data_nef_c30296_5vwe 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 5VWE stop_ 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 549 GLY start . false 2 A 550 HIS middle . . 3 A 551 MET middle . . 4 A 552 SER middle . . 5 A 553 ALA middle . . 6 A 554 TYR middle . . 7 A 555 MET middle . . 8 A 556 LEU middle . . 9 A 557 TRP middle . . 10 A 558 LEU middle . . 11 A 559 ASN middle . . 12 A 560 ALA middle . . 13 A 561 SER middle . . 14 A 562 ARG middle . . 15 A 563 GLU middle . . 16 A 564 LYS middle . . 17 A 565 ILE middle . . 18 A 566 LYS middle . . 19 A 567 SER middle . . 20 A 568 ASP middle . . 21 A 569 HIS middle . . 22 A 570 PRO middle . false 23 A 571 GLY middle . false 24 A 572 ILE middle . . 25 A 573 SER middle . . 26 A 574 ILE middle . . 27 A 575 THR middle . . 28 A 576 ASP middle . . 29 A 577 LEU middle . . 30 A 578 SER middle . . 31 A 579 LYS middle . . 32 A 580 LYS middle . . 33 A 581 ALA middle . . 34 A 582 GLY middle . false 35 A 583 GLU middle . . 36 A 584 ILE middle . . 37 A 585 TRP middle . . 38 A 586 LYS middle . . 39 A 587 GLY middle . false 40 A 588 MET middle . . 41 A 589 SER middle . . 42 A 590 LYS middle . . 43 A 591 GLU middle . . 44 A 592 LYS middle . . 45 A 593 LYS middle . . 46 A 594 GLU middle . . 47 A 595 GLU middle . . 48 A 596 TRP middle . . 49 A 597 ASP middle . . 50 A 598 ARG middle . . 51 A 599 LYS middle . . 52 A 600 ALA middle . . 53 A 601 GLU middle . . 54 A 602 ASP middle . . 55 A 603 ALA middle . . 56 A 604 ARG middle . . 57 A 605 ARG middle . . 58 A 606 ASP middle . . 59 A 607 TYR middle . . 60 A 608 GLU middle . . 61 A 609 LYS middle . . 62 A 610 ALA middle . . 63 A 611 MET middle . . 64 A 612 LYS middle . . 65 A 613 GLU middle . . 66 A 614 TYR middle . . 67 A 615 GLU middle . . 68 A 616 GLY middle . false 69 A 617 GLY end . false stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 552 SER C C 13 171.247 0.30 A 553 ALA H H 1 8.900 0.03 A 553 ALA HA H 1 4.007 0.03 A 553 ALA HB% H 1 1.713 0.03 A 553 ALA C C 13 175.111 0.30 A 553 ALA CA C 13 56.301 0.30 A 553 ALA CB C 13 19.045 0.30 A 553 ALA N N 15 124.126 0.30 A 554 TYR H H 1 7.974 0.03 A 554 TYR HA H 1 2.420 0.03 A 554 TYR HBx H 1 1.985 0.03 A 554 TYR HDx H 1 5.836 0.03 A 554 TYR HDy H 1 5.836 0.03 A 554 TYR HEx H 1 6.455 0.03 A 554 TYR HEy H 1 6.455 0.03 A 554 TYR C C 13 173.397 0.30 A 554 TYR CA C 13 60.052 0.30 A 554 TYR CB C 13 38.123 0.30 A 554 TYR N N 15 115.718 0.30 A 555 MET H H 1 7.452 0.03 A 555 MET HA H 1 3.643 0.03 A 555 MET HBx H 1 2.387 0.03 A 555 MET HBy H 1 2.565 0.03 A 555 MET HE% H 1 1.922 0.03 A 555 MET HGx H 1 1.960 0.03 A 555 MET HGy H 1 1.960 0.03 A 555 MET C C 13 176.217 0.30 A 555 MET CA C 13 57.370 0.30 A 555 MET CB C 13 32.711 0.30 A 555 MET CE C 13 16.591 0.30 A 555 MET CG C 13 32.067 0.30 A 555 MET N N 15 116.280 0.30 A 556 LEU H H 1 8.157 0.03 A 556 LEU HA H 1 3.903 0.03 A 556 LEU HBx H 1 1.769 0.03 A 556 LEU HBy H 1 2.072 0.03 A 556 LEU HDx% H 1 0.888 0.03 A 556 LEU HDy% H 1 0.907 0.03 A 556 LEU HG H 1 1.792 0.03 A 556 LEU C C 13 176.458 0.30 A 556 LEU CA C 13 58.140 0.30 A 556 LEU CB C 13 41.997 0.30 A 556 LEU CDy C 13 25.442 0.30 A 556 LEU CDx C 13 23.955 0.30 A 556 LEU CG C 13 27.050 0.30 A 556 LEU N N 15 120.825 0.30 A 557 TRP H H 1 8.082 0.03 A 557 TRP HA H 1 2.043 0.03 A 557 TRP HBx H 1 1.616 0.03 A 557 TRP HBy H 1 2.532 0.03 A 557 TRP HD1 H 1 6.233 0.03 A 557 TRP HE1 H 1 9.690 0.03 A 557 TRP HE3 H 1 6.781 0.03 A 557 TRP HH2 H 1 7.151 0.03 A 557 TRP HZ2 H 1 7.282 0.03 A 557 TRP HZ3 H 1 6.814 0.03 A 557 TRP C C 13 175.957 0.30 A 557 TRP CA C 13 60.992 0.30 A 557 TRP CB C 13 27.289 0.30 A 557 TRP N N 15 123.560 0.30 A 557 TRP NE1 N 15 129.541 0.30 A 558 LEU H H 1 8.788 0.03 A 558 LEU HA H 1 2.541 0.03 A 558 LEU HBx H 1 0.598 0.03 A 558 LEU HBy H 1 1.235 0.03 A 558 LEU HDx% H 1 0.579 0.03 A 558 LEU HDy% H 1 0.330 0.03 A 558 LEU HG H 1 0.991 0.03 A 558 LEU C C 13 175.995 0.30 A 558 LEU CA C 13 57.412 0.30 A 558 LEU CB C 13 40.555 0.30 A 558 LEU CDy C 13 25.521 0.30 A 558 LEU CDx C 13 22.633 0.30 A 558 LEU CG C 13 26.645 0.30 A 558 LEU N N 15 123.901 0.30 A 559 ASN H H 1 7.896 0.03 A 559 ASN HA H 1 4.095 0.03 A 559 ASN HBx H 1 2.603 0.03 A 559 ASN HBy H 1 2.663 0.03 A 559 ASN HD2y H 1 7.521 0.03 A 559 ASN HD2x H 1 6.830 0.03 A 559 ASN C C 13 175.089 0.30 A 559 ASN CA C 13 55.729 0.30 A 559 ASN CB C 13 37.750 0.30 A 559 ASN N N 15 116.354 0.30 A 559 ASN ND2 N 15 111.880 0.30 A 560 ALA H H 1 7.228 0.03 A 560 ALA HA H 1 4.168 0.03 A 560 ALA HB% H 1 1.436 0.03 A 560 ALA C C 13 176.858 0.30 A 560 ALA CA C 13 53.764 0.30 A 560 ALA CB C 13 19.680 0.30 A 560 ALA N N 15 119.881 0.30 A 561 SER H H 1 7.389 0.03 A 561 SER HA H 1 4.265 0.03 A 561 SER HBx H 1 2.241 0.03 A 561 SER HBy H 1 3.234 0.03 A 561 SER C C 13 171.531 0.30 A 561 SER CA C 13 59.251 0.30 A 561 SER CB C 13 63.492 0.30 A 561 SER N N 15 112.561 0.30 A 562 ARG H H 1 7.923 0.03 A 562 ARG HA H 1 3.358 0.03 A 562 ARG HBx H 1 1.564 0.03 A 562 ARG HBy H 1 1.782 0.03 A 562 ARG HDx H 1 3.034 0.03 A 562 ARG HDy H 1 3.034 0.03 A 562 ARG HGx H 1 1.332 0.03 A 562 ARG HGy H 1 1.332 0.03 A 562 ARG C C 13 174.278 0.30 A 562 ARG CA C 13 60.671 0.30 A 562 ARG CB C 13 29.969 0.30 A 562 ARG CD C 13 43.199 0.30 A 562 ARG CG C 13 27.555 0.30 A 562 ARG N N 15 122.112 0.30 A 563 GLU H H 1 8.305 0.03 A 563 GLU HA H 1 3.848 0.03 A 563 GLU HBx H 1 1.808 0.03 A 563 GLU HBy H 1 1.922 0.03 A 563 GLU HGx H 1 2.170 0.03 A 563 GLU HGy H 1 2.237 0.03 A 563 GLU C C 13 176.056 0.30 A 563 GLU CA C 13 59.130 0.30 A 563 GLU CB C 13 28.365 0.30 A 563 GLU CG C 13 36.215 0.30 A 563 GLU N N 15 116.473 0.30 A 564 LYS H H 1 7.734 0.03 A 564 LYS HA H 1 4.028 0.03 A 564 LYS HBx H 1 1.785 0.03 A 564 LYS HBy H 1 1.895 0.03 A 564 LYS HDx H 1 1.553 0.03 A 564 LYS HDy H 1 1.685 0.03 A 564 LYS HEx H 1 2.973 0.03 A 564 LYS HEy H 1 2.973 0.03 A 564 LYS HGx H 1 1.369 0.03 A 564 LYS HGy H 1 1.369 0.03 A 564 LYS C C 13 175.502 0.30 A 564 LYS CA C 13 58.610 0.30 A 564 LYS CB C 13 31.894 0.30 A 564 LYS CD C 13 28.590 0.30 A 564 LYS CE C 13 42.244 0.30 A 564 LYS CG C 13 24.737 0.30 A 564 LYS N N 15 122.918 0.30 A 565 ILE H H 1 7.868 0.03 A 565 ILE HA H 1 3.844 0.03 A 565 ILE HB H 1 1.550 0.03 A 565 ILE HD1% H 1 0.492 0.03 A 565 ILE HG1x H 1 0.914 0.03 A 565 ILE HG1y H 1 1.619 0.03 A 565 ILE HG2% H 1 0.728 0.03 A 565 ILE C C 13 176.601 0.30 A 565 ILE CA C 13 65.573 0.30 A 565 ILE CB C 13 38.113 0.30 A 565 ILE CD1 C 13 13.809 0.30 A 565 ILE CG1 C 13 28.066 0.30 A 565 ILE CG2 C 13 17.657 0.30 A 565 ILE N N 15 119.282 0.30 A 566 LYS H H 1 8.127 0.03 A 566 LYS HA H 1 3.798 0.03 A 566 LYS HBx H 1 1.685 0.03 A 566 LYS HBy H 1 1.829 0.03 A 566 LYS HDx H 1 1.454 0.03 A 566 LYS HDy H 1 1.526 0.03 A 566 LYS HEx H 1 2.767 0.03 A 566 LYS HEy H 1 2.822 0.03 A 566 LYS HGx H 1 1.214 0.03 A 566 LYS HGy H 1 1.456 0.03 A 566 LYS C C 13 176.373 0.30 A 566 LYS CA C 13 60.034 0.30 A 566 LYS CB C 13 32.300 0.30 A 566 LYS CD C 13 29.478 0.30 A 566 LYS CE C 13 41.555 0.30 A 566 LYS CG C 13 25.661 0.30 A 566 LYS N N 15 118.623 0.30 A 567 SER H H 1 8.006 0.03 A 567 SER HA H 1 4.033 0.03 A 567 SER HBx H 1 3.876 0.03 A 567 SER HBy H 1 3.923 0.03 A 567 SER C C 13 173.365 0.30 A 567 SER CA C 13 61.181 0.30 A 567 SER CB C 13 62.742 0.30 A 567 SER N N 15 114.846 0.30 A 568 ASP H H 1 7.956 0.03 A 568 ASP HA H 1 4.313 0.03 A 568 ASP HBx H 1 2.169 0.03 A 568 ASP HBy H 1 2.645 0.03 A 568 ASP C C 13 172.776 0.30 A 568 ASP CA C 13 55.347 0.30 A 568 ASP CB C 13 40.977 0.30 A 568 ASP N N 15 119.776 0.30 A 569 HIS H H 1 7.377 0.03 A 569 HIS HA H 1 4.737 0.03 A 569 HIS HBx H 1 2.834 0.03 A 569 HIS HBy H 1 3.027 0.03 A 569 HIS HD2 H 1 7.021 0.03 A 569 HIS HE1 H 1 7.819 0.03 A 569 HIS C C 13 168.002 0.30 A 569 HIS CA C 13 53.985 0.30 A 569 HIS CB C 13 29.633 0.30 A 569 HIS N N 15 118.316 0.30 A 570 PRO HA H 1 4.335 0.03 A 570 PRO HBx H 1 1.824 0.03 A 570 PRO HBy H 1 2.187 0.03 A 570 PRO HDx H 1 3.304 0.03 A 570 PRO HDy H 1 3.402 0.03 A 570 PRO HGx H 1 1.888 0.03 A 570 PRO HGy H 1 1.961 0.03 A 570 PRO C C 13 176.330 0.30 A 570 PRO CA C 13 63.963 0.30 A 570 PRO CB C 13 31.402 0.30 A 570 PRO CD C 13 49.666 0.30 A 570 PRO CG C 13 27.614 0.30 A 571 GLY H H 1 8.773 0.03 A 571 GLY HAy H 1 4.017 0.03 A 571 GLY HAx H 1 3.683 0.03 A 571 GLY C C 13 172.059 0.30 A 571 GLY CA C 13 45.332 0.30 A 571 GLY N N 15 112.042 0.30 A 572 ILE H H 1 7.723 0.03 A 572 ILE HA H 1 4.188 0.03 A 572 ILE HB H 1 2.179 0.03 A 572 ILE HD1% H 1 0.511 0.03 A 572 ILE HG1y H 1 1.554 0.03 A 572 ILE HG1x H 1 1.450 0.03 A 572 ILE HG2% H 1 0.905 0.03 A 572 ILE C C 13 172.276 0.30 A 572 ILE CA C 13 61.721 0.30 A 572 ILE CB C 13 38.230 0.30 A 572 ILE CD1 C 13 13.507 0.30 A 572 ILE CG1 C 13 28.630 0.30 A 572 ILE CG2 C 13 16.852 0.30 A 572 ILE N N 15 121.024 0.30 A 573 SER H H 1 9.000 0.03 A 573 SER HA H 1 4.420 0.03 A 573 SER HBx H 1 4.008 0.03 A 573 SER HBy H 1 4.277 0.03 A 573 SER C C 13 172.325 0.30 A 573 SER CA C 13 57.221 0.30 A 573 SER CB C 13 65.244 0.30 A 573 SER N N 15 123.212 0.30 A 574 ILE H H 1 8.662 0.03 A 574 ILE HA H 1 3.779 0.03 A 574 ILE HB H 1 1.831 0.03 A 574 ILE HD1% H 1 0.809 0.03 A 574 ILE HG1y H 1 1.525 0.03 A 574 ILE HG1x H 1 1.225 0.03 A 574 ILE HG2% H 1 0.882 0.03 A 574 ILE C C 13 176.176 0.30 A 574 ILE CA C 13 64.549 0.30 A 574 ILE CB C 13 37.675 0.30 A 574 ILE CD1 C 13 12.811 0.30 A 574 ILE CG1 C 13 28.584 0.30 A 574 ILE CG2 C 13 17.421 0.30 A 574 ILE N N 15 120.632 0.30 A 575 THR H H 1 7.883 0.03 A 575 THR HA H 1 3.986 0.03 A 575 THR HB H 1 3.991 0.03 A 575 THR HG2% H 1 1.156 0.03 A 575 THR C C 13 174.408 0.30 A 575 THR CA C 13 65.324 0.30 A 575 THR CB C 13 68.180 0.30 A 575 THR CG2 C 13 21.946 0.30 A 575 THR N N 15 114.682 0.30 A 576 ASP H H 1 7.790 0.03 A 576 ASP HA H 1 4.470 0.03 A 576 ASP HBx H 1 2.437 0.03 A 576 ASP HBy H 1 2.734 0.03 A 576 ASP C C 13 176.091 0.30 A 576 ASP CA C 13 56.980 0.30 A 576 ASP CB C 13 39.345 0.30 A 576 ASP N N 15 123.748 0.30 A 577 LEU H H 1 8.721 0.03 A 577 LEU HA H 1 3.808 0.03 A 577 LEU HBx H 1 1.549 0.03 A 577 LEU HBy H 1 1.855 0.03 A 577 LEU HDx% H 1 0.733 0.03 A 577 LEU HDy% H 1 0.762 0.03 A 577 LEU HG H 1 1.487 0.03 A 577 LEU C C 13 175.305 0.30 A 577 LEU CA C 13 58.882 0.30 A 577 LEU CB C 13 41.168 0.30 A 577 LEU CDy C 13 25.224 0.30 A 577 LEU CDx C 13 24.856 0.30 A 577 LEU CG C 13 27.576 0.30 A 577 LEU N N 15 124.958 0.30 A 578 SER H H 1 7.633 0.03 A 578 SER HA H 1 4.037 0.03 A 578 SER HBx H 1 3.939 0.03 A 578 SER HBy H 1 3.939 0.03 A 578 SER C C 13 174.459 0.30 A 578 SER CA C 13 61.758 0.30 A 578 SER CB C 13 62.577 0.30 A 578 SER N N 15 113.829 0.30 A 579 LYS H H 1 7.436 0.03 A 579 LYS HA H 1 4.028 0.03 A 579 LYS HBx H 1 1.857 0.03 A 579 LYS HBy H 1 1.857 0.03 A 579 LYS HDx H 1 1.615 0.03 A 579 LYS HDy H 1 1.615 0.03 A 579 LYS HEx H 1 2.872 0.03 A 579 LYS HEy H 1 2.872 0.03 A 579 LYS HGx H 1 1.318 0.03 A 579 LYS HGy H 1 1.484 0.03 A 579 LYS C C 13 176.403 0.30 A 579 LYS CA C 13 59.347 0.30 A 579 LYS CB C 13 32.529 0.30 A 579 LYS CD C 13 29.437 0.30 A 579 LYS CE C 13 41.962 0.30 A 579 LYS CG C 13 24.853 0.30 A 579 LYS N N 15 121.584 0.30 A 580 LYS H H 1 8.330 0.03 A 580 LYS HA H 1 4.054 0.03 A 580 LYS HBx H 1 1.622 0.03 A 580 LYS HBy H 1 1.744 0.03 A 580 LYS HDx H 1 1.323 0.03 A 580 LYS HDy H 1 1.475 0.03 A 580 LYS HEx H 1 2.320 0.03 A 580 LYS HEy H 1 2.636 0.03 A 580 LYS HGx H 1 0.881 0.03 A 580 LYS HGy H 1 1.185 0.03 A 580 LYS C C 13 175.709 0.30 A 580 LYS CA C 13 57.717 0.30 A 580 LYS CB C 13 30.854 0.30 A 580 LYS CD C 13 27.064 0.30 A 580 LYS CE C 13 40.975 0.30 A 580 LYS CG C 13 23.666 0.30 A 580 LYS N N 15 121.052 0.30 A 581 ALA H H 1 8.855 0.03 A 581 ALA HA H 1 4.223 0.03 A 581 ALA HB% H 1 1.548 0.03 A 581 ALA C C 13 176.588 0.30 A 581 ALA CA C 13 55.724 0.30 A 581 ALA CB C 13 18.840 0.30 A 581 ALA N N 15 120.946 0.30 A 582 GLY H H 1 7.904 0.03 A 582 GLY HAy H 1 3.938 0.03 A 582 GLY HAx H 1 3.857 0.03 A 582 GLY C C 13 174.129 0.30 A 582 GLY CA C 13 47.587 0.30 A 582 GLY N N 15 103.849 0.30 A 583 GLU H H 1 7.775 0.03 A 583 GLU HA H 1 3.968 0.03 A 583 GLU HBx H 1 2.097 0.03 A 583 GLU HBy H 1 2.246 0.03 A 583 GLU HGx H 1 2.164 0.03 A 583 GLU HGy H 1 2.363 0.03 A 583 GLU C C 13 177.077 0.30 A 583 GLU CA C 13 59.137 0.30 A 583 GLU CB C 13 29.734 0.30 A 583 GLU CG C 13 36.125 0.30 A 583 GLU N N 15 122.750 0.30 A 584 ILE H H 1 8.549 0.03 A 584 ILE HA H 1 3.613 0.03 A 584 ILE HB H 1 2.154 0.03 A 584 ILE HD1% H 1 0.949 0.03 A 584 ILE HG1y H 1 1.907 0.03 A 584 ILE HG1x H 1 1.075 0.03 A 584 ILE HG2% H 1 1.079 0.03 A 584 ILE C C 13 176.506 0.30 A 584 ILE CA C 13 65.216 0.30 A 584 ILE CB C 13 38.683 0.30 A 584 ILE CD1 C 13 14.447 0.30 A 584 ILE CG1 C 13 29.003 0.30 A 584 ILE CG2 C 13 18.129 0.30 A 584 ILE N N 15 123.077 0.30 A 585 TRP H H 1 8.506 0.03 A 585 TRP HA H 1 3.829 0.03 A 585 TRP HBx H 1 2.962 0.03 A 585 TRP HBy H 1 3.034 0.03 A 585 TRP HD1 H 1 6.845 0.03 A 585 TRP HE1 H 1 9.936 0.03 A 585 TRP HE3 H 1 5.715 0.03 A 585 TRP HH2 H 1 6.913 0.03 A 585 TRP HZ2 H 1 7.386 0.03 A 585 TRP HZ3 H 1 6.116 0.03 A 585 TRP C C 13 176.058 0.30 A 585 TRP CA C 13 59.968 0.30 A 585 TRP CB C 13 29.666 0.30 A 585 TRP N N 15 121.029 0.30 A 585 TRP NE1 N 15 127.242 0.30 A 586 LYS H H 1 7.968 0.03 A 586 LYS HA H 1 3.685 0.03 A 586 LYS HBx H 1 1.808 0.03 A 586 LYS HBy H 1 1.808 0.03 A 586 LYS HDx H 1 1.573 0.03 A 586 LYS HDy H 1 1.573 0.03 A 586 LYS HEx H 1 2.899 0.03 A 586 LYS HEy H 1 2.899 0.03 A 586 LYS HGx H 1 1.268 0.03 A 586 LYS HGy H 1 1.355 0.03 A 586 LYS C C 13 175.515 0.30 A 586 LYS CA C 13 59.633 0.30 A 586 LYS CB C 13 32.271 0.30 A 586 LYS CD C 13 29.383 0.30 A 586 LYS CE C 13 42.022 0.30 A 586 LYS CG C 13 24.436 0.30 A 586 LYS N N 15 117.604 0.30 A 587 GLY H H 1 7.320 0.03 A 587 GLY HAy H 1 3.993 0.03 A 587 GLY HAx H 1 3.568 0.03 A 587 GLY C C 13 171.401 0.30 A 587 GLY CA C 13 44.891 0.30 A 587 GLY N N 15 102.949 0.30 A 588 MET H H 1 7.094 0.03 A 588 MET HA H 1 3.960 0.03 A 588 MET HBx H 1 1.482 0.03 A 588 MET HBy H 1 1.585 0.03 A 588 MET HE% H 1 1.420 0.03 A 588 MET HGx H 1 2.379 0.03 A 588 MET HGy H 1 2.379 0.03 A 588 MET C C 13 173.171 0.30 A 588 MET CA C 13 56.288 0.30 A 588 MET CB C 13 33.798 0.30 A 588 MET CE C 13 15.581 0.30 A 588 MET CG C 13 31.212 0.30 A 588 MET N N 15 122.455 0.30 A 589 SER H H 1 8.387 0.03 A 589 SER HA H 1 4.131 0.03 A 589 SER HBx H 1 3.954 0.03 A 589 SER HBy H 1 4.227 0.03 A 589 SER C C 13 171.760 0.30 A 589 SER CA C 13 57.493 0.30 A 589 SER CB C 13 64.562 0.30 A 589 SER N N 15 119.297 0.30 A 590 LYS H H 1 8.749 0.03 A 590 LYS HA H 1 3.698 0.03 A 590 LYS HBx H 1 1.658 0.03 A 590 LYS HBy H 1 1.806 0.03 A 590 LYS HGx H 1 1.269 0.03 A 590 LYS HGy H 1 1.353 0.03 A 590 LYS C C 13 175.949 0.30 A 590 LYS CA C 13 59.778 0.30 A 590 LYS CB C 13 32.316 0.30 A 590 LYS CD C 13 29.415 0.30 A 590 LYS CE C 13 41.899 0.30 A 590 LYS CG C 13 24.400 0.30 A 590 LYS N N 15 122.442 0.30 A 591 GLU H H 1 8.857 0.03 A 591 GLU HA H 1 4.003 0.03 A 591 GLU HBx H 1 1.858 0.03 A 591 GLU HBy H 1 1.977 0.03 A 591 GLU HGx H 1 2.199 0.03 A 591 GLU HGy H 1 2.319 0.03 A 591 GLU C C 13 176.635 0.30 A 591 GLU CA C 13 60.034 0.30 A 591 GLU CB C 13 28.558 0.30 A 591 GLU CG C 13 36.845 0.30 A 591 GLU N N 15 117.632 0.30 A 592 LYS H H 1 7.540 0.03 A 592 LYS HA H 1 4.140 0.03 A 592 LYS HBx H 1 1.777 0.03 A 592 LYS HBy H 1 1.851 0.03 A 592 LYS HDx H 1 1.691 0.03 A 592 LYS HDy H 1 1.691 0.03 A 592 LYS HEx H 1 2.971 0.03 A 592 LYS HEy H 1 2.971 0.03 A 592 LYS HGx H 1 1.409 0.03 A 592 LYS HGy H 1 1.523 0.03 A 592 LYS C C 13 176.482 0.30 A 592 LYS CA C 13 57.905 0.30 A 592 LYS CB C 13 31.999 0.30 A 592 LYS CD C 13 28.465 0.30 A 592 LYS CE C 13 42.183 0.30 A 592 LYS CG C 13 25.536 0.30 A 592 LYS N N 15 119.950 0.30 A 593 LYS H H 1 7.930 0.03 A 593 LYS HA H 1 3.834 0.03 A 593 LYS HBx H 1 1.478 0.03 A 593 LYS HBy H 1 1.536 0.03 A 593 LYS HDx H 1 0.816 0.03 A 593 LYS HDy H 1 0.816 0.03 A 593 LYS HEx H 1 1.561 0.03 A 593 LYS HEy H 1 1.753 0.03 A 593 LYS HGx H 1 -0.281 0.03 A 593 LYS HGy H 1 0.766 0.03 A 593 LYS C C 13 176.253 0.30 A 593 LYS CA C 13 60.482 0.30 A 593 LYS CB C 13 32.302 0.30 A 593 LYS CD C 13 28.794 0.30 A 593 LYS CE C 13 42.147 0.30 A 593 LYS CG C 13 26.140 0.30 A 593 LYS N N 15 119.316 0.30 A 594 GLU H H 1 8.031 0.03 A 594 GLU HA H 1 4.105 0.03 A 594 GLU HBx H 1 1.969 0.03 A 594 GLU HBy H 1 2.102 0.03 A 594 GLU HGx H 1 2.246 0.03 A 594 GLU HGy H 1 2.467 0.03 A 594 GLU C C 13 175.965 0.30 A 594 GLU CA C 13 59.487 0.30 A 594 GLU CB C 13 29.274 0.30 A 594 GLU CG C 13 36.729 0.30 A 594 GLU N N 15 119.052 0.30 A 595 GLU H H 1 7.613 0.03 A 595 GLU HA H 1 3.856 0.03 A 595 GLU HBx H 1 1.691 0.03 A 595 GLU HBy H 1 1.919 0.03 A 595 GLU HGx H 1 1.572 0.03 A 595 GLU HGy H 1 1.861 0.03 A 595 GLU C C 13 176.048 0.30 A 595 GLU CA C 13 59.225 0.30 A 595 GLU CB C 13 29.286 0.30 A 595 GLU CG C 13 35.551 0.30 A 595 GLU N N 15 118.488 0.30 A 596 TRP H H 1 7.390 0.03 A 596 TRP HA H 1 4.345 0.03 A 596 TRP HBx H 1 3.512 0.03 A 596 TRP HBy H 1 3.850 0.03 A 596 TRP HD1 H 1 7.535 0.03 A 596 TRP HE1 H 1 10.526 0.03 A 596 TRP HE3 H 1 7.571 0.03 A 596 TRP HH2 H 1 7.082 0.03 A 596 TRP HZ2 H 1 7.616 0.03 A 596 TRP HZ3 H 1 6.955 0.03 A 596 TRP C C 13 175.271 0.30 A 596 TRP CA C 13 59.987 0.30 A 596 TRP CB C 13 29.118 0.30 A 596 TRP N N 15 121.250 0.30 A 596 TRP NE1 N 15 129.503 0.30 A 597 ASP H H 1 8.478 0.03 A 597 ASP HA H 1 4.557 0.03 A 597 ASP HBx H 1 2.718 0.03 A 597 ASP HBy H 1 2.872 0.03 A 597 ASP C C 13 176.750 0.30 A 597 ASP CA C 13 58.220 0.30 A 597 ASP CB C 13 40.717 0.30 A 597 ASP N N 15 122.473 0.30 A 598 ARG H H 1 8.146 0.03 A 598 ARG HA H 1 4.061 0.03 A 598 ARG HBx H 1 1.873 0.03 A 598 ARG HBy H 1 1.873 0.03 A 598 ARG HDx H 1 3.149 0.03 A 598 ARG HDy H 1 3.149 0.03 A 598 ARG HGx H 1 1.604 0.03 A 598 ARG HGy H 1 1.711 0.03 A 598 ARG C C 13 176.226 0.30 A 598 ARG CA C 13 59.369 0.30 A 598 ARG CB C 13 29.779 0.30 A 598 ARG CD C 13 43.245 0.30 A 598 ARG CG C 13 27.408 0.30 A 598 ARG N N 15 120.266 0.30 A 599 LYS H H 1 7.708 0.03 A 599 LYS HA H 1 4.048 0.03 A 599 LYS HBx H 1 1.880 0.03 A 599 LYS HBy H 1 1.880 0.03 A 599 LYS HDx H 1 0.958 0.03 A 599 LYS HDy H 1 1.332 0.03 A 599 LYS HEx H 1 2.424 0.03 A 599 LYS HEy H 1 2.498 0.03 A 599 LYS HGx H 1 1.330 0.03 A 599 LYS HGy H 1 1.423 0.03 A 599 LYS C C 13 177.128 0.30 A 599 LYS CA C 13 59.586 0.30 A 599 LYS CB C 13 32.656 0.30 A 599 LYS CD C 13 29.347 0.30 A 599 LYS CE C 13 41.756 0.30 A 599 LYS CG C 13 25.793 0.30 A 599 LYS N N 15 119.082 0.30 A 600 ALA H H 1 8.528 0.03 A 600 ALA HA H 1 4.094 0.03 A 600 ALA HB% H 1 1.546 0.03 A 600 ALA C C 13 177.182 0.30 A 600 ALA CA C 13 55.186 0.30 A 600 ALA CB C 13 17.569 0.30 A 600 ALA N N 15 123.516 0.30 A 601 GLU H H 1 8.116 0.03 A 601 GLU HA H 1 4.089 0.03 A 601 GLU HBx H 1 2.056 0.03 A 601 GLU HBy H 1 2.161 0.03 A 601 GLU HGx H 1 2.309 0.03 A 601 GLU HGy H 1 2.309 0.03 A 601 GLU C C 13 176.325 0.30 A 601 GLU CA C 13 59.053 0.30 A 601 GLU CB C 13 29.133 0.30 A 601 GLU CG C 13 35.886 0.30 A 601 GLU N N 15 121.235 0.30 A 602 ASP H H 1 8.287 0.03 A 602 ASP HA H 1 4.294 0.03 A 602 ASP HBx H 1 2.653 0.03 A 602 ASP HBy H 1 2.701 0.03 A 602 ASP C C 13 175.457 0.30 A 602 ASP CA C 13 57.204 0.30 A 602 ASP CB C 13 40.018 0.30 A 602 ASP N N 15 120.916 0.30 A 603 ALA H H 1 7.969 0.03 A 603 ALA HA H 1 4.173 0.03 A 603 ALA HB% H 1 1.524 0.03 A 603 ALA C C 13 177.765 0.30 A 603 ALA CA C 13 54.744 0.30 A 603 ALA CB C 13 17.921 0.30 A 603 ALA N N 15 121.551 0.30 A 604 ARG H H 1 8.056 0.03 A 604 ARG HA H 1 3.934 0.03 A 604 ARG HBx H 1 1.832 0.03 A 604 ARG HBy H 1 1.954 0.03 A 604 ARG HDx H 1 3.077 0.03 A 604 ARG HDy H 1 3.077 0.03 A 604 ARG HGx H 1 1.433 0.03 A 604 ARG HGy H 1 1.515 0.03 A 604 ARG C C 13 175.543 0.30 A 604 ARG CA C 13 59.508 0.30 A 604 ARG CB C 13 29.799 0.30 A 604 ARG CG C 13 27.221 0.30 A 604 ARG N N 15 120.331 0.30 A 605 ARG H H 1 8.109 0.03 A 605 ARG HA H 1 3.998 0.03 A 605 ARG HBx H 1 1.893 0.03 A 605 ARG HBy H 1 1.954 0.03 A 605 ARG HDx H 1 3.180 0.03 A 605 ARG HDy H 1 3.180 0.03 A 605 ARG HGx H 1 1.523 0.03 A 605 ARG HGy H 1 1.774 0.03 A 605 ARG C C 13 176.649 0.30 A 605 ARG CA C 13 59.253 0.30 A 605 ARG CB C 13 29.925 0.30 A 605 ARG CD C 13 43.220 0.30 A 605 ARG CG C 13 27.691 0.30 A 605 ARG N N 15 119.874 0.30 A 606 ASP H H 1 8.228 0.03 A 606 ASP HA H 1 4.378 0.03 A 606 ASP HBx H 1 2.625 0.03 A 606 ASP HBy H 1 2.712 0.03 A 606 ASP C C 13 175.744 0.30 A 606 ASP CA C 13 57.022 0.30 A 606 ASP CB C 13 40.304 0.30 A 606 ASP N N 15 120.190 0.30 A 607 TYR H H 1 8.083 0.03 A 607 TYR HA H 1 4.162 0.03 A 607 TYR HBx H 1 3.076 0.03 A 607 TYR HBy H 1 3.118 0.03 A 607 TYR HDx H 1 6.956 0.03 A 607 TYR HDy H 1 6.956 0.03 A 607 TYR C C 13 174.303 0.30 A 607 TYR CA C 13 60.954 0.30 A 607 TYR CB C 13 38.383 0.30 A 607 TYR N N 15 122.628 0.30 A 608 GLU H H 1 8.366 0.03 A 608 GLU HA H 1 3.733 0.03 A 608 GLU HBx H 1 1.978 0.03 A 608 GLU HBy H 1 2.060 0.03 A 608 GLU HGx H 1 2.242 0.03 A 608 GLU HGy H 1 2.499 0.03 A 608 GLU C C 13 176.454 0.30 A 608 GLU CA C 13 59.120 0.30 A 608 GLU CB C 13 29.335 0.30 A 608 GLU CG C 13 36.810 0.30 A 608 GLU N N 15 118.822 0.30 A 609 LYS H H 1 7.869 0.03 A 609 LYS HA H 1 3.940 0.03 A 609 LYS HBx H 1 1.821 0.03 A 609 LYS HBy H 1 1.821 0.03 A 609 LYS HDx H 1 1.612 0.03 A 609 LYS HDy H 1 1.612 0.03 A 609 LYS HGx H 1 1.348 0.03 A 609 LYS HGy H 1 1.447 0.03 A 609 LYS C C 13 175.476 0.30 A 609 LYS CA C 13 58.862 0.30 A 609 LYS CB C 13 32.485 0.30 A 609 LYS CD C 13 29.354 0.30 A 609 LYS CG C 13 24.859 0.30 A 609 LYS N N 15 119.218 0.30 A 610 ALA H H 1 7.741 0.03 A 610 ALA HA H 1 4.053 0.03 A 610 ALA HB% H 1 1.306 0.03 A 610 ALA C C 13 176.983 0.30 A 610 ALA CA C 13 54.050 0.30 A 610 ALA CB C 13 18.250 0.30 A 610 ALA N N 15 121.917 0.30 A 611 MET H H 1 7.911 0.03 A 611 MET HA H 1 4.208 0.03 A 611 MET HBx H 1 2.017 0.03 A 611 MET HBy H 1 2.198 0.03 A 611 MET HE% H 1 1.804 0.03 A 611 MET HGx H 1 1.812 0.03 A 611 MET HGy H 1 1.812 0.03 A 611 MET C C 13 175.168 0.30 A 611 MET CA C 13 56.311 0.30 A 611 MET CB C 13 31.897 0.30 A 611 MET CE C 13 17.118 0.30 A 611 MET CG C 13 32.016 0.30 A 611 MET N N 15 116.565 0.30 A 612 LYS H H 1 7.694 0.03 A 612 LYS HA H 1 4.065 0.03 A 612 LYS HBx H 1 1.773 0.03 A 612 LYS HBy H 1 1.773 0.03 A 612 LYS HDx H 1 1.577 0.03 A 612 LYS HDy H 1 1.577 0.03 A 612 LYS HEx H 1 2.857 0.03 A 612 LYS HEy H 1 2.857 0.03 A 612 LYS HGx H 1 1.331 0.03 A 612 LYS HGy H 1 1.393 0.03 A 612 LYS C C 13 175.135 0.30 A 612 LYS CA C 13 57.640 0.30 A 612 LYS CB C 13 32.367 0.30 A 612 LYS CD C 13 28.923 0.30 A 612 LYS CE C 13 42.038 0.30 A 612 LYS CG C 13 24.801 0.30 A 612 LYS N N 15 120.146 0.30 A 613 GLU H H 1 7.876 0.03 A 613 GLU HA H 1 4.045 0.03 A 613 GLU HBx H 1 1.838 0.03 A 613 GLU HBy H 1 1.838 0.03 A 613 GLU HGx H 1 2.046 0.03 A 613 GLU HGy H 1 2.173 0.03 A 613 GLU C C 13 174.308 0.30 A 613 GLU CA C 13 57.333 0.30 A 613 GLU CB C 13 29.698 0.30 A 613 GLU CG C 13 36.130 0.30 A 613 GLU N N 15 119.170 0.30 A 614 TYR H H 1 7.829 0.03 A 614 TYR HA H 1 4.388 0.03 A 614 TYR HBx H 1 2.915 0.03 A 614 TYR HBy H 1 2.981 0.03 A 614 TYR HDx H 1 7.012 0.03 A 614 TYR HDy H 1 7.012 0.03 A 614 TYR C C 13 173.542 0.30 A 614 TYR CA C 13 58.523 0.30 A 614 TYR CB C 13 38.642 0.30 A 614 TYR N N 15 119.519 0.30 A 615 GLU H H 1 8.078 0.03 A 615 GLU HA H 1 4.151 0.03 A 615 GLU HBx H 1 1.854 0.03 A 615 GLU HBy H 1 1.978 0.03 A 615 GLU HGx H 1 2.129 0.03 A 615 GLU HGy H 1 2.211 0.03 A 615 GLU C C 13 173.927 0.30 A 615 GLU CA C 13 56.605 0.30 A 615 GLU CB C 13 30.282 0.30 A 615 GLU CG C 13 36.306 0.30 A 615 GLU N N 15 121.638 0.30 A 616 GLY H H 1 7.695 0.03 A 616 GLY HAy H 1 3.853 0.03 A 616 GLY HAx H 1 3.792 0.03 A 616 GLY C C 13 170.909 0.30 A 616 GLY CA C 13 45.317 0.30 A 616 GLY N N 15 108.934 0.30 A 617 GLY H H 1 7.883 0.03 A 617 GLY HAx H 1 3.669 0.03 A 617 GLY HAy H 1 3.669 0.03 A 617 GLY C C 13 176.381 0.30 A 617 GLY CA C 13 45.930 0.30 A 617 GLY N N 15 114.778 0.30 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 553 ALA H A 553 ALA HA 1.0 1.8 3.0 2 2 A 553 ALA H A 553 ALA HB% 1.0 1.8 3.0 3 3 A 553 ALA H A 552 SER HA 1.0 1.8 4.0 4 4 A 553 ALA H A 554 TYR H 1.0 1.8 3.0 5 5 A 553 ALA HA A 556 LEU HBx 1.0 1.8 3.0 6 5 A 553 ALA HA A 556 LEU HBy 1.0 1.8 3.0 7 6 A 553 ALA HA A 556 LEU HDx% 1.0 1.8 3.0 8 7 A 553 ALA HB% A 596 TRP HA 1.0 1.8 4.5 9 8 A 553 ALA HB% A 596 TRP HBx 1.0 1.8 3.0 10 8 A 553 ALA HB% A 596 TRP HBy 1.0 1.8 3.0 11 9 A 553 ALA HB% A 597 ASP HBx 1.0 1.8 3.5 12 9 A 553 ALA HB% A 597 ASP HBy 1.0 1.8 3.5 13 10 A 553 ALA HB% A 556 LEU HDx% 1.0 1.8 4.5 14 11 A 553 ALA HB% A 593 LYS HEx 1.0 1.8 4.0 15 11 A 553 ALA HB% A 593 LYS HEy 1.0 1.8 4.0 16 12 A 553 ALA HB% A 593 LYS HDx 1.0 1.8 3.5 17 12 A 553 ALA HB% A 593 LYS HDy 1.0 1.8 3.5 18 13 A 553 ALA HB% A 585 TRP HH2 1.0 1.8 4.0 19 14 A 553 ALA HA A 600 ALA HB% 1.0 1.8 4.0 20 15 A 554 TYR H A 555 MET H 1.0 1.8 3.0 21 16 A 553 ALA HA A 554 TYR H 1.0 1.8 4.0 22 17 A 553 ALA HB% A 554 TYR H 1.0 1.8 3.0 23 18 A 554 TYR H A 554 TYR HA 1.0 1.8 3.0 24 19 A 554 TYR H A 554 TYR HBx 1.0 1.8 3.0 25 19 A 554 TYR H A 554 TYR HBy 1.0 1.8 3.0 26 20 A 554 TYR H A 554 TYR HD% 1.0 1.8 4.5 27 21 A 554 TYR HA A 557 TRP HBx 1.0 1.8 4.5 28 21 A 554 TYR HA A 557 TRP HBy 1.0 1.8 4.5 29 22 A 555 MET H A 556 LEU H 1.0 1.8 3.0 30 23 A 555 MET H A 554 TYR HA 1.0 1.8 4.0 31 24 A 555 MET H A 554 TYR HBx 1.0 1.8 3.5 32 24 A 555 MET H A 554 TYR HBy 1.0 1.8 3.5 33 25 A 555 MET H A 555 MET HA 1.0 1.8 3.0 34 26 A 555 MET H A 555 MET HBx 1.0 1.8 3.0 35 26 A 555 MET H A 555 MET HBy 1.0 1.8 3.0 36 27 A 555 MET H A 555 MET HGx 1.0 1.8 4.5 37 27 A 555 MET H A 555 MET HGy 1.0 1.8 4.5 38 28 A 555 MET HA A 558 LEU HBx 1.0 1.8 3.0 39 28 A 555 MET HA A 558 LEU HBy 1.0 1.8 3.0 40 29 A 555 MET HA A 555 MET HE% 1.0 1.8 5.0 41 30 A 555 MET HE% A 555 MET HBx 1.0 1.8 3.5 42 30 A 555 MET HBy A 555 MET HE% 1.0 1.8 3.5 43 31 A 555 MET HE% A 555 MET HGx 1.0 1.8 4.0 44 31 A 555 MET HGy A 555 MET HE% 1.0 1.8 4.0 45 32 A 555 MET HE% A 556 LEU HDy% 1.0 1.8 3.5 46 32 A 555 MET HE% A 556 LEU HDx% 1.0 1.8 3.5 47 33 A 556 LEU H A 557 TRP H 1.0 1.8 3.0 48 34 A 556 LEU H A 555 MET HA 1.0 1.8 4.0 49 35 A 556 LEU H A 555 MET HBx 1.0 1.8 3.0 50 35 A 556 LEU H A 555 MET HBy 1.0 1.8 3.0 51 36 A 556 LEU H A 556 LEU HA 1.0 1.8 3.0 52 37 A 556 LEU H A 556 LEU HBx 1.0 1.8 3.5 53 37 A 556 LEU HBy A 556 LEU H 1.0 1.8 3.5 54 38 A 556 LEU H A 556 LEU HG 1.0 1.8 3.5 55 39 A 556 LEU H A 556 LEU HDy% 1.0 1.8 5.0 56 40 A 556 LEU HA A 559 ASN HBx 1.0 1.8 3.0 57 40 A 556 LEU HA A 559 ASN HBy 1.0 1.8 3.0 58 41 A 556 LEU HDx% A 600 ALA HA 1.0 1.8 3.5 59 42 A 600 ALA HB% A 556 LEU HDx% 1.0 1.8 3.0 60 43 A 559 ASN HBy A 556 LEU HDy% 1.0 1.8 5.0 61 43 A 556 LEU HDy% A 559 ASN HBx 1.0 1.8 5.0 62 44 A 596 TRP HZ3 A 556 LEU HBx 1.0 1.8 3.0 63 44 A 556 LEU HBy A 596 TRP HZ3 1.0 1.8 3.0 64 45 A 596 TRP HE3 A 556 LEU HBx 1.0 1.8 4.0 65 45 A 556 LEU HBy A 596 TRP HE3 1.0 1.8 4.0 66 46 A 596 TRP HA A 556 LEU HDx% 1.0 1.8 5.0 67 47 A 556 LEU HDx% A 596 TRP HE3 1.0 1.8 3.0 68 48 A 556 LEU HDx% A 596 TRP HZ3 1.0 1.8 4.0 69 49 A 596 TRP HZ3 A 556 LEU HDy% 1.0 1.8 5.0 70 50 A 557 TRP H A 558 LEU H 1.0 1.8 3.0 71 51 A 557 TRP H A 556 LEU HA 1.0 1.8 4.0 72 52 A 557 TRP H A 556 LEU HBx 1.0 1.8 3.0 73 52 A 556 LEU HBy A 557 TRP H 1.0 1.8 3.0 74 53 A 557 TRP H A 556 LEU HG 1.0 1.8 5.0 75 54 A 556 LEU HDx% A 557 TRP H 1.0 1.8 5.0 76 55 A 557 TRP H A 557 TRP HA 1.0 1.8 3.0 77 56 A 557 TRP H A 557 TRP HBx 1.0 1.8 3.5 78 56 A 557 TRP HBy A 557 TRP H 1.0 1.8 3.5 79 57 A 557 TRP H A 557 TRP HE3 1.0 1.8 6.0 80 58 A 557 TRP H A 596 TRP HE3 1.0 1.8 6.0 81 59 A 557 TRP HA A 557 TRP HD1 1.0 1.8 5.0 82 60 A 557 TRP HE1 A 596 TRP HZ2 1.0 1.8 6.0 83 61 A 558 LEU H A 559 ASN H 1.0 1.8 3.0 84 62 A 558 LEU H A 557 TRP HA 1.0 1.8 4.0 85 63 A 558 LEU H A 557 TRP HBx 1.0 1.8 3.5 86 63 A 557 TRP HBy A 558 LEU H 1.0 1.8 3.5 87 64 A 558 LEU H A 558 LEU HA 1.0 1.8 3.0 88 65 A 558 LEU H A 558 LEU HBx 1.0 1.8 4.0 89 65 A 558 LEU HBy A 558 LEU H 1.0 1.8 4.0 90 66 A 558 LEU H A 557 TRP HE3 1.0 1.8 4.0 91 67 A 558 LEU HDy% A 581 ALA HB% 1.0 1.8 3.0 92 68 A 581 ALA HB% A 558 LEU HDx% 1.0 1.8 3.0 93 69 A 557 TRP HE3 A 558 LEU HA 1.0 1.8 3.0 94 70 A 558 LEU HA A 557 TRP HZ3 1.0 1.8 4.0 95 71 A 558 LEU HDy% A 554 TYR HE% 1.0 1.8 5.5 96 72 A 557 TRP HE3 A 558 LEU HDy% 1.0 1.8 4.0 97 73 A 557 TRP HE3 A 558 LEU HG 1.0 1.8 4.0 98 74 A 558 LEU HDx% A 554 TYR HE% 1.0 1.8 3.0 99 75 A 558 LEU HDy% A 557 TRP HZ3 1.0 1.8 4.5 100 76 A 558 LEU HA A 561 SER HBx 1.0 1.8 3.0 101 76 A 558 LEU HA A 561 SER HBy 1.0 1.8 3.0 102 77 A 559 ASN H A 560 ALA H 1.0 1.8 3.0 103 78 A 559 ASN H A 558 LEU HA 1.0 1.8 4.0 104 79 A 559 ASN H A 558 LEU HBx 1.0 1.8 3.0 105 79 A 558 LEU HBy A 559 ASN H 1.0 1.8 3.0 106 80 A 559 ASN H A 559 ASN HA 1.0 1.8 3.0 107 81 A 559 ASN H A 559 ASN HBx 1.0 1.8 3.0 108 81 A 559 ASN HBy A 559 ASN H 1.0 1.8 3.0 109 82 A 559 ASN HA A 562 ARG HBx 1.0 1.8 3.0 110 82 A 559 ASN HA A 562 ARG HBy 1.0 1.8 3.0 111 83 A 560 ALA H A 561 SER H 1.0 1.8 3.0 112 84 A 560 ALA H A 559 ASN HA 1.0 1.8 4.0 113 85 A 560 ALA H A 559 ASN HBx 1.0 1.8 3.0 114 85 A 559 ASN HBy A 560 ALA H 1.0 1.8 3.0 115 86 A 560 ALA H A 560 ALA HA 1.0 1.8 3.0 116 87 A 560 ALA H A 560 ALA HB% 1.0 1.8 3.5 117 88 A 557 TRP HA A 560 ALA HB% 1.0 1.8 3.0 118 89 A 560 ALA HB% A 596 TRP HH2 1.0 1.8 4.5 119 90 A 596 TRP HZ2 A 560 ALA HB% 1.0 1.8 6.0 120 91 A 596 TRP HZ3 A 560 ALA HB% 1.0 1.8 6.0 121 92 A 561 SER H A 562 ARG H 1.0 1.8 3.0 122 93 A 557 TRP HA A 561 SER H 1.0 1.8 4.5 123 94 A 558 LEU HA A 561 SER H 1.0 1.8 4.0 124 95 A 559 ASN HA A 561 SER H 1.0 1.8 4.5 125 96 A 561 SER H A 560 ALA HA 1.0 1.8 4.0 126 97 A 561 SER H A 560 ALA HB% 1.0 1.8 3.0 127 98 A 561 SER H A 561 SER HA 1.0 1.8 3.0 128 99 A 561 SER H A 561 SER HBx 1.0 1.8 3.5 129 99 A 561 SER HBy A 561 SER H 1.0 1.8 3.5 130 100 A 565 ILE HD1% A 561 SER HBx 1.0 1.8 6.0 131 100 A 561 SER HBy A 565 ILE HD1% 1.0 1.8 6.0 132 101 A 561 SER HA A 564 LYS HBx 1.0 1.8 3.0 133 101 A 561 SER HA A 564 LYS HBy 1.0 1.8 3.0 134 102 A 560 ALA H A 562 ARG H 1.0 1.8 4.5 135 103 A 562 ARG H A 563 GLU H 1.0 1.8 3.0 136 104 A 559 ASN HA A 562 ARG H 1.0 1.8 4.0 137 105 A 558 LEU HA A 562 ARG H 1.0 1.8 4.5 138 106 A 560 ALA HA A 562 ARG H 1.0 1.8 4.5 139 107 A 562 ARG H A 561 SER HA 1.0 1.8 4.0 140 108 A 562 ARG H A 561 SER HBx 1.0 1.8 3.0 141 108 A 561 SER HBy A 562 ARG H 1.0 1.8 3.0 142 109 A 562 ARG H A 562 ARG HA 1.0 1.8 3.0 143 110 A 562 ARG H A 562 ARG HBx 1.0 1.8 3.0 144 110 A 562 ARG HBy A 562 ARG H 1.0 1.8 3.0 145 111 A 562 ARG H A 562 ARG HGx 1.0 1.8 4.0 146 111 A 562 ARG H A 562 ARG HGy 1.0 1.8 4.0 147 112 A 565 ILE HD1% A 562 ARG HA 1.0 1.8 3.5 148 113 A 562 ARG HA A 577 LEU HDy% 1.0 1.8 4.5 149 113 A 562 ARG HA A 577 LEU HDx% 1.0 1.8 4.5 150 114 A 558 LEU HDy% A 562 ARG HA 1.0 1.8 3.0 151 115 A 562 ARG HBy A 577 LEU HDy% 1.0 1.8 6.0 152 115 A 577 LEU HDx% A 562 ARG HBx 1.0 1.8 6.0 153 115 A 562 ARG HBy A 577 LEU HDx% 1.0 1.8 6.0 154 115 A 562 ARG HBx A 577 LEU HDy% 1.0 1.8 6.0 155 116 A 558 LEU HDx% A 562 ARG HBx 1.0 1.8 5.0 156 116 A 558 LEU HDx% A 562 ARG HBy 1.0 1.8 5.0 157 117 A 558 LEU HDy% A 562 ARG HBx 1.0 1.8 3.0 158 117 A 558 LEU HDy% A 562 ARG HBy 1.0 1.8 3.0 159 118 A 562 ARG HDy A 577 LEU HDy% 1.0 1.8 6.0 160 118 A 562 ARG HDx A 577 LEU HDy% 1.0 1.8 6.0 161 118 A 577 LEU HDx% A 562 ARG HDx 1.0 1.8 6.0 162 118 A 577 LEU HDx% A 562 ARG HDy 1.0 1.8 6.0 163 119 A 563 GLU H A 564 LYS H 1.0 1.8 3.0 164 120 A 563 GLU H A 562 ARG HA 1.0 1.8 4.0 165 121 A 563 GLU H A 562 ARG HBx 1.0 1.8 3.0 166 121 A 562 ARG HBy A 563 GLU H 1.0 1.8 3.0 167 122 A 563 GLU H A 562 ARG HGx 1.0 1.8 4.5 168 122 A 563 GLU H A 562 ARG HGy 1.0 1.8 4.5 169 123 A 563 GLU H A 563 GLU HA 1.0 1.8 3.0 170 124 A 563 GLU H A 563 GLU HBx 1.0 1.8 3.0 171 124 A 563 GLU H A 563 GLU HBy 1.0 1.8 3.0 172 125 A 563 GLU H A 563 GLU HGx 1.0 1.8 4.0 173 125 A 563 GLU H A 563 GLU HGy 1.0 1.8 4.0 174 126 A 563 GLU HA A 566 LYS HBx 1.0 1.8 3.0 175 126 A 563 GLU HA A 566 LYS HBy 1.0 1.8 3.0 176 127 A 564 LYS H A 565 ILE H 1.0 1.8 3.0 177 128 A 561 SER HA A 564 LYS H 1.0 1.8 4.0 178 129 A 562 ARG HA A 564 LYS H 1.0 1.8 4.5 179 130 A 564 LYS H A 563 GLU HA 1.0 1.8 3.5 180 131 A 564 LYS H A 563 GLU HBx 1.0 1.8 3.0 181 131 A 564 LYS H A 563 GLU HBy 1.0 1.8 3.0 182 132 A 564 LYS H A 563 GLU HGx 1.0 1.8 5.0 183 132 A 564 LYS H A 563 GLU HGy 1.0 1.8 5.0 184 133 A 564 LYS H A 564 LYS HA 1.0 1.8 3.0 185 134 A 564 LYS H A 564 LYS HBx 1.0 1.8 3.5 186 134 A 564 LYS HBy A 564 LYS H 1.0 1.8 3.5 187 135 A 564 LYS H A 564 LYS HGx 1.0 1.8 4.5 188 135 A 564 LYS H A 564 LYS HGy 1.0 1.8 4.5 189 136 A 564 LYS H A 564 LYS HDx 1.0 1.8 5.0 190 136 A 564 LYS H A 564 LYS HDy 1.0 1.8 5.0 191 137 A 564 LYS H A 566 LYS H 1.0 1.8 4.5 192 138 A 564 LYS HA A 567 SER HBx 1.0 1.8 3.0 193 138 A 564 LYS HA A 567 SER HBy 1.0 1.8 3.0 194 139 A 565 ILE H A 566 LYS H 1.0 1.8 3.0 195 140 A 561 SER HA A 565 ILE H 1.0 1.8 4.5 196 141 A 562 ARG HA A 565 ILE H 1.0 1.8 4.0 197 142 A 563 GLU HA A 565 ILE H 1.0 1.8 4.5 198 143 A 565 ILE H A 564 LYS HA 1.0 1.8 4.0 199 144 A 565 ILE H A 564 LYS HBx 1.0 1.8 3.0 200 144 A 564 LYS HBy A 565 ILE H 1.0 1.8 3.0 201 145 A 565 ILE H A 565 ILE HA 1.0 1.8 3.0 202 146 A 565 ILE H A 565 ILE HB 1.0 1.8 3.0 203 147 A 565 ILE H A 565 ILE HG1x 1.0 1.8 4.0 204 147 A 565 ILE H A 565 ILE HG1y 1.0 1.8 4.0 205 148 A 565 ILE H A 565 ILE HG2% 1.0 1.8 5.0 206 149 A 565 ILE HD1% A 565 ILE H 1.0 1.8 5.0 207 150 A 565 ILE HA A 568 ASP HBx 1.0 1.8 3.0 208 150 A 565 ILE HA A 568 ASP HBy 1.0 1.8 3.0 209 151 A 562 ARG HA A 565 ILE HB 1.0 1.8 3.0 210 152 A 565 ILE HD1% A 581 ALA HA 1.0 1.8 3.5 211 153 A 565 ILE HD1% A 557 TRP HH2 1.0 1.8 5.0 212 154 A 557 TRP HZ3 A 565 ILE HD1% 1.0 1.8 3.0 213 155 A 565 ILE HG2% A 569 HIS HD2 1.0 1.8 3.0 214 156 A 565 ILE HA A 569 HIS HD2 1.0 1.8 3.0 215 157 A 565 ILE HD1% A 584 ILE HG2% 1.0 1.8 5.0 216 158 A 565 ILE HD1% A 584 ILE HD1% 1.0 1.8 3.0 217 159 A 562 ARG HA A 566 LYS H 1.0 1.8 4.5 218 160 A 563 GLU HA A 566 LYS H 1.0 1.8 4.0 219 161 A 564 LYS HA A 566 LYS H 1.0 1.8 5.0 220 162 A 566 LYS H A 565 ILE HA 1.0 1.8 4.0 221 163 A 566 LYS H A 567 SER H 1.0 1.8 3.0 222 164 A 566 LYS H A 565 ILE HB 1.0 1.8 3.5 223 165 A 566 LYS H A 565 ILE HG1x 1.0 1.8 5.0 224 165 A 566 LYS H A 565 ILE HG1y 1.0 1.8 5.0 225 166 A 565 ILE HD1% A 566 LYS H 1.0 1.8 7.0 226 167 A 566 LYS H A 566 LYS HA 1.0 1.8 3.0 227 168 A 566 LYS H A 566 LYS HBx 1.0 1.8 3.5 228 168 A 566 LYS HBy A 566 LYS H 1.0 1.8 3.5 229 169 A 566 LYS H A 566 LYS HGx 1.0 1.8 5.0 230 169 A 566 LYS H A 566 LYS HGy 1.0 1.8 5.0 231 170 A 566 LYS H A 566 LYS HDx 1.0 1.8 5.5 232 170 A 566 LYS H A 566 LYS HDy 1.0 1.8 5.5 233 171 A 566 LYS HA A 572 ILE HG2% 1.0 1.8 3.5 234 172 A 566 LYS HA A 577 LEU HDy% 1.0 1.8 3.0 235 173 A 577 LEU HDx% A 566 LYS HGx 1.0 1.8 3.0 236 173 A 577 LEU HDx% A 566 LYS HGy 1.0 1.8 3.0 237 174 A 566 LYS H A 577 LEU HDy% 1.0 1.8 4.0 238 175 A 566 LYS HA A 572 ILE HD1% 1.0 1.8 5.5 239 176 A 566 LYS HBx A 577 LEU HDy% 1.0 1.8 4.0 240 176 A 566 LYS HBy A 577 LEU HDy% 1.0 1.8 4.0 241 177 A 577 LEU HDx% A 566 LYS HBy 1.0 1.8 3.5 242 177 A 577 LEU HDx% A 566 LYS HBx 1.0 1.8 3.5 243 178 A 566 LYS HDx A 577 LEU HDy% 1.0 1.8 3.5 244 178 A 577 LEU HDx% A 566 LYS HDx 1.0 1.8 3.5 245 178 A 577 LEU HDx% A 566 LYS HDy 1.0 1.8 3.5 246 178 A 566 LYS HDy A 577 LEU HDy% 1.0 1.8 3.5 247 179 A 566 LYS HEx A 577 LEU HDy% 1.0 1.8 5.0 248 179 A 566 LYS HEy A 577 LEU HDy% 1.0 1.8 5.0 249 179 A 577 LEU HDx% A 566 LYS HEx 1.0 1.8 5.0 250 179 A 577 LEU HDx% A 566 LYS HEy 1.0 1.8 5.0 251 180 A 563 GLU HA A 567 SER H 1.0 1.8 4.5 252 181 A 564 LYS HA A 567 SER H 1.0 1.8 4.0 253 182 A 565 ILE HA A 567 SER H 1.0 1.8 4.5 254 183 A 567 SER H A 566 LYS HA 1.0 1.8 4.0 255 184 A 567 SER H A 566 LYS HBx 1.0 1.8 4.0 256 184 A 566 LYS HBy A 567 SER H 1.0 1.8 4.0 257 185 A 567 SER H A 566 LYS HGx 1.0 1.8 6.0 258 185 A 567 SER H A 566 LYS HGy 1.0 1.8 6.0 259 186 A 567 SER H A 568 ASP H 1.0 1.8 3.0 260 187 A 567 SER H A 567 SER HA 1.0 1.8 3.0 261 188 A 567 SER H A 567 SER HBx 1.0 1.8 3.5 262 188 A 567 SER HBy A 567 SER H 1.0 1.8 3.5 263 189 A 567 SER H A 569 HIS H 1.0 1.8 4.5 264 190 A 564 LYS HA A 568 ASP H 1.0 1.8 4.5 265 191 A 565 ILE HA A 568 ASP H 1.0 1.8 4.0 266 192 A 568 ASP H A 569 HIS H 1.0 1.8 3.0 267 193 A 568 ASP H A 567 SER HA 1.0 1.8 4.0 268 194 A 568 ASP H A 567 SER HBx 1.0 1.8 3.5 269 194 A 567 SER HBy A 568 ASP H 1.0 1.8 3.5 270 195 A 568 ASP H A 568 ASP HA 1.0 1.8 3.0 271 196 A 568 ASP H A 568 ASP HBx 1.0 1.8 3.0 272 196 A 568 ASP HBy A 568 ASP H 1.0 1.8 3.0 273 197 A 569 HIS HD2 A 568 ASP H 1.0 1.8 4.5 274 198 A 569 HIS HD2 A 568 ASP HBx 1.0 1.8 3.0 275 198 A 568 ASP HBy A 569 HIS HD2 1.0 1.8 3.0 276 199 A 565 ILE HA A 569 HIS H 1.0 1.8 4.5 277 200 A 566 LYS HA A 569 HIS H 1.0 1.8 4.0 278 201 A 567 SER HA A 569 HIS H 1.0 1.8 4.5 279 202 A 569 HIS H A 568 ASP HA 1.0 1.8 4.0 280 203 A 569 HIS H A 568 ASP HBx 1.0 1.8 3.5 281 203 A 568 ASP HBy A 569 HIS H 1.0 1.8 3.5 282 204 A 569 HIS H A 569 HIS HA 1.0 1.8 3.0 283 205 A 569 HIS H A 569 HIS HBx 1.0 1.8 4.0 284 205 A 569 HIS H A 569 HIS HBy 1.0 1.8 4.0 285 206 A 569 HIS HD2 A 569 HIS H 1.0 1.8 5.0 286 207 A 572 ILE HG2% A 569 HIS H 1.0 1.8 5.0 287 208 A 572 ILE HD1% A 569 HIS H 1.0 1.8 6.0 288 209 A 572 ILE HG2% A 569 HIS HBx 1.0 1.8 3.0 289 209 A 572 ILE HG2% A 569 HIS HBy 1.0 1.8 3.0 290 210 A 572 ILE HD1% A 569 HIS HBx 1.0 1.8 3.0 291 210 A 572 ILE HD1% A 569 HIS HBy 1.0 1.8 3.0 292 211 A 569 HIS H A 570 PRO HDx 1.0 1.8 4.5 293 211 A 569 HIS H A 570 PRO HDy 1.0 1.8 4.5 294 212 A 569 HIS HD2 A 569 HIS HBx 1.0 1.8 3.5 295 212 A 569 HIS HD2 A 569 HIS HBy 1.0 1.8 3.5 296 213 A 569 HIS HA A 570 PRO HDx 1.0 1.8 3.5 297 213 A 569 HIS HA A 570 PRO HDy 1.0 1.8 3.5 298 214 A 570 PRO HA A 570 PRO HDx 1.0 1.8 4.0 299 214 A 570 PRO HDy A 570 PRO HA 1.0 1.8 4.0 300 215 A 570 PRO HA A 571 GLY H 1.0 1.8 4.0 301 216 A 572 ILE H A 573 SER H 1.0 1.8 4.5 302 217 A 572 ILE H A 572 ILE HA 1.0 1.8 3.0 303 218 A 572 ILE H A 572 ILE HB 1.0 1.8 3.0 304 219 A 572 ILE HG2% A 572 ILE H 1.0 1.8 4.5 305 220 A 572 ILE H A 572 ILE HG1y 1.0 1.8 5.0 306 220 A 572 ILE H A 572 ILE HG1x 1.0 1.8 5.0 307 221 A 572 ILE HD1% A 572 ILE H 1.0 1.8 6.0 308 222 A 572 ILE H A 569 HIS HBx 1.0 1.8 5.0 309 222 A 569 HIS HBy A 572 ILE H 1.0 1.8 5.0 310 223 A 572 ILE H A 571 GLY HAy 1.0 1.8 4.0 311 223 A 572 ILE H A 571 GLY HAx 1.0 1.8 4.0 312 224 A 570 PRO HA A 572 ILE H 1.0 1.8 5.0 313 225 A 572 ILE HB A 569 HIS HBx 1.0 1.8 3.0 314 225 A 569 HIS HBy A 572 ILE HB 1.0 1.8 3.0 315 226 A 572 ILE HG2% A 577 LEU HA 1.0 1.8 5.0 316 227 A 572 ILE HG2% A 577 LEU HDy% 1.0 1.8 3.0 317 227 A 577 LEU HDx% A 572 ILE HG2% 1.0 1.8 3.0 318 228 A 572 ILE HD1% A 577 LEU HA 1.0 1.8 4.0 319 229 A 572 ILE HD1% A 577 LEU HDy% 1.0 1.8 3.0 320 229 A 577 LEU HDx% A 572 ILE HD1% 1.0 1.8 3.0 321 230 A 572 ILE HA A 576 ASP HBx 1.0 1.8 5.0 322 230 A 572 ILE HA A 576 ASP HBy 1.0 1.8 5.0 323 231 A 572 ILE HD1% A 576 ASP HBx 1.0 1.8 3.0 324 231 A 572 ILE HD1% A 576 ASP HBy 1.0 1.8 3.0 325 232 A 572 ILE HG1x A 576 ASP HBx 1.0 1.8 3.0 326 232 A 572 ILE HG1y A 576 ASP HBx 1.0 1.8 3.0 327 232 A 576 ASP HBy A 572 ILE HG1y 1.0 1.8 3.0 328 232 A 572 ILE HG1x A 576 ASP HBy 1.0 1.8 3.0 329 233 A 572 ILE HG2% A 576 ASP HBx 1.0 1.8 5.0 330 233 A 572 ILE HG2% A 576 ASP HBy 1.0 1.8 5.0 331 234 A 572 ILE HG2% A 566 LYS HDx 1.0 1.8 6.0 332 234 A 566 LYS HDy A 572 ILE HG2% 1.0 1.8 6.0 333 235 A 573 SER H A 572 ILE HA 1.0 1.8 3.0 334 236 A 573 SER H A 572 ILE HB 1.0 1.8 4.5 335 237 A 573 SER H A 572 ILE HG1y 1.0 1.8 5.0 336 237 A 573 SER H A 572 ILE HG1x 1.0 1.8 5.0 337 238 A 572 ILE HG2% A 573 SER H 1.0 1.8 6.0 338 239 A 572 ILE HD1% A 573 SER H 1.0 1.8 6.0 339 240 A 573 SER H A 573 SER HA 1.0 1.8 3.5 340 241 A 573 SER H A 573 SER HBx 1.0 1.8 3.5 341 241 A 573 SER H A 573 SER HBy 1.0 1.8 3.5 342 242 A 573 SER H A 574 ILE H 1.0 1.8 5.0 343 243 A 573 SER H A 576 ASP HBx 1.0 1.8 4.5 344 243 A 573 SER H A 576 ASP HBy 1.0 1.8 4.5 345 244 A 573 SER HA A 574 ILE H 1.0 1.8 3.0 346 245 A 574 ILE H A 573 SER HBx 1.0 1.8 4.0 347 245 A 573 SER HBy A 574 ILE H 1.0 1.8 4.0 348 246 A 574 ILE H A 574 ILE HA 1.0 1.8 3.5 349 247 A 574 ILE H A 574 ILE HB 1.0 1.8 3.0 350 248 A 574 ILE H A 574 ILE HG1y 1.0 1.8 4.0 351 248 A 574 ILE H A 574 ILE HG1x 1.0 1.8 4.0 352 249 A 574 ILE H A 574 ILE HG2% 1.0 1.8 5.0 353 250 A 574 ILE H A 575 THR H 1.0 1.8 5.0 354 251 A 573 SER HA A 574 ILE HG2% 1.0 1.8 6.0 355 252 A 574 ILE HG2% A 575 THR HA 1.0 1.8 6.0 356 253 A 574 ILE HG2% A 575 THR HB 1.0 1.8 5.5 357 254 A 574 ILE HG2% A 575 THR HG2% 1.0 1.8 5.5 358 255 A 574 ILE HA A 577 LEU HBx 1.0 1.8 3.0 359 255 A 574 ILE HA A 577 LEU HBy 1.0 1.8 3.0 360 256 A 574 ILE HA A 577 LEU HDy% 1.0 1.8 3.0 361 256 A 577 LEU HDx% A 574 ILE HA 1.0 1.8 3.0 362 257 A 573 SER HA A 574 ILE HA 1.0 1.8 5.0 363 258 A 574 ILE HA A 573 SER HBx 1.0 1.8 6.0 364 258 A 573 SER HBy A 574 ILE HA 1.0 1.8 6.0 365 259 A 573 SER HA A 574 ILE HB 1.0 1.8 5.5 366 260 A 574 ILE HB A 573 SER HBx 1.0 1.8 6.0 367 260 A 573 SER HBy A 574 ILE HB 1.0 1.8 6.0 368 261 A 573 SER HA A 574 ILE HD1% 1.0 1.8 6.0 369 262 A 574 ILE HD1% A 573 SER HBx 1.0 1.8 6.0 370 262 A 573 SER HBy A 574 ILE HD1% 1.0 1.8 6.0 371 263 A 575 THR H A 574 ILE HD1% 1.0 1.8 5.5 372 264 A 574 ILE HD1% A 566 LYS HEx 1.0 1.8 6.0 373 264 A 566 LYS HEy A 574 ILE HD1% 1.0 1.8 6.0 374 265 A 575 THR H A 576 ASP H 1.0 1.8 3.0 375 266 A 574 ILE HA A 575 THR H 1.0 1.8 4.5 376 267 A 574 ILE HB A 575 THR H 1.0 1.8 3.0 377 268 A 575 THR H A 574 ILE HG1y 1.0 1.8 5.0 378 268 A 574 ILE HG1x A 575 THR H 1.0 1.8 5.0 379 269 A 574 ILE HG2% A 575 THR H 1.0 1.8 5.0 380 270 A 575 THR H A 575 THR HA 1.0 1.8 3.0 381 271 A 575 THR H A 575 THR HB 1.0 1.8 3.5 382 272 A 575 THR H A 575 THR HG2% 1.0 1.8 5.0 383 273 A 575 THR HB A 576 ASP HA 1.0 1.8 6.0 384 274 A 574 ILE HB A 575 THR HB 1.0 1.8 5.5 385 275 A 575 THR HG2% A 576 ASP HA 1.0 1.8 5.0 386 276 A 575 THR HG2% A 579 LYS HEx 1.0 1.8 3.5 387 276 A 575 THR HG2% A 579 LYS HEy 1.0 1.8 3.5 388 277 A 574 ILE HB A 575 THR HG2% 1.0 1.8 6.0 389 278 A 573 SER H A 576 ASP H 1.0 1.8 5.0 390 279 A 574 ILE HA A 576 ASP H 1.0 1.8 4.5 391 280 A 575 THR HA A 576 ASP H 1.0 1.8 4.0 392 281 A 575 THR HB A 576 ASP H 1.0 1.8 3.0 393 282 A 575 THR HG2% A 576 ASP H 1.0 1.8 5.0 394 283 A 576 ASP H A 577 LEU H 1.0 1.8 3.0 395 284 A 576 ASP H A 578 SER H 1.0 1.8 5.0 396 285 A 576 ASP H A 576 ASP HA 1.0 1.8 3.0 397 286 A 576 ASP H A 576 ASP HBx 1.0 1.8 3.5 398 286 A 576 ASP HBy A 576 ASP H 1.0 1.8 3.5 399 287 A 576 ASP HA A 579 LYS HBx 1.0 1.8 3.5 400 287 A 576 ASP HA A 579 LYS HBy 1.0 1.8 3.5 401 288 A 576 ASP HA A 579 LYS HGx 1.0 1.8 5.0 402 288 A 576 ASP HA A 579 LYS HGy 1.0 1.8 5.0 403 289 A 572 ILE HG2% A 576 ASP HBx 1.0 1.8 5.0 404 289 A 572 ILE HG2% A 576 ASP HBy 1.0 1.8 5.0 405 290 A 572 ILE HD1% A 576 ASP HBx 1.0 1.8 3.0 406 290 A 572 ILE HD1% A 576 ASP HBy 1.0 1.8 3.0 407 291 A 572 ILE HG1x A 576 ASP HBx 1.0 1.8 3.0 408 291 A 572 ILE HG1y A 576 ASP HBx 1.0 1.8 3.0 409 291 A 576 ASP HBy A 572 ILE HG1y 1.0 1.8 3.0 410 291 A 572 ILE HG1x A 576 ASP HBy 1.0 1.8 3.0 411 292 A 572 ILE HA A 576 ASP HBx 1.0 1.8 5.0 412 292 A 572 ILE HA A 576 ASP HBy 1.0 1.8 5.0 413 293 A 576 ASP HBx A 579 LYS HBx 1.0 1.8 6.0 414 293 A 576 ASP HBy A 579 LYS HBx 1.0 1.8 6.0 415 293 A 579 LYS HBy A 576 ASP HBx 1.0 1.8 6.0 416 293 A 576 ASP HBy A 579 LYS HBy 1.0 1.8 6.0 417 294 A 572 ILE HG2% A 576 ASP H 1.0 1.8 7.0 418 295 A 572 ILE HD1% A 576 ASP H 1.0 1.8 6.0 419 296 A 576 ASP H A 572 ILE HG1y 1.0 1.8 5.0 420 296 A 572 ILE HG1x A 576 ASP H 1.0 1.8 5.0 421 297 A 572 ILE HA A 576 ASP H 1.0 1.8 7.0 422 298 A 574 ILE HA A 577 LEU H 1.0 1.8 4.0 423 299 A 575 THR HA A 577 LEU H 1.0 1.8 4.5 424 300 A 576 ASP HA A 577 LEU H 1.0 1.8 4.0 425 301 A 577 LEU H A 576 ASP HBx 1.0 1.8 3.0 426 301 A 576 ASP HBy A 577 LEU H 1.0 1.8 3.0 427 302 A 577 LEU HA A 577 LEU H 1.0 1.8 3.0 428 303 A 577 LEU H A 577 LEU HBx 1.0 1.8 3.5 429 303 A 577 LEU HBy A 577 LEU H 1.0 1.8 3.5 430 304 A 577 LEU H A 577 LEU HG 1.0 1.8 4.5 431 305 A 577 LEU H A 577 LEU HDy% 1.0 1.8 6.0 432 305 A 577 LEU HDx% A 577 LEU H 1.0 1.8 6.0 433 306 A 577 LEU H A 578 SER H 1.0 1.8 3.0 434 307 A 577 LEU H A 579 LYS H 1.0 1.8 5.0 435 308 A 577 LEU HA A 580 LYS HBx 1.0 1.8 3.0 436 308 A 577 LEU HA A 580 LYS HBy 1.0 1.8 3.0 437 309 A 572 ILE HG2% A 577 LEU H 1.0 1.8 5.0 438 310 A 572 ILE HD1% A 577 LEU H 1.0 1.8 5.0 439 311 A 572 ILE HG2% A 577 LEU HBx 1.0 1.8 5.0 440 311 A 572 ILE HG2% A 577 LEU HBy 1.0 1.8 5.0 441 312 A 572 ILE HD1% A 577 LEU HBx 1.0 1.8 5.5 442 312 A 572 ILE HD1% A 577 LEU HBy 1.0 1.8 5.5 443 313 A 572 ILE HG2% A 577 LEU HG 1.0 1.8 3.0 444 314 A 572 ILE HD1% A 577 LEU HG 1.0 1.8 4.0 445 315 A 572 ILE HD1% A 577 LEU HDy% 1.0 1.8 3.0 446 316 A 577 LEU HDx% A 566 LYS HEy 1.0 1.8 4.5 447 316 A 577 LEU HDx% A 566 LYS HEx 1.0 1.8 4.5 448 317 A 578 SER HA A 577 LEU HDy% 1.0 1.8 7.0 449 317 A 577 LEU HDx% A 578 SER HA 1.0 1.8 7.0 450 318 A 578 SER H A 579 LYS H 1.0 1.8 3.0 451 319 A 578 SER H A 580 LYS H 1.0 1.8 5.0 452 320 A 574 ILE HA A 578 SER H 1.0 1.8 5.0 453 321 A 575 THR HA A 578 SER H 1.0 1.8 4.0 454 322 A 576 ASP HA A 578 SER H 1.0 1.8 4.5 455 323 A 577 LEU HA A 578 SER H 1.0 1.8 4.0 456 324 A 578 SER H A 577 LEU HBx 1.0 1.8 3.0 457 324 A 577 LEU HBy A 578 SER H 1.0 1.8 3.0 458 325 A 578 SER H A 577 LEU HDy% 1.0 1.8 6.0 459 325 A 577 LEU HDx% A 578 SER H 1.0 1.8 6.0 460 326 A 578 SER H A 578 SER HA 1.0 1.8 3.0 461 327 A 578 SER H A 578 SER HBx 1.0 1.8 3.5 462 327 A 578 SER H A 578 SER HBy 1.0 1.8 3.5 463 328 A 581 ALA HB% A 578 SER HA 1.0 1.8 3.0 464 329 A 575 THR HA A 578 SER HBx 1.0 1.8 3.5 465 329 A 575 THR HA A 578 SER HBy 1.0 1.8 3.5 466 330 A 579 LYS H A 580 LYS H 1.0 1.8 3.0 467 331 A 579 LYS H A 581 ALA H 1.0 1.8 5.0 468 332 A 575 THR HA A 579 LYS H 1.0 1.8 5.0 469 333 A 576 ASP HA A 579 LYS H 1.0 1.8 3.5 470 334 A 577 LEU HA A 579 LYS H 1.0 1.8 4.5 471 335 A 579 LYS H A 578 SER HA 1.0 1.8 4.0 472 336 A 579 LYS H A 578 SER HBx 1.0 1.8 3.0 473 336 A 579 LYS H A 578 SER HBy 1.0 1.8 3.0 474 337 A 579 LYS H A 579 LYS HA 1.0 1.8 3.0 475 338 A 579 LYS H A 579 LYS HBx 1.0 1.8 3.5 476 338 A 579 LYS HBy A 579 LYS H 1.0 1.8 3.5 477 339 A 579 LYS H A 579 LYS HGx 1.0 1.8 4.5 478 339 A 579 LYS HGy A 579 LYS H 1.0 1.8 4.5 479 340 A 579 LYS H A 579 LYS HDx 1.0 1.8 5.5 480 340 A 579 LYS H A 579 LYS HDy 1.0 1.8 5.5 481 341 A 580 LYS H A 581 ALA H 1.0 1.8 3.0 482 342 A 580 LYS H A 582 GLY H 1.0 1.8 5.0 483 343 A 576 ASP HA A 580 LYS H 1.0 1.8 4.5 484 344 A 577 LEU HA A 580 LYS H 1.0 1.8 4.0 485 345 A 578 SER HA A 580 LYS H 1.0 1.8 4.5 486 346 A 580 LYS H A 579 LYS HA 1.0 1.8 4.0 487 347 A 580 LYS H A 579 LYS HBx 1.0 1.8 3.0 488 347 A 579 LYS HBy A 580 LYS H 1.0 1.8 3.0 489 348 A 580 LYS H A 580 LYS HA 1.0 1.8 3.0 490 349 A 580 LYS H A 580 LYS HBx 1.0 1.8 3.5 491 349 A 580 LYS HBy A 580 LYS H 1.0 1.8 3.5 492 350 A 580 LYS H A 580 LYS HGx 1.0 1.8 4.5 493 350 A 580 LYS H A 580 LYS HGy 1.0 1.8 4.5 494 351 A 580 LYS H A 580 LYS HDx 1.0 1.8 5.5 495 351 A 580 LYS H A 580 LYS HDy 1.0 1.8 5.5 496 352 A 572 ILE HD1% A 580 LYS H 1.0 1.8 5.5 497 353 A 580 LYS HA A 583 GLU HBx 1.0 1.8 3.0 498 353 A 580 LYS HA A 583 GLU HBy 1.0 1.8 3.0 499 354 A 577 LEU HDx% A 580 LYS HBy 1.0 1.8 5.0 500 354 A 577 LEU HDx% A 580 LYS HBx 1.0 1.8 5.0 501 355 A 572 ILE HD1% A 580 LYS HBx 1.0 1.8 5.0 502 355 A 572 ILE HD1% A 580 LYS HBy 1.0 1.8 5.0 503 356 A 572 ILE HD1% A 580 LYS HGx 1.0 1.8 5.5 504 356 A 572 ILE HD1% A 580 LYS HGy 1.0 1.8 5.5 505 357 A 572 ILE HG2% A 580 LYS HGx 1.0 1.8 5.0 506 357 A 572 ILE HG2% A 580 LYS HGy 1.0 1.8 5.0 507 358 A 572 ILE HG2% A 580 LYS HDx 1.0 1.8 5.0 508 358 A 572 ILE HG2% A 580 LYS HDy 1.0 1.8 5.0 509 359 A 572 ILE HG2% A 580 LYS HEx 1.0 1.8 5.0 510 359 A 572 ILE HG2% A 580 LYS HEy 1.0 1.8 5.0 511 360 A 572 ILE HD1% A 580 LYS HDx 1.0 1.8 5.5 512 360 A 572 ILE HD1% A 580 LYS HDy 1.0 1.8 5.5 513 361 A 577 LEU HDx% A 580 LYS HDx 1.0 1.8 6.0 514 361 A 577 LEU HDy% A 580 LYS HDx 1.0 1.8 6.0 515 361 A 580 LYS HDy A 577 LEU HDy% 1.0 1.8 6.0 516 361 A 577 LEU HDx% A 580 LYS HDy 1.0 1.8 6.0 517 362 A 572 ILE HD1% A 580 LYS HEx 1.0 1.8 5.5 518 362 A 572 ILE HD1% A 580 LYS HEy 1.0 1.8 5.5 519 363 A 577 LEU HDx% A 580 LYS HEx 1.0 1.8 6.0 520 363 A 577 LEU HDy% A 580 LYS HEx 1.0 1.8 6.0 521 363 A 580 LYS HEy A 577 LEU HDy% 1.0 1.8 6.0 522 363 A 577 LEU HDx% A 580 LYS HEy 1.0 1.8 6.0 523 364 A 569 HIS HD2 A 580 LYS HEx 1.0 1.8 5.5 524 364 A 569 HIS HD2 A 580 LYS HEy 1.0 1.8 5.5 525 365 A 569 HIS HE1 A 580 LYS HEx 1.0 1.8 6.0 526 365 A 580 LYS HEy A 569 HIS HE1 1.0 1.8 6.0 527 366 A 581 ALA H A 582 GLY H 1.0 1.8 3.0 528 367 A 581 ALA HA A 581 ALA H 1.0 1.8 3.0 529 368 A 578 SER HA A 581 ALA H 1.0 1.8 3.5 530 369 A 581 ALA H A 579 LYS HA 1.0 1.8 4.5 531 370 A 581 ALA H A 580 LYS HA 1.0 1.8 4.0 532 371 A 581 ALA H A 580 LYS HBx 1.0 1.8 3.0 533 371 A 580 LYS HBy A 581 ALA H 1.0 1.8 3.0 534 372 A 581 ALA HA A 581 ALA H 1.0 1.8 3.5 535 373 A 581 ALA HB% A 581 ALA H 1.0 1.8 4.0 536 374 A 565 ILE HD1% A 581 ALA H 1.0 1.8 6.0 537 375 A 581 ALA H A 577 LEU HDy% 1.0 1.8 6.0 538 375 A 577 LEU HDx% A 581 ALA H 1.0 1.8 6.0 539 376 A 581 ALA HA A 584 ILE HB 1.0 1.8 3.0 540 377 A 581 ALA HA A 584 ILE HG2% 1.0 1.8 5.0 541 378 A 581 ALA HA A 584 ILE HD1% 1.0 1.8 4.0 542 379 A 581 ALA HB% A 565 ILE HD1% 1.0 1.8 5.0 543 380 A 581 ALA HB% A 577 LEU HDx% 1.0 1.8 5.5 544 381 A 581 ALA HA A 557 TRP HH2 1.0 1.8 4.0 545 382 A 581 ALA HB% A 557 TRP HH2 1.0 1.8 4.5 546 383 A 581 ALA HB% A 554 TYR HE% 1.0 1.8 6.0 547 384 A 557 TRP HE3 A 581 ALA HB% 1.0 1.8 4.5 548 385 A 582 GLY H A 583 GLU H 1.0 1.8 3.0 549 386 A 582 GLY H A 584 ILE H 1.0 1.8 5.0 550 387 A 578 SER HA A 582 GLY H 1.0 1.8 4.5 551 388 A 579 LYS HA A 582 GLY H 1.0 1.8 4.0 552 389 A 582 GLY H A 580 LYS HA 1.0 1.8 4.5 553 390 A 581 ALA HA A 582 GLY H 1.0 1.8 4.0 554 391 A 581 ALA HB% A 582 GLY H 1.0 1.8 3.5 555 392 A 582 GLY H A 582 GLY HAy 1.0 1.8 3.0 556 392 A 582 GLY H A 582 GLY HAx 1.0 1.8 3.0 557 393 A 554 TYR HE% A 582 GLY HAy 1.0 1.8 4.0 558 393 A 554 TYR HE% A 582 GLY HAx 1.0 1.8 4.0 559 394 A 582 GLY HAx A 585 TRP HBx 1.0 1.8 3.0 560 394 A 582 GLY HAy A 585 TRP HBx 1.0 1.8 3.0 561 394 A 585 TRP HBy A 582 GLY HAy 1.0 1.8 3.0 562 394 A 582 GLY HAx A 585 TRP HBy 1.0 1.8 3.0 563 395 A 583 GLU H A 584 ILE H 1.0 1.8 3.0 564 396 A 579 LYS HA A 583 GLU H 1.0 1.8 4.5 565 397 A 580 LYS HA A 583 GLU H 1.0 1.8 4.0 566 398 A 581 ALA HA A 583 GLU H 1.0 1.8 4.5 567 399 A 583 GLU H A 582 GLY HAy 1.0 1.8 3.5 568 399 A 583 GLU H A 582 GLY HAx 1.0 1.8 3.5 569 400 A 583 GLU H A 583 GLU HA 1.0 1.8 3.0 570 401 A 583 GLU H A 583 GLU HBx 1.0 1.8 4.0 571 401 A 583 GLU HBy A 583 GLU H 1.0 1.8 4.0 572 402 A 583 GLU H A 583 GLU HGx 1.0 1.8 4.5 573 402 A 583 GLU H A 583 GLU HGy 1.0 1.8 4.5 574 403 A 580 LYS HGx A 583 GLU HGx 1.0 1.8 5.0 575 403 A 580 LYS HGy A 583 GLU HGx 1.0 1.8 5.0 576 403 A 583 GLU HGy A 580 LYS HGx 1.0 1.8 5.0 577 403 A 580 LYS HGy A 583 GLU HGy 1.0 1.8 5.0 578 404 A 583 GLU HA A 586 LYS HBx 1.0 1.8 3.0 579 404 A 583 GLU HA A 586 LYS HBy 1.0 1.8 3.0 580 405 A 580 LYS HA A 584 ILE H 1.0 1.8 4.5 581 406 A 581 ALA HA A 584 ILE H 1.0 1.8 4.0 582 407 A 584 ILE H A 582 GLY HAy 1.0 1.8 5.0 583 407 A 584 ILE H A 582 GLY HAx 1.0 1.8 5.0 584 408 A 584 ILE H A 583 GLU HA 1.0 1.8 4.0 585 409 A 584 ILE H A 583 GLU HBx 1.0 1.8 3.0 586 409 A 583 GLU HBy A 584 ILE H 1.0 1.8 3.0 587 410 A 584 ILE H A 583 GLU HGx 1.0 1.8 5.0 588 410 A 584 ILE H A 583 GLU HGy 1.0 1.8 5.0 589 411 A 584 ILE H A 584 ILE HA 1.0 1.8 3.0 590 412 A 584 ILE HB A 584 ILE H 1.0 1.8 3.0 591 413 A 584 ILE H A 584 ILE HG1y 1.0 1.8 4.5 592 413 A 584 ILE H A 584 ILE HG1x 1.0 1.8 4.5 593 414 A 584 ILE HG2% A 584 ILE H 1.0 1.8 5.0 594 415 A 584 ILE HD1% A 584 ILE H 1.0 1.8 5.5 595 416 A 557 TRP HH2 A 584 ILE H 1.0 1.8 6.0 596 417 A 584 ILE H A 585 TRP H 1.0 1.8 3.0 597 418 A 584 ILE H A 586 LYS H 1.0 1.8 5.0 598 419 A 565 ILE HD1% A 584 ILE HG2% 1.0 1.8 6.0 599 420 A 565 ILE HD1% A 584 ILE HD1% 1.0 1.8 4.5 600 421 A 565 ILE HG2% A 584 ILE HD1% 1.0 1.8 5.0 601 422 A 557 TRP HE1 A 584 ILE HG2% 1.0 1.8 5.5 602 423 A 584 ILE HG2% A 557 TRP HZ2 1.0 1.8 4.0 603 424 A 557 TRP HH2 A 584 ILE HG2% 1.0 1.8 5.0 604 425 A 584 ILE HD1% A 557 TRP HZ2 1.0 1.8 5.5 605 426 A 557 TRP HH2 A 584 ILE HD1% 1.0 1.8 5.5 606 427 A 584 ILE HB A 557 TRP HZ2 1.0 1.8 5.0 607 428 A 557 TRP HH2 A 584 ILE HB 1.0 1.8 4.0 608 429 A 584 ILE HG2% A 588 MET HGx 1.0 1.8 5.5 609 429 A 584 ILE HG2% A 588 MET HGy 1.0 1.8 5.5 610 430 A 584 ILE HG2% A 585 TRP HA 1.0 1.8 5.5 611 431 A 584 ILE HD1% A 569 HIS HE1 1.0 1.8 5.0 612 432 A 584 ILE HD1% A 580 LYS HDx 1.0 1.8 5.0 613 432 A 584 ILE HD1% A 580 LYS HDy 1.0 1.8 5.0 614 433 A 584 ILE HD1% A 580 LYS HGx 1.0 1.8 5.5 615 433 A 584 ILE HD1% A 580 LYS HGy 1.0 1.8 5.5 616 434 A 565 ILE HB A 584 ILE HD1% 1.0 1.8 5.0 617 435 A 565 ILE HD1% A 584 ILE HD1% 1.0 1.8 4.5 618 436 A 565 ILE HA A 584 ILE HD1% 1.0 1.8 6.5 619 437 A 584 ILE HD1% A 580 LYS HA 1.0 1.8 7.0 620 438 A 583 GLU H A 585 TRP H 1.0 1.8 5.0 621 439 A 585 TRP H A 586 LYS H 1.0 1.8 3.0 622 440 A 585 TRP H A 587 GLY H 1.0 1.8 5.0 623 441 A 554 TYR HE% A 585 TRP H 1.0 1.8 5.0 624 442 A 585 TRP H A 557 TRP HZ2 1.0 1.8 3.5 625 443 A 557 TRP HZ3 A 585 TRP H 1.0 1.8 5.5 626 444 A 557 TRP HH2 A 585 TRP H 1.0 1.8 3.5 627 445 A 581 ALA HA A 585 TRP H 1.0 1.8 4.5 628 446 A 585 TRP H A 582 GLY HAy 1.0 1.8 4.5 629 446 A 582 GLY HAx A 585 TRP H 1.0 1.8 4.5 630 447 A 583 GLU HA A 585 TRP H 1.0 1.8 4.5 631 448 A 584 ILE HA A 585 TRP H 1.0 1.8 4.0 632 449 A 584 ILE HB A 585 TRP H 1.0 1.8 3.0 633 450 A 584 ILE HG2% A 585 TRP H 1.0 1.8 5.0 634 451 A 584 ILE HD1% A 585 TRP H 1.0 1.8 6.0 635 452 A 585 TRP H A 585 TRP HA 1.0 1.8 3.0 636 453 A 585 TRP H A 585 TRP HBx 1.0 1.8 3.5 637 453 A 585 TRP HBy A 585 TRP H 1.0 1.8 3.5 638 454 A 554 TYR HD% A 585 TRP H 1.0 1.8 6.5 639 455 A 585 TRP H A 585 TRP HE3 1.0 1.8 6.5 640 456 A 584 ILE HG2% A 585 TRP HE1 1.0 1.8 7.0 641 457 A 585 TRP HE1 A 596 TRP HE1 1.0 1.8 6.0 642 458 A 585 TRP HA A 585 TRP HE3 1.0 1.8 4.0 643 459 A 554 TYR HE% A 585 TRP HBx 1.0 1.8 4.0 644 459 A 554 TYR HE% A 585 TRP HBy 1.0 1.8 4.0 645 460 A 586 LYS H A 587 GLY H 1.0 1.8 3.0 646 461 A 586 LYS H A 588 MET H 1.0 1.8 5.0 647 462 A 586 LYS H A 582 GLY HAy 1.0 1.8 4.5 648 462 A 582 GLY HAx A 586 LYS H 1.0 1.8 4.5 649 463 A 583 GLU HA A 586 LYS H 1.0 1.8 4.0 650 464 A 584 ILE HA A 586 LYS H 1.0 1.8 4.5 651 465 A 586 LYS H A 585 TRP HA 1.0 1.8 4.0 652 466 A 586 LYS H A 585 TRP HBx 1.0 1.8 3.0 653 466 A 585 TRP HBy A 586 LYS H 1.0 1.8 3.0 654 467 A 586 LYS H A 586 LYS HA 1.0 1.8 3.0 655 468 A 586 LYS H A 586 LYS HBx 1.0 1.8 3.5 656 468 A 586 LYS HBy A 586 LYS H 1.0 1.8 3.5 657 469 A 586 LYS H A 585 TRP HD1 1.0 1.8 5.5 658 470 A 587 GLY H A 588 MET H 1.0 1.8 3.0 659 471 A 583 GLU HA A 587 GLY H 1.0 1.8 4.5 660 472 A 584 ILE HA A 587 GLY H 1.0 1.8 4.0 661 473 A 585 TRP HA A 587 GLY H 1.0 1.8 4.5 662 474 A 587 GLY H A 586 LYS HA 1.0 1.8 4.0 663 475 A 587 GLY H A 586 LYS HBx 1.0 1.8 3.0 664 475 A 586 LYS HBy A 587 GLY H 1.0 1.8 3.0 665 476 A 587 GLY H A 586 LYS HGx 1.0 1.8 5.0 666 476 A 587 GLY H A 586 LYS HGy 1.0 1.8 5.0 667 477 A 587 GLY H A 587 GLY HAy 1.0 1.8 3.0 668 477 A 587 GLY H A 587 GLY HAx 1.0 1.8 3.0 669 478 A 588 MET H A 589 SER H 1.0 1.8 4.5 670 479 A 584 ILE HA A 588 MET H 1.0 1.8 4.5 671 480 A 585 TRP HA A 588 MET H 1.0 1.8 4.0 672 481 A 588 MET H A 586 LYS HA 1.0 1.8 4.5 673 482 A 588 MET H A 587 GLY HAy 1.0 1.8 4.0 674 482 A 588 MET H A 587 GLY HAx 1.0 1.8 4.0 675 483 A 588 MET H A 588 MET HA 1.0 1.8 3.0 676 484 A 588 MET H A 588 MET HBx 1.0 1.8 3.5 677 484 A 588 MET H A 588 MET HBy 1.0 1.8 3.5 678 485 A 588 MET H A 588 MET HGx 1.0 1.8 4.0 679 485 A 588 MET HGy A 588 MET H 1.0 1.8 4.0 680 486 A 585 TRP HA A 588 MET HBx 1.0 1.8 3.5 681 486 A 585 TRP HA A 588 MET HBy 1.0 1.8 3.5 682 487 A 585 TRP HA A 588 MET HGx 1.0 1.8 4.5 683 487 A 588 MET HGy A 585 TRP HA 1.0 1.8 4.5 684 488 A 584 ILE HG2% A 588 MET HGx 1.0 1.8 5.5 685 488 A 584 ILE HG2% A 588 MET HGy 1.0 1.8 5.5 686 489 A 592 LYS H A 588 MET HGx 1.0 1.8 5.0 687 489 A 588 MET HGy A 592 LYS H 1.0 1.8 5.0 688 490 A 593 LYS H A 588 MET HGx 1.0 1.8 5.5 689 490 A 588 MET HGy A 593 LYS H 1.0 1.8 5.5 690 491 A 584 ILE HG2% A 588 MET HE% 1.0 1.8 6.0 691 492 A 585 TRP HA A 588 MET HE% 1.0 1.8 4.5 692 493 A 592 LYS H A 588 MET HE% 1.0 1.8 5.0 693 494 A 593 LYS H A 588 MET HE% 1.0 1.8 4.5 694 495 A 588 MET HE% A 593 LYS HDx 1.0 1.8 5.5 695 495 A 593 LYS HDy A 588 MET HE% 1.0 1.8 5.5 696 496 A 557 TRP HE1 A 588 MET HE% 1.0 1.8 4.0 697 497 A 596 TRP HE1 A 588 MET HE% 1.0 1.8 4.5 698 498 A 588 MET HE% A 596 TRP HD1 1.0 1.8 4.5 699 499 A 557 TRP HD1 A 588 MET HE% 1.0 1.8 4.5 700 500 A 557 TRP HZ2 A 588 MET HE% 1.0 1.8 5.5 701 501 A 585 TRP HE3 A 588 MET HE% 1.0 1.8 4.5 702 502 A 588 MET HE% A 585 TRP HZ3 1.0 1.8 4.5 703 503 A 585 TRP HH2 A 588 MET HE% 1.0 1.8 5.5 704 504 A 588 MET HE% A 585 TRP HZ2 1.0 1.8 5.5 705 505 A 588 MET HBx A 592 LYS HBx 1.0 1.8 5.0 706 505 A 588 MET HBy A 592 LYS HBx 1.0 1.8 5.0 707 505 A 592 LYS HBy A 588 MET HBx 1.0 1.8 5.0 708 505 A 588 MET HBy A 592 LYS HBy 1.0 1.8 5.0 709 506 A 588 MET HGx A 592 LYS HBx 1.0 1.8 4.5 710 506 A 588 MET HGy A 592 LYS HBx 1.0 1.8 4.5 711 506 A 592 LYS HBy A 588 MET HGx 1.0 1.8 4.5 712 506 A 588 MET HGy A 592 LYS HBy 1.0 1.8 4.5 713 507 A 588 MET HE% A 592 LYS HEx 1.0 1.8 6.0 714 507 A 588 MET HE% A 592 LYS HEy 1.0 1.8 6.0 715 508 A 589 SER H A 590 LYS H 1.0 1.8 5.0 716 509 A 589 SER H A 588 MET HA 1.0 1.8 3.5 717 510 A 589 SER H A 588 MET HBx 1.0 1.8 4.5 718 510 A 589 SER H A 588 MET HBy 1.0 1.8 4.5 719 511 A 589 SER H A 588 MET HGx 1.0 1.8 4.5 720 511 A 588 MET HGy A 589 SER H 1.0 1.8 4.5 721 512 A 589 SER H A 589 SER HA 1.0 1.8 4.0 722 513 A 589 SER H A 588 MET HBx 1.0 1.8 4.0 723 513 A 589 SER H A 588 MET HBy 1.0 1.8 4.0 724 514 A 589 SER H A 592 LYS H 1.0 1.8 6.0 725 515 A 590 LYS H A 591 GLU H 1.0 1.8 4.5 726 516 A 590 LYS H A 589 SER HA 1.0 1.8 3.0 727 517 A 590 LYS H A 589 SER HBx 1.0 1.8 4.0 728 517 A 590 LYS H A 589 SER HBy 1.0 1.8 4.0 729 518 A 590 LYS H A 590 LYS HA 1.0 1.8 4.0 730 519 A 590 LYS H A 590 LYS HBx 1.0 1.8 3.5 731 519 A 590 LYS H A 590 LYS HBy 1.0 1.8 3.5 732 520 A 590 LYS H A 590 LYS HDx 1.0 1.8 5.0 733 520 A 590 LYS H A 590 LYS HDy 1.0 1.8 5.0 734 521 A 591 GLU H A 589 SER HBx 1.0 1.8 4.0 735 521 A 591 GLU H A 589 SER HBy 1.0 1.8 4.0 736 522 A 591 GLU H A 590 LYS HA 1.0 1.8 4.0 737 523 A 591 GLU H A 590 LYS HBx 1.0 1.8 4.0 738 523 A 591 GLU H A 590 LYS HBy 1.0 1.8 4.0 739 524 A 591 GLU H A 590 LYS HDx 1.0 1.8 4.5 740 524 A 591 GLU H A 590 LYS HDy 1.0 1.8 4.5 741 525 A 591 GLU H A 591 GLU HA 1.0 1.8 3.0 742 526 A 591 GLU H A 591 GLU HBx 1.0 1.8 3.5 743 526 A 591 GLU H A 591 GLU HBy 1.0 1.8 3.5 744 527 A 591 GLU H A 591 GLU HGx 1.0 1.8 4.5 745 527 A 591 GLU H A 591 GLU HGy 1.0 1.8 4.5 746 528 A 592 LYS H A 591 GLU H 1.0 1.8 3.0 747 529 A 593 LYS H A 591 GLU H 1.0 1.8 5.0 748 530 A 591 GLU HA A 594 GLU HBx 1.0 1.8 3.5 749 530 A 591 GLU HA A 594 GLU HBy 1.0 1.8 3.5 750 531 A 592 LYS H A 593 LYS H 1.0 1.8 3.0 751 532 A 592 LYS H A 591 GLU HA 1.0 1.8 4.0 752 533 A 592 LYS H A 591 GLU HBx 1.0 1.8 4.0 753 533 A 592 LYS H A 591 GLU HBy 1.0 1.8 4.0 754 534 A 592 LYS H A 592 LYS HA 1.0 1.8 3.0 755 535 A 592 LYS H A 592 LYS HBx 1.0 1.8 3.5 756 535 A 592 LYS H A 592 LYS HBy 1.0 1.8 3.5 757 536 A 592 LYS H A 592 LYS HGx 1.0 1.8 5.0 758 536 A 592 LYS H A 592 LYS HGy 1.0 1.8 5.0 759 537 A 592 LYS H A 592 LYS HDx 1.0 1.8 4.5 760 537 A 592 LYS H A 592 LYS HDy 1.0 1.8 4.5 761 538 A 592 LYS HA A 595 GLU HBx 1.0 1.8 3.5 762 538 A 592 LYS HA A 595 GLU HBy 1.0 1.8 3.5 763 539 A 596 TRP HE1 A 592 LYS HGx 1.0 1.8 4.5 764 539 A 596 TRP HE1 A 592 LYS HGy 1.0 1.8 4.5 765 540 A 593 LYS H A 594 GLU H 1.0 1.8 3.0 766 541 A 593 LYS H A 590 LYS HA 1.0 1.8 4.0 767 542 A 593 LYS H A 591 GLU HA 1.0 1.8 4.5 768 543 A 593 LYS H A 592 LYS HA 1.0 1.8 4.0 769 544 A 593 LYS H A 592 LYS HBx 1.0 1.8 3.0 770 544 A 593 LYS H A 592 LYS HBy 1.0 1.8 3.0 771 545 A 593 LYS H A 593 LYS HA 1.0 1.8 3.0 772 546 A 593 LYS H A 593 LYS HBx 1.0 1.8 3.5 773 546 A 593 LYS H A 593 LYS HBy 1.0 1.8 3.5 774 547 A 593 LYS H A 593 LYS HGx 1.0 1.8 4.0 775 547 A 593 LYS H A 593 LYS HGy 1.0 1.8 4.0 776 548 A 593 LYS H A 593 LYS HDx 1.0 1.8 4.5 777 548 A 593 LYS HDy A 593 LYS H 1.0 1.8 4.5 778 549 A 590 LYS HA A 593 LYS HBx 1.0 1.8 3.5 779 549 A 590 LYS HA A 593 LYS HBy 1.0 1.8 3.5 780 550 A 585 TRP HZ2 A 593 LYS HA 1.0 1.8 4.0 781 551 A 596 TRP HD1 A 593 LYS HA 1.0 1.8 3.5 782 552 A 585 TRP HZ2 A 593 LYS HGx 1.0 1.8 5.0 783 552 A 585 TRP HZ2 A 593 LYS HGy 1.0 1.8 5.0 784 553 A 593 LYS HA A 596 TRP HBx 1.0 1.8 3.0 785 553 A 596 TRP HBy A 593 LYS HA 1.0 1.8 3.0 786 554 A 594 GLU H A 595 GLU H 1.0 1.8 3.0 787 555 A 590 LYS HA A 594 GLU H 1.0 1.8 5.0 788 556 A 591 GLU HA A 594 GLU H 1.0 1.8 4.0 789 557 A 592 LYS HA A 594 GLU H 1.0 1.8 4.5 790 558 A 594 GLU H A 593 LYS HA 1.0 1.8 4.0 791 559 A 594 GLU H A 593 LYS HBx 1.0 1.8 3.0 792 559 A 594 GLU H A 593 LYS HBy 1.0 1.8 3.0 793 560 A 593 LYS HDy A 594 GLU H 1.0 1.8 4.5 794 561 A 594 GLU H A 594 GLU HA 1.0 1.8 3.0 795 562 A 594 GLU H A 594 GLU HBx 1.0 1.8 3.5 796 562 A 594 GLU HBy A 594 GLU H 1.0 1.8 3.5 797 563 A 594 GLU H A 594 GLU HGx 1.0 1.8 4.0 798 563 A 594 GLU H A 594 GLU HGy 1.0 1.8 4.0 799 564 A 594 GLU HA A 597 ASP HBx 1.0 1.8 3.0 800 564 A 597 ASP HBy A 594 GLU HA 1.0 1.8 3.0 801 565 A 595 GLU H A 596 TRP H 1.0 1.8 3.0 802 566 A 595 GLU H A 597 ASP H 1.0 1.8 5.0 803 567 A 591 GLU HA A 595 GLU H 1.0 1.8 4.5 804 568 A 592 LYS HA A 595 GLU H 1.0 1.8 4.0 805 569 A 593 LYS HA A 595 GLU H 1.0 1.8 4.5 806 570 A 595 GLU H A 594 GLU HA 1.0 1.8 4.0 807 571 A 595 GLU H A 594 GLU HBx 1.0 1.8 3.0 808 571 A 594 GLU HBy A 595 GLU H 1.0 1.8 3.0 809 572 A 595 GLU H A 595 GLU HA 1.0 1.8 3.0 810 573 A 595 GLU H A 595 GLU HBx 1.0 1.8 3.5 811 573 A 595 GLU HBy A 595 GLU H 1.0 1.8 3.5 812 574 A 595 GLU H A 595 GLU HGx 1.0 1.8 4.5 813 574 A 595 GLU H A 595 GLU HGy 1.0 1.8 4.5 814 575 A 585 TRP HZ2 A 595 GLU HGx 1.0 1.8 5.5 815 575 A 585 TRP HZ2 A 595 GLU HGy 1.0 1.8 5.5 816 576 A 595 GLU HA A 598 ARG HBx 1.0 1.8 3.0 817 576 A 595 GLU HA A 598 ARG HBy 1.0 1.8 3.0 818 577 A 596 TRP H A 597 ASP H 1.0 1.8 3.0 819 578 A 596 TRP H A 598 ARG H 1.0 1.8 5.0 820 579 A 592 LYS HA A 596 TRP H 1.0 1.8 4.5 821 580 A 593 LYS HA A 596 TRP H 1.0 1.8 4.0 822 581 A 596 TRP H A 595 GLU HA 1.0 1.8 4.0 823 582 A 596 TRP H A 595 GLU HBx 1.0 1.8 3.5 824 582 A 595 GLU HBy A 596 TRP H 1.0 1.8 3.5 825 583 A 596 TRP HA A 596 TRP H 1.0 1.8 3.0 826 584 A 596 TRP H A 596 TRP HBx 1.0 1.8 3.5 827 584 A 596 TRP HBy A 596 TRP H 1.0 1.8 3.5 828 585 A 553 ALA HB% A 596 TRP H 1.0 1.8 4.0 829 586 A 585 TRP HH2 A 596 TRP H 1.0 1.8 5.5 830 587 A 557 TRP HD1 A 596 TRP HE1 1.0 1.8 3.5 831 588 A 585 TRP HH2 A 596 TRP HBx 1.0 1.8 4.0 832 588 A 596 TRP HBy A 585 TRP HH2 1.0 1.8 4.0 833 589 A 596 TRP HA A 596 TRP HE3 1.0 1.8 4.0 834 590 A 596 TRP HA A 599 LYS HBx 1.0 1.8 3.0 835 590 A 596 TRP HA A 599 LYS HBy 1.0 1.8 3.0 836 591 A 597 ASP H A 598 ARG H 1.0 1.8 3.0 837 592 A 597 ASP H A 599 LYS H 1.0 1.8 5.0 838 593 A 593 LYS HA A 597 ASP H 1.0 1.8 4.5 839 594 A 594 GLU HA A 597 ASP H 1.0 1.8 3.5 840 595 A 597 ASP H A 595 GLU HA 1.0 1.8 4.5 841 596 A 596 TRP HA A 597 ASP H 1.0 1.8 4.0 842 597 A 597 ASP H A 596 TRP HBx 1.0 1.8 3.0 843 597 A 596 TRP HBy A 597 ASP H 1.0 1.8 3.0 844 598 A 597 ASP H A 597 ASP HA 1.0 1.8 3.0 845 599 A 597 ASP H A 597 ASP HBx 1.0 1.8 3.5 846 599 A 597 ASP HBy A 597 ASP H 1.0 1.8 3.5 847 600 A 553 ALA HB% A 597 ASP H 1.0 1.8 4.5 848 601 A 553 ALA HB% A 597 ASP HA 1.0 1.8 4.0 849 602 A 585 TRP HH2 A 597 ASP H 1.0 1.8 6.5 850 603 A 596 TRP HE3 A 597 ASP H 1.0 1.8 6.0 851 604 A 600 ALA HB% A 597 ASP HA 1.0 1.8 3.0 852 605 A 598 ARG H A 599 LYS H 1.0 1.8 3.0 853 606 A 594 GLU HA A 598 ARG H 1.0 1.8 4.5 854 607 A 595 GLU HA A 598 ARG H 1.0 1.8 4.0 855 608 A 596 TRP HA A 598 ARG H 1.0 1.8 4.5 856 609 A 598 ARG H A 597 ASP HA 1.0 1.8 4.0 857 610 A 598 ARG H A 597 ASP HBx 1.0 1.8 3.0 858 610 A 597 ASP HBy A 598 ARG H 1.0 1.8 3.0 859 611 A 598 ARG H A 598 ARG HA 1.0 1.8 3.0 860 612 A 598 ARG H A 598 ARG HBx 1.0 1.8 3.5 861 612 A 598 ARG HBy A 598 ARG H 1.0 1.8 3.5 862 613 A 598 ARG H A 598 ARG HGx 1.0 1.8 4.5 863 613 A 598 ARG H A 598 ARG HGy 1.0 1.8 4.5 864 614 A 595 GLU HA A 598 ARG HBx 1.0 1.8 3.5 865 614 A 595 GLU HA A 598 ARG HBy 1.0 1.8 3.5 866 615 A 598 ARG HA A 601 GLU HBx 1.0 1.8 3.0 867 615 A 598 ARG HA A 601 GLU HBy 1.0 1.8 3.0 868 616 A 599 LYS H A 600 ALA H 1.0 1.8 3.0 869 617 A 595 GLU HA A 599 LYS H 1.0 1.8 4.5 870 618 A 596 TRP HA A 599 LYS H 1.0 1.8 4.0 871 619 A 599 LYS H A 598 ARG HA 1.0 1.8 4.0 872 620 A 599 LYS H A 598 ARG HBx 1.0 1.8 3.0 873 620 A 598 ARG HBy A 599 LYS H 1.0 1.8 3.0 874 621 A 599 LYS H A 598 ARG HGx 1.0 1.8 5.0 875 621 A 599 LYS H A 598 ARG HGy 1.0 1.8 5.0 876 622 A 599 LYS H A 599 LYS HA 1.0 1.8 3.0 877 623 A 599 LYS H A 599 LYS HBx 1.0 1.8 3.5 878 623 A 599 LYS HBy A 599 LYS H 1.0 1.8 3.5 879 624 A 599 LYS H A 599 LYS HGx 1.0 1.8 4.5 880 624 A 599 LYS H A 599 LYS HGy 1.0 1.8 4.5 881 625 A 596 TRP HA A 599 LYS HBx 1.0 1.8 3.5 882 625 A 596 TRP HA A 599 LYS HBy 1.0 1.8 3.5 883 626 A 599 LYS HA A 602 ASP HBx 1.0 1.8 3.0 884 626 A 599 LYS HA A 602 ASP HBy 1.0 1.8 3.0 885 627 A 556 LEU HDx% A 599 LYS HBx 1.0 1.8 5.5 886 627 A 556 LEU HDy% A 599 LYS HBx 1.0 1.8 5.5 887 627 A 599 LYS HBy A 556 LEU HDy% 1.0 1.8 5.5 888 627 A 556 LEU HDx% A 599 LYS HBy 1.0 1.8 5.5 889 628 A 600 ALA H A 601 GLU H 1.0 1.8 3.0 890 629 A 600 ALA H A 602 ASP H 1.0 1.8 5.0 891 630 A 596 TRP HA A 600 ALA H 1.0 1.8 4.5 892 631 A 597 ASP HA A 600 ALA H 1.0 1.8 4.0 893 632 A 598 ARG HA A 600 ALA H 1.0 1.8 4.5 894 633 A 600 ALA H A 599 LYS HA 1.0 1.8 4.0 895 634 A 600 ALA H A 599 LYS HBx 1.0 1.8 3.0 896 634 A 599 LYS HBy A 600 ALA H 1.0 1.8 3.0 897 635 A 600 ALA HA A 600 ALA H 1.0 1.8 3.0 898 636 A 600 ALA HB% A 600 ALA H 1.0 1.8 3.5 899 637 A 600 ALA HB% A 597 ASP HA 1.0 1.8 3.5 900 638 A 600 ALA H A 556 LEU HDy% 1.0 1.8 5.0 901 638 A 556 LEU HDx% A 600 ALA H 1.0 1.8 5.0 902 639 A 600 ALA H A 556 LEU HDy% 1.0 1.8 5.0 903 639 A 556 LEU HDx% A 600 ALA H 1.0 1.8 5.0 904 640 A 600 ALA HA A 603 ALA HB% 1.0 1.8 3.5 905 641 A 552 SER HA A 600 ALA HB% 1.0 1.8 5.5 906 642 A 601 GLU H A 602 ASP H 1.0 1.8 3.0 907 643 A 599 LYS H A 601 GLU H 1.0 1.8 5.0 908 644 A 598 ARG HA A 601 GLU H 1.0 1.8 4.0 909 645 A 599 LYS HA A 601 GLU H 1.0 1.8 4.5 910 646 A 600 ALA HA A 601 GLU H 1.0 1.8 4.0 911 647 A 600 ALA HB% A 601 GLU H 1.0 1.8 3.5 912 648 A 601 GLU H A 601 GLU HA 1.0 1.8 3.0 913 649 A 601 GLU H A 601 GLU HBx 1.0 1.8 3.5 914 649 A 601 GLU HBy A 601 GLU H 1.0 1.8 3.5 915 650 A 601 GLU H A 601 GLU HGx 1.0 1.8 5.0 916 650 A 601 GLU H A 601 GLU HGy 1.0 1.8 5.0 917 651 A 601 GLU HA A 604 ARG HBx 1.0 1.8 3.0 918 651 A 601 GLU HA A 604 ARG HBy 1.0 1.8 3.0 919 652 A 602 ASP H A 603 ALA H 1.0 1.8 3.0 920 653 A 598 ARG HA A 602 ASP H 1.0 1.8 4.5 921 654 A 599 LYS HA A 602 ASP H 1.0 1.8 4.0 922 655 A 600 ALA HA A 602 ASP H 1.0 1.8 4.5 923 656 A 602 ASP H A 601 GLU HA 1.0 1.8 4.0 924 657 A 602 ASP H A 601 GLU HBx 1.0 1.8 3.0 925 657 A 601 GLU HBy A 602 ASP H 1.0 1.8 3.0 926 658 A 602 ASP H A 601 GLU HGx 1.0 1.8 5.0 927 658 A 602 ASP H A 601 GLU HGy 1.0 1.8 5.0 928 659 A 602 ASP H A 602 ASP HA 1.0 1.8 3.0 929 660 A 602 ASP H A 602 ASP HBx 1.0 1.8 3.5 930 660 A 602 ASP HBy A 602 ASP H 1.0 1.8 3.5 931 661 A 599 LYS HA A 602 ASP HBx 1.0 1.8 3.5 932 661 A 599 LYS HA A 602 ASP HBy 1.0 1.8 3.5 933 662 A 602 ASP HA A 605 ARG HBx 1.0 1.8 3.0 934 662 A 602 ASP HA A 605 ARG HBy 1.0 1.8 3.0 935 663 A 602 ASP HA A 605 ARG HDx 1.0 1.8 5.0 936 663 A 602 ASP HA A 605 ARG HDy 1.0 1.8 5.0 937 664 A 603 ALA H A 604 ARG H 1.0 1.8 3.0 938 665 A 599 LYS HA A 603 ALA H 1.0 1.8 4.5 939 666 A 600 ALA HA A 603 ALA H 1.0 1.8 4.0 940 667 A 601 GLU HA A 603 ALA H 1.0 1.8 4.5 941 668 A 603 ALA H A 602 ASP HA 1.0 1.8 4.0 942 669 A 603 ALA H A 602 ASP HBx 1.0 1.8 3.0 943 669 A 602 ASP HBy A 603 ALA H 1.0 1.8 3.0 944 670 A 603 ALA H A 603 ALA HA 1.0 1.8 3.0 945 671 A 603 ALA HB% A 603 ALA H 1.0 1.8 3.5 946 672 A 600 ALA HA A 603 ALA HB% 1.0 1.8 3.5 947 673 A 603 ALA HB% A 556 LEU HDy% 1.0 1.8 5.0 948 673 A 556 LEU HDx% A 603 ALA HB% 1.0 1.8 5.0 949 674 A 603 ALA HA A 606 ASP HBx 1.0 1.8 3.0 950 674 A 603 ALA HA A 606 ASP HBy 1.0 1.8 3.0 951 675 A 604 ARG H A 605 ARG H 1.0 1.8 3.0 952 676 A 600 ALA HA A 604 ARG H 1.0 1.8 4.5 953 677 A 601 GLU HA A 604 ARG H 1.0 1.8 4.0 954 678 A 602 ASP HA A 604 ARG H 1.0 1.8 4.5 955 679 A 604 ARG H A 603 ALA HA 1.0 1.8 4.0 956 680 A 603 ALA HB% A 604 ARG H 1.0 1.8 3.0 957 681 A 604 ARG H A 604 ARG HA 1.0 1.8 3.0 958 682 A 604 ARG H A 604 ARG HBx 1.0 1.8 3.5 959 682 A 604 ARG HBy A 604 ARG H 1.0 1.8 3.5 960 683 A 601 GLU HA A 604 ARG HBx 1.0 1.8 3.5 961 683 A 601 GLU HA A 604 ARG HBy 1.0 1.8 3.5 962 684 A 604 ARG HA A 607 TYR HBx 1.0 1.8 3.0 963 684 A 604 ARG HA A 607 TYR HBy 1.0 1.8 3.0 964 685 A 604 ARG HA A 607 TYR HBx 1.0 1.8 3.0 965 685 A 604 ARG HA A 607 TYR HBy 1.0 1.8 3.0 966 686 A 605 ARG H A 606 ASP H 1.0 1.8 3.0 967 687 A 601 GLU HA A 605 ARG H 1.0 1.8 4.5 968 688 A 602 ASP HA A 605 ARG H 1.0 1.8 4.0 969 689 A 603 ALA HA A 605 ARG H 1.0 1.8 4.5 970 690 A 605 ARG H A 604 ARG HA 1.0 1.8 4.0 971 691 A 605 ARG H A 604 ARG HBx 1.0 1.8 3.0 972 691 A 604 ARG HBy A 605 ARG H 1.0 1.8 3.0 973 692 A 605 ARG H A 605 ARG HA 1.0 1.8 3.0 974 693 A 605 ARG H A 605 ARG HBx 1.0 1.8 3.5 975 693 A 605 ARG HBy A 605 ARG H 1.0 1.8 3.5 976 694 A 602 ASP HA A 605 ARG HBx 1.0 1.8 3.5 977 694 A 602 ASP HA A 605 ARG HBy 1.0 1.8 3.5 978 695 A 605 ARG HA A 608 GLU HBx 1.0 1.8 3.0 979 695 A 605 ARG HA A 608 GLU HBy 1.0 1.8 3.0 980 696 A 605 ARG HA A 605 ARG HDx 1.0 1.8 4.5 981 696 A 605 ARG HDy A 605 ARG HA 1.0 1.8 4.5 982 697 A 606 ASP H A 607 TYR H 1.0 1.8 3.0 983 698 A 602 ASP HA A 606 ASP H 1.0 1.8 4.5 984 699 A 603 ALA HA A 606 ASP H 1.0 1.8 4.0 985 700 A 604 ARG HA A 606 ASP H 1.0 1.8 4.5 986 701 A 606 ASP H A 605 ARG HA 1.0 1.8 4.0 987 702 A 606 ASP H A 605 ARG HBx 1.0 1.8 3.0 988 702 A 605 ARG HBy A 606 ASP H 1.0 1.8 3.0 989 703 A 606 ASP H A 605 ARG HGx 1.0 1.8 5.0 990 703 A 606 ASP H A 605 ARG HGy 1.0 1.8 5.0 991 704 A 606 ASP H A 606 ASP HA 1.0 1.8 3.0 992 705 A 606 ASP H A 606 ASP HBx 1.0 1.8 3.5 993 705 A 606 ASP HBy A 606 ASP H 1.0 1.8 3.5 994 706 A 603 ALA HA A 606 ASP HBx 1.0 1.8 3.0 995 706 A 603 ALA HA A 606 ASP HBy 1.0 1.8 3.0 996 707 A 607 TYR H A 608 GLU H 1.0 1.8 3.0 997 708 A 603 ALA HA A 607 TYR H 1.0 1.8 4.5 998 709 A 604 ARG HA A 607 TYR H 1.0 1.8 4.0 999 710 A 605 ARG HA A 607 TYR H 1.0 1.8 4.5 1000 711 A 607 TYR H A 606 ASP HA 1.0 1.8 4.0 1001 712 A 607 TYR H A 606 ASP HBx 1.0 1.8 3.0 1002 712 A 606 ASP HBy A 607 TYR H 1.0 1.8 3.0 1003 713 A 607 TYR H A 607 TYR HA 1.0 1.8 3.0 1004 714 A 607 TYR H A 607 TYR HBx 1.0 1.8 3.5 1005 714 A 607 TYR HBy A 607 TYR H 1.0 1.8 3.5 1006 715 A 604 ARG HA A 607 TYR HBx 1.0 1.8 3.0 1007 715 A 604 ARG HA A 607 TYR HBy 1.0 1.8 3.0 1008 716 A 608 GLU H A 609 LYS H 1.0 1.8 3.0 1009 717 A 604 ARG HA A 608 GLU H 1.0 1.8 4.5 1010 718 A 605 ARG HA A 608 GLU H 1.0 1.8 4.0 1011 719 A 606 ASP HA A 608 GLU H 1.0 1.8 4.5 1012 720 A 608 GLU H A 607 TYR HA 1.0 1.8 4.0 1013 721 A 608 GLU H A 607 TYR HBx 1.0 1.8 3.0 1014 721 A 607 TYR HBy A 608 GLU H 1.0 1.8 3.0 1015 722 A 608 GLU H A 608 GLU HA 1.0 1.8 3.0 1016 723 A 608 GLU H A 608 GLU HBx 1.0 1.8 3.5 1017 723 A 608 GLU HBy A 608 GLU H 1.0 1.8 3.5 1018 724 A 608 GLU H A 608 GLU HGx 1.0 1.8 4.5 1019 724 A 608 GLU H A 608 GLU HGy 1.0 1.8 4.5 1020 725 A 605 ARG HA A 608 GLU HBx 1.0 1.8 3.0 1021 725 A 605 ARG HA A 608 GLU HBy 1.0 1.8 3.0 1022 726 A 609 LYS H A 610 ALA H 1.0 1.8 3.0 1023 727 A 605 ARG HA A 609 LYS H 1.0 1.8 4.5 1024 728 A 606 ASP HA A 609 LYS H 1.0 1.8 4.0 1025 729 A 607 TYR HA A 609 LYS H 1.0 1.8 4.5 1026 730 A 609 LYS H A 608 GLU HA 1.0 1.8 4.0 1027 731 A 609 LYS H A 608 GLU HBx 1.0 1.8 3.0 1028 731 A 608 GLU HBy A 609 LYS H 1.0 1.8 3.0 1029 732 A 609 LYS H A 609 LYS HA 1.0 1.8 3.0 1030 733 A 609 LYS H A 609 LYS HBx 1.0 1.8 3.5 1031 733 A 609 LYS H A 609 LYS HBy 1.0 1.8 3.5 1032 734 A 609 LYS H A 609 LYS HGx 1.0 1.8 4.5 1033 734 A 609 LYS H A 609 LYS HGy 1.0 1.8 4.5 1034 735 A 609 LYS H A 609 LYS HDx 1.0 1.8 5.5 1035 735 A 609 LYS H A 609 LYS HDy 1.0 1.8 5.5 1036 736 A 606 ASP HA A 609 LYS HBx 1.0 1.8 3.0 1037 736 A 606 ASP HA A 609 LYS HBy 1.0 1.8 3.0 1038 737 A 609 LYS HA A 612 LYS HBx 1.0 1.8 3.0 1039 737 A 609 LYS HA A 612 LYS HBy 1.0 1.8 3.0 1040 738 A 610 ALA H A 611 MET H 1.0 1.8 3.0 1041 739 A 608 GLU H A 610 ALA H 1.0 1.8 5.0 1042 740 A 606 ASP HA A 610 ALA H 1.0 1.8 4.5 1043 741 A 607 TYR HA A 610 ALA H 1.0 1.8 4.0 1044 742 A 608 GLU HA A 610 ALA H 1.0 1.8 4.5 1045 743 A 610 ALA H A 609 LYS HA 1.0 1.8 4.0 1046 744 A 610 ALA H A 609 LYS HBx 1.0 1.8 3.0 1047 744 A 610 ALA H A 609 LYS HBy 1.0 1.8 3.0 1048 745 A 610 ALA H A 610 ALA HA 1.0 1.8 3.0 1049 746 A 610 ALA H A 610 ALA HB% 1.0 1.8 3.5 1050 747 A 607 TYR HA A 610 ALA HB% 1.0 1.8 3.0 1051 748 A 610 ALA HA A 613 GLU HBx 1.0 1.8 3.5 1052 748 A 610 ALA HA A 613 GLU HBy 1.0 1.8 3.5 1053 749 A 610 ALA HB% A 611 MET HGx 1.0 1.8 5.0 1054 749 A 610 ALA HB% A 611 MET HGy 1.0 1.8 5.0 1055 750 A 610 ALA HB% A 614 TYR HD% 1.0 1.8 5.0 1056 751 A 611 MET H A 612 LYS H 1.0 1.8 3.0 1057 752 A 607 TYR HA A 611 MET H 1.0 1.8 4.5 1058 753 A 608 GLU HA A 611 MET H 1.0 1.8 4.0 1059 754 A 609 LYS HA A 611 MET H 1.0 1.8 4.5 1060 755 A 611 MET H A 610 ALA HA 1.0 1.8 4.0 1061 756 A 611 MET H A 610 ALA HB% 1.0 1.8 3.0 1062 757 A 611 MET H A 611 MET HA 1.0 1.8 3.0 1063 758 A 611 MET H A 611 MET HBx 1.0 1.8 3.5 1064 758 A 611 MET H A 611 MET HBy 1.0 1.8 3.5 1065 759 A 611 MET H A 611 MET HGx 1.0 1.8 4.5 1066 759 A 611 MET H A 611 MET HGy 1.0 1.8 4.5 1067 760 A 611 MET H A 611 MET HE% 1.0 1.8 4.5 1068 761 A 611 MET HA A 611 MET HE% 1.0 1.8 4.5 1069 762 A 608 GLU HA A 611 MET HBx 1.0 1.8 3.0 1070 762 A 608 GLU HA A 611 MET HBy 1.0 1.8 3.0 1071 763 A 611 MET HA A 614 TYR HBx 1.0 1.8 3.5 1072 763 A 611 MET HA A 614 TYR HBy 1.0 1.8 3.5 1073 764 A 611 MET HE% A 614 TYR HE% 1.0 1.8 4.0 1074 765 A 611 MET HE% A 607 TYR HD% 1.0 1.8 4.0 1075 766 A 611 MET HE% A 614 TYR HE% 1.0 1.8 4.0 1076 767 A 611 MET HE% A 607 TYR HD% 1.0 1.8 4.0 1077 768 A 614 TYR HD% A 611 MET HA 1.0 1.8 5.0 1078 769 A 612 LYS H A 613 GLU H 1.0 1.8 3.0 1079 770 A 609 LYS HA A 612 LYS H 1.0 1.8 4.0 1080 771 A 610 ALA HA A 612 LYS H 1.0 1.8 4.5 1081 772 A 612 LYS H A 611 MET HA 1.0 1.8 4.0 1082 773 A 612 LYS H A 611 MET HBx 1.0 1.8 3.0 1083 773 A 612 LYS H A 611 MET HBy 1.0 1.8 3.0 1084 774 A 612 LYS H A 612 LYS HA 1.0 1.8 3.0 1085 775 A 612 LYS H A 612 LYS HBx 1.0 1.8 3.5 1086 775 A 612 LYS HBy A 612 LYS H 1.0 1.8 3.5 1087 776 A 612 LYS H A 612 LYS HGx 1.0 1.8 4.5 1088 776 A 612 LYS H A 612 LYS HGy 1.0 1.8 4.5 1089 777 A 612 LYS H A 612 LYS HDx 1.0 1.8 5.5 1090 777 A 612 LYS H A 612 LYS HDy 1.0 1.8 5.5 1091 778 A 613 GLU H A 614 TYR H 1.0 1.8 3.0 1092 779 A 609 LYS HA A 613 GLU H 1.0 1.8 4.5 1093 780 A 610 ALA HA A 613 GLU H 1.0 1.8 4.0 1094 781 A 611 MET HA A 613 GLU H 1.0 1.8 4.5 1095 782 A 613 GLU H A 612 LYS HA 1.0 1.8 4.0 1096 783 A 613 GLU H A 612 LYS HBx 1.0 1.8 3.0 1097 783 A 612 LYS HBy A 613 GLU H 1.0 1.8 3.0 1098 784 A 613 GLU H A 613 GLU HA 1.0 1.8 3.0 1099 785 A 613 GLU H A 613 GLU HBx 1.0 1.8 3.5 1100 785 A 613 GLU HBy A 613 GLU H 1.0 1.8 3.5 1101 786 A 613 GLU H A 613 GLU HGx 1.0 1.8 4.5 1102 786 A 613 GLU H A 613 GLU HGy 1.0 1.8 4.5 1103 787 A 614 TYR H A 615 GLU H 1.0 1.8 3.0 1104 788 A 610 ALA HA A 614 TYR H 1.0 1.8 4.5 1105 789 A 611 MET HA A 614 TYR H 1.0 1.8 4.0 1106 790 A 612 LYS HA A 614 TYR H 1.0 1.8 4.5 1107 791 A 614 TYR H A 613 GLU HA 1.0 1.8 4.0 1108 792 A 614 TYR H A 613 GLU HBx 1.0 1.8 3.0 1109 792 A 613 GLU HBy A 614 TYR H 1.0 1.8 3.0 1110 793 A 614 TYR H A 613 GLU HGx 1.0 1.8 5.0 1111 793 A 614 TYR H A 613 GLU HGy 1.0 1.8 5.0 1112 794 A 614 TYR H A 614 TYR HA 1.0 1.8 3.0 1113 795 A 614 TYR H A 614 TYR HBx 1.0 1.8 3.5 1114 795 A 614 TYR HBy A 614 TYR H 1.0 1.8 3.5 1115 796 A 614 TYR HD% A 614 TYR H 1.0 1.8 5.0 1116 797 A 615 GLU H A 616 GLY H 1.0 1.8 3.5 1117 798 A 611 MET HA A 615 GLU H 1.0 1.8 4.5 1118 799 A 612 LYS HA A 615 GLU H 1.0 1.8 4.0 1119 800 A 613 GLU HA A 615 GLU H 1.0 1.8 4.5 1120 801 A 615 GLU H A 614 TYR HA 1.0 1.8 4.0 1121 802 A 615 GLU H A 614 TYR HBx 1.0 1.8 3.5 1122 802 A 614 TYR HBy A 615 GLU H 1.0 1.8 3.5 1123 803 A 614 TYR HD% A 615 GLU H 1.0 1.8 5.0 1124 804 A 615 GLU H A 615 GLU HA 1.0 1.8 3.0 1125 805 A 615 GLU H A 615 GLU HBx 1.0 1.8 4.0 1126 805 A 615 GLU H A 615 GLU HBy 1.0 1.8 4.0 1127 806 A 615 GLU H A 615 GLU HGx 1.0 1.8 5.0 1128 806 A 615 GLU H A 615 GLU HGy 1.0 1.8 5.0 1129 807 A 614 TYR HD% A 615 GLU HGx 1.0 1.8 5.5 1130 807 A 614 TYR HD% A 615 GLU HGy 1.0 1.8 5.5 1131 808 A 616 GLY H A 615 GLU HA 1.0 1.8 5.0 1132 809 A 616 GLY H A 616 GLY HAy 1.0 1.8 3.5 1133 809 A 616 GLY H A 616 GLY HAx 1.0 1.8 3.5 1134 810 A 617 GLY H A 617 GLY HAx 1.0 1.8 3.5 1135 810 A 617 GLY H A 617 GLY HAy 1.0 1.8 3.5 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 552 SER C A 553 ALA N A 553 ALA CA A 553 ALA C 1.0 -62.473 -54.195 PHI 2 2 A 553 ALA N A 553 ALA CA A 553 ALA C A 554 TYR N 1.0 -37.794 -26.392 PSI 3 3 A 553 ALA C A 554 TYR N A 554 TYR CA A 554 TYR C 1.0 -71.124 -57.614 PHI 4 4 A 554 TYR N A 554 TYR CA A 554 TYR C A 555 MET N 1.0 -42.056 -29.014 PSI 5 5 A 554 TYR C A 555 MET N A 555 MET CA A 555 MET C 1.0 -67.631 -60.289 PHI 6 6 A 555 MET N A 555 MET CA A 555 MET C A 556 LEU N 1.0 -46.418 -33.554 PSI 7 7 A 555 MET C A 556 LEU N A 556 LEU CA A 556 LEU C 1.0 -68.746 -62.206 PHI 8 8 A 556 LEU N A 556 LEU CA A 556 LEU C A 557 TRP N 1.0 -46.456 -40.156 PSI 9 9 A 556 LEU C A 557 TRP N A 557 TRP CA A 557 TRP C 1.0 -67.629 -56.893 PHI 10 10 A 557 TRP N A 557 TRP CA A 557 TRP C A 558 LEU N 1.0 -50.550 -42.626 PSI 11 11 A 557 TRP C A 558 LEU N A 558 LEU CA A 558 LEU C 1.0 -66.106 -60.658 PHI 12 12 A 558 LEU N A 558 LEU CA A 558 LEU C A 559 ASN N 1.0 -47.640 -38.514 PSI 13 13 A 558 LEU C A 559 ASN N A 559 ASN CA A 559 ASN C 1.0 -70.149 -62.101 PHI 14 14 A 559 ASN N A 559 ASN CA A 559 ASN C A 560 ALA N 1.0 -44.501 -34.947 PSI 15 15 A 559 ASN C A 560 ALA N A 560 ALA CA A 560 ALA C 1.0 -70.490 -61.516 PHI 16 16 A 560 ALA N A 560 ALA CA A 560 ALA C A 561 SER N 1.0 -44.793 -32.533 PSI 17 17 A 560 ALA C A 561 SER N A 561 SER CA A 561 SER C 1.0 -72.895 -63.505 PHI 18 18 A 561 SER N A 561 SER CA A 561 SER C A 562 ARG N 1.0 -44.067 -28.229 PSI 19 19 A 561 SER C A 562 ARG N A 562 ARG CA A 562 ARG C 1.0 -64.715 -56.229 PHI 20 20 A 562 ARG N A 562 ARG CA A 562 ARG C A 563 GLU N 1.0 -49.347 -41.797 PSI 21 21 A 562 ARG C A 563 GLU N A 563 GLU CA A 563 GLU C 1.0 -67.533 -63.309 PHI 22 22 A 563 GLU N A 563 GLU CA A 563 GLU C A 564 LYS N 1.0 -42.954 -33.514 PSI 23 23 A 563 GLU C A 564 LYS N A 564 LYS CA A 564 LYS C 1.0 -69.702 -63.390 PHI 24 24 A 564 LYS N A 564 LYS CA A 564 LYS C A 565 ILE N 1.0 -45.811 -39.263 PSI 25 25 A 564 LYS C A 565 ILE N A 565 ILE CA A 565 ILE C 1.0 -65.841 -58.487 PHI 26 26 A 565 ILE N A 565 ILE CA A 565 ILE C A 566 LYS N 1.0 -47.497 -40.713 PSI 27 27 A 565 ILE C A 566 LYS N A 566 LYS CA A 566 LYS C 1.0 -66.468 -59.368 PHI 28 28 A 566 LYS N A 566 LYS CA A 566 LYS C A 567 SER N 1.0 -41.125 -32.473 PSI 29 29 A 566 LYS C A 567 SER N A 567 SER CA A 567 SER C 1.0 -73.326 -61.438 PHI 30 30 A 567 SER N A 567 SER CA A 567 SER C A 568 ASP N 1.0 -38.916 -26.968 PSI 31 31 A 567 SER C A 568 ASP N A 568 ASP CA A 568 ASP C 1.0 -88.057 -73.547 PHI 32 32 A 568 ASP N A 568 ASP CA A 568 ASP C A 569 HIS N 1.0 -35.087 -5.087 PSI 33 33 A 568 ASP C A 569 HIS N A 569 HIS CA A 569 HIS C 1.0 -132.596 -73.824 PHI 34 34 A 569 HIS N A 569 HIS CA A 569 HIS C A 570 PRO N 1.0 75.763 138.589 PSI 35 35 A 569 HIS C A 570 PRO N A 570 PRO CA A 570 PRO C 1.0 -67.961 -53.665 PHI 36 36 A 570 PRO N A 570 PRO CA A 570 PRO C A 571 GLY N 1.0 129.462 142.818 PSI 37 37 A 571 GLY C A 572 ILE N A 572 ILE CA A 572 ILE C 1.0 -86.320 -59.378 PHI 38 38 A 572 ILE N A 572 ILE CA A 572 ILE C A 573 SER N 1.0 121.525 139.307 PSI 39 39 A 572 ILE C A 573 SER N A 573 SER CA A 573 SER C 1.0 -80.070 -64.144 PHI 40 40 A 573 SER N A 573 SER CA A 573 SER C A 574 ILE N 1.0 153.029 165.563 PSI 41 41 A 573 SER C A 574 ILE N A 574 ILE CA A 574 ILE C 1.0 -63.928 -54.348 PHI 42 42 A 574 ILE N A 574 ILE CA A 574 ILE C A 575 THR N 1.0 -46.644 -35.766 PSI 43 43 A 574 ILE C A 575 THR N A 575 THR CA A 575 THR C 1.0 -71.431 -60.577 PHI 44 44 A 575 THR N A 575 THR CA A 575 THR C A 576 ASP N 1.0 -43.787 -34.563 PSI 45 45 A 575 THR C A 576 ASP N A 576 ASP CA A 576 ASP C 1.0 -72.101 -64.593 PHI 46 46 A 576 ASP N A 576 ASP CA A 576 ASP C A 577 LEU N 1.0 -44.024 -33.894 PSI 47 47 A 576 ASP C A 577 LEU N A 577 LEU CA A 577 LEU C 1.0 -66.140 -60.016 PHI 48 48 A 577 LEU N A 577 LEU CA A 577 LEU C A 578 SER N 1.0 -49.784 -42.202 PSI 49 49 A 577 LEU C A 578 SER N A 578 SER CA A 578 SER C 1.0 -66.870 -59.682 PHI 50 50 A 578 SER N A 578 SER CA A 578 SER C A 579 LYS N 1.0 -44.020 -35.520 PSI 51 51 A 578 SER C A 579 LYS N A 579 LYS CA A 579 LYS C 1.0 -67.563 -61.363 PHI 52 52 A 579 LYS N A 579 LYS CA A 579 LYS C A 580 LYS N 1.0 -46.630 -37.924 PSI 53 53 A 579 LYS C A 580 LYS N A 580 LYS CA A 580 LYS C 1.0 -70.719 -62.913 PHI 54 54 A 580 LYS N A 580 LYS CA A 580 LYS C A 581 ALA N 1.0 -44.592 -34.134 PSI 55 55 A 580 LYS C A 581 ALA N A 581 ALA CA A 581 ALA C 1.0 -69.160 -62.270 PHI 56 56 A 581 ALA N A 581 ALA CA A 581 ALA C A 582 GLY N 1.0 -44.731 -35.271 PSI 57 57 A 581 ALA C A 582 GLY N A 582 GLY CA A 582 GLY C 1.0 -68.065 -59.783 PHI 58 58 A 582 GLY N A 582 GLY CA A 582 GLY C A 583 GLU N 1.0 -46.341 -38.145 PSI 59 59 A 582 GLY C A 583 GLU N A 583 GLU CA A 583 GLU C 1.0 -69.525 -61.639 PHI 60 60 A 583 GLU N A 583 GLU CA A 583 GLU C A 584 ILE N 1.0 -45.843 -36.935 PSI 61 61 A 583 GLU C A 584 ILE N A 584 ILE CA A 584 ILE C 1.0 -66.712 -58.636 PHI 62 62 A 584 ILE N A 584 ILE CA A 584 ILE C A 585 TRP N 1.0 -51.485 -40.073 PSI 63 63 A 584 ILE C A 585 TRP N A 585 TRP CA A 585 TRP C 1.0 -65.692 -57.734 PHI 64 64 A 585 TRP N A 585 TRP CA A 585 TRP C A 586 LYS N 1.0 -46.725 -34.747 PSI 65 65 A 585 TRP C A 586 LYS N A 586 LYS CA A 586 LYS C 1.0 -71.269 -62.375 PHI 66 66 A 586 LYS N A 586 LYS CA A 586 LYS C A 587 GLY N 1.0 -35.091 -20.139 PSI 67 67 A 587 GLY C A 588 MET N A 588 MET CA A 588 MET C 1.0 -75.174 -60.062 PHI 68 68 A 588 MET N A 588 MET CA A 588 MET C A 589 SER N 1.0 132.522 154.492 PSI 69 69 A 588 MET C A 589 SER N A 589 SER CA A 589 SER C 1.0 -74.275 -62.335 PHI 70 70 A 589 SER N A 589 SER CA A 589 SER C A 590 LYS N 1.0 145.285 160.325 PSI 71 71 A 589 SER C A 590 LYS N A 590 LYS CA A 590 LYS C 1.0 -64.788 -55.498 PHI 72 72 A 590 LYS N A 590 LYS CA A 590 LYS C A 591 GLU N 1.0 -45.580 -34.464 PSI 73 73 A 590 LYS C A 591 GLU N A 591 GLU CA A 591 GLU C 1.0 -72.993 -54.259 PHI 74 74 A 591 GLU N A 591 GLU CA A 591 GLU C A 592 LYS N 1.0 -46.466 -35.362 PSI 75 75 A 591 GLU C A 592 LYS N A 592 LYS CA A 592 LYS C 1.0 -71.147 -63.869 PHI 76 76 A 592 LYS N A 592 LYS CA A 592 LYS C A 593 LYS N 1.0 -43.133 -35.107 PSI 77 77 A 592 LYS C A 593 LYS N A 593 LYS CA A 593 LYS C 1.0 -68.070 -61.274 PHI 78 78 A 593 LYS N A 593 LYS CA A 593 LYS C A 594 GLU N 1.0 -44.850 -37.062 PSI 79 79 A 593 LYS C A 594 GLU N A 594 GLU CA A 594 GLU C 1.0 -66.630 -59.942 PHI 80 80 A 594 GLU N A 594 GLU CA A 594 GLU C A 595 GLU N 1.0 -46.495 -39.225 PSI 81 81 A 594 GLU C A 595 GLU N A 595 GLU CA A 595 GLU C 1.0 -68.257 -62.009 PHI 82 82 A 595 GLU N A 595 GLU CA A 595 GLU C A 596 TRP N 1.0 -45.757 -38.561 PSI 83 83 A 595 GLU C A 596 TRP N A 596 TRP CA A 596 TRP C 1.0 -67.214 -59.326 PHI 84 84 A 596 TRP N A 596 TRP CA A 596 TRP C A 597 ASP N 1.0 -48.536 -40.140 PSI 85 85 A 596 TRP C A 597 ASP N A 597 ASP CA A 597 ASP C 1.0 -67.409 -61.185 PHI 86 86 A 597 ASP N A 597 ASP CA A 597 ASP C A 598 ARG N 1.0 -44.457 -35.539 PSI 87 87 A 597 ASP C A 598 ARG N A 598 ARG CA A 598 ARG C 1.0 -68.002 -61.424 PHI 88 88 A 598 ARG N A 598 ARG CA A 598 ARG C A 599 LYS N 1.0 -46.999 -38.203 PSI 89 89 A 598 ARG C A 599 LYS N A 599 LYS CA A 599 LYS C 1.0 -66.975 -60.769 PHI 90 90 A 599 LYS N A 599 LYS CA A 599 LYS C A 600 ALA N 1.0 -46.612 -38.466 PSI 91 91 A 599 LYS C A 600 ALA N A 600 ALA CA A 600 ALA C 1.0 -65.630 -62.286 PHI 92 92 A 600 ALA N A 600 ALA CA A 600 ALA C A 601 GLU N 1.0 -44.017 -38.373 PSI 93 93 A 600 ALA C A 601 GLU N A 601 GLU CA A 601 GLU C 1.0 -67.933 -62.179 PHI 94 94 A 601 GLU N A 601 GLU CA A 601 GLU C A 602 ASP N 1.0 -45.686 -36.072 PSI 95 95 A 601 GLU C A 602 ASP N A 602 ASP CA A 602 ASP C 1.0 -68.263 -62.027 PHI 96 96 A 602 ASP N A 602 ASP CA A 602 ASP C A 603 ALA N 1.0 -44.952 -36.740 PSI 97 97 A 602 ASP C A 603 ALA N A 603 ALA CA A 603 ALA C 1.0 -67.652 -62.312 PHI 98 98 A 603 ALA N A 603 ALA CA A 603 ALA C A 604 ARG N 1.0 -42.815 -36.593 PSI 99 99 A 603 ALA C A 604 ARG N A 604 ARG CA A 604 ARG C 1.0 -67.866 -61.468 PHI 100 100 A 604 ARG N A 604 ARG CA A 604 ARG C A 605 ARG N 1.0 -46.330 -36.584 PSI 101 101 A 604 ARG C A 605 ARG N A 605 ARG CA A 605 ARG C 1.0 -70.310 -64.242 PHI 102 102 A 605 ARG N A 605 ARG CA A 605 ARG C A 606 ASP N 1.0 -40.147 -32.869 PSI 103 103 A 605 ARG C A 606 ASP N A 606 ASP CA A 606 ASP C 1.0 -71.500 -64.332 PHI 104 104 A 606 ASP N A 606 ASP CA A 606 ASP C A 607 TYR N 1.0 -39.697 -33.797 PSI 105 105 A 606 ASP C A 607 TYR N A 607 TYR CA A 607 TYR C 1.0 -67.288 -61.608 PHI 106 106 A 607 TYR N A 607 TYR CA A 607 TYR C A 608 GLU N 1.0 -48.831 -41.233 PSI 107 107 A 607 TYR C A 608 GLU N A 608 GLU CA A 608 GLU C 1.0 -67.894 -59.940 PHI 108 108 A 608 GLU N A 608 GLU CA A 608 GLU C A 609 LYS N 1.0 -42.431 -32.669 PSI 109 109 A 608 GLU C A 609 LYS N A 609 LYS CA A 609 LYS C 1.0 -68.877 -61.409 PHI 110 110 A 609 LYS N A 609 LYS CA A 609 LYS C A 610 ALA N 1.0 -47.922 -36.624 PSI 111 111 A 609 LYS C A 610 ALA N A 610 ALA CA A 610 ALA C 1.0 -70.860 -62.924 PHI 112 112 A 610 ALA N A 610 ALA CA A 610 ALA C A 611 MET N 1.0 -42.587 -33.985 PSI 113 113 A 610 ALA C A 611 MET N A 611 MET CA A 611 MET C 1.0 -73.044 -63.466 PHI 114 114 A 611 MET N A 611 MET CA A 611 MET C A 612 LYS N 1.0 -39.150 -29.874 PSI 115 115 A 611 MET C A 612 LYS N A 612 LYS CA A 612 LYS C 1.0 -71.346 -64.912 PHI 116 116 A 612 LYS N A 612 LYS CA A 612 LYS C A 613 GLU N 1.0 -39.018 -24.458 PSI stop_ save_