==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE/PROTEIN BINDING 08-APR-10 2XBB . COMPND 2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE NEDD4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.MASPERO,V.CECATIELLO,A.MUSACCHIO,S.POLO,S.PASQUALATO . 902 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45305.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 605 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 51 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 51 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 119 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 287 31.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 1 2 2 2 0 0 7 7 2 2 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 1 5 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 5 2 4 2 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 5 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 520 A R 0 0 127 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0-120.2 -4.9 28.8 48.2 2 521 A D > - 0 0 87 1,-0.0 4,-1.2 0, 0.0 3,-0.1 -0.350 360.0 -88.8-112.0-166.1 -4.2 25.1 48.9 3 522 A Y H > S+ 0 0 52 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.944 114.1 58.6 -73.9 -52.6 -2.4 23.0 51.5 4 523 A K H > S+ 0 0 122 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.757 108.8 49.5 -53.8 -26.5 1.2 22.8 50.2 5 524 A R H > S+ 0 0 117 2,-0.2 4,-2.1 1,-0.1 -1,-0.3 0.908 110.0 48.6 -79.1 -44.6 1.3 26.6 50.3 6 525 A K H X S+ 0 0 56 -4,-1.2 4,-3.0 -3,-0.2 -2,-0.2 0.924 107.9 55.9 -58.0 -47.4 -0.0 26.9 53.9 7 526 A Y H X S+ 0 0 67 -4,-2.7 4,-3.0 2,-0.2 5,-0.3 0.868 107.9 47.0 -57.6 -41.7 2.4 24.3 55.2 8 527 A E H X S+ 0 0 75 -4,-1.0 4,-2.5 -5,-0.2 -1,-0.2 0.968 114.4 47.2 -62.8 -51.8 5.4 26.2 53.9 9 528 A F H X S+ 0 0 86 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.859 114.1 51.3 -54.0 -38.1 4.0 29.4 55.4 10 529 A F H X S+ 0 0 0 -4,-3.0 4,-1.0 2,-0.2 -2,-0.2 0.976 110.9 42.4 -65.3 -59.6 3.4 27.3 58.5 11 530 A R H < S+ 0 0 83 -4,-3.0 3,-0.3 1,-0.2 -2,-0.2 0.846 116.2 53.0 -57.6 -33.1 6.9 25.8 59.0 12 531 A R H < S+ 0 0 165 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.887 106.5 50.4 -70.5 -40.1 8.3 29.2 58.1 13 532 A K H < S+ 0 0 117 -4,-2.1 2,-1.0 -5,-0.2 -1,-0.2 0.594 84.9 104.8 -75.6 -11.1 6.2 31.0 60.7 14 533 A L S < S- 0 0 14 -4,-1.0 2,-0.1 -3,-0.3 227,-0.0 -0.626 75.3-133.1 -73.4 103.9 7.4 28.5 63.4 15 534 A K - 0 0 154 -2,-1.0 2,-0.3 1,-0.1 -2,-0.1 -0.365 12.1-136.6 -61.1 126.7 9.9 30.5 65.4 16 535 A K - 0 0 156 -2,-0.1 2,-0.3 1,-0.0 -1,-0.1 -0.675 23.0-118.9 -81.4 139.8 13.2 28.6 66.0 17 536 A Q - 0 0 65 -2,-0.3 3,-0.2 31,-0.2 -1,-0.0 -0.626 26.6-177.0 -85.2 137.4 14.5 29.0 69.6 18 537 A N S S+ 0 0 141 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.368 77.5 65.5-112.9 -0.1 17.9 30.6 70.1 19 538 A D S S+ 0 0 91 2,-0.1 -1,-0.2 29,-0.0 -2,-0.0 -0.333 91.2 83.6-114.3 48.1 18.0 30.1 73.9 20 539 A I S S- 0 0 36 -3,-0.2 29,-0.1 31,-0.0 28,-0.0 -0.969 84.1 -89.2-149.1 155.0 18.2 26.3 73.8 21 540 A P - 0 0 64 0, 0.0 32,-0.1 0, 0.0 -2,-0.1 -0.241 39.4-115.7 -62.4 159.1 20.6 23.4 73.3 22 541 A N S S+ 0 0 136 30,-0.1 31,-0.4 1,-0.0 2,-0.3 0.414 95.8 31.6 -80.1 4.0 21.3 22.2 69.8 23 542 A K - 0 0 71 29,-0.2 2,-0.5 32,-0.0 31,-0.2 -0.991 65.5-139.3-154.2 152.3 19.8 18.8 70.6 24 543 A F E -a 54 0A 6 29,-3.0 31,-3.0 -2,-0.3 2,-0.3 -0.961 31.9-147.9-115.3 112.9 17.2 17.2 72.8 25 544 A E E +a 55 0A 79 -2,-0.5 2,-0.4 29,-0.2 31,-0.2 -0.596 20.1 175.5 -89.6 135.9 18.6 14.0 74.2 26 545 A M E -a 56 0A 0 29,-2.4 31,-2.6 -2,-0.3 2,-0.7 -0.962 14.5-167.7-139.5 120.9 16.5 10.8 74.9 27 546 A K E +a 57 0A 100 -2,-0.4 2,-0.2 29,-0.2 31,-0.2 -0.913 29.7 171.3-104.7 106.5 17.8 7.5 76.1 28 547 A L E -a 58 0A 4 29,-2.3 31,-3.0 -2,-0.7 2,-0.4 -0.714 32.2-144.6-118.3 163.1 14.9 5.1 75.7 29 548 A R > - 0 0 140 -2,-0.2 3,-3.0 29,-0.2 7,-0.2 -0.984 16.9-140.8-128.0 121.0 14.1 1.3 75.9 30 549 A R G > S+ 0 0 78 -2,-0.4 3,-1.1 1,-0.3 4,-0.2 0.793 101.0 61.3 -49.0 -37.5 11.5 -0.1 73.5 31 550 A A G 3 S+ 0 0 101 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.670 122.7 22.6 -65.6 -15.9 10.1 -2.4 76.2 32 551 A T G <> S+ 0 0 40 -3,-3.0 4,-2.7 2,-0.1 5,-0.3 -0.069 76.9 136.3-142.5 35.5 9.2 0.7 78.2 33 552 A V H <> S+ 0 0 7 -3,-1.1 4,-3.1 1,-0.2 5,-0.3 0.865 73.3 55.5 -53.7 -40.3 9.0 3.5 75.6 34 553 A L H > S+ 0 0 8 -4,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.979 115.3 33.3 -59.3 -61.2 5.8 4.9 77.2 35 554 A E H > S+ 0 0 10 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.812 121.3 51.4 -69.3 -28.9 7.1 5.3 80.7 36 555 A D H X S+ 0 0 16 -4,-2.7 4,-1.8 -7,-0.2 -1,-0.2 0.911 115.2 41.1 -71.7 -42.7 10.6 6.2 79.5 37 556 A S H X S+ 0 0 0 -4,-3.1 4,-2.5 -5,-0.3 5,-0.4 0.883 114.4 54.1 -71.3 -39.2 9.3 8.9 77.1 38 557 A Y H X S+ 0 0 11 -4,-2.9 4,-2.9 -5,-0.3 5,-0.2 0.958 111.5 42.7 -59.4 -53.3 6.7 10.1 79.7 39 558 A R H X S+ 0 0 57 -4,-2.0 4,-0.8 2,-0.2 -1,-0.2 0.920 116.5 47.3 -62.9 -45.0 9.3 10.7 82.4 40 559 A R H X S+ 0 0 95 -4,-1.8 4,-0.5 -5,-0.2 3,-0.2 0.955 120.7 35.7 -60.7 -53.3 11.9 12.3 80.2 41 560 A I H >< S+ 0 0 0 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.906 118.4 48.8 -71.5 -44.4 9.5 14.6 78.4 42 561 A M H 3< S+ 0 0 45 -4,-2.9 -1,-0.2 -5,-0.4 -2,-0.2 0.607 101.5 69.9 -71.5 -9.5 7.3 15.4 81.3 43 562 A G H 3< S+ 0 0 60 -4,-0.8 2,-0.5 -5,-0.2 -1,-0.2 0.772 82.1 82.6 -76.2 -27.2 10.4 16.1 83.3 44 563 A V << - 0 0 16 -3,-1.0 3,-0.1 -4,-0.5 6,-0.0 -0.681 59.0-166.4 -87.2 126.5 11.2 19.2 81.4 45 564 A K S S+ 0 0 189 -2,-0.5 2,-0.8 1,-0.2 -1,-0.2 0.899 77.6 61.8 -77.0 -42.7 9.4 22.4 82.6 46 565 A R > - 0 0 87 1,-0.2 3,-1.7 2,-0.0 4,-0.2 -0.780 67.1-162.4 -91.2 108.6 10.3 24.5 79.6 47 566 A A G > S+ 0 0 9 -2,-0.8 3,-2.2 1,-0.3 4,-0.3 0.710 80.5 82.2 -61.5 -21.2 8.8 22.9 76.5 48 567 A D G > S+ 0 0 36 1,-0.3 3,-1.7 2,-0.2 4,-0.4 0.786 79.3 66.1 -55.6 -30.3 11.1 25.1 74.4 49 568 A F G X S+ 0 0 74 -3,-1.7 3,-1.0 1,-0.3 -1,-0.3 0.769 91.1 64.7 -61.6 -25.5 13.9 22.5 75.0 50 569 A L G < S+ 0 0 0 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.565 87.6 69.1 -77.6 -8.5 11.7 20.0 72.9 51 570 A K G < S+ 0 0 26 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.2 0.711 78.6 102.3 -79.1 -21.0 12.2 22.2 69.8 52 571 A A S < S- 0 0 6 -3,-1.0 -28,-0.2 -4,-0.4 -29,-0.2 -0.234 96.2 -74.5 -62.7 152.5 15.9 21.2 69.7 53 572 A R - 0 0 140 -31,-0.4 -29,-3.0 -32,-0.1 2,-0.4 -0.224 58.1-110.0 -50.3 127.8 16.9 18.6 67.2 54 573 A L E -a 24 0A 8 -31,-0.2 2,-0.6 -3,-0.1 16,-0.2 -0.476 34.6-175.2 -70.3 121.6 15.7 15.2 68.4 55 574 A W E +a 25 0A 57 -31,-3.0 -29,-2.4 -2,-0.4 2,-0.4 -0.806 16.1 171.3-118.4 87.7 18.6 13.0 69.5 56 575 A I E -a 26 0A 4 -2,-0.6 2,-0.4 10,-0.2 -29,-0.2 -0.803 15.9-173.2-107.9 138.8 17.1 9.6 70.4 57 576 A E E -a 27 0A 18 -31,-2.6 -29,-2.3 -2,-0.4 2,-0.5 -0.964 10.6-153.6-132.0 117.5 18.8 6.3 71.3 58 577 A F E > S-a 28 0A 1 -2,-0.4 3,-2.5 1,-0.2 -29,-0.2 -0.771 75.6 -19.6 -89.8 127.0 16.9 3.0 71.8 59 578 A D T 3 S- 0 0 84 -31,-3.0 -1,-0.2 -2,-0.5 -30,-0.1 0.783 123.0 -57.0 51.2 35.2 18.5 0.4 74.0 60 579 A G T 3 S+ 0 0 51 -32,-0.4 -1,-0.3 -3,-0.4 2,-0.1 0.414 90.9 155.2 81.5 -3.0 22.0 1.9 73.7 61 580 A E < - 0 0 75 -3,-2.5 2,-0.3 2,-0.0 -1,-0.3 -0.375 20.8-174.9 -60.4 131.4 22.0 1.7 69.9 62 581 A K + 0 0 134 -3,-0.1 3,-0.1 1,-0.1 -5,-0.0 -0.893 48.5 37.8-131.8 157.1 24.4 4.3 68.5 63 582 A G S S+ 0 0 85 1,-0.3 2,-0.2 -2,-0.3 -1,-0.1 0.384 77.5 132.4 88.8 -3.1 25.5 5.7 65.1 64 583 A L S S- 0 0 88 1,-0.1 -1,-0.3 -3,-0.1 2,-0.1 -0.494 70.7 -86.1 -81.7 151.1 22.1 5.5 63.5 65 584 A D > - 0 0 72 -2,-0.2 4,-1.7 1,-0.1 5,-0.2 -0.333 33.3-138.5 -56.4 127.8 20.5 8.4 61.6 66 585 A Y H > S+ 0 0 51 1,-0.2 4,-2.7 2,-0.2 3,-0.3 0.925 101.7 50.1 -55.0 -49.5 18.8 10.7 64.0 67 586 A G H > S+ 0 0 16 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.878 108.8 51.9 -58.6 -41.1 15.8 11.3 61.7 68 587 A G H > S+ 0 0 17 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.834 112.8 45.0 -65.7 -33.6 15.3 7.5 61.2 69 588 A V H X S+ 0 0 10 -4,-1.7 4,-2.1 -3,-0.3 -2,-0.2 0.860 111.7 51.8 -78.2 -38.6 15.3 6.9 64.9 70 589 A A H X S+ 0 0 2 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.914 107.3 54.1 -60.4 -43.7 13.0 9.8 65.6 71 590 A R H X S+ 0 0 41 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.876 109.1 48.2 -59.3 -38.6 10.6 8.4 63.0 72 591 A E H X S+ 0 0 63 -4,-1.1 4,-2.9 2,-0.2 -1,-0.2 0.889 108.3 54.1 -70.6 -39.4 10.6 5.1 64.8 73 592 A W H X S+ 0 0 0 -4,-2.1 4,-3.3 1,-0.2 5,-0.4 0.917 105.5 51.7 -60.9 -45.7 9.9 6.7 68.2 74 593 A F H X S+ 0 0 2 -4,-2.2 4,-0.9 1,-0.2 60,-0.7 0.808 114.0 46.4 -62.0 -29.2 6.9 8.6 66.9 75 594 A F H X S+ 0 0 92 -4,-1.0 4,-1.7 -5,-0.2 -2,-0.2 0.906 116.0 43.3 -76.0 -44.8 5.6 5.3 65.6 76 595 A L H X S+ 0 0 42 -4,-2.9 4,-0.8 2,-0.2 -2,-0.2 0.892 115.8 46.3 -70.9 -41.3 6.4 3.3 68.8 77 596 A I H X S+ 0 0 0 -4,-3.3 4,-3.1 1,-0.2 3,-0.4 0.853 109.2 56.5 -71.1 -34.2 5.1 5.9 71.3 78 597 A S H X S+ 0 0 0 -4,-0.9 4,-2.4 -5,-0.4 -2,-0.2 0.935 102.7 54.7 -59.3 -46.5 1.9 6.4 69.2 79 598 A K H < S+ 0 0 113 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.755 116.1 39.5 -60.2 -24.8 1.2 2.7 69.5 80 599 A E H >< S+ 0 0 54 -4,-0.8 3,-1.8 -3,-0.4 -2,-0.2 0.910 114.1 48.2 -90.5 -52.2 1.4 3.0 73.3 81 600 A M H 3< S+ 0 0 1 -4,-3.1 8,-0.4 1,-0.3 7,-0.2 0.900 117.0 45.1 -52.7 -44.1 -0.3 6.4 73.9 82 601 A F T 3< S+ 0 0 11 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.1 0.250 81.3 122.1 -91.0 10.9 -3.2 5.4 71.7 83 602 A N X - 0 0 40 -3,-1.8 3,-2.2 1,-0.2 5,-0.4 -0.679 57.5-148.6 -76.5 112.4 -3.5 1.9 73.2 84 603 A P G > S+ 0 0 3 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.673 87.7 82.4 -56.3 -18.7 -7.1 1.7 74.5 85 604 A Y G 3 S+ 0 0 26 1,-0.3 738,-3.2 2,-0.1 675,-0.1 0.749 88.4 53.1 -58.6 -25.3 -5.8 -0.7 77.3 86 605 A Y G < S- 0 0 20 -3,-2.2 -1,-0.3 -6,-0.2 739,-0.1 0.645 106.3-127.6 -87.7 -16.3 -4.7 2.4 79.3 87 606 A G S < S+ 0 0 0 -3,-1.3 21,-0.2 2,-0.4 22,-0.2 0.605 81.6 106.7 81.1 11.5 -8.1 4.1 79.1 88 607 A L S S+ 0 0 3 -5,-0.4 14,-2.7 1,-0.3 2,-0.3 0.940 88.1 13.1 -80.8 -59.0 -6.8 7.4 77.8 89 608 A F E S-B 101 0B 1 -8,-0.4 -2,-0.4 12,-0.3 2,-0.3 -0.783 70.7-173.2-113.7 161.6 -8.1 7.0 74.2 90 609 A E E -B 100 0B 51 10,-2.6 10,-3.0 -2,-0.3 2,-0.3 -0.960 35.6 -85.5-148.0 163.1 -10.6 4.5 72.8 91 610 A Y E -B 99 0B 108 -2,-0.3 8,-0.2 8,-0.2 6,-0.1 -0.557 36.7-129.1 -74.7 136.5 -12.0 3.5 69.4 92 611 A S S S- 0 0 7 6,-2.7 2,-0.3 -2,-0.3 -1,-0.1 0.810 78.3 -16.5 -57.1 -37.0 -14.9 5.7 68.3 93 612 A A S > S- 0 0 32 5,-0.3 3,-1.8 3,-0.2 2,-0.2 -0.945 89.7 -59.0-158.1 175.1 -17.2 2.8 67.5 94 613 A T T 3 S+ 0 0 121 -2,-0.3 3,-0.1 1,-0.3 668,-0.0 -0.471 123.1 4.7 -66.5 129.9 -17.4 -0.9 66.9 95 614 A D T 3 S+ 0 0 162 1,-0.3 2,-0.3 -2,-0.2 -1,-0.3 0.641 106.5 121.4 67.8 15.1 -15.3 -1.9 63.9 96 615 A N < - 0 0 65 -3,-1.8 -1,-0.3 1,-0.1 -3,-0.2 -0.867 49.8-160.7-108.9 148.0 -14.1 1.7 63.6 97 616 A Y + 0 0 169 -2,-0.3 39,-0.3 -6,-0.1 -1,-0.1 0.742 54.4 108.2 -98.8 -27.2 -10.4 2.7 63.8 98 617 A T - 0 0 26 -7,-0.1 -6,-2.7 39,-0.1 2,-0.3 -0.175 64.4-128.5 -56.1 144.5 -10.6 6.4 64.6 99 618 A L E +Bc 91 137B 8 37,-3.1 39,-2.1 -8,-0.2 2,-0.3 -0.758 26.0 179.1-102.5 141.5 -9.6 7.4 68.2 100 619 A Q E -B 90 0B 12 -10,-3.0 -10,-2.6 -2,-0.3 2,-0.2 -0.959 38.7 -90.9-135.5 155.1 -11.5 9.5 70.7 101 620 A I E -B 89 0B 11 -2,-0.3 -12,-0.3 -12,-0.2 -13,-0.1 -0.463 40.4-121.8 -66.5 130.3 -10.8 10.6 74.3 102 621 A N > - 0 0 7 -14,-2.7 3,-1.3 -2,-0.2 4,-0.1 -0.649 14.8-151.8 -74.3 113.2 -12.2 8.1 76.8 103 622 A P T 3 S+ 0 0 19 0, 0.0 3,-0.4 0, 0.0 -1,-0.2 0.805 95.7 55.2 -56.2 -30.1 -14.6 10.2 79.0 104 623 A N T >> + 0 0 30 1,-0.2 3,-0.6 2,-0.1 4,-0.6 -0.185 68.3 124.5 -97.1 39.9 -13.8 7.8 81.8 105 624 A S H X> + 0 0 0 -3,-1.3 4,-2.2 1,-0.2 3,-0.8 0.855 68.7 58.8 -65.4 -36.7 -10.1 8.3 81.7 106 625 A G H 34 S+ 0 0 32 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.711 102.2 54.1 -68.0 -21.4 -9.9 9.3 85.4 107 626 A L H <4 S+ 0 0 103 -3,-0.6 -1,-0.2 -20,-0.1 -2,-0.2 0.639 111.2 44.7 -87.8 -15.9 -11.4 6.0 86.4 108 627 A C H << S+ 0 0 0 -3,-0.8 2,-0.3 -4,-0.6 717,-0.2 0.812 132.8 4.5 -92.2 -38.2 -8.8 4.0 84.6 109 628 A N >< - 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0 0 58 0, 0.0 4,-1.5 0, 0.0 3,-0.7 -0.374 16.2-141.7 -56.3 123.4 1.1 28.4 68.4 243 762 A Q T 34 S+ 0 0 76 1,-0.3 4,-0.4 -5,-0.2 3,-0.2 0.881 101.0 52.8 -54.8 -43.8 -2.7 28.0 68.7 244 763 A D T >4 S+ 0 0 135 1,-0.2 3,-0.5 2,-0.2 -1,-0.3 0.812 107.2 53.7 -63.7 -30.1 -3.3 31.1 66.6 245 764 A L G X4 S+ 0 0 23 -3,-0.7 3,-1.1 1,-0.2 -1,-0.2 0.841 102.4 54.9 -75.6 -34.0 -1.0 29.8 63.9 246 765 A I G >< S+ 0 0 1 -4,-1.5 3,-1.4 1,-0.3 -1,-0.2 0.514 84.7 85.6 -80.8 -4.0 -2.7 26.4 63.4 247 766 A K G < S+ 0 0 95 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.1 0.598 72.2 76.0 -71.6 -10.6 -6.1 28.2 62.8 248 767 A I G < S+ 0 0 56 -3,-1.1 2,-0.3 -4,-0.1 -1,-0.3 0.626 88.4 71.9 -75.5 -13.0 -5.1 28.5 59.1 249 768 A F S < S- 0 0 6 -3,-1.4 2,-0.2 -4,-0.1 -246,-0.0 -0.705 75.0-137.5-100.3 153.6 -5.9 24.8 58.6 250 769 A D > - 0 0 50 -2,-0.3 4,-2.8 1,-0.0 5,-0.2 -0.498 41.6 -87.9 -95.7 176.8 -9.3 23.1 58.6 251 770 A E H > S+ 0 0 24 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.829 127.7 48.1 -54.5 -35.5 -10.1 19.8 60.3 252 771 A N H > S+ 0 0 80 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.912 113.3 44.6 -75.2 -43.2 -9.0 17.8 57.2 253 772 A E H > S+ 0 0 32 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.882 111.4 55.3 -66.4 -39.0 -5.6 19.7 56.6 254 773 A L H X S+ 0 0 0 -4,-2.8 4,-1.4 1,-0.2 5,-0.2 0.890 105.2 52.1 -60.2 -41.6 -4.9 19.5 60.3 255 774 A E H X S+ 0 0 52 -4,-1.4 4,-2.0 -5,-0.2 3,-0.2 0.893 110.7 48.3 -62.1 -40.2 -5.3 15.7 60.3 256 775 A L H < S+ 0 0 82 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.848 107.6 57.5 -67.1 -35.0 -2.9 15.5 57.4 257 776 A L H < S+ 0 0 9 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.811 122.8 19.2 -67.1 -33.4 -0.4 17.7 59.3 258 777 A M H < S+ 0 0 0 -4,-1.4 -125,-2.7 -3,-0.2 2,-0.3 0.543 115.8 63.1-119.4 -10.7 -0.1 15.5 62.3 259 778 A C B < +d 133 0C 0 -4,-2.0 2,-0.3 -127,-0.2 -125,-0.2 -0.898 63.3 71.0-125.4 151.1 -1.3 12.1 61.3 260 779 A G S S- 0 0 2 -127,-2.0 2,-0.4 -2,-0.3 -125,-0.1 -0.895 75.7 -53.0 142.5-172.2 -0.1 9.4 58.9 261 780 A L - 0 0 69 53,-0.3 53,-0.5 -2,-0.3 -128,-0.1 -0.827 30.3-159.2-105.8 142.9 2.7 6.9 58.3 262 781 A G S S+ 0 0 27 -2,-0.4 2,-0.2 -191,-0.2 -1,-0.1 0.958 73.6 26.4 -82.5 -58.5 6.4 7.8 58.4 263 782 A D S S- 0 0 48 -192,-0.1 2,-0.3 50,-0.1 36,-0.1 -0.594 82.7-108.6-105.9 170.4 8.1 4.9 56.5 264 783 A V - 0 0 9 -2,-0.2 2,-0.8 34,-0.2 3,-0.1 -0.710 19.0-118.8-104.6 146.8 6.8 2.6 53.8 265 784 A D > - 0 0 97 -2,-0.3 4,-2.7 1,-0.2 3,-0.2 -0.739 23.4-162.0 -79.2 109.8 5.9 -1.1 53.8 266 785 A V H > S+ 0 0 15 -2,-0.8 4,-2.8 1,-0.2 5,-0.2 0.847 88.1 54.7 -64.7 -36.2 8.3 -2.6 51.2 267 786 A N H > S+ 0 0 92 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.853 114.0 41.5 -65.4 -35.5 6.3 -5.8 50.8 268 787 A D H > S+ 0 0 44 -3,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.861 113.6 53.1 -77.2 -38.7 3.2 -3.7 49.9 269 788 A W H < S+ 0 0 0 -4,-2.7 3,-0.3 1,-0.2 -2,-0.2 0.914 113.8 44.1 -59.1 -44.5 5.3 -1.3 47.8 270 789 A R H >< S+ 0 0 88 -4,-2.8 3,-1.8 1,-0.2 -2,-0.2 0.948 106.8 57.2 -66.4 -51.9 6.6 -4.3 45.8 271 790 A E H 3< S+ 0 0 134 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.680 110.7 44.7 -59.6 -20.7 3.4 -6.2 45.4 272 791 A H T 3< S+ 0 0 63 -4,-1.0 59,-0.8 -3,-0.3 2,-0.4 -0.147 86.4 114.4-119.0 37.2 1.7 -3.2 43.7 273 792 A T E < -g 331 0F 11 -3,-1.8 2,-0.3 57,-0.1 59,-0.2 -0.892 51.3-149.3-107.5 138.7 4.5 -2.2 41.3 274 793 A K E -g 332 0F 125 57,-3.0 59,-2.3 -2,-0.4 2,-0.4 -0.804 8.5-145.6-106.4 148.7 4.2 -2.4 37.5 275 794 A Y E -g 333 0F 52 -2,-0.3 2,-0.3 57,-0.2 59,-0.2 -0.930 12.4-166.7-119.6 139.5 7.0 -3.1 35.1 276 795 A K E > +g 334 0F 117 57,-1.9 59,-1.8 -2,-0.4 3,-1.1 -0.851 57.2 18.9-120.7 156.2 7.6 -1.8 31.6 277 796 A N T 3 S- 0 0 106 -2,-0.3 -1,-0.2 1,-0.3 3,-0.1 0.839 132.0 -35.3 62.7 42.8 9.8 -2.5 28.6 278 797 A G T 3 S+ 0 0 62 1,-0.4 -1,-0.3 -3,-0.2 56,-0.1 0.008 104.9 120.7 107.3 -28.1 11.0 -6.0 29.4 279 798 A Y < + 0 0 11 -3,-1.1 -1,-0.4 54,-0.1 2,-0.3 -0.304 32.4 167.9 -70.4 153.1 11.3 -5.8 33.2 280 799 A S > - 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0 0 48 -3,-0.6 -22,-1.2 -4,-0.2 2,-0.3 -0.906 68.0-145.9-104.1 126.8 -15.8 -25.7 105.7 580 723 B V B -N 556 0J 43 -2,-0.5 2,-0.9 -24,-0.2 -24,-0.2 -0.691 18.9-116.4 -93.0 143.7 -17.5 -24.2 108.7 581 724 B V + 0 0 0 -26,-2.7 -26,-0.4 -2,-0.3 -28,-0.2 -0.690 48.2 163.9 -81.1 108.0 -16.2 -24.6 112.2 582 725 B T >> - 0 0 37 -2,-0.9 4,-1.1 -32,-0.1 3,-0.8 -0.580 55.0 -94.3-114.4 178.6 -18.8 -26.6 114.2 583 726 B N T 34 S+ 0 0 64 1,-0.2 4,-0.3 -2,-0.2 -2,-0.0 0.716 122.7 56.4 -64.3 -21.0 -18.9 -28.5 117.5 584 727 B K T 34 S+ 0 0 196 1,-0.2 -1,-0.2 2,-0.1 4,-0.1 0.657 120.5 24.0 -88.9 -15.7 -18.2 -31.7 115.5 585 728 B N T <> S+ 0 0 34 -3,-0.8 4,-1.9 2,-0.1 -2,-0.2 0.269 91.0 98.1-131.3 9.1 -15.0 -30.5 113.8 586 729 B K H X S+ 0 0 26 -4,-1.1 4,-3.0 2,-0.2 5,-0.2 0.860 79.2 61.2 -68.4 -35.4 -13.7 -27.8 116.1 587 730 B K H > S+ 0 0 158 -4,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.928 108.0 44.6 -53.6 -46.7 -11.3 -30.2 117.8 588 731 B E H > S+ 0 0 80 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.897 110.4 55.7 -63.4 -42.2 -9.7 -30.7 114.4 589 732 B Y H X S+ 0 0 25 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.933 108.9 46.8 -56.2 -49.7 -9.8 -27.0 113.8 590 733 B I H >X S+ 0 0 10 -4,-3.0 4,-2.5 2,-0.2 3,-0.5 0.971 110.9 50.8 -55.5 -59.1 -7.8 -26.4 117.0 591 734 B Y H 3X S+ 0 0 139 -4,-2.3 4,-2.3 1,-0.3 -1,-0.2 0.876 112.0 48.1 -46.7 -46.0 -5.2 -29.0 116.3 592 735 B L H 3X S+ 0 0 29 -4,-2.5 4,-1.8 1,-0.2 -1,-0.3 0.833 109.5 52.4 -68.2 -34.5 -4.6 -27.5 112.8 593 736 B V H S+ 0 0 30 -4,-2.3 5,-2.3 -5,-0.2 4,-2.1 0.855 113.4 47.4 -59.9 -37.5 0.3 -27.0 114.1 596 739 B W H <>S+ 0 0 10 -4,-1.8 5,-0.8 3,-0.2 -1,-0.2 0.888 113.8 46.8 -72.3 -39.5 0.2 -24.1 111.7 597 740 B R H <5S+ 0 0 34 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.810 132.2 15.2 -71.8 -31.9 1.2 -21.5 114.4 598 741 B F H <5S+ 0 0 8 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.678 133.5 18.6-118.3 -26.2 4.1 -23.6 115.8 599 742 B V T ><5S+ 0 0 27 -4,-2.1 3,-1.1 -5,-0.4 -3,-0.2 0.808 108.2 49.3-117.0 -71.7 5.0 -26.4 113.4 600 743 B N G > S+ 0 0 17 -3,-1.1 4,-2.0 1,-0.1 -1,-0.3 -0.098 79.2 119.1-115.0 35.3 8.6 -23.3 110.2 603 746 B Q H <> S+ 0 0 115 -3,-1.5 4,-1.6 2,-0.2 -1,-0.1 0.951 77.4 40.1 -66.5 -52.7 9.3 -26.9 109.2 604 747 B K H > S+ 0 0 133 -4,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.875 116.1 50.4 -68.7 -39.1 12.4 -26.4 107.0 605 748 B Q H > S+ 0 0 11 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.941 111.6 46.9 -63.9 -47.6 14.0 -23.8 109.3 606 749 B M H X S+ 0 0 4 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.810 110.3 54.6 -65.6 -30.0 13.6 -26.0 112.4 607 750 B A H X S+ 0 0 41 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.885 107.4 49.8 -68.9 -40.0 15.0 -28.9 110.5 608 751 B A H X S+ 0 0 11 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.913 112.3 47.5 -63.6 -44.4 18.1 -26.9 109.6 609 752 B F H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.932 113.4 47.2 -63.6 -47.3 18.6 -25.9 113.2 610 753 B K H X S+ 0 0 38 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.891 109.1 54.6 -62.1 -41.5 18.1 -29.4 114.5 611 754 B E H X S+ 0 0 108 -4,-2.5 4,-0.5 1,-0.2 -1,-0.2 0.907 112.6 43.4 -59.2 -42.4 20.5 -30.9 111.8 612 755 B G H >< S+ 0 0 0 -4,-1.9 3,-0.6 2,-0.2 4,-0.4 0.908 115.4 47.4 -69.9 -43.8 23.2 -28.5 112.9 613 756 B F H >X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 3,-1.1 0.860 109.9 53.2 -66.4 -37.2 22.6 -29.0 116.6 614 757 B F H 3< S+ 0 0 39 -4,-2.7 5,-0.2 1,-0.3 -1,-0.2 0.581 91.5 74.6 -78.6 -10.3 22.5 -32.8 116.3 615 758 B E T << S+ 0 0 54 -3,-0.6 -1,-0.3 -4,-0.5 -2,-0.2 0.751 114.7 23.0 -69.0 -23.6 25.9 -32.7 114.5 616 759 B L T <4 S+ 0 0 4 -3,-1.1 -2,-0.2 -4,-0.4 -3,-0.1 0.808 127.3 44.9-105.4 -54.7 27.4 -32.0 118.0 617 760 B I S < S- 0 0 0 -4,-2.4 -1,-0.3 -227,-0.0 2,-0.2 -0.851 89.4-121.3 -95.9 122.5 24.8 -33.4 120.5 618 761 B P >> - 0 0 61 0, 0.0 4,-1.6 0, 0.0 3,-1.1 -0.450 14.6-139.6 -62.8 124.5 23.4 -36.8 119.6 619 762 B Q H 3> S+ 0 0 74 1,-0.3 4,-0.6 -5,-0.2 3,-0.2 0.880 102.5 53.2 -52.9 -42.8 19.6 -36.5 119.2 620 763 B D H 34 S+ 0 0 144 1,-0.2 -1,-0.3 2,-0.2 3,-0.2 0.770 108.2 51.7 -66.4 -25.8 19.0 -39.8 121.0 621 764 B L H X4 S+ 0 0 23 -3,-1.1 3,-1.2 1,-0.2 -1,-0.2 0.844 102.1 56.5 -80.4 -35.4 21.2 -38.6 124.0 622 765 B I H >< S+ 0 0 0 -4,-1.6 3,-1.6 1,-0.3 -1,-0.2 0.578 83.1 86.2 -77.2 -8.6 19.4 -35.3 124.6 623 766 B K T 3< + 0 0 94 -4,-0.6 -1,-0.3 1,-0.3 -2,-0.1 0.631 69.7 79.7 -65.9 -12.9 16.1 -37.0 125.1 624 767 B I T < S+ 0 0 53 -3,-1.2 2,-0.3 -4,-0.1 -1,-0.3 0.461 87.1 72.1 -75.2 -0.1 17.0 -37.6 128.7 625 768 B F S < S- 0 0 5 -3,-1.6 2,-0.1 -243,-0.0 -246,-0.0 -0.870 75.2-137.0-114.1 149.0 16.0 -34.0 129.4 626 769 B D > - 0 0 52 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.398 42.6 -90.2 -88.1 177.7 12.6 -32.4 129.5 627 770 B E H > S+ 0 0 39 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.833 127.2 50.7 -58.5 -33.8 11.8 -29.0 127.8 628 771 B N H > S+ 0 0 86 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.909 111.8 44.4 -73.1 -43.5 12.7 -27.2 131.0 629 772 B E H > S+ 0 0 26 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.872 110.3 56.6 -66.6 -38.1 16.1 -28.9 131.6 630 773 B L H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 5,-0.3 0.913 106.3 49.6 -61.2 -43.7 16.9 -28.4 127.9 631 774 B E H X S+ 0 0 50 -4,-1.6 4,-2.6 1,-0.2 -1,-0.2 0.874 111.7 49.2 -60.0 -38.6 16.4 -24.7 128.2 632 775 B L H < S+ 0 0 80 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.824 111.7 49.3 -70.6 -32.3 18.6 -24.7 131.3 633 776 B L H < S+ 0 0 8 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.775 123.3 29.2 -78.3 -28.4 21.3 -26.7 129.4 634 777 B M H < S+ 0 0 0 -4,-1.8 -125,-2.7 -5,-0.2 2,-0.3 0.853 115.3 46.1 -99.6 -45.4 21.3 -24.4 126.3 635 778 B C E < +m 509 0I 4 -4,-2.6 2,-0.3 -5,-0.3 -125,-0.2 -0.702 51.4 170.8-113.1 155.5 20.4 -20.9 127.4 636 779 B G E -m 510 0I 9 -127,-2.4 -125,-1.1 -2,-0.3 3,-0.1 -0.847 48.4-100.1-143.9-178.2 21.2 -18.4 130.1 637 780 B L S S- 0 0 102 1,-0.4 2,-0.3 -2,-0.3 -127,-0.1 0.290 71.9-108.1 -88.6 9.4 20.7 -14.8 131.1 638 781 B G - 0 0 39 -129,-0.3 -1,-0.4 -127,-0.1 2,-0.2 -0.687 59.2 -29.6 97.4-154.9 24.2 -14.0 129.7 639 782 B D S S- 0 0 56 -2,-0.3 2,-0.0 1,-0.1 35,-0.0 -0.512 78.3 -73.3 -98.4 168.3 27.3 -13.2 131.8 640 783 B V - 0 0 12 -2,-0.2 2,-0.7 34,-0.1 -1,-0.1 -0.318 40.6-136.6 -62.3 135.5 27.5 -11.5 135.2 641 784 B D > - 0 0 82 1,-0.2 4,-2.6 -3,-0.1 5,-0.1 -0.857 11.2-164.2 -96.7 111.4 26.9 -7.7 135.3 642 785 B V H > S+ 0 0 14 -2,-0.7 4,-3.5 1,-0.2 5,-0.2 0.836 88.7 55.5 -65.2 -34.1 29.5 -6.0 137.5 643 786 B N H > S+ 0 0 87 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.943 113.0 40.8 -62.4 -48.0 27.4 -2.8 137.7 644 787 B D H > S+ 0 0 35 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.876 117.5 50.1 -65.4 -39.1 24.4 -4.7 139.0 645 788 B W H >< S+ 0 0 0 -4,-2.6 3,-0.5 1,-0.2 -2,-0.2 0.949 114.3 42.8 -62.9 -51.7 26.7 -6.8 141.2 646 789 B R H >< S+ 0 0 100 -4,-3.5 3,-1.0 1,-0.2 -1,-0.2 0.786 109.0 59.6 -66.5 -30.0 28.5 -3.8 142.7 647 790 B E H 3< S+ 0 0 124 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.791 107.7 43.8 -74.7 -27.6 25.3 -1.8 143.1 648 791 B H T << S+ 0 0 67 -4,-1.1 59,-0.6 -3,-0.5 2,-0.4 -0.148 86.8 118.5-111.3 37.6 23.7 -4.4 145.4 649 792 B T E < -p 707 0L 10 -3,-1.0 2,-0.3 57,-0.1 59,-0.2 -0.881 50.1-149.3-106.3 134.4 26.7 -5.1 147.6 650 793 B K E -p 708 0L 117 57,-2.8 59,-2.6 -2,-0.4 2,-0.4 -0.742 9.1-146.1-100.2 150.4 26.7 -4.4 151.4 651 794 B Y E -p 709 0L 52 -2,-0.3 2,-0.3 57,-0.2 59,-0.2 -0.958 12.4-166.8-123.0 133.9 29.9 -3.5 153.3 652 795 B K E > +p 710 0L 109 57,-1.8 59,-1.7 -2,-0.4 3,-1.1 -0.816 57.1 17.0-115.5 156.2 30.8 -4.4 156.9 653 796 B N T 3 S- 0 0 107 -2,-0.3 -1,-0.2 1,-0.3 3,-0.1 0.853 132.2 -33.0 60.6 46.0 33.3 -3.3 159.5 654 797 B G T 3 S+ 0 0 59 1,-0.4 -1,-0.3 -3,-0.2 56,-0.1 0.115 106.0 118.5 104.6 -20.8 34.5 0.0 158.1 655 798 B Y < + 0 0 12 -3,-1.1 -1,-0.4 54,-0.1 2,-0.3 -0.321 32.7 163.6 -75.4 161.4 34.3 -0.6 154.4 656 799 B S > - 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