==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-SEP-09 3JU3 . COMPND 2 MOLECULE: PROBABLE 2-OXOACID FERREDOXIN OXIDOREDUCTASE, ALP . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA ACIDOPHILUM; . AUTHOR C.CHANG,N.MARSHALL,J.BEARDEN,A.JOACHIMIAK,MIDWEST CENTER FOR . 116 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9350.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 73 62.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 6.0 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 . 1 0.9 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 . 13 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 35 30.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 0 0 0 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 503 A A 0 0 98 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 42.8 19.7 23.9 9.6 2 504 A E + 0 0 131 1,-0.1 3,-0.1 47,-0.1 47,-0.0 0.667 360.0 40.1 -73.3 -11.2 22.8 25.8 10.4 3 505 A K S S+ 0 0 137 1,-0.3 43,-2.2 45,-0.1 2,-0.3 0.579 125.5 16.4-115.5 -23.5 20.4 27.4 13.0 4 506 A A E -A 45 0A 30 41,-0.2 2,-0.4 2,-0.0 -1,-0.3 -0.959 62.3-164.6-151.0 142.7 18.2 24.7 14.4 5 507 A V E -A 44 0A 48 39,-2.2 39,-2.8 -2,-0.3 2,-0.7 -0.973 16.5-139.8-130.1 144.4 18.6 20.9 14.4 6 508 A L E -A 43 0A 54 -2,-0.4 2,-0.5 37,-0.2 37,-0.2 -0.928 23.3-159.9-101.3 114.4 16.1 18.2 15.1 7 509 A I E +A 42 0A 54 35,-3.3 35,-2.6 -2,-0.7 2,-0.3 -0.838 54.2 9.1 -99.7 131.7 17.9 15.5 17.1 8 510 A G S S- 0 0 46 -2,-0.5 2,-0.2 33,-0.2 33,-0.2 -0.704 109.3 -8.5 104.4-156.4 16.3 12.0 17.2 9 511 A E - 0 0 142 31,-0.4 -2,-0.1 -2,-0.3 33,-0.0 -0.536 56.6-128.0 -82.4 141.6 13.4 10.6 15.2 10 512 A K S S+ 0 0 167 -2,-0.2 2,-0.4 -4,-0.1 -1,-0.1 0.875 100.2 42.4 -54.1 -48.5 11.2 12.8 13.0 11 513 A E S S+ 0 0 168 29,-0.1 2,-0.3 4,-0.0 -2,-0.1 -0.821 77.2 157.5 -96.4 140.8 8.0 11.5 14.6 12 514 A A - 0 0 17 -2,-0.4 28,-0.2 27,-0.1 3,-0.1 -0.965 52.7-119.1-158.7 154.8 8.0 11.1 18.4 13 515 A D S S+ 0 0 98 26,-0.4 2,-0.4 -2,-0.3 27,-0.2 0.843 105.6 25.5 -56.0 -40.2 5.6 11.0 21.3 14 516 A I E -b 40 0A 25 25,-1.4 27,-2.4 -3,-0.1 2,-0.6 -0.995 65.2-159.6-130.1 133.7 7.3 14.1 22.8 15 517 A T E -b 41 0A 78 -2,-0.4 27,-0.2 25,-0.2 2,-0.2 -0.932 15.1-160.5-113.8 105.6 9.2 16.9 21.0 16 518 A F E -b 42 0A 20 25,-2.6 27,-3.1 -2,-0.6 2,-0.4 -0.543 2.7-160.1 -75.5 147.9 11.4 18.8 23.5 17 519 A V E +b 43 0A 45 25,-0.2 2,-0.3 -2,-0.2 27,-0.2 -0.998 26.8 136.1-128.3 130.2 12.5 22.4 22.5 18 520 A T E -b 44 0A 20 25,-1.7 27,-2.5 -2,-0.4 2,-0.3 -0.941 29.2-158.8-156.3-178.1 15.5 24.0 24.1 19 521 A W E > +b 45 0A 40 -2,-0.3 3,-1.0 25,-0.2 27,-0.1 -0.920 58.8 9.0-151.9 166.6 18.7 26.1 23.5 20 522 A G G > S+ 0 0 18 25,-0.6 3,-1.2 -2,-0.3 -2,-0.0 -0.218 118.3 0.2 62.5-136.1 21.8 26.6 25.5 21 523 A S G > S+ 0 0 91 1,-0.3 3,-0.6 2,-0.1 -1,-0.2 0.654 117.3 66.2 -76.0 -19.6 22.7 24.7 28.6 22 524 A Q G <> S+ 0 0 35 -3,-1.0 4,-2.3 1,-0.2 -1,-0.3 0.490 73.3 96.8 -84.0 3.0 19.7 22.3 29.0 23 525 A K H <> S+ 0 0 78 -3,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.936 84.6 45.2 -54.5 -53.7 20.6 20.4 25.8 24 526 A G H <> S+ 0 0 35 -3,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.919 110.2 52.1 -63.8 -47.0 22.5 17.6 27.6 25 527 A P H > S+ 0 0 29 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.912 111.6 48.6 -52.1 -45.4 19.9 17.1 30.4 26 528 A I H X S+ 0 0 12 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.926 106.0 56.5 -61.9 -44.3 17.2 16.7 27.7 27 529 A L H X S+ 0 0 49 -4,-2.1 4,-1.3 1,-0.3 -1,-0.2 0.868 108.5 47.5 -60.7 -38.0 19.2 14.2 25.7 28 530 A D H X S+ 0 0 84 -4,-1.9 4,-2.3 2,-0.2 -1,-0.3 0.835 108.0 54.5 -65.5 -37.5 19.5 11.9 28.7 29 531 A V H X S+ 0 0 0 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.879 104.8 56.3 -64.9 -37.8 15.8 12.2 29.4 30 532 A I H X S+ 0 0 10 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.907 108.0 46.7 -52.6 -46.9 15.3 11.0 25.8 31 533 A E H X S+ 0 0 98 -4,-1.3 4,-0.9 1,-0.2 -2,-0.2 0.924 111.4 50.5 -68.8 -42.9 17.4 7.9 26.5 32 534 A D H >X S+ 0 0 50 -4,-2.3 4,-0.6 1,-0.2 3,-0.5 0.873 106.7 56.0 -57.6 -41.6 15.5 7.2 29.8 33 535 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.6 1,-0.2 3,-1.5 0.886 98.1 61.0 -59.6 -40.7 12.1 7.5 28.0 34 536 A K H ><5S+ 0 0 118 -4,-1.5 3,-2.0 1,-0.3 -1,-0.2 0.862 95.7 63.4 -53.0 -36.6 13.1 4.8 25.4 35 537 A E H <<5S+ 0 0 166 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.764 106.7 42.4 -61.9 -28.7 13.4 2.4 28.4 36 538 A E T <<5S- 0 0 104 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.198 124.6-103.6-100.2 11.1 9.7 2.9 29.0 37 539 A G T < 5S+ 0 0 66 -3,-2.0 2,-0.5 1,-0.2 -3,-0.2 0.686 78.8 134.4 71.8 24.2 8.9 2.7 25.3 38 540 A I < - 0 0 23 -5,-2.6 2,-0.3 -6,-0.1 -1,-0.2 -0.899 43.7-148.4-107.1 128.0 8.3 6.4 24.9 39 541 A S + 0 0 43 -2,-0.5 -25,-1.4 -3,-0.1 -26,-0.4 -0.688 20.7 170.9 -95.1 148.2 9.9 8.2 22.0 40 542 A A E - b 0 14A 9 -2,-0.3 -31,-0.4 -27,-0.2 2,-0.3 -0.995 13.1-166.0-151.8 146.3 11.1 11.8 22.1 41 543 A N E - b 0 15A 1 -27,-2.4 -25,-2.6 -2,-0.3 2,-0.4 -0.780 16.7-130.9-126.0 176.1 13.0 14.1 19.9 42 544 A L E -Ab 7 16A 0 -35,-2.6 -35,-3.3 -2,-0.3 2,-0.8 -0.974 3.5-157.1-135.3 118.9 14.7 17.5 20.5 43 545 A L E -Ab 6 17A 56 -27,-3.1 -25,-1.7 -2,-0.4 2,-0.6 -0.882 24.8-165.1 -90.2 114.4 14.4 20.6 18.4 44 546 A Y E -Ab 5 18A 36 -39,-2.8 -39,-2.2 -2,-0.8 2,-0.6 -0.915 10.1-150.2-109.8 120.5 17.6 22.5 19.4 45 547 A L E -Ab 4 19A 32 -27,-2.5 -25,-0.6 -2,-0.6 2,-0.3 -0.796 15.7-140.2 -91.1 123.5 17.9 26.1 18.6 46 548 A K - 0 0 80 -43,-2.2 -27,-0.0 -2,-0.6 -44,-0.0 -0.669 6.1-150.8 -86.0 138.0 21.5 27.1 18.1 47 549 A X S S+ 0 0 101 -2,-0.3 -1,-0.1 1,-0.2 -44,-0.0 0.985 82.8 11.7 -75.5 -61.8 22.7 30.5 19.5 48 550 A F S S+ 0 0 150 3,-0.0 -1,-0.2 4,-0.0 -45,-0.1 0.174 92.0 164.6-113.1 23.7 25.5 32.0 17.4 49 551 A S + 0 0 34 -46,-0.1 2,-0.1 2,-0.1 -47,-0.1 -0.622 61.1 20.4-102.0 150.7 25.4 29.7 14.3 50 552 A P S S- 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -48,-0.0 0.867 99.5-133.5 -62.6 149.9 26.5 30.0 11.7 51 553 A F - 0 0 113 -2,-0.1 2,-2.0 1,-0.1 3,-0.2 -0.484 11.6-119.6 -72.8 144.1 28.9 32.5 13.2 52 554 A P > + 0 0 66 0, 0.0 4,-2.6 0, 0.0 5,-0.4 -0.405 48.9 162.5 -79.5 66.4 29.6 35.8 11.4 53 555 A T H > + 0 0 90 -2,-2.0 4,-3.0 1,-0.2 5,-0.2 0.912 68.7 42.5 -53.4 -56.2 33.3 35.0 11.0 54 556 A E H > S+ 0 0 149 -3,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.904 116.0 48.3 -61.5 -44.9 34.2 37.6 8.3 55 557 A F H > S+ 0 0 152 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.908 116.2 42.5 -62.2 -46.6 32.1 40.4 9.8 56 558 A V H X S+ 0 0 43 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.934 113.2 53.6 -68.3 -44.9 33.5 40.0 13.3 57 559 A K H X S+ 0 0 146 -4,-3.0 4,-2.2 -5,-0.4 -2,-0.2 0.919 110.3 46.1 -55.9 -47.1 37.0 39.5 11.9 58 560 A N H < S+ 0 0 94 -4,-2.6 4,-0.5 2,-0.2 -1,-0.2 0.749 114.0 48.6 -74.2 -23.2 36.9 42.8 9.9 59 561 A V H >< S+ 0 0 79 -4,-1.5 3,-0.5 -3,-0.2 4,-0.4 0.929 118.6 37.5 -72.8 -47.0 35.5 44.8 12.8 60 562 A L H >< S+ 0 0 84 -4,-2.7 3,-0.9 1,-0.2 -2,-0.2 0.829 105.2 68.1 -80.6 -26.0 38.0 43.6 15.4 61 563 A S T 3< S+ 0 0 93 -4,-2.2 -1,-0.2 -5,-0.3 -3,-0.1 0.776 109.5 35.8 -65.2 -28.8 41.0 43.5 13.1 62 564 A S T < S+ 0 0 96 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.2 0.387 90.7 120.0-105.5 3.4 41.0 47.3 12.8 63 565 A A < - 0 0 47 -3,-0.9 3,-0.2 -4,-0.4 -3,-0.0 -0.408 57.5-145.1 -70.7 140.1 39.9 48.2 16.4 64 566 A N S S- 0 0 174 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.907 86.1 -1.1 -61.9 -45.4 42.2 50.3 18.6 65 567 A L - 0 0 135 2,-0.0 2,-0.4 0, 0.0 -1,-0.3 -0.943 66.9-156.7-157.0 124.6 41.2 48.4 21.7 66 568 A V - 0 0 79 -2,-0.3 2,-0.5 -3,-0.2 -6,-0.0 -0.899 5.9-172.9-113.2 134.1 38.8 45.5 22.3 67 569 A I - 0 0 131 -2,-0.4 2,-0.4 2,-0.0 -2,-0.0 -0.959 13.3-150.6-126.8 110.7 37.1 44.7 25.6 68 570 A D - 0 0 153 -2,-0.5 2,-0.6 1,-0.0 -2,-0.0 -0.664 11.1-150.8 -79.9 134.1 35.0 41.5 25.8 69 571 A V - 0 0 113 -2,-0.4 -2,-0.0 0, 0.0 -1,-0.0 -0.920 15.1-127.6-114.4 111.3 32.1 41.9 28.3 70 572 A E + 0 0 189 -2,-0.6 2,-0.2 1,-0.1 0, 0.0 -0.291 41.8 170.6 -56.6 137.5 31.1 38.6 30.0 71 573 A S - 0 0 103 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.764 21.2-158.3-143.2-175.0 27.3 38.2 29.6 72 574 A N - 0 0 131 -2,-0.2 2,-0.3 2,-0.0 0, 0.0 -0.968 3.1-155.3-157.1 171.6 24.3 35.8 30.1 73 575 A Y - 0 0 170 -2,-0.3 2,-0.4 2,-0.0 -2,-0.0 -0.963 1.5-167.8-156.6 139.9 20.8 35.1 29.0 74 576 A T + 0 0 127 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -1.000 28.8 139.2-126.7 132.5 17.7 33.2 30.5 75 577 A A - 0 0 35 -2,-0.4 2,-0.6 -56,-0.1 -56,-0.2 -0.980 52.1-123.3-167.7 154.6 14.6 32.3 28.4 76 578 A Q >> - 0 0 94 -2,-0.3 3,-1.2 1,-0.1 4,-0.5 -0.925 30.0-140.7 -90.5 121.8 11.9 30.0 27.4 77 579 A A H 3> S+ 0 0 10 -2,-0.6 4,-2.0 1,-0.2 5,-0.2 0.628 90.9 83.9 -59.5 -11.7 12.3 29.5 23.7 78 580 A A H 3> S+ 0 0 21 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.841 82.8 56.7 -62.4 -37.8 8.4 29.6 23.5 79 581 A Q H <> S+ 0 0 148 -3,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.964 112.5 37.9 -61.6 -50.5 8.3 33.4 23.4 80 582 A X H X S+ 0 0 81 -4,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.837 114.0 56.0 -74.2 -29.1 10.5 33.8 20.4 81 583 A I H X>S+ 0 0 24 -4,-2.0 4,-2.8 2,-0.2 6,-0.6 0.905 110.1 46.4 -64.5 -44.8 9.0 30.8 18.6 82 584 A K H X5S+ 0 0 104 -4,-2.4 4,-1.6 3,-0.2 -2,-0.2 0.890 111.0 53.2 -61.0 -43.0 5.5 32.3 19.0 83 585 A L H <5S+ 0 0 129 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.946 120.4 31.0 -58.6 -52.8 6.8 35.7 17.8 84 586 A Y H <5S+ 0 0 187 -4,-2.5 -2,-0.2 1,-0.1 -1,-0.2 0.845 134.7 21.5 -78.5 -37.5 8.3 34.2 14.6 85 587 A T H <5S- 0 0 85 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.549 89.7-124.9-112.0 -15.6 6.1 31.3 13.7 86 588 A G << + 0 0 58 -4,-1.6 2,-0.4 -5,-0.5 -4,-0.2 0.394 66.1 132.7 80.4 -3.9 2.8 31.9 15.5 87 589 A I - 0 0 107 -6,-0.6 2,-0.7 1,-0.0 -1,-0.3 -0.690 43.9-156.0 -79.5 127.4 2.9 28.5 17.2 88 590 A D - 0 0 81 -2,-0.4 2,-0.5 -3,-0.1 -9,-0.1 -0.856 5.6-151.1-107.4 99.3 2.1 28.8 20.9 89 591 A I - 0 0 59 -2,-0.7 -7,-0.1 -11,-0.2 -11,-0.0 -0.537 10.3-169.5 -61.5 113.0 3.7 25.9 22.8 90 592 A K + 0 0 174 -2,-0.5 2,-0.4 2,-0.0 -1,-0.2 0.771 61.7 70.6 -82.3 -24.2 1.4 25.4 25.8 91 593 A N + 0 0 79 2,-0.0 2,-0.3 22,-0.0 -2,-0.0 -0.758 61.2 169.8 -99.2 138.7 3.5 22.9 27.8 92 594 A K - 0 0 125 -2,-0.4 2,-0.6 17,-0.1 -16,-0.0 -0.979 33.4-145.1-146.5 152.7 6.7 23.9 29.5 93 595 A I - 0 0 59 -2,-0.3 2,-0.2 8,-0.0 3,-0.1 -0.971 32.9-176.4-116.7 108.3 9.3 22.8 31.9 94 596 A L - 0 0 81 -2,-0.6 7,-0.2 1,-0.1 2,-0.1 -0.503 38.2 -74.2 -95.1 169.4 10.5 25.8 34.0 95 597 A K - 0 0 71 -2,-0.2 2,-0.6 5,-0.1 5,-0.2 -0.418 48.8-137.8 -62.3 140.1 13.2 26.1 36.6 96 598 A Y B > -C 99 0B 28 3,-1.9 3,-0.8 1,-0.2 -1,-0.1 -0.914 65.0 -28.2-116.0 112.6 12.1 24.6 40.0 97 599 A N T 3 S- 0 0 173 -2,-0.6 -1,-0.2 1,-0.2 3,-0.1 0.852 125.8 -39.7 46.3 50.9 12.9 26.3 43.3 98 600 A G T 3 S+ 0 0 86 1,-0.2 2,-0.3 -3,-0.1 -1,-0.2 0.382 126.5 65.2 97.0 -2.6 16.0 28.2 42.3 99 601 A R B < S-C 96 0B 119 -3,-0.8 -3,-1.9 3,-0.0 -1,-0.2 -0.929 89.9 -90.8-138.0 160.9 17.7 25.5 40.1 100 602 A H - 0 0 107 -2,-0.3 -5,-0.1 -5,-0.2 2,-0.1 -0.388 58.4 -97.5 -60.4 153.0 17.1 23.7 36.8 101 603 A X - 0 0 44 -7,-0.2 -1,-0.1 1,-0.1 2,-0.1 -0.382 37.9-108.7 -69.2 156.1 15.2 20.5 37.5 102 604 A T > - 0 0 66 1,-0.1 4,-3.1 -3,-0.1 5,-0.2 -0.389 32.1-104.2 -74.5 162.8 17.0 17.1 37.7 103 605 A E H > S+ 0 0 60 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.870 125.7 50.8 -54.9 -40.2 16.7 14.5 34.9 104 606 A D H > S+ 0 0 121 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.866 112.0 46.8 -65.1 -38.7 14.3 12.5 37.1 105 607 A E H > S+ 0 0 63 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.877 113.7 47.6 -70.0 -38.8 12.2 15.7 37.7 106 608 A I H X S+ 0 0 7 -4,-3.1 4,-2.7 2,-0.2 -2,-0.2 0.935 112.0 50.1 -65.8 -47.5 12.3 16.5 34.0 107 609 A L H X S+ 0 0 23 -4,-2.8 4,-2.4 -5,-0.2 5,-0.2 0.944 111.1 51.1 -53.1 -49.0 11.3 12.9 33.2 108 610 A K H X S+ 0 0 146 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.916 112.6 43.1 -54.6 -54.0 8.5 13.1 35.8 109 611 A S H X S+ 0 0 21 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.841 111.2 56.5 -62.4 -41.1 7.1 16.4 34.3 110 612 A A H X S+ 0 0 3 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.900 109.4 44.3 -57.3 -46.8 7.4 15.1 30.8 111 613 A K H X S+ 0 0 56 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.921 111.2 54.4 -66.4 -44.5 5.3 12.0 31.5 112 614 A E H X S+ 0 0 126 -4,-2.3 4,-0.7 2,-0.2 -2,-0.2 0.891 110.9 46.2 -51.2 -42.7 2.8 14.1 33.4 113 615 A I H < S+ 0 0 43 -4,-2.1 3,-0.5 2,-0.2 -2,-0.2 0.895 110.8 52.6 -72.3 -41.5 2.5 16.3 30.3 114 616 A L H < S+ 0 0 65 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.904 113.6 43.3 -54.2 -47.4 2.2 13.2 28.0 115 617 A N H < 0 0 135 -4,-2.8 -1,-0.2 1,-0.1 -2,-0.2 0.544 360.0 360.0 -82.2 -6.8 -0.6 11.8 30.1 116 618 A K < 0 0 190 -4,-0.7 -2,-0.2 -3,-0.5 -1,-0.1 0.997 360.0 360.0 -72.1 360.0 -2.5 15.2 30.5