==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 21-NOV-12 4I1S . COMPND 2 MOLECULE: MELANOMA DIFFERENTIATION ASSOCIATED PROTEIN-5; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR C.MOTZ,G.WITTE,K.P.HOPFNER . 290 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15337.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 203 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 19 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 42.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 0 1 0 0 0 0 0 0 1 1 0 0 1 2 0 1 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 PARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 1 546 A E 0 0 218 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -50.1 6.4 12.2 5.1 2 547 A D > - 0 0 34 1,-0.1 4,-2.5 2,-0.0 5,-0.1 -0.912 360.0-169.5-124.6 102.6 9.2 14.8 4.9 3 548 A L H > S+ 0 0 114 -2,-0.4 4,-2.0 1,-0.2 5,-0.1 0.803 84.8 52.8 -65.7 -31.7 11.9 13.1 2.8 4 549 A F H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.948 111.4 44.9 -67.9 -49.9 14.5 15.7 3.6 5 550 A K H > S+ 0 0 83 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.922 111.8 54.7 -57.6 -44.6 14.0 15.4 7.3 6 551 A D H X S+ 0 0 75 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.881 106.5 50.3 -59.0 -42.6 14.0 11.6 6.9 7 552 A R H X S+ 0 0 74 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.926 109.2 51.9 -59.1 -47.1 17.4 11.7 5.2 8 553 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.916 110.0 48.9 -56.0 -44.6 18.8 13.9 8.0 9 554 A L H X S+ 0 0 44 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.828 109.7 52.0 -67.5 -32.9 17.6 11.5 10.6 10 555 A E H X S+ 0 0 96 -4,-1.8 4,-2.1 -5,-0.2 -1,-0.2 0.923 110.3 49.0 -69.2 -42.1 19.2 8.6 8.7 11 556 A I H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.929 109.1 51.0 -62.0 -46.0 22.5 10.4 8.6 12 557 A X H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.864 107.9 54.2 -63.2 -34.7 22.5 11.2 12.3 13 558 A T H X S+ 0 0 64 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.937 106.2 51.9 -62.1 -46.4 21.8 7.5 13.0 14 559 A N H X S+ 0 0 57 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.900 110.2 49.1 -54.7 -43.1 24.9 6.6 10.9 15 560 A I H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.917 109.6 50.6 -68.2 -39.5 27.0 9.0 12.9 16 561 A Q H X>S+ 0 0 16 -4,-2.3 5,-2.0 1,-0.2 4,-0.8 0.910 111.3 49.5 -65.2 -37.7 25.7 7.7 16.2 17 562 A T H <5S+ 0 0 99 -4,-2.6 3,-0.4 3,-0.2 -1,-0.2 0.912 107.7 54.9 -63.4 -42.7 26.5 4.2 15.0 18 563 A F H <5S+ 0 0 42 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.913 119.2 31.3 -60.0 -42.1 30.0 5.3 14.0 19 564 A C H <5S- 0 0 11 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.394 110.4-123.2-100.1 4.9 30.9 6.7 17.4 20 565 A Q T <5 + 0 0 173 -4,-0.8 2,-0.3 -3,-0.4 -3,-0.2 0.909 58.7 139.9 61.0 52.4 28.7 4.1 19.2 21 566 A I < - 0 0 29 -5,-2.0 -1,-0.2 -6,-0.1 -2,-0.1 -0.931 30.3-175.7-123.7 148.8 26.3 6.3 21.2 22 567 A S - 0 0 104 -2,-0.3 2,-0.1 -5,-0.0 -5,-0.0 -0.593 12.6-167.1-146.4 86.4 22.6 5.9 21.9 23 568 A P - 0 0 17 0, 0.0 9,-0.1 0, 0.0 -2,-0.0 -0.361 25.4-130.8 -70.1 144.4 21.1 8.9 23.9 24 569 A X S S+ 0 0 179 -2,-0.1 8,-0.1 2,-0.1 0, 0.0 0.840 83.6 87.0 -65.4 -34.4 17.6 8.6 25.4 25 570 A S S S- 0 0 40 6,-0.2 2,-0.3 1,-0.1 3,-0.1 -0.217 81.6-113.0 -67.6 156.8 16.5 11.9 23.8 26 571 A D > - 0 0 120 1,-0.1 3,-1.4 2,-0.0 6,-0.3 -0.656 34.7 -95.3 -91.7 146.5 15.1 12.3 20.3 27 572 A F T 3 S+ 0 0 56 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 -0.240 109.0 28.0 -50.0 141.2 16.8 14.0 17.4 28 573 A G T 3 S+ 0 0 26 1,-0.3 2,-0.3 2,-0.1 -1,-0.2 0.498 95.6 114.0 86.3 2.2 15.6 17.6 17.0 29 574 A T S X> S- 0 0 49 -3,-1.4 4,-2.2 1,-0.1 3,-0.6 -0.807 73.0-121.4-108.6 151.2 14.8 18.2 20.7 30 575 A Q H 3> S+ 0 0 108 -2,-0.3 4,-3.5 1,-0.2 5,-0.3 0.892 112.7 54.1 -53.3 -46.7 16.4 20.5 23.2 31 576 A P H 3> S+ 0 0 77 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.841 109.0 51.0 -63.0 -25.9 17.3 17.8 25.7 32 577 A Y H <> S+ 0 0 1 -3,-0.6 4,-2.4 -6,-0.3 -2,-0.2 0.926 111.5 47.0 -70.3 -44.7 19.1 16.1 22.8 33 578 A E H X S+ 0 0 38 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.906 110.9 51.2 -57.9 -45.6 20.9 19.3 22.1 34 579 A Q H X S+ 0 0 83 -4,-3.5 4,-1.9 1,-0.2 -1,-0.2 0.888 109.8 52.1 -61.8 -35.4 21.7 19.7 25.7 35 580 A W H X S+ 0 0 94 -4,-1.7 4,-2.7 -5,-0.3 -2,-0.2 0.916 107.3 49.1 -68.3 -46.0 23.1 16.1 25.6 36 581 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.896 108.7 56.4 -56.3 -39.6 25.4 16.7 22.6 37 582 A I H X S+ 0 0 32 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.922 109.7 44.1 -63.7 -42.1 26.6 19.8 24.4 38 583 A Q H X S+ 0 0 89 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.959 112.4 51.3 -65.0 -51.3 27.6 17.7 27.4 39 584 A X H X S+ 0 0 24 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.891 110.2 50.5 -51.3 -43.9 29.2 14.9 25.4 40 585 A E H X S+ 0 0 41 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.897 110.3 48.5 -63.9 -41.5 31.3 17.4 23.5 41 586 A K H X S+ 0 0 111 -4,-1.6 4,-1.8 -5,-0.2 -1,-0.2 0.905 112.1 49.4 -64.9 -42.1 32.6 19.1 26.6 42 587 A K H X S+ 0 0 118 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.868 106.9 55.4 -65.8 -37.0 33.5 15.7 28.1 43 588 A A H <>S+ 0 0 4 -4,-2.1 5,-2.3 1,-0.2 4,-0.4 0.867 107.7 48.8 -68.2 -35.9 35.3 14.6 25.0 44 589 A A H <5S+ 0 0 61 -4,-1.7 -1,-0.2 3,-0.2 -2,-0.2 0.886 113.9 47.8 -67.5 -39.0 37.5 17.7 25.2 45 590 A R H <5S+ 0 0 164 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.999 119.4 36.3 -63.0 -63.7 38.2 17.0 28.8 46 591 A D T <5S- 0 0 110 -4,-3.1 -1,-0.2 1,-0.1 -2,-0.2 0.540 110.9-125.5 -65.3 -5.6 39.0 13.3 28.4 47 592 A G T 5 + 0 0 58 -4,-0.4 2,-1.0 -5,-0.3 -3,-0.2 0.860 51.6 159.6 61.9 35.3 40.7 14.3 25.1 48 593 A N >< - 0 0 69 -5,-2.3 4,-1.9 -6,-0.2 -1,-0.2 -0.793 19.4-172.5 -90.3 102.0 38.6 11.9 23.0 49 594 A R H > S+ 0 0 72 -2,-1.0 4,-2.4 1,-0.2 5,-0.3 0.910 78.8 52.6 -66.5 -45.0 38.9 13.3 19.5 50 595 A K H > S+ 0 0 56 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.931 112.2 45.6 -54.2 -50.8 36.4 11.0 17.8 51 596 A D H > S+ 0 0 46 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.861 112.1 52.5 -62.3 -36.9 33.6 11.7 20.3 52 597 A R H X S+ 0 0 79 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.958 112.7 41.2 -67.3 -50.4 34.3 15.5 20.2 53 598 A V H X S+ 0 0 0 -4,-2.4 4,-3.2 2,-0.2 5,-0.3 0.915 113.9 53.2 -66.8 -41.7 34.1 15.9 16.4 54 599 A C H X S+ 0 0 0 -4,-2.2 4,-3.1 -5,-0.3 5,-0.2 0.952 111.7 45.9 -57.2 -47.5 31.1 13.6 16.2 55 600 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.941 111.7 53.0 -60.6 -44.6 29.2 15.6 18.8 56 601 A E H X S+ 0 0 46 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.932 114.3 40.9 -53.9 -51.2 30.3 18.8 17.0 57 602 A H H X S+ 0 0 3 -4,-3.2 4,-2.0 1,-0.2 3,-0.3 0.891 110.0 57.4 -66.6 -41.0 28.9 17.5 13.7 58 603 A L H X S+ 0 0 0 -4,-3.1 4,-2.6 -5,-0.3 -1,-0.2 0.883 103.4 56.0 -58.1 -37.3 25.7 16.0 15.3 59 604 A K H X S+ 0 0 21 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.896 103.6 53.4 -60.5 -40.1 25.0 19.5 16.6 60 605 A K H X S+ 0 0 14 -4,-1.2 4,-2.0 -3,-0.3 -1,-0.2 0.907 111.6 45.6 -63.0 -41.1 25.1 20.9 13.1 61 606 A Y H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.881 110.5 52.4 -67.5 -40.3 22.6 18.4 12.0 62 607 A N H X S+ 0 0 2 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.929 109.7 51.1 -60.8 -42.1 20.4 19.0 15.0 63 608 A E H X S+ 0 0 7 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.915 107.7 51.6 -58.2 -45.6 20.5 22.7 14.1 64 609 A A H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.894 106.1 55.8 -60.0 -39.5 19.4 21.9 10.5 65 610 A L H X S+ 0 0 10 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.891 108.3 47.7 -56.7 -42.5 16.5 19.9 11.9 66 611 A Q H X S+ 0 0 62 -4,-1.7 4,-1.5 2,-0.2 5,-0.2 0.864 112.1 48.1 -71.8 -36.2 15.3 22.9 13.8 67 612 A I H X S+ 0 0 5 -4,-2.1 4,-3.2 2,-0.2 -2,-0.2 0.910 111.3 52.0 -67.8 -41.6 15.6 25.2 10.9 68 613 A N H < S+ 0 0 16 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.932 112.4 46.0 -57.1 -44.5 13.8 22.7 8.7 69 614 A D H < S+ 0 0 65 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.773 125.4 27.7 -70.4 -29.3 11.0 22.5 11.3 70 615 A T H < S+ 0 0 20 -4,-1.5 2,-0.2 -3,-0.1 -2,-0.2 0.704 132.2 9.9-112.4 -25.3 10.6 26.3 11.8 71 616 A I S < S- 0 0 1 -4,-3.2 2,-0.1 -5,-0.2 58,-0.1 -0.423 106.2 -41.2-129.5-154.7 11.7 28.0 8.6 72 617 A R > - 0 0 49 -2,-0.2 4,-1.5 89,-0.1 3,-0.2 -0.382 34.2-123.3 -85.5 157.8 12.5 26.3 5.3 73 618 A R H > S+ 0 0 31 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.867 111.8 58.2 -51.7 -44.8 14.2 23.2 3.9 74 619 A I H > S+ 0 0 41 45,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.896 105.5 49.5 -60.7 -38.2 16.5 25.3 1.7 75 620 A D H > S+ 0 0 10 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.832 109.7 50.9 -69.8 -32.4 17.8 27.2 4.8 76 621 A A H X S+ 0 0 0 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.936 110.4 49.7 -70.1 -44.3 18.4 23.9 6.6 77 622 A Y H X S+ 0 0 7 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.904 110.0 50.9 -58.0 -43.6 20.4 22.6 3.6 78 623 A N H X S+ 0 0 54 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.874 104.3 57.5 -64.0 -38.7 22.4 25.8 3.5 79 624 A H H X S+ 0 0 21 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.910 113.7 39.5 -54.2 -43.1 23.3 25.6 7.2 80 625 A L H X S+ 0 0 0 -4,-1.6 4,-2.9 2,-0.2 5,-0.3 0.942 114.2 51.5 -75.9 -48.2 24.8 22.1 6.5 81 626 A K H X S+ 0 0 55 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.910 110.1 49.6 -53.4 -47.7 26.5 22.9 3.2 82 627 A T H X S+ 0 0 66 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.910 111.1 50.2 -61.2 -41.8 28.2 26.0 4.6 83 628 A F H X S+ 0 0 21 -4,-1.3 4,-2.2 -5,-0.3 3,-0.2 0.970 114.1 42.9 -63.8 -50.2 29.5 24.0 7.6 84 629 A Y H X S+ 0 0 2 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.830 110.6 57.0 -66.1 -31.5 30.9 21.2 5.4 85 630 A N H X S+ 0 0 67 -4,-2.7 4,-1.9 -5,-0.3 -1,-0.2 0.881 109.4 46.3 -62.5 -37.2 32.3 23.8 3.0 86 631 A D H X S+ 0 0 90 -4,-2.0 4,-2.8 -3,-0.2 5,-0.3 0.894 111.2 50.8 -72.7 -37.7 34.2 25.3 5.9 87 632 A E H X>S+ 0 0 13 -4,-2.2 4,-2.3 2,-0.2 5,-0.6 0.912 110.9 49.1 -65.1 -42.2 35.4 22.0 7.1 88 633 A K H X5S+ 0 0 90 -4,-2.4 4,-2.0 3,-0.2 5,-0.3 0.932 113.2 48.4 -61.3 -45.5 36.7 21.1 3.7 89 634 A E H <5S+ 0 0 124 -4,-1.9 4,-0.5 1,-0.2 -2,-0.2 0.960 119.3 34.9 -60.6 -55.1 38.4 24.4 3.4 90 635 A K H <5S+ 0 0 156 -4,-2.8 -1,-0.2 1,-0.1 -2,-0.2 0.744 132.0 25.4 -78.1 -21.5 40.2 24.4 6.7 91 636 A K H <5S+ 0 0 49 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.2 0.714 117.5 49.1-116.3 -25.2 40.9 20.7 7.0 92 637 A F << 0 0 67 -4,-2.0 -3,-0.2 -5,-0.6 -2,-0.1 0.370 360.0 360.0-104.6 5.5 41.1 19.0 3.6 93 638 A E 0 0 139 -4,-0.5 -1,-0.1 -5,-0.3 -3,-0.1 0.252 360.0 360.0-151.1 360.0 43.5 21.6 2.0 94 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 95 664 A G 0 0 113 0, 0.0 2,-1.7 0, 0.0 -4,-0.1 0.000 360.0 360.0 360.0 173.2 47.1 18.0 8.0 96 665 A S + 0 0 98 2,-0.0 2,-0.5 0, 0.0 -4,-0.1 -0.160 360.0 135.1 -77.4 43.3 45.4 17.3 11.3 97 666 A L + 0 0 53 -2,-1.7 2,-0.2 -6,-0.1 -5,-0.0 -0.844 29.6 174.1 -97.0 129.4 42.8 15.4 9.4 98 667 A D > - 0 0 42 -2,-0.5 4,-2.5 -48,-0.0 5,-0.2 -0.608 46.3 -78.7-125.6-172.7 41.7 12.0 10.8 99 668 A E H > S+ 0 0 124 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.817 124.5 50.7 -59.0 -39.3 39.3 9.0 10.3 100 669 A S H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.926 110.6 49.2 -66.3 -45.7 36.4 10.8 11.9 101 670 A D H > S+ 0 0 4 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.922 114.4 45.7 -56.6 -48.5 36.8 13.9 9.7 102 671 A I H X S+ 0 0 74 -4,-2.5 4,-3.0 2,-0.2 5,-0.3 0.953 114.1 48.9 -59.1 -49.7 37.0 11.7 6.6 103 672 A F H X S+ 0 0 48 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.905 114.3 43.9 -59.1 -45.2 34.0 9.7 7.7 104 673 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.942 115.3 47.8 -68.4 -46.6 31.8 12.7 8.5 105 674 A X H X S+ 0 0 9 -4,-2.4 4,-2.5 -5,-0.3 -2,-0.2 0.933 114.1 46.0 -61.4 -46.5 32.8 14.6 5.3 106 675 A T H X S+ 0 0 53 -4,-3.0 4,-2.7 -5,-0.2 -1,-0.2 0.925 108.5 56.7 -66.2 -41.1 32.2 11.6 3.0 107 676 A L H X S+ 0 0 5 -4,-2.3 4,-0.9 -5,-0.3 -1,-0.2 0.922 111.2 43.7 -51.5 -46.9 28.9 10.8 4.7 108 677 A F H >X S+ 0 0 0 -4,-2.1 4,-1.4 2,-0.2 3,-0.9 0.935 111.5 52.2 -65.9 -47.1 27.7 14.3 3.9 109 678 A L H 3X S+ 0 0 72 -4,-2.5 4,-0.5 1,-0.3 3,-0.3 0.882 104.6 58.3 -57.7 -37.2 29.0 14.3 0.3 110 679 A R H 3< S+ 0 0 158 -4,-2.7 -1,-0.3 1,-0.2 4,-0.2 0.840 118.2 31.4 -56.1 -32.9 27.2 11.0 -0.3 111 680 A N H S+ 0 0 67 -3,-0.4 4,-2.4 -4,-0.2 5,-0.2 0.922 114.4 48.7 -74.4 -40.5 19.8 14.3 -2.8 115 684 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.917 112.2 50.4 -60.7 -43.7 19.6 16.8 0.0 116 685 A K H X S+ 0 0 71 -4,-2.7 4,-1.7 -5,-0.2 -1,-0.2 0.935 111.6 46.1 -60.2 -48.5 20.2 19.6 -2.5 117 686 A K H X S+ 0 0 148 -4,-2.0 4,-0.9 2,-0.2 -1,-0.2 0.833 112.0 50.6 -69.5 -33.5 17.5 18.4 -4.9 118 687 A L H >< S+ 0 0 31 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.935 110.7 50.9 -64.3 -44.5 15.0 17.9 -2.0 119 688 A A H 3< S+ 0 0 9 -4,-2.6 -45,-0.3 1,-0.2 -2,-0.2 0.819 107.2 54.1 -61.2 -30.0 15.8 21.4 -0.9 120 689 A E H 3< S+ 0 0 102 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.691 83.3 103.7 -81.2 -19.1 15.2 22.8 -4.5 121 690 A N S << S- 0 0 83 -4,-0.9 2,-0.2 -3,-0.8 -47,-0.1 -0.477 84.3-112.2 -66.4 127.9 11.8 21.3 -4.7 122 691 A P - 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