607 ILE HB 1.0 1.717 3.275 398 398 A 607 ILE HD1% A 607 ILE HB 1.0 1.832 3.852 399 399 A 542 LEU HA A 596 ARG HGy 1.0 1.998 5.718 400 400 A 607 ILE HA A 607 ILE HG1x 1.0 1.842 3.906 401 401 A 607 ILE HD1% A 607 ILE HG1x 1.0 1.615 2.875 402 402 A 607 ILE HG1y A 607 ILE HG1x 1.0 1.318 2.010 403 403 A 607 ILE HD1% A 607 ILE HG1y 1.0 1.519 2.559 404 404 A 607 ILE HB A 607 ILE HG1x 1.0 1.676 3.104 405 405 A 607 ILE HB A 607 ILE HG1y 1.0 1.725 3.307 406 406 A 602 VAL HB A 573 LYS HGy 1.0 1.775 3.539 407 407 A 602 VAL HB A 602 VAL HGx% 1.0 1.581 2.755 408 408 A 599 LEU HA A 602 VAL HGx% 1.0 1.804 3.688 409 409 A 602 VAL HGy% A 602 VAL HGx% 1.0 1.543 2.631 410 410 A 573 LYS HEy A 602 VAL HGx% 1.0 1.865 4.057 411 411 A 573 LYS HDy A 602 VAL HGx% 1.0 1.916 4.446 412 412 A 582 ASP HBy A 582 ASP HA 1.0 1.683 3.129 413 413 A 582 ASP HBx A 582 ASP HBy 1.0 1.531 2.595 414 414 A 583 ALA HB% A 582 ASP HBy 1.0 1.990 5.456 415 415 A 582 ASP HBy A 578 ILE HG2% 1.0 1.998 5.718 416 416 A 582 ASP HBx A 578 ILE HG2% 1.0 1.996 5.634 417 417 A 582 ASP HBx A 583 ALA HB% 1.0 1.939 4.657 418 418 A 582 ASP HBx A 582 ASP HA 1.0 1.673 3.093 419 419 A 577 VAL HA A 577 VAL HB 1.0 1.779 3.559 420 420 A 577 VAL HB A 577 VAL HGy% 1.0 1.627 2.919 421 421 A 577 VAL HB A 546 ALA HB% 1.0 1.977 5.153 422 422 A 574 CYS HA A 577 VAL HGx% 1.0 1.783 3.585 423 423 A 577 VAL HGx% A 595 LYS HGx 1.0 1.951 4.795 424 424 A 577 VAL HGx% A 595 LYS HGy 1.0 1.982 5.260 425 425 A 599 LEU HBy A 577 VAL HGx% 1.0 1.990 5.444 426 426 A 577 VAL HGy% A 595 LYS HGy 1.0 1.852 3.972 427 427 A 570 VAL HB A 567 LYS HA 1.0 1.937 4.645 428 428 A 570 VAL HB A 570 VAL HGx% 1.0 1.559 2.683 429 429 A 566 ASP HA A 570 VAL HGx% 1.0 1.970 5.042 430 430 A 570 VAL HGy% A 570 VAL HGx% 1.0 1.842 3.912 431 431 A 603 CYS HBy A 570 VAL HGx% 1.0 1.937 4.645 432 432 A 567 LYS HBy A 570 VAL HGx% 1.0 1.966 4.982 433 433 A 542 LEU HDy% A 542 LEU HDx% 1.0 1.522 2.568 434 434 A 570 VAL HGy% A 603 CYS HA 1.0 1.939 4.665 435 435 A 553 VAL HB A 567 LYS HGx 1.0 1.707 3.231 436 436 A 542 LEU HA A 542 LEU HBy 1.0 1.715 3.265 437 437 A 542 LEU HBx A 542 LEU HBy 1.0 1.546 2.642 438 438 A 542 LEU HG A 542 LEU HBx 1.0 1.706 3.228 439 439 A 542 LEU HDy% A 542 LEU HBy 1.0 1.847 3.939 440 440 A 542 LEU HG A 542 LEU HDy% 1.0 1.728 3.320 441 441 A 573 LYS HDy A 573 LYS HEy 1.0 1.771 3.519 442 442 A 573 LYS HDy A 573 LYS HDx 1.0 1.515 2.547 443 443 A 542 LEU HBx A 542 LEU HDx% 1.0 1.841 3.903 444 444 A 542 LEU HDy% A 542 LEU HBx 1.0 1.679 3.115 445 445 A 558 LEU HA A 558 LEU HBy 1.0 1.574 2.734 446 446 A 588 GLU HA A 588 GLU HBx 1.0 1.705 3.225 447 447 A 588 GLU HA A 588 GLU HBy 1.0 1.630 2.930 448 448 A 558 LEU HG A 561 LYS HEy 1.0 1.945 4.723 449 449 A 555 ASP HBy A 558 LEU HBy 1.0 1.972 5.082 450 450 A 558 LEU HG A 558 LEU HDy% 1.0 1.667 3.071 451 451 A 558 LEU HBx A 558 LEU HDx% 1.0 1.652 3.010 452 452 A 558 LEU HG A 558 LEU HDx% 1.0 1.653 3.013 453 453 A 573 LYS HEy A 599 LEU HDy% 1.0 1.882 4.170 454 454 A 558 LEU HDy% A 553 VAL HA 1.0 1.977 5.153 455 455 A 558 LEU HDy% A 558 LEU HBy 1.0 1.802 3.682 456 456 A 571 LEU HDy% A 571 LEU HBy 1.0 1.766 3.496 457 457 A 571 LEU HDy% A 550 LYS HEy 1.0 1.616 2.876 458 458 A 601 GLN HA A 604 ASN HBx 1.0 1.911 4.399 459 459 A 575 GLN HA A 578 ILE HG2% 1.0 1.845 3.925 460 460 A 575 GLN HA A 578 ILE HD1% 1.0 1.839 3.889 461 461 A 601 GLN HA A 601 GLN HGy 1.0 1.618 2.886 462 462 A 575 GLN HA A 578 ILE HG1x 1.0 1.980 5.220 463 463 A 575 GLN HA A 578 ILE HA 1.0 1.996 5.656 464 464 A 601 GLN HA A 605 PRO HDy 1.0 1.771 3.519 465 465 A 581 LEU HA A 581 LEU HG 1.0 1.814 3.748 466 466 A 575 GLN HA A 575 GLN HBx 1.0 1.660 3.042 467 467 A 575 GLN HA A 575 GLN HBy 1.0 1.698 3.194 468 468 A 575 GLN HGy A 575 GLN HBx 1.0 1.793 3.635 469 469 A 575 GLN HGy A 575 GLN HBy 1.0 1.691 3.165 470 470 A 601 GLN HA A 601 GLN HBx 1.0 1.655 3.021 471 471 A 601 GLN HA A 601 GLN HBy 1.0 1.580 2.756 472 472 A 601 GLN HGx A 601 GLN HBy 1.0 1.759 3.465 473 473 A 601 GLN HGx A 601 GLN HBx 1.0 1.775 3.539 474 474 A 601 GLN HGx A 601 GLN HGy 1.0 1.466 2.400 475 475 A 571 LEU HA A 571 LEU HG 1.0 1.618 2.886 476 476 A 571 LEU HBx A 571 LEU HBy 1.0 1.542 2.630 477 477 A 571 LEU HG A 571 LEU HBy 1.0 1.678 3.112 478 478 A 571 LEU HG A 554 GLU HBx 1.0 1.893 4.257 479 479 A 571 LEU HG A 571 LEU HBx 1.0 1.581 2.755 480 480 A 571 LEU HG A 550 LYS HGy 1.0 1.892 4.248 481 481 A 586 LEU HBy A 586 LEU HDy% 1.0 1.847 3.939 482 482 A 586 LEU HBx A 586 LEU HDy% 1.0 1.823 3.797 483 483 A 586 LEU HDx% A 586 LEU HDy% 1.0 1.744 3.396 484 484 A 581 LEU HA A 581 LEU HDx% 1.0 1.951 4.795 485 485 A 581 LEU HA A 584 ASN HBy 1.0 1.892 4.250 486 486 A 581 LEU HA A 581 LEU HBx 1.0 1.690 3.160 487 487 A 581 LEU HA A 581 LEU HBy 1.0 1.735 3.351 488 488 A 581 LEU HBx A 581 LEU HBy 1.0 1.514 2.540 489 489 A 581 LEU HDy% A 581 LEU HBx 1.0 1.752 3.432 490 490 A 581 LEU HDx% A 581 LEU HBx 1.0 1.731 3.337 491 491 A 581 LEU HDx% A 581 LEU HBy 1.0 1.642 2.970 492 492 A 581 LEU HG A 581 LEU HBy 1.0 1.868 4.078 493 493 A 581 LEU HDx% A 581 LEU HDy% 1.0 1.664 3.058 494 494 A 581 LEU HDx% A 578 ILE HD1% 1.0 1.996 5.642 495 495 A 542 LEU HA A 581 LEU HDy% 1.0 1.978 5.184 496 496 A 581 LEU HDy% A 581 LEU HG 1.0 1.623 2.907 497 497 A 581 LEU HDy% A 581 LEU HBy 1.0 1.436 2.316 498 498 A 599 LEU HA A 599 LEU HG 1.0 1.801 3.675 499 499 A 602 VAL HB A 599 LEU HA 1.0 1.723 3.297 500 500 A 599 LEU HA A 573 LYS HEx 1.0 1.915 4.433 501 501 A 599 LEU HA A 599 LEU HBy 1.0 1.569 2.717 502 502 A 559 LYS HA A 558 LEU HBy 1.0 1.907 4.369 503 503 A 599 LEU HA A 573 LYS HDx 1.0 1.881 4.169 504 504 A 599 LEU HBx A 599 LEU HG 1.0 1.615 2.873 505 505 A 599 LEU HBy A 599 LEU HG 1.0 1.603 2.833 506 506 A 599 LEU HG A 546 ALA HB% 1.0 1.690 3.158 507 507 A 573 LYS HDx A 599 LEU HDy% 1.0 1.873 4.105 508 508 A 599 LEU HBx A 599 LEU HDy% 1.0 1.867 4.071 509 509 A 573 LYS HEx A 599 LEU HDy% 1.0 1.997 5.695 510 510 A 573 LYS HGy A 599 LEU HDy% 1.0 1.457 2.373 511 511 A 543 GLU HBy A 543 GLU HA 1.0 1.650 3.002 512 512 A 543 GLU HA A 546 ALA HB% 1.0 1.842 3.912 513 513 A 581 LEU HDx% A 543 GLU HA 1.0 1.598 2.814 514 514 A 554 GLU HGy A 554 GLU HGx 1.0 1.672 3.086 515 515 A 543 GLU HBy A 581 LEU HDx% 1.0 1.802 3.682 516 516 A 543 GLU HA A 543 GLU HGy 1.0 1.765 3.491 517 517 A 543 GLU HA A 543 GLU HGx 1.0 1.799 3.663 518 518 A 581 LEU HDx% A 543 GLU HGy 1.0 1.679 3.115 519 519 A 581 LEU HDx% A 543 GLU HGx 1.0 1.393 2.199 520 520 A 598 GLU HA A 598 GLU HGx 1.0 1.600 2.820 521 521 A 595 LYS HBy A 595 LYS HA 1.0 1.693 3.171 522 522 A 595 LYS HA A 595 LYS HDx 1.0 1.848 3.948 523 523 A 595 LYS HA A 598 GLU HBx 1.0 1.783 3.585 524 524 A 595 LYS HA A 598 GLU HBy 1.0 1.895 4.277 525 525 A 595 LYS HA A 595 LYS HBx 1.0 1.787 3.601 526 526 A 595 LYS HBy A 595 LYS HBx 1.0 1.483 2.447 527 527 A 592 PHE HA A 595 LYS HBx 1.0 1.952 4.798 528 528 A 595 LYS HBy A 595 LYS HDx 1.0 1.878 4.148 529 529 A 542 LEU HDy% A 595 LYS HBy 1.0 1.901 4.323 530 530 A 595 LYS HBy A 595 LYS HDy 1.0 1.849 3.955 531 531 A 542 LEU HDy% A 595 LYS HBx 1.0 1.902 4.328 532 532 A 595 LYS HDx A 595 LYS HBx 1.0 1.927 4.549 533 533 A 595 LYS HGx A 595 LYS HA 1.0 1.840 3.898 534 534 A 595 LYS HGy A 595 LYS HA 1.0 1.900 4.312 535 535 A 595 LYS HGx A 595 LYS HEx 1.0 1.852 3.970 536 536 A 595 LYS HGy A 595 LYS HEx 1.0 1.918 4.460 537 537 A 595 LYS HGx A 595 LYS HGy 1.0 1.642 2.972 538 538 A 595 LYS HGy A 595 LYS HDx 1.0 1.756 3.448 539 539 A 595 LYS HGy A 595 LYS HDy 1.0 1.767 3.501 540 540 A 595 LYS HBy A 595 LYS HGy 1.0 1.698 3.194 541 541 A 595 LYS HGy A 595 LYS HBx 1.0 1.543 2.635 542 542 A 595 LYS HBy A 595 LYS HGx 1.0 1.620 2.892 543 543 A 595 LYS HGx A 595 LYS HBx 1.0 1.597 2.811 544 544 A 595 LYS HA A 595 LYS HDy 1.0 1.745 3.399 545 545 A 595 LYS HGx A 595 LYS HDx 1.0 1.705 3.225 546 546 A 595 LYS HGx A 595 LYS HDy 1.0 1.675 3.101 547 547 A 595 LYS HA A 595 LYS HEx 1.0 1.865 4.059 548 548 A 595 LYS HA A 595 LYS HEy 1.0 1.866 4.068 549 549 A 595 LYS HGx A 595 LYS HEy 1.0 1.847 3.941 550 550 A 595 LYS HGy A 595 LYS HEy 1.0 1.923 4.505 551 551 A 595 LYS HEx A 595 LYS HEy 1.0 1.554 2.670 552 552 A 595 LYS HDx A 595 LYS HEy 1.0 1.623 2.907 553 553 A 595 LYS HDy A 595 LYS HEy 1.0 1.755 3.443 554 554 A 595 LYS HDx A 595 LYS HEx 1.0 1.581 2.759 555 555 A 595 LYS HDy A 595 LYS HEx 1.0 1.687 3.151 556 556 A 595 LYS HBx A 595 LYS HEy 1.0 1.865 4.057 557 557 A 564 GLU HGy A 564 GLU HBy 1.0 1.621 2.895 558 558 A 593 GLU HGy A 592 PHE HBy 1.0 1.821 3.783 559 559 A 593 GLU HA A 596 ARG HBy 1.0 1.756 3.448 560 560 A 596 ARG HDy A 596 ARG HBy 1.0 1.818 3.768 561 561 A 596 ARG HBy A 596 ARG HGx 1.0 1.878 4.146 562 562 A 596 ARG HGy A 596 ARG HBy 1.0 1.792 3.628 563 563 A 542 LEU HDy% A 596 ARG HBy 1.0 1.697 3.189 564 564 A 596 ARG HBx A 596 ARG HGy 1.0 1.613 2.867 565 565 A 596 ARG HDx A 596 ARG HGx 1.0 1.636 2.948 566 566 A 596 ARG HDx A 596 ARG HGy 1.0 1.769 3.515 567 567 A 596 ARG HDy A 596 ARG HGy 1.0 1.832 3.844 568 568 A 542 LEU HDy% A 596 ARG HGx 1.0 1.623 2.907 569 569 A 596 ARG HBx A 596 ARG HGx 1.0 1.651 3.007 570 570 A 596 ARG HDy A 596 ARG HGx 1.0 1.830 3.836 571 571 A 596 ARG HBx A 596 ARG HDy 1.0 1.893 4.253 572 572 A 596 ARG HDx A 596 ARG HBy 1.0 1.912 4.416 573 573 A 596 ARG HBx A 596 ARG HDx 1.0 1.868 4.082 574 574 A 596 ARG HA A 596 ARG HBy 1.0 1.676 3.106 575 575 A 596 ARG HA A 596 ARG HGx 1.0 1.691 3.163 576 576 A 596 ARG HA A 596 ARG HGy 1.0 1.767 3.505 577 577 A 552 ALA HA A 555 ASP HBx 1.0 1.785 3.595 578 578 A 555 ASP HBy A 552 ALA HA 1.0 1.633 2.941 579 579 A 555 ASP HBy A 558 LEU HDx% 1.0 1.677 3.109 580 580 A 558 LEU HDx% A 555 ASP HBx 1.0 1.666 3.064 581 581 A 555 ASP HA A 555 ASP HBx 1.0 1.726 3.314 582 582 A 589 LYS HA A 589 LYS HBx 1.0 1.726 3.310 583 583 A 589 LYS HA A 589 LYS HBy 1.0 1.633 2.939 584 584 A 589 LYS HBx A 589 LYS HGx 1.0 1.664 3.058 585 585 A 589 LYS HBy A 589 LYS HGx 1.0 1.623 2.901 586 586 A 589 LYS HA A 589 LYS HGx 1.0 1.842 3.906 587 587 A 589 LYS HGx A 589 LYS HEx 1.0 1.437 2.319 588 588 A 589 LYS HA A 589 LYS HGy 1.0 1.887 4.217 589 589 A 589 LYS HDy A 589 LYS HGx 1.0 1.536 2.610 590 590 A 573 LYS HEx A 602 VAL HGx% 1.0 1.821 3.783 591 591 A 573 LYS HEy A 602 VAL HGx% 1.0 1.910 4.390 592 592 A 573 LYS HGy A 573 LYS HEx 1.0 1.702 3.208 593 593 A 573 LYS HGy A 573 LYS HEy 1.0 1.716 3.272 594 594 A 599 LEU HG A 573 LYS HEx 1.0 1.898 4.292 595 595 A 573 LYS HEy A 599 LEU HDy% 1.0 1.961 4.919 596 596 A 573 LYS HDy A 573 LYS HEx 1.0 1.715 3.265 597 597 A 573 LYS HEy A 573 LYS HDx 1.0 1.696 3.184 598 598 A 573 LYS HDx A 573 LYS HEx 1.0 1.664 3.058 599 599 A 573 LYS HEy A 573 LYS HEx 1.0 1.489 2.467 600 600 A 573 LYS HA A 573 LYS HDx 1.0 1.655 3.023 601 601 A 573 LYS HDx A 602 VAL HGx% 1.0 1.961 4.923 602 602 A 573 LYS HDx A 599 LEU HDy% 1.0 1.931 4.591 603 603 A 573 LYS HGy A 573 LYS HDx 1.0 1.618 2.886 604 604 A 573 LYS HGy A 602 VAL HGx% 1.0 1.665 3.061 605 605 A 558 LEU HDy% A 561 LYS HGy 1.0 1.767 3.505 606 606 A 558 LEU HDy% A 561 LYS HGx 1.0 1.867 4.071 607 607 A 573 LYS HBy A 602 VAL HGx% 1.0 1.718 3.278 608 608 A 573 LYS HBy A 602 VAL HGy% 1.0 1.600 2.824 609 609 A 588 GLU HBx A 588 GLU HBy 1.0 1.436 2.316 610 610 A 573 LYS HBy A 573 LYS HA 1.0 1.672 3.088 611 611 A 573 LYS HA A 576 GLU HBx 1.0 1.597 2.811 612 612 A 585 THR HG2% A 582 ASP HA 1.0 1.774 3.534 613 613 A 573 LYS HA A 573 LYS HDy 1.0 1.696 3.184 614 614 A 573 LYS HA A 602 VAL HGy% 1.0 1.936 4.638 615 615 A 573 LYS HA A 577 VAL HGx% 1.0 1.916 4.442 616 616 A 588 GLU HGy A 588 GLU HBy 1.0 1.667 3.069 617 617 A 598 GLU HA A 598 GLU HGy 1.0 1.781 3.569 618 618 A 598 GLU HGx A 598 GLU HGy 1.0 1.455 2.369 619 619 A 598 GLU HGx A 595 LYS HA 1.0 1.823 3.797 620 620 A 598 GLU HA A 598 GLU HBx 1.0 1.669 3.075 621 621 A 573 LYS HEx A 598 GLU HBy 1.0 1.823 3.797 622 622 A 573 LYS HEy A 598 GLU HBy 1.0 1.789 3.611 623 623 A 573 LYS HEx A 598 GLU HBx 1.0 1.988 5.392 624 624 A 596 ARG HBx A 596 ARG HBy 1.0 1.273 1.905 625 625 A 598 GLU HA A 598 GLU HBy 1.0 1.618 2.886 626 626 A 567 LYS HEy A 564 GLU HA 1.0 1.995 5.627 627 627 A 594 HIS HA A 597 LYS HBy 1.0 1.781 3.569 628 628 A 561 LYS HA A 561 LYS HDy 1.0 1.858 4.006 629 629 A 591 GLU HA A 594 HIS HBy 1.0 1.717 3.275 630 630 A 556 GLU HA A 556 GLU HGy 1.0 1.798 3.658 631 631 A 554 GLU HGy A 554 GLU HA 1.0 1.623 2.905 632 632 A 551 SER HA A 554 GLU HGx 1.0 1.978 5.180 633 633 A 553 VAL HGy% A 554 GLU HGx 1.0 1.823 3.797 634 634 A 571 LEU HDy% A 554 GLU HGx 1.0 1.759 3.465 635 635 A 571 LEU HDy% A 554 GLU HBx 1.0 1.751 3.423 636 636 A 550 LYS HGy A 554 GLU HGy 1.0 1.962 4.940 637 637 A 554 GLU HBx A 554 GLU HA 1.0 1.661 3.045 638 638 A 554 GLU HGx A 554 GLU HA 1.0 1.837 3.877 639 639 A 591 GLU HGy A 587 ALA HB% 1.0 1.857 4.001 640 640 A 591 GLU HGx A 587 ALA HB% 1.0 1.881 4.173 641 641 A 591 GLU HBy A 587 ALA HB% 1.0 1.754 3.440 642 642 A 576 GLU HBy A 576 GLU HBx 1.0 1.419 2.269 643 643 A 591 GLU HA A 591 GLU HBx 1.0 1.749 3.419 644 644 A 576 GLU HA A 576 GLU HGx 1.0 1.702 3.208 645 645 A 576 GLU HA A 576 GLU HBy 1.0 1.581 2.757 646 646 A 569 LYS HBx A 569 LYS HA 1.0 1.703 3.213 647 647 A 569 LYS HGx A 569 LYS HA 1.0 1.822 3.790 648 648 A 600 GLU HA A 600 GLU HGy 1.0 1.639 2.965 649 649 A 597 LYS HA A 600 GLU HBy 1.0 1.711 3.247 650 650 A 603 CYS HBx A 600 GLU HA 1.0 1.942 4.702 651 651 A 600 GLU HA A 600 GLU HBy 1.0 1.684 3.136 652 652 A 564 GLU HBy A 564 GLU HA 1.0 1.671 3.083 653 653 A 556 GLU HBy A 559 LYS HGy 1.0 1.847 3.939 654 654 A 564 GLU HGy A 564 GLU HA 1.0 1.772 3.524 655 655 A 549 MET HA A 549 MET HGy 1.0 1.753 3.435 656 656 A 550 LYS HEy A 550 LYS HBx 1.0 1.615 2.875 657 657 A 539 LYS HBx A 539 LYS HA 1.0 1.765 3.491 658 658 A 539 LYS HBy A 539 LYS HA 1.0 1.589 2.785 659 659 A 539 LYS HA A 542 LEU HBx 1.0 1.922 4.502 660 660 A 539 LYS HBy A 539 LYS HDy 1.0 1.751 3.427 661 661 A 539 LYS HBx A 539 LYS HDy 1.0 1.728 3.320 662 662 A 539 LYS HGy A 539 LYS HEy 1.0 1.792 3.628 663 663 A 574 CYS HBy A 550 LYS HDy 1.0 1.794 3.640 664 664 A 567 LYS HA A 562 ILE HD1% 1.0 1.755 3.443 665 665 A 567 LYS HA A 562 ILE HG2% 1.0 1.857 4.003 666 666 A 567 LYS HA A 553 VAL HGy% 1.0 1.813 3.741 667 667 A 567 LYS HA A 567 LYS HGx 1.0 1.686 3.146 668 668 A 553 VAL HB A 567 LYS HA 1.0 1.664 3.056 669 669 A 574 CYS HBy A 550 LYS HBy 1.0 1.897 4.289 670 670 A 571 LEU HDy% A 550 LYS HBy 1.0 1.835 3.869 671 671 A 567 LYS HBx A 562 ILE HG2% 1.0 1.406 2.234 672 672 A 571 LEU HDy% A 550 LYS HBx 1.0 1.596 2.806 673 673 A 569 LYS HBx A 602 VAL HGy% 1.0 1.838 3.886 674 674 A 589 LYS HBy A 589 LYS HEx 1.0 1.963 4.957 675 675 A 571 LEU HG A 567 LYS HGy 1.0 1.848 3.944 676 676 A 553 VAL HGy% A 567 LYS HGx 1.0 1.789 3.611 677 677 A 567 LYS HEy A 554 GLU HA 1.0 1.740 3.376 678 678 A 550 LYS HEy A 550 LYS HDy 1.0 1.642 2.974 679 679 A 550 LYS HDy A 578 ILE HD1% 1.0 1.761 3.473 680 680 A 550 LYS HDy A 550 LYS HGy 1.0 1.700 3.200 681 681 A 550 LYS HDy A 550 LYS HBx 1.0 1.476 2.428 682 682 A 550 LYS HA A 550 LYS HBy 1.0 1.649 3.001 683 683 A 550 LYS HA A 550 LYS HGx 1.0 1.871 4.093 684 684 A 571 LEU HDy% A 550 LYS HA 1.0 1.725 3.307 685 685 A 550 LYS HA A 550 LYS HBx 1.0 1.562 2.694 686 686 A 550 LYS HDy A 550 LYS HA 1.0 1.943 4.715 687 687 A 597 LYS HBy A 597 LYS HEx 1.0 1.929 4.571 688 688 A 597 LYS HDy A 594 HIS HA 1.0 1.944 4.718 689 689 A 597 LYS HA A 597 LYS HBy 1.0 1.631 2.933 690 690 A 599 LEU HBy A 598 GLU HA 1.0 1.998 5.766 691 691 A 597 LYS HGy A 597 LYS HBy 1.0 1.582 2.760 692 692 A 561 LYS HBy A 561 LYS HBx 1.0 1.495 2.487 693 693 A 561 LYS HGy A 561 LYS HBx 1.0 1.755 3.443 694 694 A 561 LYS HGx A 561 LYS HBx 1.0 1.844 3.920 695 695 A 558 LEU HDy% A 561 LYS HBx 1.0 1.698 3.194 696 696 A 558 LEU HDy% A 561 LYS HBy 1.0 1.717 3.275 697 697 A 568 LYS HDx A 568 LYS HA 1.0 1.943 4.697 698 698 A 561 LYS HGx A 561 LYS HDy 1.0 1.596 2.808 699 699 A 558 LEU HDy% A 561 LYS HDy 1.0 1.638 2.960 700 700 A 561 LYS HGx A 561 LYS HEy 1.0 1.532 2.598 701 701 A 547 PHE HA A 550 LYS HBy 1.0 1.691 3.165 702 702 A 567 LYS HBx A 564 GLU HA 1.0 1.840 3.894 703 703 A 567 LYS HBy A 564 GLU HA 1.0 1.637 2.955 704 704 A 559 LYS HA A 559 LYS HGy 1.0 1.836 3.874 705 705 A 559 LYS HA A 559 LYS HGx 1.0 1.954 7.258 706 706 A 569 LYS HGy A 569 LYS HA 1.0 1.845 3.929 707 707 A 569 LYS HGx A 602 VAL HGx% 1.0 1.975 5.135 708 708 A 594 HIS HBy A 594 HIS HD2 1.0 1.925 4.527 709 709 A 580 TRP HBy A 580 TRP HD1 1.0 1.890 4.238 710 710 A 580 TRP HBx A 580 TRP HD1 1.0 1.964 4.960 711 711 A 545 TYR HBx A 545 TYR HDx 1.0 1.821 3.783 712 712 A 545 TYR HBy A 545 TYR HDx 1.0 1.817 3.761 713 713 A 592 PHE HBy A 592 PHE HDx 1.0 1.790 3.618 714 714 A 547 PHE HBy A 547 PHE HDx 1.0 1.575 2.739 715 715 A 589 LYS HA A 592 PHE HDy 1.0 1.823 3.797 716 716 A 545 TYR HA A 545 TYR HDx 1.0 1.780 3.564 717 717 A 547 PHE HA A 547 PHE HDx 1.0 1.690 3.160 718 718 A 569 LYS HEy A 602 VAL HGy% 1.0 1.852 3.974 719 719 A 569 LYS HEy A 569 LYS HDy 1.0 1.653 3.017 720 720 A 569 LYS HBy A 569 LYS HA 1.0 1.559 2.685 721 721 A 568 LYS HA A 568 LYS HGy 1.0 1.691 3.165 722 722 A 568 LYS HBy A 568 LYS HA 1.0 1.665 3.063 723 723 A 565 ALA HA A 568 LYS HDy 1.0 1.563 2.699 724 724 A 568 LYS HBy A 568 LYS HEy 1.0 1.853 3.977 725 725 A 539 LYS HBy A 592 PHE HDx 1.0 1.917 4.449 726 726 A 589 LYS HEx A 589 LYS HGy 1.0 1.864 4.054 727 727 A 559 LYS HGx A 557 GLY HAy 1.0 1.931 4.587 728 728 A 559 LYS HGx A 559 LYS HEy 1.0 1.842 3.910 729 729 A 559 LYS HGy A 559 LYS HDy 1.0 1.579 2.753 730 730 A 610 LEU HA A 610 LEU HBx 1.0 1.717 3.275 731 731 A 610 LEU HA A 610 LEU HBy 1.0 1.644 2.980 732 732 A 610 LEU HBx A 610 LEU HBy 1.0 1.366 2.130 733 733 A 610 LEU HDx% A 610 LEU HBx 1.0 1.653 3.017 734 734 A 607 ILE HA A 610 LEU HG 1.0 1.874 4.124 735 735 A 610 LEU HA A 610 LEU HG 1.0 1.686 3.146 736 736 A 610 LEU HDx% A 610 LEU HBy 1.0 1.602 2.830 737 737 A 610 LEU HDx% A 610 LEU HG 1.0 1.624 2.910 738 738 A 610 LEU HG A 610 LEU HDy% 1.0 1.562 2.696 739 739 A 561 LYS HBx A 610 LEU HDy% 1.0 1.741 3.381 740 740 A 578 ILE HD1% A 547 PHE HDx 1.0 1.875 4.127 741 741 A 585 THR HA A 592 PHE HEx 1.0 1.945 4.725 742 742 A 580 TRP HA A 580 TRP HD1 1.0 1.911 4.399 743 743 A 539 LYS HA A 592 PHE HDx 1.0 1.874 4.116 744 744 A 600 GLU HA A 545 TYR HEx 1.0 1.919 4.473 745 745 A 594 HIS HA A 594 HIS HD2 1.0 1.963 4.943 746 746 A 581 LEU HA A 592 PHE HEx 1.0 1.775 3.543 747 747 A 599 LEU HBx A 545 TYR HEx 1.0 1.922 4.492 748 748 A 543 GLU HGx A 547 PHE HEx 1.0 1.910 4.390 749 749 A 543 GLU HGy A 547 PHE HDx 1.0 1.911 4.395 750 750 A 550 LYS HDy A 547 PHE HDx 1.0 1.980 5.226 751 751 A 542 LEU HG A 592 PHE HDx 1.0 1.782 3.574 752 752 A 599 LEU HDx% A 545 TYR HEx 1.0 1.878 4.144 753 753 A 581 LEU HG A 592 PHE HEx 1.0 1.917 4.455 754 754 A 578 ILE HG1x A 547 PHE HDx 1.0 1.553 2.665 755 755 A 599 LEU HG A 545 TYR HEx 1.0 1.942 4.702 756 756 A 599 LEU HG A 545 TYR HDx 1.0 1.830 3.836 757 757 A 581 LEU HDx% A 592 PHE HEx 1.0 1.996 5.642 758 758 A 581 LEU HDy% A 592 PHE HEx 1.0 1.666 3.064 759 759 A 539 LYS HGy A 592 PHE HEx 1.0 1.332 2.046 760 760 A 542 LEU HDy% A 545 TYR HDy 1.0 1.952 4.816 761 761 A 542 LEU HDy% A 592 PHE HDx 1.0 1.978 5.188 762 762 A 592 PHE HEx A 587 ALA HB% 1.0 1.837 3.877 763 763 A 592 PHE HDx A 538 ALA HB% 1.0 1.893 4.255 764 764 A 549 MET HE% A 545 TYR HEx 1.0 1.892 4.248 765 765 A 549 MET HE% A 545 TYR HDx 1.0 1.896 4.278 766 766 A 549 MET HA A 549 MET HE% 1.0 1.714 3.260 767 767 A 548 ASN HBy A 549 MET HE% 1.0 1.853 3.977 768 768 A 548 ASN HBx A 549 MET HE% 1.0 1.776 3.548 769 769 A 552 ALA HB% A 549 MET HE% 1.0 1.995 5.591 770 770 A 607 ILE HD1% A 549 MET HE% 1.0 1.916 4.444 771 771 A 545 TYR HBx A 549 MET HE% 1.0 1.999 6.129 772 772 A 607 ILE HG1y A 549 MET HE% 1.0 1.998 6.266 773 773 A 546 ALA HA A 549 MET HE% 1.0 1.992 5.518 774 774 A 578 ILE HG2% A 547 PHE HEx 1.0 1.924 4.510 775 775 A 608 SER HA A 607 ILE HG2% 1.0 1.947 4.761 776 776 A 569 LYS HBx A 569 LYS HEy 1.0 1.781 3.569 777 777 A 597 LYS HGy A 597 LYS HEy 1.0 1.818 3.768 778 778 A 597 LYS HDy A 597 LYS HEy 1.0 1.421 2.273 779 779 A 566 ASP HA A 569 LYS HEy 1.0 1.989 5.425 780 780 A 539 LYS HGx A 539 LYS HEx 1.0 1.521 2.565 781 781 A 569 LYS HEy A 605 PRO HDx 1.0 1.929 4.563 782 782 A 602 VAL HA A 569 LYS HEy 1.0 1.738 3.366 783 783 A 593 GLU HA A 596 ARG HDx 1.0 1.864 4.050 784 784 A 596 ARG HA A 596 ARG HDx 1.0 1.962 4.940 785 785 A 567 LYS HEy A 554 GLU HGx 1.0 1.988 5.396 786 786 A 571 LEU HDx% A 571 LEU HBy 1.0 1.821 3.783 787 787 A 571 LEU HDx% A 567 LYS HGy 1.0 1.891 4.245 788 788 A 571 LEU HDy% A 571 LEU HDx% 1.0 1.838 3.886 789 789 A 580 TRP HBx A 580 TRP HE3 1.0 1.900 4.312 790 790 A 580 TRP HBy A 580 TRP HE3 1.0 1.933 4.607 791 791 A 542 LEU HG A 580 TRP HZ3 1.0 1.862 4.038 792 792 A 581 LEU HDy% A 580 TRP HZ3 1.0 1.841 3.905 793 793 A 577 VAL HGy% A 580 TRP HE3 1.0 1.865 4.057 794 794 A 587 ALA HB% A 580 TRP HZ2 1.0 1.862 4.036 795 795 A 587 ALA HB% A 580 TRP HH2 1.0 1.796 3.652 796 796 A 587 ALA HB% A 580 TRP HZ3 1.0 1.993 5.531 797 797 A 591 GLU HBy A 580 TRP HZ2 1.0 1.861 4.029 798 798 A 591 GLU HBx A 580 TRP HZ2 1.0 1.951 4.789 799 799 A 591 GLU HBy A 580 TRP HH2 1.0 1.954 4.840 800 800 A 592 PHE HA A 580 TRP HZ3 1.0 1.835 3.865 801 801 A 592 PHE HA A 580 TRP HH2 1.0 1.917 4.449 802 802 A 610 LEU H A 609 GLY H 1.0 1.790 3.620 803 803 A 607 ILE H A 606 ILE H 1.0 1.750 3.420 804 804 A 604 ASN H A 603 CYS H 1.0 1.829 3.833 805 805 A 603 CYS H A 602 VAL H 1.0 1.760 3.470 806 806 A 602 VAL H A 601 GLN H 1.0 1.701 3.203 807 807 A 601 GLN H A 600 GLU H 1.0 1.811 3.731 808 808 A 600 GLU H A 599 LEU H 1.0 1.801 3.675 809 809 A 596 ARG H A 595 LYS H 1.0 1.750 3.420 810 810 A 595 LYS H A 594 HIS H 1.0 1.687 3.151 811 811 A 594 HIS H A 593 GLU H 1.0 1.693 3.171 812 812 A 593 GLU H A 592 PHE H 1.0 1.782 3.574 813 813 A 592 PHE H A 591 GLU H 1.0 1.744 3.394 814 814 A 591 GLU H A 590 ASP H 1.0 1.766 3.496 815 815 A 587 ALA H A 586 LEU H 1.0 1.820 3.778 816 816 A 586 LEU H A 585 THR H 1.0 1.852 3.974 817 817 A 585 THR H A 584 ASN H 1.0 1.855 3.989 818 818 A 584 ASN H A 583 ALA H 1.0 1.797 3.655 819 819 A 583 ALA H A 582 ASP H 1.0 1.796 3.646 820 820 A 580 TRP HE3 A 581 LEU H 1.0 1.881 4.165 821 821 A 582 ASP H A 581 LEU H 1.0 1.829 3.833 822 822 A 581 LEU H A 580 TRP H 1.0 1.454 2.368 823 823 A 580 TRP H A 579 SER H 1.0 1.815 3.749 824 824 A 578 ILE H A 577 VAL H 1.0 1.819 3.771 825 825 A 575 GLN H A 574 CYS H 1.0 1.815 3.753 826 826 A 574 CYS H A 573 LYS H 1.0 1.803 3.687 827 827 A 541 ALA HA A 541 ALA H 1.0 1.780 3.564 828 828 A 538 ALA HB% A 538 ALA H 1.0 1.987 5.357 829 829 A 541 ALA H A 540 ASN H 1.0 1.802 3.684 830 830 A 540 ASN H A 539 LYS H 1.0 1.722 3.294 831 831 A 541 ALA H A 542 LEU H 1.0 1.729 3.327 832 832 A 542 LEU H A 543 GLU H 1.0 1.710 3.246 833 833 A 546 ALA H A 545 TYR H 1.0 1.709 3.237 834 834 A 547 PHE HDx A 547 PHE H 1.0 1.969 5.021 835 835 A 547 PHE H A 551 SER H 1.0 1.998 6.244 836 836 A 547 PHE H A 548 ASN H 1.0 1.801 3.675 837 837 A 548 ASN H A 549 MET H 1.0 1.755 3.445 838 838 A 549 MET H A 550 LYS H 1.0 1.801 3.677 839 839 A 551 SER H A 552 ALA H 1.0 1.723 3.297 840 840 A 552 ALA H A 553 VAL H 1.0 1.801 3.671 841 841 A 553 VAL H A 554 GLU H 1.0 1.829 3.829 842 842 A 554 GLU H A 555 ASP H 1.0 1.800 3.668 843 843 A 555 ASP H A 556 GLU H 1.0 1.966 5.000 844 844 A 557 GLY H A 558 LEU H 1.0 1.822 3.794 845 845 A 559 LYS H A 560 GLY H 1.0 1.929 4.563 846 846 A 560 GLY H A 561 LYS H 1.0 1.850 3.964 847 847 A 561 LYS H A 562 ILE H 1.0 1.709 3.237 848 848 A 562 ILE H A 563 SER H 1.0 1.999 5.867 849 849 A 564 GLU H A 565 ALA H 1.0 1.710 3.246 850 850 A 565 ALA H A 566 ASP H 1.0 1.690 3.162 851 851 A 566 ASP H A 567 LYS H 1.0 1.709 3.239 852 852 A 567 LYS H A 568 LYS H 1.0 1.698 3.196 853 853 A 568 LYS H A 569 LYS H 1.0 1.773 3.533 854 854 A 570 VAL H A 571 LEU H 1.0 1.768 3.510 855 855 A 573 LYS H A 572 ASP H 1.0 1.809 3.721 856 856 A 571 LEU H A 572 ASP H 1.0 1.838 3.884 857 857 A 539 LYS HA A 539 LYS H 1.0 1.868 4.078 858 858 A 538 ALA HA A 539 LYS H 1.0 1.876 4.126 859 859 A 538 ALA HB% A 539 LYS H 1.0 1.726 3.314 860 860 A 539 LYS HA A 540 ASN H 1.0 1.927 4.549 861 861 A 540 ASN HA A 540 ASN H 1.0 1.810 3.724 862 862 A 540 ASN HA A 541 ALA H 1.0 1.892 4.250 863 863 A 541 ALA HB% A 541 ALA H 1.0 1.804 3.694 864 864 A 541 ALA HB% A 542 LEU H 1.0 1.867 4.071 865 865 A 543 GLU HA A 543 GLU H 1.0 1.825 3.813 866 866 A 543 GLU HA A 544 SER H 1.0 1.951 4.789 867 867 A 609 GLY H A 609 GLY HAy 1.0 1.706 3.228 868 868 A 608 SER HA A 609 GLY H 1.0 1.835 3.871 869 869 A 608 SER HA A 608 SER H 1.0 1.859 4.021 870 870 A 607 ILE HA A 607 ILE H 1.0 1.693 3.173 871 871 A 606 ILE HA A 606 ILE H 1.0 1.839 3.889 872 872 A 603 CYS HA A 604 ASN H 1.0 1.900 4.312 873 873 A 572 ASP HBx A 572 ASP H 1.0 1.764 3.486 874 874 A 572 ASP HBy A 572 ASP H 1.0 1.825 3.805 875 875 A 572 ASP HA A 572 ASP H 1.0 1.856 3.994 876 876 A 565 ALA HB% A 565 ALA H 1.0 1.792 3.628 877 877 A 564 GLU HBy A 565 ALA H 1.0 1.858 4.010 878 878 A 557 GLY HAy A 557 GLY H 1.0 1.732 3.342 879 879 A 552 ALA HA A 552 ALA H 1.0 1.740 3.376 880 880 A 552 ALA HB% A 552 ALA H 1.0 1.663 3.055 881 881 A 555 ASP HA A 555 ASP H 1.0 1.907 4.371 882 882 A 547 PHE HA A 547 PHE H 1.0 1.792 3.628 883 883 A 547 PHE HBy A 547 PHE H 1.0 1.668 3.072 884 884 A 546 ALA HA A 547 PHE H 1.0 1.897 4.287 885 885 A 546 ALA HB% A 547 PHE H 1.0 1.852 3.974 886 886 A 544 SER HA A 544 SER H 1.0 1.802 3.684 887 887 A 544 SER HBy A 544 SER H 1.0 1.714 3.260 888 888 A 545 TYR HBx A 545 TYR H 1.0 1.748 3.410 889 889 A 545 TYR HBy A 545 TYR H 1.0 1.744 3.396 890 890 A 544 SER HA A 545 TYR H 1.0 1.907 4.371 891 891 A 544 SER HBy A 545 TYR H 1.0 1.830 3.838 892 892 A 543 GLU HA A 545 TYR H 1.0 2.000 5.992 893 893 A 545 TYR HBx A 546 ALA H 1.0 1.877 4.139 894 894 A 545 TYR HBy A 546 ALA H 1.0 1.802 3.684 895 895 A 546 ALA HA A 546 ALA H 1.0 1.804 3.694 896 896 A 546 ALA HB% A 546 ALA H 1.0 1.787 3.599 897 897 A 547 PHE HA A 548 ASN H 1.0 1.948 4.764 898 898 A 543 GLU HA A 546 ALA H 1.0 1.781 3.571 899 899 A 548 ASN HBy A 548 ASN H 1.0 1.830 3.838 900 900 A 549 MET HA A 549 MET H 1.0 1.876 4.126 901 901 A 546 ALA HA A 549 MET H 1.0 1.909 4.389 902 902 A 548 ASN HBx A 549 MET H 1.0 1.853 3.979 903 903 A 548 ASN HBy A 549 MET H 1.0 1.881 4.171 904 904 A 547 PHE HA A 550 LYS H 1.0 1.830 3.838 905 905 A 551 SER HA A 551 SER H 1.0 1.792 3.628 906 906 A 552 ALA HB% A 553 VAL H 1.0 1.820 3.782 907 907 A 553 VAL HB A 553 VAL H 1.0 1.835 3.867 908 908 A 553 VAL HA A 553 VAL H 1.0 1.803 3.687 909 909 A 552 ALA HA A 555 ASP H 1.0 1.909 4.389 910 910 A 545 TYR HA A 545 TYR H 1.0 1.846 3.934 911 911 A 545 TYR HA A 546 ALA H 1.0 1.973 6.945 912 912 A 565 ALA HA A 565 ALA H 1.0 1.615 2.875 913 913 A 540 ASN HBy A 541 ALA H 1.0 1.812 3.738 914 914 A 540 ASN HBy A 540 ASN H 1.0 1.721 3.287 915 915 A 548 ASN HA A 548 ASN H 1.0 1.747 3.407 916 916 A 548 ASN HA A 549 MET H 1.0 1.998 5.772 917 917 A 575 GLN HBx A 576 GLU H 1.0 1.663 3.053 918 918 A 576 GLU HBx A 576 GLU H 1.0 1.688 3.156 919 919 A 542 LEU HA A 543 GLU H 1.0 2.000 6.042 920 920 A 575 GLN HBx A 575 GLN H 1.0 1.737 3.359 921 921 A 592 PHE HDx A 539 LYS H 1.0 1.965 4.973 922 922 A 537 SER HBy A 539 LYS H 1.0 1.956 4.856 923 923 A 539 LYS HBy A 539 LYS H 1.0 1.753 3.437 924 924 A 539 LYS H A 539 LYS HDx 1.0 1.956 4.864 925 925 A 539 LYS HBx A 540 ASN H 1.0 1.764 3.488 926 926 A 539 LYS HBy A 540 ASN H 1.0 1.835 3.871 927 927 A 543 GLU HBy A 540 ASN H 1.0 1.997 5.681 928 928 A 540 ASN H A 539 LYS HDx 1.0 1.981 5.243 929 929 A 540 ASN HBy A 540 ASN HD2y 1.0 1.853 3.979 930 930 A 537 SER HA A 540 ASN HD2y 1.0 1.998 5.750 931 931 A 540 ASN HD2y A 540 ASN HD2x 1.0 1.590 2.786 932 932 A 548 ASN HD2x A 548 ASN HD2y 1.0 1.459 2.379 933 933 A 540 ASN HBy A 540 ASN HD2x 1.0 1.532 2.598 934 934 A 542 LEU HA A 542 LEU H 1.0 1.825 3.809 935 935 A 541 ALA HA A 542 LEU H 1.0 1.856 4.000 936 936 A 539 LYS HA A 542 LEU H 1.0 1.898 4.296 937 937 A 542 LEU HBy A 542 LEU H 1.0 1.753 3.435 938 938 A 542 LEU HBx A 542 LEU H 1.0 1.705 3.223 939 939 A 542 LEU HDy% A 542 LEU H 1.0 1.876 4.132 940 940 A 543 GLU HGy A 543 GLU H 1.0 1.896 4.280 941 941 A 543 GLU HGx A 543 GLU H 1.0 1.909 4.389 942 942 A 581 LEU HDx% A 543 GLU H 1.0 1.910 4.398 943 943 A 542 LEU HBy A 543 GLU H 1.0 1.843 3.911 944 944 A 581 LEU HDy% A 543 GLU H 1.0 1.905 4.345 945 945 A 543 GLU HBy A 544 SER H 1.0 1.704 3.222 946 946 A 543 GLU HGy A 545 TYR H 1.0 1.999 5.891 947 947 A 545 TYR HDx A 545 TYR H 1.0 1.950 4.788 948 948 A 545 TYR H A 544 SER H 1.0 1.778 3.558 949 949 A 545 TYR HDx A 546 ALA H 1.0 1.920 4.478 950 950 A 580 TRP HZ3 A 546 ALA H 1.0 1.494 10.528 951 951 A 578 ILE HG1y A 546 ALA H 1.0 1.944 4.708 952 952 A 578 ILE HG1x A 546 ALA H 1.0 1.985 5.321 953 953 A 578 ILE HG1y A 547 PHE H 1.0 1.980 5.230 954 954 A 551 SER H A 548 ASN H 1.0 1.933 4.605 955 955 A 548 ASN HBx A 548 ASN H 1.0 1.723 3.301 956 956 A 547 PHE HBy A 548 ASN H 1.0 1.823 3.797 957 957 A 548 ASN HBx A 548 ASN HD2y 1.0 1.880 4.158 958 958 A 548 ASN HBy A 548 ASN HD2y 1.0 1.907 4.371 959 959 A 544 SER HBy A 548 ASN HD2x 1.0 1.976 5.154 960 960 A 548 ASN HBx A 548 ASN HD2x 1.0 1.928 4.560 961 961 A 548 ASN HBy A 548 ASN HD2x 1.0 1.863 4.043 962 962 A 549 MET HBy A 549 MET H 1.0 1.792 3.628 963 963 A 549 MET HBx A 549 MET H 1.0 1.667 3.069 964 964 A 549 MET HGx A 549 MET H 1.0 1.726 3.316 965 965 A 599 LEU HDy% A 549 MET H 1.0 1.985 6.703 966 966 A 550 LYS HA A 550 LYS H 1.0 1.819 3.771 967 967 A 549 MET HBx A 550 LYS H 1.0 1.867 4.071 968 968 A 550 LYS HBy A 550 LYS H 1.0 1.997 6.279 969 969 A 550 LYS HBx A 550 LYS H 1.0 1.577 2.743 970 970 A 549 MET HBy A 550 LYS H 1.0 1.789 3.613 971 971 A 546 ALA HB% A 550 LYS H 1.0 1.992 5.500 972 972 A 571 LEU HDy% A 550 LYS H 1.0 1.943 4.707 973 973 A 548 ASN HA A 551 SER H 1.0 1.971 5.063 974 974 A 551 SER HBy A 551 SER H 1.0 1.745 3.397 975 975 A 550 LYS HBx A 551 SER H 1.0 1.871 4.101 976 976 A 550 LYS HDy A 551 SER H 1.0 1.961 4.923 977 977 A 550 LYS HGy A 551 SER H 1.0 1.942 4.694 978 978 A 551 SER HBy A 552 ALA H 1.0 1.820 3.782 979 979 A 549 MET HE% A 552 ALA H 1.0 1.998 5.780 980 980 A 553 VAL HGx% A 552 ALA H 1.0 1.998 5.750 981 981 A 570 VAL HGy% A 552 ALA H 1.0 1.957 7.215 982 982 A 550 LYS HA A 553 VAL H 1.0 1.973 5.097 983 983 A 567 LYS HBx A 553 VAL H 1.0 1.970 7.008 984 984 A 553 VAL HGy% A 553 VAL H 1.0 1.734 3.346 985 985 A 570 VAL HGy% A 553 VAL H 1.0 1.992 5.524 986 986 A 554 GLU HA A 554 GLU H 1.0 1.863 4.043 987 987 A 553 VAL HA A 554 GLU H 1.0 1.838 3.884 988 988 A 550 LYS HA A 554 GLU H 1.0 1.982 5.260 989 989 A 555 ASP HBx A 554 GLU H 1.0 1.959 4.887 990 990 A 554 GLU HGx A 554 GLU H 1.0 1.874 4.120 991 991 A 567 LYS HDy A 554 GLU H 1.0 1.972 6.970 992 992 A 571 LEU HBy A 554 GLU H 1.0 1.988 6.644 993 993 A 554 GLU HGy A 554 GLU H 1.0 1.815 3.753 994 994 A 554 GLU HBy A 554 GLU H 1.0 1.883 4.185 995 995 A 553 VAL HGy% A 554 GLU H 1.0 1.353 2.097 996 996 A 571 LEU HDy% A 554 GLU H 1.0 1.931 4.579 997 997 A 555 ASP HBx A 555 ASP H 1.0 1.769 3.513 998 998 A 555 ASP HBy A 555 ASP H 1.0 1.764 3.488 999 999 A 554 GLU HBx A 555 ASP H 1.0 1.978 5.196 1000 1000 A 554 GLU HBy A 555 ASP H 1.0 1.829 3.833 1001 1001 A 558 LEU HDx% A 555 ASP H 1.0 1.948 4.766 1002 1002 A 556 GLU HA A 556 GLU H 1.0 1.867 4.071 1003 1003 A 555 ASP HA A 556 GLU H 1.0 1.742 3.388 1004 1004 A 555 ASP HBy A 556 GLU H 1.0 1.989 5.421 1005 1005 A 555 ASP HBx A 556 GLU H 1.0 1.854 3.984 1006 1006 A 556 GLU HGy A 556 GLU H 1.0 1.853 3.979 1007 1007 A 556 GLU HBy A 556 GLU H 1.0 1.780 3.564 1008 1008 A 556 GLU HBy A 557 GLY H 1.0 1.876 4.126 1009 1009 A 556 GLU HGy A 557 GLY H 1.0 1.988 5.386 1010 1010 A 555 ASP HBy A 557 GLY H 1.0 1.894 4.264 1011 1011 A 555 ASP HBx A 557 GLY H 1.0 1.864 4.054 1012 1012 A 558 LEU HBy A 557 GLY H 1.0 1.997 5.661 1013 1013 A 558 LEU HBx A 557 GLY H 1.0 1.882 4.178 1014 1014 A 558 LEU HA A 558 LEU H 1.0 1.868 4.078 1015 1015 A 557 GLY HAy A 558 LEU H 1.0 1.855 3.989 1016 1016 A 555 ASP HBy A 558 LEU H 1.0 1.893 4.257 1017 1017 A 558 LEU HDy% A 558 LEU H 1.0 1.959 7.185 1018 1018 A 558 LEU HDx% A 558 LEU H 1.0 1.831 3.845 1019 1019 A 558 LEU HBx A 558 LEU H 1.0 1.765 3.493 1020 1020 A 558 LEU HBy A 558 LEU H 1.0 1.768 3.510 1021 1021 A 559 LYS HGy A 558 LEU H 1.0 1.998 5.816 1022 1022 A 556 GLU HGy A 558 LEU H 1.0 1.999 6.199 1023 1023 A 559 LYS H A 561 LYS H 1.0 2.000 6.070 1024 1024 A 558 LEU HA A 559 LYS H 1.0 1.899 4.303 1025 1025 A 559 LYS HA A 559 LYS H 1.0 1.804 3.694 1026 1026 A 559 LYS HBy A 559 LYS H 1.0 1.670 3.080 1027 1027 A 559 LYS HGy A 559 LYS H 1.0 1.975 5.145 1028 1028 A 559 LYS HGx A 559 LYS H 1.0 1.933 4.605 1029 1029 A 560 GLY H A 560 GLY HAy 1.0 1.692 3.166 1030 1030 A 559 LYS HBy A 560 GLY H 1.0 1.911 4.407 1031 1031 A 593 GLU HA A 594 HIS H 1.0 1.794 3.640 1032 1032 A 593 GLU HBy A 594 HIS H 1.0 1.660 3.042 1033 1033 A 594 HIS HBy A 594 HIS H 1.0 1.679 3.115 1034 1034 A 561 LYS HGx A 561 LYS H 1.0 1.744 3.394 1035 1035 A 561 LYS HBy A 561 LYS H 1.0 1.712 3.250 1036 1036 A 562 ILE HG2% A 561 LYS H 1.0 1.961 4.923 1037 1037 A 558 LEU HDy% A 561 LYS H 1.0 1.969 5.033 1038 1038 A 561 LYS HA A 561 LYS H 1.0 1.813 3.745 1039 1039 A 561 LYS H A 560 GLY HAy 1.0 1.926 4.536 1040 1040 A 561 LYS HA A 562 ILE H 1.0 1.991 5.449 1041 1041 A 562 ILE HB A 562 ILE H 1.0 1.722 3.296 1042 1042 A 561 LYS HBx A 562 ILE H 1.0 1.944 4.712 1043 1043 A 562 ILE HG1y A 562 ILE H 1.0 1.924 4.516 1044 1044 A 562 ILE HG2% A 562 ILE H 1.0 1.779 3.561 1045 1045 A 563 SER HA A 563 SER H 1.0 1.843 3.915 1046 1046 A 563 SER HBy A 563 SER H 1.0 1.890 4.234 1047 1047 A 566 ASP HBx A 563 SER H 1.0 1.915 4.433 1048 1048 A 562 ILE HB A 563 SER H 1.0 1.898 4.296 1049 1049 A 562 ILE HG1x A 563 SER H 1.0 1.917 4.457 1050 1050 A 566 ASP HBy A 563 SER H 1.0 1.963 4.951 1051 1051 A 562 ILE HG1y A 563 SER H 1.0 1.911 4.407 1052 1052 A 562 ILE HG2% A 563 SER H 1.0 1.860 4.026 1053 1053 A 563 SER HA A 564 GLU H 1.0 1.770 3.520 1054 1054 A 564 GLU HA A 564 GLU H 1.0 1.742 3.388 1055 1055 A 564 GLU HBy A 564 GLU H 1.0 1.577 2.743 1056 1056 A 564 GLU HGy A 564 GLU H 1.0 1.211 1.765 1057 1057 A 565 ALA HB% A 564 GLU H 1.0 1.998 6.258 1058 1058 A 563 SER HBx A 565 ALA H 1.0 1.994 5.568 1059 1059 A 564 GLU HA A 565 ALA H 1.0 1.897 4.287 1060 1060 A 564 GLU HGy A 565 ALA H 1.0 1.846 3.930 1061 1061 A 566 ASP HA A 566 ASP H 1.0 1.853 3.979 1062 1062 A 565 ALA HA A 566 ASP H 1.0 1.834 3.858 1063 1063 A 566 ASP HBx A 566 ASP H 1.0 1.772 3.530 1064 1064 A 566 ASP HBy A 566 ASP H 1.0 1.837 3.879 1065 1065 A 565 ALA HB% A 566 ASP H 1.0 1.787 3.599 1066 1066 A 562 ILE HG2% A 566 ASP H 1.0 1.993 5.531 1067 1067 A 567 LYS HBx A 566 ASP H 1.0 1.969 5.031 1068 1068 A 567 LYS HBy A 566 ASP H 1.0 1.956 4.852 1069 1069 A 563 SER H A 566 ASP H 1.0 1.880 4.158 1070 1070 A 564 GLU HA A 567 LYS H 1.0 1.884 4.192 1071 1071 A 567 LYS HA A 567 LYS H 1.0 1.856 3.994 1072 1072 A 566 ASP HBx A 567 LYS H 1.0 1.882 4.178 1073 1073 A 567 LYS HBy A 567 LYS H 1.0 1.714 3.258 1074 1074 A 567 LYS HBx A 567 LYS H 1.0 1.661 3.049 1075 1075 A 567 LYS HGx A 567 LYS H 1.0 1.906 4.362 1076 1076 A 570 VAL HB A 567 LYS H 1.0 1.989 6.607 1077 1077 A 562 ILE HG2% A 567 LYS H 1.0 1.730 3.330 1078 1078 A 566 ASP HBy A 567 LYS H 1.0 1.874 4.120 1079 1079 A 562 ILE HD1% A 567 LYS H 1.0 1.564 2.700 1080 1080 A 568 LYS HA A 568 LYS H 1.0 1.787 3.605 1081 1081 A 567 LYS HA A 568 LYS H 1.0 1.946 4.742 1082 1082 A 565 ALA HA A 568 LYS H 1.0 1.889 4.227 1083 1083 A 568 LYS HBy A 568 LYS H 1.0 1.598 2.816 1084 1084 A 568 LYS HDy A 568 LYS H 1.0 1.866 4.060 1085 1085 A 568 LYS HGy A 568 LYS H 1.0 1.888 4.220 1086 1086 A 567 LYS HGx A 568 LYS H 1.0 1.884 4.192 1087 1087 A 562 ILE HG2% A 568 LYS H 1.0 1.994 5.580 1088 1088 A 571 LEU HG A 568 LYS H 1.0 1.985 5.321 1089 1089 A 569 LYS HA A 570 VAL H 1.0 1.881 4.165 1090 1090 A 568 LYS HA A 569 LYS H 1.0 1.972 5.076 1091 1091 A 570 VAL HA A 570 VAL H 1.0 1.819 3.775 1092 1092 A 570 VAL HGx% A 570 VAL H 1.0 1.692 3.168 1093 1093 A 570 VAL HGy% A 570 VAL H 1.0 1.921 4.495 1094 1094 A 569 LYS HGy A 569 LYS H 1.0 1.794 3.640 1095 1095 A 569 LYS HGx A 569 LYS H 1.0 1.786 3.596 1096 1096 A 568 LYS HBy A 569 LYS H 1.0 1.540 2.622 1097 1097 A 570 VAL HB A 570 VAL H 1.0 1.660 3.042 1098 1098 A 566 ASP HBy A 570 VAL H 1.0 2.000 6.142 1099 1099 A 571 LEU HA A 571 LEU H 1.0 1.772 3.530 1100 1100 A 570 VAL HA A 571 LEU H 1.0 1.781 3.569 1101 1101 A 567 LYS HA A 571 LEU H 1.0 1.876 4.126 1102 1102 A 570 VAL HB A 571 LEU H 1.0 1.864 4.054 1103 1103 A 571 LEU HBy A 571 LEU H 1.0 1.837 3.879 1104 1104 A 571 LEU HDx% A 571 LEU H 1.0 1.934 4.618 1105 1105 A 571 LEU HBx A 571 LEU H 1.0 1.731 3.335 1106 1106 A 571 LEU HDy% A 571 LEU H 1.0 1.923 4.505 1107 1107 A 570 VAL HGx% A 571 LEU H 1.0 1.867 4.071 1108 1108 A 571 LEU HBx A 572 ASP H 1.0 1.771 3.523 1109 1109 A 571 LEU HBy A 572 ASP H 1.0 1.862 4.032 1110 1110 A 571 LEU HDy% A 572 ASP H 1.0 2.000 5.946 1111 1111 A 575 GLN HBy A 572 ASP H 1.0 1.954 4.838 1112 1112 A 569 LYS HA A 572 ASP H 1.0 1.949 4.783 1113 1113 A 571 LEU HA A 572 ASP H 1.0 1.812 3.734 1114 1114 A 573 LYS HA A 573 LYS H 1.0 1.856 4.000 1115 1115 A 569 LYS HA A 573 LYS H 1.0 1.959 4.895 1116 1116 A 570 VAL HA A 573 LYS H 1.0 1.967 5.003 1117 1117 A 572 ASP HBx A 573 LYS H 1.0 1.837 3.875 1118 1118 A 572 ASP HBy A 573 LYS H 1.0 1.876 4.132 1119 1119 A 570 VAL HB A 573 LYS H 1.0 1.999 5.835 1120 1120 A 573 LYS HBy A 573 LYS H 1.0 1.676 3.106 1121 1121 A 573 LYS HGy A 573 LYS H 1.0 1.887 4.213 1122 1122 A 602 VAL HGx% A 573 LYS H 1.0 1.996 5.638 1123 1123 A 602 VAL HGy% A 573 LYS H 1.0 1.920 4.484 1124 1124 A 574 CYS HA A 574 CYS H 1.0 1.798 3.662 1125 1125 A 573 LYS HA A 574 CYS H 1.0 1.952 4.798 1126 1126 A 574 CYS HBx A 574 CYS H 1.0 1.806 3.704 1127 1127 A 574 CYS H A 550 LYS HEx 1.0 1.944 4.722 1128 1128 A 574 CYS HBy A 574 CYS H 1.0 1.851 3.969 1129 1129 A 573 LYS HBy A 574 CYS H 1.0 1.825 3.805 1130 1130 A 575 GLN HBx A 574 CYS H 1.0 2.000 5.848 1131 1131 A 602 VAL HGy% A 574 CYS H 1.0 1.943 4.705 1132 1132 A 550 LYS HDy A 574 CYS H 1.0 1.987 6.663 1133 1133 A 573 LYS HGy A 574 CYS H 1.0 1.995 5.631 1134 1134 A 572 ASP HA A 575 GLN H 1.0 1.891 4.241 1135 1135 A 575 GLN HA A 575 GLN H 1.0 1.808 3.714 1136 1136 A 574 CYS HBx A 575 GLN H 1.0 1.797 3.653 1137 1137 A 575 GLN HGy A 575 GLN H 1.0 1.762 3.482 1138 1138 A 575 GLN HE2y A 575 GLN HE2x 1.0 1.511 2.535 1139 1139 A 575 GLN HGy A 575 GLN HE2y 1.0 1.829 3.829 1140 1140 A 575 GLN HGy A 575 GLN HE2x 1.0 1.927 4.547 1141 1141 A 575 GLN HA A 575 GLN HE2y 1.0 2.000 6.014 1142 1142 A 575 GLN HBx A 575 GLN HE2y 1.0 1.992 5.514 1143 1143 A 578 ILE HG2% A 575 GLN HE2x 1.0 1.948 4.764 1144 1144 A 578 ILE HG2% A 575 GLN HE2y 1.0 1.801 3.671 1145 1145 A 573 LYS HA A 576 GLU H 1.0 1.856 4.000 1146 1146 A 576 GLU HA A 576 GLU H 1.0 1.751 3.429 1147 1147 A 577 VAL HGy% A 576 GLU H 1.0 1.949 7.325 1148 1148 A 577 VAL HGx% A 576 GLU H 1.0 1.839 3.889 1149 1149 A 576 GLU HA A 577 VAL H 1.0 1.768 3.510 1150 1150 A 577 VAL HA A 577 VAL H 1.0 1.645 2.983 1151 1151 A 577 VAL HGx% A 577 VAL H 1.0 1.642 2.974 1152 1152 A 577 VAL HB A 577 VAL H 1.0 1.634 2.946 1153 1153 A 575 GLN HA A 578 ILE H 1.0 1.850 3.964 1154 1154 A 577 VAL HA A 578 ILE H 1.0 1.816 3.756 1155 1155 A 577 VAL HB A 578 ILE H 1.0 1.899 4.303 1156 1156 A 578 ILE HB A 578 ILE H 1.0 1.702 3.206 1157 1157 A 578 ILE HG1x A 578 ILE H 1.0 1.863 4.043 1158 1158 A 578 ILE HG1y A 578 ILE H 1.0 1.717 3.271 1159 1159 A 546 ALA HB% A 578 ILE H 1.0 1.965 4.981 1160 1160 A 578 ILE HD1% A 578 ILE H 1.0 1.920 4.486 1161 1161 A 579 SER HA A 579 SER H 1.0 1.834 3.858 1162 1162 A 579 SER HBy A 579 SER H 1.0 1.681 3.125 1163 1163 A 578 ILE HA A 579 SER H 1.0 1.895 4.273 1164 1164 A 578 ILE HB A 579 SER H 1.0 1.817 3.767 1165 1165 A 578 ILE HG2% A 579 SER H 1.0 1.858 4.010 1166 1166 A 578 ILE HG1x A 579 SER H 1.0 1.978 5.196 1167 1167 A 575 GLN HBx A 579 SER H 1.0 1.985 5.313 1168 1168 A 576 GLU HBx A 579 SER H 1.0 1.998 6.272 1169 1169 A 580 TRP HE3 A 580 TRP H 1.0 1.966 4.990 1170 1170 A 581 LEU HBx A 580 TRP H 1.0 1.969 5.029 1171 1171 A 583 ALA HB% A 580 TRP H 1.0 1.953 4.823 1172 1172 A 581 LEU HDx% A 580 TRP H 1.0 1.993 6.483 1173 1173 A 580 TRP HA A 580 TRP H 1.0 1.704 3.220 1174 1174 A 580 TRP HBx A 580 TRP H 1.0 1.686 3.142 1175 1175 A 580 TRP HBy A 580 TRP H 1.0 1.740 3.376 1176 1176 A 579 SER HA A 580 TRP H 1.0 1.968 5.020 1177 1177 A 580 TRP HBx A 581 LEU H 1.0 1.718 3.274 1178 1178 A 580 TRP HBy A 581 LEU H 1.0 1.940 4.668 1179 1179 A 581 LEU HBx A 581 LEU H 1.0 1.649 2.997 1180 1180 A 581 LEU HBy A 581 LEU H 1.0 1.819 3.775 1181 1181 A 581 LEU HDy% A 581 LEU H 1.0 1.961 4.923 1182 1182 A 581 LEU HDx% A 581 LEU H 1.0 1.859 4.021 1183 1183 A 582 ASP HA A 582 ASP H 1.0 1.799 3.665 1184 1184 A 581 LEU HA A 582 ASP H 1.0 1.913 4.417 1185 1185 A 581 LEU HBx A 582 ASP H 1.0 1.757 3.455 1186 1186 A 583 ALA HB% A 582 ASP H 1.0 1.900 4.312 1187 1187 A 581 LEU HDx% A 582 ASP H 1.0 1.916 4.446 1188 1188 A 582 ASP HBx A 582 ASP H 1.0 1.641 2.969 1189 1189 A 582 ASP HBy A 582 ASP H 1.0 1.590 2.788 1190 1190 A 581 LEU HBy A 582 ASP H 1.0 1.786 3.596 1191 1191 A 583 ALA HA A 583 ALA H 1.0 1.821 3.785 1192 1192 A 580 TRP HA A 583 ALA H 1.0 1.980 5.222 1193 1193 A 580 TRP HBx A 583 ALA H 1.0 1.993 5.551 1194 1194 A 582 ASP HBx A 583 ALA H 1.0 1.812 3.734 1195 1195 A 582 ASP HBy A 583 ALA H 1.0 1.921 4.495 1196 1196 A 583 ALA HA A 584 ASN H 1.0 1.925 4.531 1197 1197 A 580 TRP HA A 584 ASN H 1.0 1.975 5.127 1198 1198 A 581 LEU HA A 584 ASN H 1.0 1.943 4.701 1199 1199 A 584 ASN HBx A 584 ASN H 1.0 1.885 4.199 1200 1200 A 583 ALA HB% A 584 ASN H 1.0 1.835 3.871 1201 1201 A 584 ASN HBy A 584 ASN H 1.0 1.832 3.854 1202 1202 A 585 THR HA A 585 THR H 1.0 1.840 3.902 1203 1203 A 585 THR HB A 585 THR H 1.0 1.876 4.132 1204 1204 A 585 THR HG2% A 585 THR H 1.0 1.806 3.704 1205 1205 A 586 LEU HDx% A 585 THR H 1.0 1.983 5.273 1206 1206 A 586 LEU HG A 585 THR H 1.0 2.000 6.064 1207 1207 A 585 THR HA A 586 LEU H 1.0 1.951 4.807 1208 1208 A 585 THR HB A 586 LEU H 1.0 1.869 4.083 1209 1209 A 586 LEU HBx A 586 LEU H 1.0 1.986 6.682 1210 1210 A 586 LEU HBy A 586 LEU H 1.0 1.599 2.817 1211 1211 A 585 THR HG2% A 586 LEU H 1.0 1.983 5.279 1212 1212 A 587 ALA HB% A 586 LEU H 1.0 1.978 5.180 1213 1213 A 586 LEU HDy% A 586 LEU H 1.0 1.928 4.560 1214 1214 A 587 ALA HA A 587 ALA H 1.0 1.838 3.884 1215 1215 A 587 ALA HB% A 587 ALA H 1.0 1.701 3.207 1216 1216 A 586 LEU HG A 587 ALA H 1.0 1.997 5.709 1217 1217 A 586 LEU HBy A 587 ALA H 1.0 1.874 4.120 1218 1218 A 586 LEU HBx A 587 ALA H 1.0 1.999 5.821 1219 1219 A 588 GLU HA A 588 GLU H 1.0 1.880 4.158 1220 1220 A 587 ALA HA A 588 GLU H 1.0 1.665 3.061 1221 1221 A 587 ALA HB% A 588 GLU H 1.0 1.754 3.440 1222 1222 A 588 GLU HBy A 588 GLU H 1.0 1.797 3.655 1223 1223 A 588 GLU HBx A 588 GLU H 1.0 1.765 3.493 1224 1224 A 589 LYS HA A 589 LYS H 1.0 1.835 3.871 1225 1225 A 588 GLU HA A 589 LYS H 1.0 1.719 3.281 1226 1226 A 588 GLU HBx A 589 LYS H 1.0 1.765 3.493 1227 1227 A 588 GLU HBy A 589 LYS H 1.0 1.661 3.047 1228 1228 A 589 LYS HGx A 589 LYS H 1.0 1.812 3.738 1229 1229 A 589 LYS HGy A 589 LYS H 1.0 1.806 3.704 1230 1230 A 589 LYS HA A 590 ASP H 1.0 1.959 4.897 1231 1231 A 590 ASP HA A 590 ASP H 1.0 1.815 3.749 1232 1232 A 590 ASP HBy A 590 ASP H 1.0 1.822 3.794 1233 1233 A 588 GLU HBx A 590 ASP H 1.0 1.838 3.884 1234 1234 A 589 LYS HBx A 590 ASP H 1.0 1.918 4.464 1235 1235 A 589 LYS HBy A 590 ASP H 1.0 1.727 3.317 1236 1236 A 589 LYS HGy A 590 ASP H 1.0 1.860 4.026 1237 1237 A 589 LYS HGx A 590 ASP H 1.0 1.841 3.907 1238 1238 A 590 ASP HA A 591 GLU H 1.0 1.897 4.287 1239 1239 A 591 GLU HA A 591 GLU H 1.0 1.716 3.270 1240 1240 A 587 ALA HB% A 591 GLU H 1.0 1.948 4.764 1241 1241 A 599 LEU HBy A 599 LEU H 1.0 1.737 3.359 1242 1242 A 591 GLU HBx A 591 GLU H 1.0 1.499 2.495 1243 1243 A 591 GLU HA A 592 PHE H 1.0 1.873 4.113 1244 1244 A 592 PHE HA A 592 PHE H 1.0 1.738 3.368 1245 1245 A 592 PHE HBy A 592 PHE H 1.0 1.750 3.420 1246 1246 A 591 GLU HBx A 592 PHE H 1.0 1.757 3.455 1247 1247 A 591 GLU HBy A 592 PHE H 1.0 1.806 3.700 1248 1248 A 590 ASP HBy A 592 PHE H 1.0 1.960 7.172 1249 1249 A 597 LYS HA A 597 LYS H 1.0 1.793 3.635 1250 1250 A 596 ARG HA A 597 LYS H 1.0 1.934 4.616 1251 1251 A 590 ASP HA A 593 GLU H 1.0 1.880 4.158 1252 1252 A 593 GLU HA A 593 GLU H 1.0 1.736 3.358 1253 1253 A 592 PHE HBy A 593 GLU H 1.0 1.761 3.477 1254 1254 A 593 GLU HGy A 593 GLU H 1.0 1.744 3.396 1255 1255 A 597 LYS HBy A 597 LYS H 1.0 1.631 2.935 1256 1256 A 596 ARG HBx A 597 LYS H 1.0 1.643 2.977 1257 1257 A 594 HIS HBy A 595 LYS H 1.0 1.760 3.466 1258 1258 A 595 LYS HA A 595 LYS H 1.0 1.832 3.854 1259 1259 A 594 HIS HA A 595 LYS H 1.0 1.902 4.320 1260 1260 A 595 LYS HBx A 595 LYS H 1.0 1.563 2.695 1261 1261 A 595 LYS HBy A 595 LYS H 1.0 1.554 2.666 1262 1262 A 595 LYS HGx A 595 LYS H 1.0 1.934 4.606 1263 1263 A 595 LYS HGy A 595 LYS H 1.0 1.992 5.500 1264 1264 A 595 LYS HDy A 595 LYS H 1.0 1.880 4.158 1265 1265 A 593 GLU HA A 596 ARG H 1.0 1.778 3.556 1266 1266 A 596 ARG HA A 596 ARG H 1.0 1.706 3.226 1267 1267 A 596 ARG HBy A 596 ARG H 1.0 1.690 3.162 1268 1268 A 596 ARG HBx A 596 ARG H 1.0 1.643 2.977 1269 1269 A 596 ARG HDx A 596 ARG H 1.0 2.000 5.946 1270 1270 A 595 LYS HBx A 596 ARG H 1.0 1.546 2.644 1271 1271 A 595 LYS HBy A 596 ARG H 1.0 1.816 3.756 1272 1272 A 596 ARG HDy A 596 ARG HE 1.0 1.874 4.120 1273 1273 A 596 ARG HDx A 596 ARG HE 1.0 1.921 4.489 1274 1274 A 596 ARG HGx A 596 ARG HE 1.0 1.882 4.178 1275 1275 A 596 ARG HBx A 596 ARG HE 1.0 1.915 4.443 1276 1276 A 593 GLU HA A 596 ARG HE 1.0 1.671 3.087 1277 1277 A 597 LYS HGy A 597 LYS H 1.0 1.416 2.262 1278 1278 A 542 LEU HDy% A 597 LYS H 1.0 1.990 6.570 1279 1279 A 597 LYS HDy A 597 LYS H 1.0 1.835 3.867 1280 1280 A 597 LYS HA A 598 GLU H 1.0 1.767 3.501 1281 1281 A 595 LYS HA A 598 GLU H 1.0 1.879 4.151 1282 1282 A 597 LYS HBy A 598 GLU H 1.0 1.688 3.152 1283 1283 A 598 GLU HBx A 598 GLU H 1.0 1.694 3.178 1284 1284 A 598 GLU HGx A 598 GLU H 1.0 1.720 3.286 1285 1285 A 599 LEU HBy A 598 GLU H 1.0 1.962 4.944 1286 1286 A 599 LEU HG A 599 LEU H 1.0 1.925 4.527 1287 1287 A 595 LYS HA A 599 LEU H 1.0 1.923 4.505 1288 1288 A 599 LEU HA A 599 LEU H 1.0 1.823 3.797 1289 1289 A 599 LEU HBx A 599 LEU H 1.0 1.783 3.583 1290 1290 A 598 GLU HBy A 599 LEU H 1.0 1.694 3.180 1291 1291 A 599 LEU HDx% A 599 LEU H 1.0 1.963 4.941 1292 1292 A 600 GLU HA A 600 GLU H 1.0 1.830 3.838 1293 1293 A 600 GLU HBy A 600 GLU H 1.0 1.761 3.473 1294 1294 A 599 LEU HBx A 600 GLU H 1.0 1.679 3.115 1295 1295 A 599 LEU HBy A 600 GLU H 1.0 1.848 3.944 1296 1296 A 599 LEU HDx% A 600 GLU H 1.0 1.806 3.704 1297 1297 A 599 LEU HG A 600 GLU H 1.0 1.967 5.015 1298 1298 A 601 GLN HA A 601 GLN H 1.0 1.703 3.213 1299 1299 A 600 GLU HBy A 601 GLN H 1.0 1.619 2.889 1300 1300 A 601 GLN HGx A 601 GLN H 1.0 1.696 3.186 1301 1301 A 601 GLN HGy A 601 GLN H 1.0 1.722 3.292 1302 1302 A 601 GLN HE2y A 601 GLN HE2x 1.0 1.524 2.574 1303 1303 A 602 VAL HA A 602 VAL H 1.0 1.831 3.845 1304 1304 A 599 LEU HA A 602 VAL H 1.0 1.812 3.734 1305 1305 A 573 LYS HEx A 602 VAL H 1.0 1.993 5.537 1306 1306 A 601 GLN HGy A 602 VAL H 1.0 2.000 5.920 1307 1307 A 602 VAL HB A 602 VAL H 1.0 1.685 3.139 1308 1308 A 602 VAL HGx% A 602 VAL H 1.0 1.843 3.911 1309 1309 A 602 VAL HGy% A 602 VAL H 1.0 1.944 4.722 1310 1310 A 603 CYS HA A 603 CYS H 1.0 1.813 3.741 1311 1311 A 602 VAL HA A 603 CYS H 1.0 1.958 4.892 1312 1312 A 600 GLU HA A 603 CYS H 1.0 1.928 4.554 1313 1313 A 603 CYS HBx A 603 CYS H 1.0 1.832 3.850 1314 1314 A 602 VAL HB A 603 CYS H 1.0 1.830 3.838 1315 1315 A 602 VAL HGx% A 603 CYS H 1.0 1.919 4.471 1316 1316 A 602 VAL HGy% A 603 CYS H 1.0 1.982 5.252 1317 1317 A 603 CYS HBy A 603 CYS H 1.0 1.884 4.192 1318 1318 A 573 LYS HEx A 603 CYS H 1.0 1.997 6.293 1319 1319 A 600 GLU HA A 604 ASN H 1.0 1.954 4.832 1320 1320 A 604 ASN HA A 604 ASN H 1.0 1.925 4.523 1321 1321 A 604 ASN HBx A 604 ASN H 1.0 1.750 3.420 1322 1322 A 605 PRO HDx A 604 ASN H 1.0 1.858 4.010 1323 1323 A 605 PRO HDy A 604 ASN H 1.0 1.863 4.043 1324 1324 A 604 ASN HBy A 604 ASN H 1.0 1.755 3.443 1325 1325 A 604 ASN HD2y A 604 ASN HD2x 1.0 1.503 2.511 1326 1326 A 604 ASN HBx A 604 ASN HD2x 1.0 1.939 4.657 1327 1327 A 604 ASN HBy A 604 ASN HD2x 1.0 1.944 4.718 1328 1328 A 604 ASN HBx A 604 ASN HD2y 1.0 1.862 4.038 1329 1329 A 604 ASN HBy A 604 ASN HD2y 1.0 1.883 4.185 1330 1330 A 605 PRO HGx A 604 ASN HD2y 1.0 1.980 5.210 1331 1331 A 601 GLN HBy A 604 ASN HD2x 1.0 1.956 4.846 1332 1332 A 605 PRO HGx A 604 ASN HD2x 1.0 1.810 3.724 1333 1333 A 605 PRO HGx A 604 ASN H 1.0 1.984 5.310 1334 1334 A 600 GLU HBy A 604 ASN H 1.0 1.994 5.544 1335 1335 A 605 PRO HDy A 606 ILE H 1.0 1.859 4.021 1336 1336 A 603 CYS HA A 606 ILE H 1.0 1.981 5.235 1337 1337 A 606 ILE HB A 606 ILE H 1.0 1.764 3.484 1338 1338 A 606 ILE HG2% A 606 ILE H 1.0 1.928 4.552 1339 1339 A 606 ILE HG1y A 606 ILE H 1.0 1.783 3.583 1340 1340 A 605 PRO HGx A 606 ILE H 1.0 1.953 4.813 1341 1341 A 607 ILE HB A 607 ILE H 1.0 1.687 3.149 1342 1342 A 606 ILE HB A 607 ILE H 1.0 1.893 4.257 1343 1343 A 607 ILE HG1x A 607 ILE H 1.0 1.889 4.227 1344 1344 A 607 ILE HG1y A 607 ILE H 1.0 1.873 4.107 1345 1345 A 606 ILE HG1y A 607 ILE H 1.0 1.950 4.780 1346 1346 A 608 SER HBy A 608 SER H 1.0 1.719 3.281 1347 1347 A 607 ILE HG2% A 607 ILE H 1.0 1.917 4.445 1348 1348 A 610 LEU HG A 609 GLY H 1.0 1.953 4.819 1349 1349 A 609 GLY H A 610 LEU HDy% 1.0 2.000 5.920 1350 1350 A 610 LEU HA A 610 LEU H 1.0 1.701 3.207 1351 1351 A 610 LEU H A 609 GLY HAy 1.0 1.744 3.396 1352 1352 A 610 LEU HBx A 610 LEU H 1.0 1.796 3.650 1353 1353 A 610 LEU H A 610 LEU HDy% 1.0 1.909 4.389 1354 1354 A 610 LEU HBy A 610 LEU H 1.0 1.578 2.750 stop_ save_