==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-OCT-10 2XVG . COMPND 2 MOLECULE: ALPHA XYLOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CELLVIBRIO JAPONICUS; . AUTHOR J.LARSBRINK,A.IZUMI,F.IBATULLIN,A.NAKHAI,H.J.GILBERT,G.J.DAV . 944 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32352.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 640 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 227 24.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.1 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 . 96 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 141 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.2 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 4 1 1 1 1 0 1 0 1 2 1 3 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 4 1 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 . 7 6 10 6 6 6 4 0 1 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 . 2 1 1 3 2 1 1 1 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 45 A A 0 0 112 0, 0.0 2,-0.2 0, 0.0 17,-0.1 0.000 360.0 360.0 360.0 87.8 81.9 74.2 20.4 2 46 A L - 0 0 87 1,-0.1 84,-0.2 14,-0.1 2,-0.1 -0.590 360.0 -97.8-100.3 158.2 78.4 72.8 19.7 3 47 A A - 0 0 9 82,-1.3 2,-0.2 -2,-0.2 13,-0.2 -0.376 33.0-116.5 -71.8 144.5 75.6 71.7 22.1 4 48 A Q E -A 15 0A 140 11,-1.5 11,-2.4 -2,-0.1 2,-0.5 -0.549 30.4-141.3 -72.1 143.8 75.0 68.1 23.1 5 49 A V E -A 14 0A 39 9,-0.2 2,-0.5 -2,-0.2 9,-0.2 -0.953 14.1-167.6-117.4 124.6 71.6 66.8 21.9 6 50 A E E -A 13 0A 111 7,-2.0 7,-1.9 -2,-0.5 2,-1.0 -0.942 17.9-141.0-106.9 122.7 69.4 64.5 23.9 7 51 A R E -A 12 0A 144 -2,-0.5 5,-0.2 5,-0.2 2,-0.1 -0.719 26.2-175.8 -85.0 100.5 66.5 63.0 21.9 8 52 A T - 0 0 27 3,-1.9 3,-0.1 -2,-1.0 5,-0.0 -0.323 39.2-112.0 -85.6 176.4 63.4 63.0 24.2 9 53 A A S S+ 0 0 81 1,-0.2 -1,-0.1 -2,-0.1 3,-0.1 0.521 121.2 42.9 -80.9 -10.3 60.0 61.4 23.4 10 54 A E S S- 0 0 64 1,-0.1 18,-3.2 16,-0.1 2,-0.3 0.354 131.7 -75.3-114.7 -0.9 58.6 65.0 23.3 11 55 A G E S- B 0 27A 0 16,-0.2 -3,-1.9 -3,-0.1 2,-0.3 -0.963 72.6 -31.2 149.7-128.3 61.4 66.5 21.4 12 56 A V E -AB 7 26A 0 14,-0.9 14,-2.7 -2,-0.3 2,-0.4 -0.920 27.0-155.9-131.3 158.0 64.9 67.6 22.2 13 57 A V E -AB 6 25A 10 -7,-1.9 -7,-2.0 -2,-0.3 2,-0.4 -0.938 19.1-161.5-128.7 108.4 67.0 68.9 25.1 14 58 A L E -AB 5 24A 0 10,-2.6 10,-2.4 -2,-0.4 2,-0.7 -0.754 8.3-148.4 -87.6 132.1 70.1 70.8 24.0 15 59 A T E -AB 4 23A 40 -11,-2.4 -11,-1.5 -2,-0.4 8,-0.2 -0.893 18.5-146.0-100.9 108.6 72.9 71.2 26.5 16 60 A L - 0 0 13 6,-1.8 -14,-0.1 -2,-0.7 3,-0.1 -0.534 4.7-146.4 -79.4 140.4 74.6 74.6 25.7 17 61 A P S S+ 0 0 74 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.846 75.5 12.6 -74.2 -40.5 78.4 74.9 26.3 18 62 A E S S+ 0 0 166 -17,-0.1 2,-0.2 3,-0.1 3,-0.1 -0.973 89.7 60.3-142.9 156.8 78.6 78.6 27.4 19 63 A G S S- 0 0 60 -2,-0.3 -3,-0.0 1,-0.1 68,-0.0 -0.483 88.5 -76.2 111.9 170.6 76.3 81.4 28.4 20 64 A T S S+ 0 0 106 -2,-0.2 2,-0.6 87,-0.1 -1,-0.1 0.877 112.8 77.4 -76.5 -37.1 73.9 81.8 31.2 21 65 A V + 0 0 9 1,-0.2 -3,-0.1 19,-0.1 3,-0.1 -0.670 58.0 176.2 -72.0 115.1 71.3 79.5 29.6 22 66 A K + 0 0 111 17,-1.8 -6,-1.8 -2,-0.6 2,-0.4 0.776 61.0 29.6 -92.8 -35.0 72.6 76.0 30.2 23 67 A K E -BC 15 39A 35 16,-2.2 16,-3.1 -8,-0.2 2,-0.5 -0.988 57.2-165.5-135.4 140.8 69.7 73.9 28.8 24 68 A L E -BC 14 38A 0 -10,-2.4 -10,-2.6 -2,-0.4 2,-0.4 -0.961 11.8-166.7-128.1 116.9 67.1 74.4 26.0 25 69 A R E -BC 13 37A 27 12,-2.2 12,-2.4 -2,-0.5 2,-0.5 -0.848 7.9-166.4-108.5 135.6 64.1 72.1 25.7 26 70 A L E -BC 12 36A 1 -14,-2.7 -14,-0.9 -2,-0.4 2,-0.4 -0.976 10.4-172.2-113.9 130.3 61.7 71.8 22.8 27 71 A Q E -BC 11 35A 13 8,-2.0 8,-3.3 -2,-0.5 2,-0.8 -0.982 21.7-136.1-126.7 127.0 58.5 70.0 23.5 28 72 A V E + C 0 34A 3 -18,-3.2 30,-1.7 -2,-0.4 6,-0.2 -0.705 27.2 172.4 -82.5 113.2 55.9 69.0 20.8 29 73 A M E - 0 0 15 4,-2.8 2,-0.3 -2,-0.8 5,-0.2 0.731 62.8 -32.6 -94.8 -27.7 52.6 69.9 22.3 30 74 A G E > S- C 0 33A 9 3,-1.5 3,-0.8 28,-0.1 -1,-0.3 -0.932 81.9 -64.5-169.3-171.2 50.5 69.2 19.2 31 75 A E T 3 S+ 0 0 72 -2,-0.3 47,-0.7 1,-0.2 48,-0.2 0.826 134.9 22.8 -59.8 -30.7 50.6 69.4 15.4 32 76 A R T 3 S+ 0 0 54 46,-0.1 333,-2.8 45,-0.1 2,-0.4 0.134 110.6 80.5-123.2 18.2 50.9 73.2 15.6 33 77 A I E < +CD 30 364A 7 -3,-0.8 -4,-2.8 331,-0.2 -3,-1.5 -0.970 45.1 178.8-140.1 117.8 52.4 73.9 19.1 34 78 A I E -CD 28 363A 0 329,-1.8 329,-3.0 -2,-0.4 2,-0.3 -0.983 20.7-140.9-119.0 129.7 55.9 73.7 20.3 35 79 A R E -CD 27 362A 37 -8,-3.3 -8,-2.0 -2,-0.4 2,-0.5 -0.690 14.6-161.0 -84.9 139.3 57.0 74.5 23.9 36 80 A V E +CD 26 361A 0 325,-3.4 325,-2.2 -2,-0.3 2,-0.5 -0.983 10.4 179.0-126.4 121.5 60.3 76.3 24.3 37 81 A T E -CD 25 360A 0 -12,-2.4 -12,-2.2 -2,-0.5 2,-0.6 -0.886 10.4-168.0-130.4 104.0 62.0 76.4 27.7 38 82 A A E -CD 24 359A 0 321,-2.4 321,-2.1 -2,-0.5 -14,-0.2 -0.811 17.4-165.6 -88.9 119.5 65.4 78.1 28.2 39 83 A L E -C 23 0A 0 -16,-3.1 -16,-2.2 -2,-0.6 -17,-1.8 -0.914 25.8-155.1-116.3 122.2 66.8 77.0 31.6 40 84 A P S S+ 0 0 23 0, 0.0 2,-0.3 0, 0.0 -19,-0.1 -0.398 84.6 32.6 -82.9 57.3 69.7 78.7 33.6 41 85 A G S S- 0 0 14 -2,-1.4 -2,-0.1 -18,-0.1 -19,-0.1 -0.953 88.6-100.8 175.7-169.5 70.3 75.3 35.3 42 86 A T S S+ 0 0 100 -2,-0.3 2,-0.7 1,-0.1 3,-0.1 0.413 92.5 79.0-120.5 -2.3 70.2 71.6 34.8 43 87 A D > - 0 0 101 1,-0.2 3,-2.8 -20,-0.0 4,-0.3 -0.782 46.4-178.3-116.8 88.3 66.9 70.6 36.6 44 88 A F G > S+ 0 0 30 -2,-0.7 3,-1.9 1,-0.3 -1,-0.2 0.769 80.7 77.7 -53.7 -22.9 63.8 71.4 34.5 45 89 A G G 3 S+ 0 0 62 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.675 76.9 71.6 -58.3 -18.9 62.0 70.0 37.5 46 90 A I G < S+ 0 0 50 -3,-2.8 -1,-0.3 311,-0.1 -2,-0.2 0.680 77.7 96.2 -72.3 -17.1 62.6 73.4 39.2 47 91 A V S < S- 0 0 26 -3,-1.9 3,-0.1 -4,-0.3 -8,-0.0 -0.625 82.7-112.7 -81.1 131.2 60.1 74.9 36.9 48 92 A P - 0 0 72 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.170 29.3 -94.3 -68.2 148.9 56.6 75.2 38.5 49 93 A E - 0 0 150 1,-0.1 3,-0.0 2,-0.0 0, 0.0 -0.426 56.4-104.8 -56.3 126.7 53.4 73.3 37.5 50 94 A S - 0 0 29 1,-0.2 -1,-0.1 -2,-0.2 132,-0.0 -0.256 26.3-165.6 -58.3 138.7 51.6 75.6 35.1 51 95 A I S S+ 0 0 10 -3,-0.1 -1,-0.2 3,-0.0 550,-0.1 0.733 94.8 39.6 -85.0 -29.6 48.6 77.5 36.3 52 96 A Q S S+ 0 0 0 1,-0.1 2,-0.4 551,-0.0 -2,-0.1 0.920 105.2 65.8 -85.1 -49.9 47.7 78.3 32.7 53 97 A V + 0 0 6 1,-0.1 327,-0.3 2,-0.0 -3,-0.1 -0.638 40.2 167.0 -84.4 125.9 48.5 75.1 30.7 54 98 A V + 0 0 71 325,-2.7 2,-0.4 -2,-0.4 326,-0.2 0.383 53.2 103.1-107.0 0.1 46.5 72.0 31.3 55 99 A A - 0 0 24 324,-1.4 3,-0.1 326,-0.0 324,-0.1 -0.690 57.5-153.7 -93.6 132.1 47.9 70.3 28.3 56 100 A K - 0 0 134 -2,-0.4 3,-0.1 1,-0.1 -2,-0.1 -0.599 39.5 -74.1 -96.4 158.1 50.6 67.7 28.4 57 101 A P - 0 0 41 0, 0.0 -28,-0.2 0, 0.0 -1,-0.1 -0.220 61.4-103.8 -47.7 137.3 53.2 66.8 25.7 58 102 A A - 0 0 24 -30,-1.7 -30,-0.1 1,-0.1 -28,-0.1 -0.353 30.7-174.5 -72.8 146.6 51.6 64.9 22.9 59 103 A T S S+ 0 0 145 -30,-0.1 -1,-0.1 -3,-0.1 -29,-0.0 0.644 82.6 51.3-107.6 -25.5 52.0 61.2 22.4 60 104 A N S S+ 0 0 135 2,-0.1 -1,-0.1 1,-0.0 -2,-0.0 0.099 83.3 104.2-104.3 21.0 50.2 60.8 19.1 61 105 A V - 0 0 17 -33,-0.1 -33,-0.1 -31,-0.0 -31,-0.0 -0.887 63.4-139.3-113.0 109.4 52.0 63.5 17.1 62 106 A P + 0 0 94 0, 0.0 15,-0.3 0, 0.0 2,-0.3 -0.291 31.1 167.0 -60.8 140.1 54.6 62.4 14.5 63 107 A F - 0 0 64 13,-0.1 2,-0.3 14,-0.1 13,-0.2 -0.987 23.1-140.1-155.1 157.2 57.8 64.5 14.4 64 108 A S E -H 75 0B 44 11,-2.2 11,-1.6 -2,-0.3 2,-0.4 -0.831 1.9-155.0-120.3 153.4 61.3 64.4 12.9 65 109 A V E +H 74 0B 24 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.921 17.0 176.0-131.2 107.8 64.7 65.4 14.2 66 110 A D E -H 73 0B 99 7,-2.6 7,-2.8 -2,-0.4 2,-0.4 -0.907 5.4-172.1-114.6 142.8 67.4 66.2 11.7 67 111 A Q E +H 72 0B 93 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.997 15.3 149.2-138.0 130.8 70.8 67.5 12.6 68 112 A A E > -H 71 0B 67 3,-2.0 3,-1.6 -2,-0.4 2,-0.2 -0.853 61.0 -33.4-165.4 129.4 73.6 68.8 10.4 69 113 A G T 3 S- 0 0 62 -2,-0.3 -1,-0.0 1,-0.2 0, 0.0 -0.427 121.8 -18.4 61.6-123.6 76.4 71.3 10.8 70 114 A E T 3 S+ 0 0 115 -2,-0.2 15,-2.6 -3,-0.1 16,-0.4 0.327 121.9 73.2-101.4 5.3 75.3 74.2 13.1 71 115 A K E < -HI 68 84B 115 -3,-1.6 -3,-2.0 13,-0.2 2,-0.4 -0.904 55.8-160.8-125.5 151.2 71.6 73.7 12.9 72 116 A L E -HI 67 83B 0 11,-1.8 11,-2.1 -2,-0.3 2,-0.4 -0.965 13.8-154.7-133.7 112.1 69.1 71.2 14.3 73 117 A V E +HI 66 82B 31 -7,-2.8 -7,-2.6 -2,-0.4 2,-0.5 -0.769 13.9 179.3 -98.5 133.2 65.7 70.9 12.8 74 118 A L E +HI 65 81B 0 7,-2.2 7,-3.1 -2,-0.4 2,-0.3 -0.988 21.1 172.1-125.9 115.7 62.6 69.6 14.7 75 119 A K E -HI 64 80B 94 -11,-1.6 -11,-2.2 -2,-0.5 5,-0.3 -0.962 24.2-171.1-136.1 149.4 59.5 69.5 12.6 76 120 A T - 0 0 14 3,-3.4 -13,-0.1 -2,-0.3 -45,-0.1 -0.444 53.5 -85.2-108.1-168.8 55.8 68.4 12.5 77 121 A S S S+ 0 0 73 -15,-0.3 -45,-0.1 1,-0.2 3,-0.1 0.696 128.8 25.2 -70.9 -16.5 53.3 68.4 9.6 78 122 A Q S S+ 0 0 74 -47,-0.7 17,-0.5 1,-0.2 2,-0.3 0.511 123.1 36.7-125.2 -15.6 52.5 72.0 10.4 79 123 A V - 0 0 2 -48,-0.2 -3,-3.4 15,-0.2 2,-0.4 -1.000 51.7-165.6-147.7 143.2 55.5 73.6 12.1 80 124 A S E -IJ 75 93B 17 13,-1.9 13,-2.2 -2,-0.3 2,-0.5 -0.997 6.0-160.2-133.8 134.6 59.3 73.5 12.0 81 125 A A E -IJ 74 92B 0 -7,-3.1 -7,-2.2 -2,-0.4 2,-0.6 -0.951 3.7-164.1-114.1 124.4 61.8 74.8 14.6 82 126 A E E -IJ 73 91B 41 9,-2.9 9,-1.3 -2,-0.5 2,-0.4 -0.922 10.8-171.4-111.2 110.5 65.4 75.5 13.6 83 127 A V E -IJ 72 90B 1 -11,-2.1 -11,-1.8 -2,-0.6 2,-0.4 -0.816 20.6-128.2-103.9 138.6 67.8 75.8 16.5 84 128 A S E > -I 71 0B 26 5,-2.1 4,-0.6 -2,-0.4 -13,-0.2 -0.686 4.9-151.6 -81.9 134.0 71.4 77.0 16.4 85 129 A L T 4 S+ 0 0 2 -15,-2.6 -82,-1.3 -2,-0.4 -14,-0.1 0.459 91.1 64.7 -81.0 -0.0 73.8 74.6 18.1 86 130 A L T 4 S- 0 0 81 -16,-0.4 -1,-0.2 -84,-0.2 -15,-0.1 0.930 125.9 -5.4 -88.0 -56.2 76.0 77.7 18.7 87 131 A D T 4 S- 0 0 73 2,-0.1 -2,-0.1 -70,-0.1 -71,-0.1 0.654 95.7-108.0-114.9 -26.8 74.0 80.0 21.0 88 132 A G < + 0 0 0 -4,-0.6 2,-0.2 1,-0.2 -3,-0.1 0.490 58.5 158.5 111.8 9.8 70.7 78.2 21.3 89 133 A T - 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0 0 38 0, 0.0 3,-2.0 0, 0.0 6,-0.2 -0.477 51.6-116.8 -60.9 137.9 24.5 91.1 58.2 432 476 A E T 3 S+ 0 0 110 1,-0.3 3,-0.5 -2,-0.1 -2,-0.1 0.832 112.2 48.3 -50.2 -39.3 26.8 94.1 58.1 433 477 A D T 3 S+ 0 0 99 1,-0.2 -1,-0.3 40,-0.0 40,-0.1 0.013 103.5 65.0 -94.9 29.1 29.3 92.5 60.6 434 478 A A X + 0 0 13 -3,-2.0 3,-2.7 5,-0.1 4,-0.5 -0.038 55.1 161.1-143.5 35.9 29.5 89.1 58.8 435 479 A W T 3 S+ 0 0 4 -3,-0.5 36,-2.3 1,-0.3 39,-0.2 -0.410 79.2 30.0 -55.8 129.6 31.1 89.5 55.4 436 480 A G T 3 S+ 0 0 0 34,-0.2 -1,-0.3 3,-0.1 34,-0.1 0.238 94.3 94.0 99.0 -15.5 32.3 86.0 54.5 437 481 A S S < S- 0 0 14 -3,-2.7 -2,-0.2 -6,-0.2 3,-0.1 0.752 78.5-146.6 -77.2 -24.3 29.5 84.3 56.5 438 482 A H + 0 0 6 -4,-0.5 2,-0.2 1,-0.2 -3,-0.1 0.685 48.5 142.1 61.8 19.1 27.4 84.1 53.4 439 483 A D - 0 0 71 -5,-0.4 2,-0.7 -8,-0.1 -1,-0.2 -0.484 52.5-120.2 -80.6 161.2 24.2 84.6 55.5 440 484 A F - 0 0 24 -10,-0.2 -10,-0.3 -2,-0.2 -11,-0.0 -0.913 25.6-116.5-108.2 112.7 21.3 86.7 54.4 441 485 A D > - 0 0 38 -12,-2.4 4,-2.1 -2,-0.7 3,-0.3 -0.158 21.4-142.7 -32.5 124.7 20.3 89.7 56.5 442 486 A K T 4 S+ 0 0 158 1,-0.2 -1,-0.2 2,-0.2 -12,-0.0 0.688 93.1 65.1 -77.6 -18.3 16.8 88.8 57.8 443 487 A Q T 4 S+ 0 0 150 2,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.879 122.1 13.4 -69.4 -38.4 15.6 92.5 57.5 444 488 A F T 4 S+ 0 0 83 -3,-0.3 -41,-2.5 -15,-0.1 -40,-0.4 0.670 136.8 34.7-113.4 -23.9 15.9 92.6 53.7 445 489 A F < + 0 0 3 -4,-2.1 -2,-0.1 -43,-0.2 -1,-0.1 -0.444 63.4 156.9-135.3 62.0 16.4 89.1 52.5 446 490 A P S S+ 0 0 62 0, 0.0 -1,-0.1 0, 0.0 -6,-0.1 0.784 75.4 25.5 -67.0 -32.9 14.2 86.9 54.9 447 491 A D > + 0 0 89 1,-0.1 4,-2.3 2,-0.0 5,-0.1 -0.836 60.2 176.6-136.2 92.6 13.8 84.0 52.5 448 492 A P H > S+ 0 0 12 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.913 84.6 55.0 -63.4 -42.4 16.5 83.5 49.9 449 493 A K H > S+ 0 0 103 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.872 110.2 47.2 -57.5 -39.2 15.0 80.3 48.5 450 494 A A H > S+ 0 0 23 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.902 109.0 54.0 -69.8 -43.5 11.7 82.1 47.9 451 495 A L H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.949 113.2 42.2 -53.3 -52.0 13.5 85.0 46.3 452 496 A V H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.2 0.922 113.1 55.3 -60.3 -43.0 15.1 82.6 43.8 453 497 A D H X S+ 0 0 72 -4,-2.5 4,-2.0 -5,-0.3 -2,-0.2 0.914 108.7 46.1 -59.4 -40.7 11.8 80.8 43.5 454 498 A K H X S+ 0 0 106 -4,-3.0 4,-0.8 2,-0.2 -1,-0.2 0.860 113.0 50.7 -69.7 -37.2 10.0 84.1 42.5 455 499 A V H ><>S+ 0 0 0 -4,-2.2 5,-1.6 -5,-0.2 3,-1.0 0.952 111.8 46.8 -61.7 -49.1 12.7 84.9 40.1 456 500 A H H ><5S+ 0 0 67 -4,-3.0 3,-2.1 1,-0.3 -2,-0.2 0.863 104.3 60.9 -62.3 -36.3 12.5 81.5 38.5 457 501 A A H 3<5S+ 0 0 76 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.735 101.6 54.8 -65.4 -23.2 8.7 81.7 38.3 458 502 A M T <<5S- 0 0 46 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.027 122.5-110.3 -92.7 20.7 9.2 84.7 36.1 459 503 A N T < 5S+ 0 0 86 -3,-2.1 2,-0.3 1,-0.2 -3,-0.2 0.833 79.9 119.8 55.6 36.8 11.5 82.6 33.8 460 504 A A < - 0 0 1 -5,-1.6 2,-0.3 378,-0.1 -38,-0.2 -0.786 56.3-131.1-123.7 170.1 14.6 84.5 34.8 461 505 A Q E -e 422 0I 7 -40,-2.7 -38,-2.0 -2,-0.3 2,-0.4 -0.832 16.0-145.4-116.4 156.4 17.9 83.5 36.4 462 506 A I E -e 423 0I 2 -2,-0.3 71,-2.2 -40,-0.2 72,-0.9 -0.990 7.8-164.3-129.2 138.0 19.6 85.2 39.3 463 507 A M E -ef 424 534I 0 -40,-1.8 -38,-3.1 -2,-0.4 2,-0.4 -0.859 9.5-155.4-114.8 153.5 23.3 85.7 40.0 464 508 A I E -ef 425 535I 0 70,-1.5 72,-2.7 -2,-0.3 -38,-0.2 -0.973 17.6-113.3-136.6 140.8 24.8 86.7 43.3 465 509 A S E + f 0 536I 0 -40,-2.2 2,-0.3 -2,-0.4 72,-0.2 -0.484 32.8 171.5 -71.6 137.4 28.0 88.4 44.5 466 510 A V - 0 0 1 70,-2.2 72,-0.4 -2,-0.2 -39,-0.0 -0.910 11.3-164.4-145.8 124.1 30.6 86.5 46.5 467 511 A W - 0 0 13 -2,-0.3 72,-0.1 2,-0.2 73,-0.1 -0.321 33.3-119.6 -93.4 174.1 34.1 87.9 47.3 468 512 A P S S+ 0 0 0 0, 0.0 40,-2.0 0, 0.0 2,-0.3 0.151 81.8 116.4 -95.8 24.5 37.2 86.0 48.5 469 513 A K E +K 507 0J 2 38,-0.2 2,-0.4 36,-0.0 38,-0.2 -0.698 41.3 179.2-105.3 138.0 36.9 88.3 51.5 470 514 A F E -K 506 0J 0 36,-2.9 36,-2.3 -2,-0.3 -34,-0.2 -0.998 25.4-132.9-141.1 137.2 36.2 87.3 55.1 471 515 A Y > - 0 0 1 -36,-2.3 3,-1.6 -2,-0.4 6,-0.4 -0.714 24.5-129.6 -82.9 138.1 35.9 89.1 58.4 472 516 A P T 3 S+ 0 0 39 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.639 105.4 68.5 -64.1 -12.2 37.9 87.4 61.2 473 517 A T T 3 S+ 0 0 95 31,-0.2 2,-0.1 -38,-0.1 -39,-0.1 0.776 84.9 93.8 -73.7 -23.5 34.8 87.5 63.4 474 518 A T S <> S- 0 0 9 -3,-1.6 4,-2.4 -39,-0.2 3,-0.3 -0.415 75.9-134.1 -81.3 143.8 33.1 84.9 61.1 475 519 A D H > S+ 0 0 125 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.837 108.3 57.1 -54.0 -40.7 33.0 81.1 61.5 476 520 A N H > S+ 0 0 20 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.845 106.4 48.0 -64.0 -38.0 33.9 80.7 57.8 477 521 A Y H > S+ 0 0 16 -6,-0.4 4,-3.7 -3,-0.3 5,-0.2 0.972 110.1 52.9 -60.4 -56.3 37.0 82.8 58.3 478 522 A K H X S+ 0 0 112 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.829 108.2 51.1 -48.7 -39.0 38.0 80.7 61.3 479 523 A E H X S+ 0 0 82 -4,-1.9 4,-0.6 2,-0.2 3,-0.3 0.960 114.8 41.5 -67.7 -52.2 37.6 77.4 59.3 480 524 A L H ><>S+ 0 0 0 -4,-1.9 5,-1.9 1,-0.2 3,-1.6 0.944 112.1 56.1 -56.5 -49.2 39.8 78.6 56.5 481 525 A N H ><5S+ 0 0 57 -4,-3.7 3,-1.2 1,-0.3 5,-0.3 0.811 100.1 58.7 -58.2 -31.0 42.3 80.2 58.9 482 526 A A H 3<5S+ 0 0 87 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.632 103.0 51.8 -77.5 -16.9 42.9 76.9 60.9 483 527 A K T <<5S- 0 0 123 -3,-1.6 -1,-0.3 -4,-0.6 -2,-0.2 0.341 122.7-109.7 -92.8 3.4 44.1 75.1 57.7 484 528 A G T < 5S+ 0 0 57 -3,-1.2 -3,-0.2 -4,-0.3 -2,-0.1 0.606 82.2 127.3 77.9 18.0 46.5 78.1 57.2 485 529 A F < + 0 0 23 -5,-1.9 24,-1.7 -6,-0.2 2,-0.4 0.126 36.6 100.5 -99.0 20.1 44.5 79.4 54.2 486 530 A M E -L 508 0J 14 -5,-0.3 2,-1.4 -6,-0.2 22,-0.2 -0.901 68.5-135.6-105.3 134.8 44.0 83.1 55.2 487 531 A F E > +L 507 0J 5 20,-2.5 20,-0.7 -2,-0.4 3,-0.7 -0.707 34.8 175.7 -80.9 87.9 46.1 86.0 53.8 488 532 A N T >> + 0 0 49 -2,-1.4 4,-1.4 1,-0.2 3,-1.1 0.420 51.2 90.3 -82.5 -4.3 46.5 87.6 57.3 489 533 A R H 3> S+ 0 0 66 67,-0.4 4,-2.0 1,-0.3 -1,-0.2 0.787 81.3 63.3 -67.5 -26.4 48.9 90.5 56.6 490 534 A N H <4>S+ 0 0 0 -3,-0.7 5,-1.9 66,-0.3 -1,-0.3 0.811 104.0 49.6 -62.2 -29.3 45.9 92.8 55.8 491 535 A L H X45S+ 0 0 33 -3,-1.1 3,-1.4 3,-0.2 -2,-0.2 0.883 107.3 51.3 -77.6 -40.1 44.9 92.2 59.4 492 536 A D H 3<5S+ 0 0 113 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.2 0.877 108.6 53.7 -62.5 -37.8 48.3 93.1 60.9 493 537 A E T 3<5S- 0 0 52 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.457 108.4-131.8 -74.7 -4.3 48.2 96.3 58.8 494 538 A K T < 5 + 0 0 147 -3,-1.4 2,-0.7 1,-0.2 -3,-0.2 0.908 38.4 176.9 48.8 52.6 44.8 97.1 60.4 495 539 A N < - 0 0 2 -5,-1.9 10,-0.5 10,-0.2 2,-0.4 -0.771 13.3-158.6 -89.8 115.1 43.2 97.9 57.1 496 540 A L B -M 504 0K 69 -2,-0.7 8,-0.2 8,-0.1 6,-0.0 -0.733 9.4-136.9 -93.0 139.7 39.5 98.7 57.4 497 541 A D - 0 0 18 6,-1.8 -1,-0.1 -2,-0.4 48,-0.0 0.131 33.6 -92.5 -73.1-158.3 37.2 98.4 54.4 498 542 A W S S+ 0 0 126 4,-0.1 2,-0.5 3,-0.0 -1,-0.1 0.459 84.7 111.5-104.9 -5.0 34.5 101.0 53.6 499 543 A I S > S- 0 0 20 4,-0.1 3,-2.0 2,-0.1 -2,-0.1 -0.607 90.7 -51.2 -77.4 122.1 31.5 99.5 55.4 500 544 A G T 3 S- 0 0 60 -2,-0.5 3,-0.1 1,-0.3 0, 0.0 -0.253 125.4 -9.6 57.8-134.7 30.3 101.6 58.4 501 545 A K T 3 S- 0 0 202 1,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.622 119.1 -93.2 -67.3 -16.3 33.0 102.5 60.8 502 546 A G < - 0 0 17 -3,-2.0 2,-0.3 2,-0.0 -4,-0.1 0.382 38.8-129.4 105.0 126.6 35.2 100.0 58.9 503 547 A Y - 0 0 61 -4,-0.1 -6,-1.8 -3,-0.1 2,-0.2 -0.795 17.3-114.9-109.9 145.2 35.9 96.4 59.4 504 548 A L B +M 496 0K 74 -2,-0.3 2,-0.3 -8,-0.2 -31,-0.2 -0.487 48.3 171.7 -64.9 144.0 39.0 94.3 59.6 505 549 A N - 0 0 2 -10,-0.5 2,-0.3 -34,-0.2 -34,-0.2 -0.998 21.4-166.1-162.9 153.0 39.1 91.8 56.7 506 550 A A E -K 470 0J 0 -36,-2.3 -36,-2.9 -2,-0.3 2,-0.4 -0.933 17.6-127.5-143.2 158.6 41.3 89.3 54.9 507 551 A F E -KL 469 487J 0 -20,-0.7 -20,-2.5 -2,-0.3 -38,-0.2 -0.902 27.0-121.6-112.6 141.0 41.4 87.3 51.6 508 552 A Y E - L 0 486J 0 -40,-2.0 -22,-0.2 -2,-0.4 -1,-0.0 -0.196 23.2-111.9 -77.5 172.0 41.7 83.6 51.3 509 553 A D - 0 0 9 -24,-1.7 3,-0.5 1,-0.1 -1,-0.1 -0.935 29.5-179.7-109.8 110.5 44.5 81.8 49.4 510 554 A P + 0 0 1 0, 0.0 6,-0.2 0, 0.0 -1,-0.1 0.415 59.5 94.3 -93.7 -1.0 43.1 80.0 46.3 511 555 A F S S+ 0 0 12 4,-0.1 3,-0.1 2,-0.0 49,-0.0 0.453 76.3 69.2 -78.3 -0.6 46.4 78.5 45.2 512 556 A S S > S- 0 0 22 -3,-0.5 4,-2.1 1,-0.1 3,-0.3 -0.975 72.1-148.4-113.2 130.3 45.7 75.3 47.0 513 557 A P H > S+ 0 0 104 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.879 103.2 59.1 -59.5 -36.9 42.9 73.0 45.7 514 558 A E H > S+ 0 0 118 1,-0.2 4,-1.0 2,-0.2 -3,-0.0 0.868 107.6 47.1 -59.0 -37.8 42.4 71.9 49.4 515 559 A A H > S+ 0 0 0 -3,-0.3 4,-2.2 1,-0.2 3,-0.3 0.890 110.2 49.3 -68.6 -45.3 41.7 75.6 50.1 516 560 A T H X S+ 0 0 10 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.744 103.5 63.0 -72.5 -17.4 39.3 76.2 47.3 517 561 A A H X S+ 0 0 57 -4,-1.5 4,-1.6 -5,-0.2 -1,-0.2 0.878 106.6 42.9 -74.5 -38.2 37.4 73.1 48.2 518 562 A I H X S+ 0 0 20 -4,-1.0 4,-2.9 -3,-0.3 5,-0.2 0.929 111.8 55.2 -64.1 -51.0 36.5 74.6 51.6 519 563 A F H X S+ 0 0 1 -4,-2.2 4,-1.9 1,-0.2 3,-0.3 0.955 111.8 42.9 -46.3 -58.8 35.7 77.9 50.0 520 564 A W H X S+ 0 0 18 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.862 111.5 55.0 -55.9 -39.6 33.2 76.2 47.6 521 565 A K H X S+ 0 0 93 -4,-1.6 4,-2.7 1,-0.2 -1,-0.2 0.860 106.3 52.5 -68.5 -34.7 31.8 74.1 50.4 522 566 A Q H X S+ 0 0 5 -4,-2.9 4,-1.9 -3,-0.3 -1,-0.2 0.943 115.4 38.8 -59.7 -48.0 31.0 77.2 52.4 523 567 A I H X>S+ 0 0 0 -4,-1.9 5,-2.1 -5,-0.2 4,-1.9 0.744 116.2 54.0 -79.0 -22.0 29.2 78.9 49.6 524 568 A R H <>S+ 0 0 92 -4,-2.1 5,-1.1 -5,-0.3 -2,-0.2 0.936 110.4 45.8 -71.3 -49.5 27.6 75.6 48.7 525 569 A D H <5S+ 0 0 56 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.858 126.4 29.1 -60.3 -38.3 26.3 75.0 52.2 526 570 A K H <5S+ 0 0 90 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.649 134.7 14.9-103.3 -22.5 24.9 78.6 52.5 527 571 A I T ><>S+ 0 0 0 -4,-1.9 3,-1.5 -5,-0.2 5,-0.7 0.722 113.9 59.9-122.3 -49.5 24.0 79.8 49.0 528 572 A N G > + 0 0 0 -72,-0.1 4,-0.7 1,-0.1 -1,-0.2 0.812 66.8 144.9 64.3 40.8 37.4 91.3 43.6 540 584 A V T 4 + 0 0 0 -3,-0.3 33,-0.3 2,-0.2 -1,-0.1 0.198 52.1 74.8-102.2 19.2 39.6 88.5 42.3 541 585 A E T 4 S- 0 0 5 31,-0.1 31,-0.5 32,-0.1 32,-0.2 0.938 120.0-109.0 -53.2 -51.7 42.7 90.5 41.4 542 586 A P T 4 - 0 0 6 0, 0.0 2,-0.6 0, 0.0 -2,-0.2 0.543 52.2-174.4 -81.2 159.6 42.8 90.4 44.4 543 587 A D < + 0 0 13 -4,-0.7 3,-0.3 1,-0.2 -382,-0.0 -0.808 20.5 158.6-107.6 81.3 42.0 93.9 45.6 544 588 A I S S+ 0 0 15 -2,-0.6 2,-0.5 1,-0.3 -1,-0.2 0.979 77.7 11.1 -72.3 -54.8 42.5 93.2 49.3 545 589 A H S > S- 0 0 16 -3,-0.2 3,-1.1 -48,-0.0 -1,-0.3 -0.975 89.8-124.9-123.0 123.1 43.1 96.8 50.1 546 590 A S T 3 S+ 0 0 27 -2,-0.5 -242,-0.1 -3,-0.3 -309,-0.1 -0.415 84.7 8.3 -66.9 128.5 42.2 99.4 47.5 547 591 A N T 3 S+ 0 0 4 1,-0.3 -310,-2.2 -2,-0.2 -1,-0.2 0.533 83.7 133.3 85.7 11.1 45.0 101.8 46.4 548 592 A L < - 0 0 1 -3,-1.1 -1,-0.3 -312,-0.2 -310,-0.1 -0.378 69.3 -80.1 -75.4 171.2 48.0 100.5 48.2 549 593 A T > - 0 0 19 -312,-0.5 4,-2.1 1,-0.1 -1,-0.2 -0.274 37.5-115.9 -65.6 160.1 51.2 100.2 46.2 550 594 A F H > S+ 0 0 21 2,-0.2 4,-1.5 1,-0.2 -1,-0.1 0.771 117.6 55.7 -73.1 -22.4 51.6 97.2 43.9 551 595 A E H > S+ 0 0 63 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.927 107.9 48.2 -69.2 -45.6 54.5 96.0 46.0 552 596 A K H > S+ 0 0 61 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.894 109.4 53.2 -59.7 -41.3 52.3 96.1 49.1 553 597 A R H X S+ 0 0 11 -4,-2.1 4,-0.5 2,-0.2 -1,-0.2 0.866 111.2 47.0 -60.7 -38.1 49.6 94.2 47.1 554 598 A K H >< S+ 0 0 2 -4,-1.5 3,-1.4 1,-0.2 -2,-0.2 0.945 109.5 53.2 -64.7 -48.5 52.3 91.6 46.4 555 599 A W H >< S+ 0 0 58 -4,-3.0 3,-1.6 1,-0.3 -2,-0.2 0.850 100.6 63.9 -56.4 -37.1 53.5 91.5 50.0 556 600 A L H 3< S+ 0 0 4 -4,-2.2 -67,-0.4 1,-0.3 -1,-0.3 0.720 97.8 52.0 -65.9 -24.5 49.9 90.8 51.1 557 601 A M T << S+ 0 0 4 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.1 0.059 87.5 144.4-101.5 28.2 49.6 87.5 49.4 558 602 A T < + 0 0 15 -3,-1.6 -69,-0.1 1,-0.2 6,-0.1 -0.966 58.7 25.8-117.6 126.7 52.8 86.2 51.0 559 603 A P S S+ 0 0 105 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 0.533 82.5 155.4 -84.2 146.0 53.1 83.4 51.8 560 604 A N B > -N 563 0L 11 3,-2.2 3,-1.5 -2,-0.1 -75,-0.0 -0.720 60.0 -91.4-117.6 178.2 50.7 81.7 49.4 561 605 A A T 3 S+ 0 0 58 1,-0.3 3,-0.1 -2,-0.2 -3,-0.0 0.736 124.2 46.7 -63.3 -21.2 50.8 78.0 48.3 562 606 A R T 3 S- 0 0 77 1,-0.2 2,-0.4 2,-0.1 -1,-0.3 0.232 118.7 -98.5-108.2 12.3 52.9 78.8 45.2 563 607 A G B < S+N 560 0L 25 -3,-1.5 -3,-2.2 5,-0.0 -1,-0.2 -0.918 78.3 15.2 114.2-133.7 55.5 81.1 46.9 564 608 A N - 0 0 21 -2,-0.4 4,-0.3 -5,-0.2 -2,-0.1 -0.143 68.7-111.9 -77.3 170.0 55.6 84.9 46.9 565 609 A G S > S+ 0 0 0 1,-0.2 3,-1.0 2,-0.1 -10,-0.1 0.916 118.4 49.3 -63.9 -41.9 52.9 87.4 46.1 566 610 A A G > S+ 0 0 0 1,-0.2 3,-1.5 2,-0.2 -381,-0.4 0.847 94.9 70.0 -68.9 -38.4 54.9 88.5 43.1 567 611 A E G 3 S+ 0 0 32 1,-0.3 -384,-0.3 -383,-0.1 -1,-0.2 0.586 118.8 21.4 -57.0 -10.4 55.4 85.0 41.6 568 612 A I G X> S+ 0 0 2 -3,-1.0 3,-2.2 -4,-0.3 4,-0.5 0.144 76.7 137.1-145.3 21.0 51.7 84.8 40.8 569 613 A F T <4 S+ 0 0 5 -3,-1.5 -385,-0.2 1,-0.3 3,-0.1 0.709 81.3 39.0 -49.8 -23.8 50.5 88.4 40.7 570 614 A N T 34 S+ 0 0 1 -387,-2.4 -1,-0.3 -4,-0.2 3,-0.2 0.574 104.6 66.3-101.0 -7.7 48.4 87.7 37.6 571 615 A A T X4 + 0 0 0 -3,-2.2 3,-1.6 -388,-0.4 -2,-0.1 0.429 60.0 105.6-103.3 0.8 47.0 84.3 38.3 572 616 A Y T 3X S+ 0 0 2 -4,-0.5 4,-1.5 -31,-0.5 5,-0.2 0.901 76.0 57.9 -50.5 -48.8 44.6 84.6 41.3 573 617 A A H 3> S+ 0 0 1 -33,-0.3 4,-2.2 -3,-0.2 -1,-0.3 0.732 100.2 58.2 -61.8 -19.5 41.4 84.4 39.3 574 618 A V H <> S+ 0 0 0 -3,-1.6 4,-2.9 2,-0.2 -1,-0.2 0.982 106.1 40.1 -81.4 -54.3 42.1 81.0 37.8 575 619 A P H > S+ 0 0 20 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.870 119.5 53.8 -56.5 -33.4 42.6 78.6 40.7 576 620 A H H >X S+ 0 0 0 -4,-1.5 4,-1.4 2,-0.2 3,-0.6 0.976 111.6 38.3 -66.5 -60.3 39.8 80.5 42.4 577 621 A A H 3X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 3,-0.3 0.915 111.2 63.1 -61.5 -36.6 37.2 80.1 39.7 578 622 A E H 3X S+ 0 0 55 -4,-2.9 4,-2.6 -5,-0.3 -1,-0.2 0.862 100.0 53.1 -53.8 -39.7 38.4 76.6 39.1 579 623 A G H < - 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0 0 0 -2,-0.3 -434,-0.4 -30,-0.1 2,-0.3 -0.882 11.3-172.0-151.7-173.9 41.5 86.4 34.5 601 645 A F > - 0 0 0 -2,-0.3 3,-2.3 -436,-0.1 4,-0.3 -0.897 59.8 -38.2-168.1 174.5 44.7 84.8 33.2 602 646 A G T 3 S+ 0 0 0 -2,-0.3 35,-0.1 1,-0.2 -436,-0.0 -0.220 129.5 20.2 -43.5 129.7 45.4 82.1 30.7 603 647 A G T > S+ 0 0 0 -222,-0.1 3,-3.0 34,-0.0 -1,-0.2 0.286 78.5 124.9 93.5 -12.4 42.8 79.3 31.1 604 648 A I G X + 0 0 0 -3,-2.3 3,-2.1 1,-0.3 5,-0.5 0.857 68.7 66.2 -48.9 -35.6 40.1 81.3 32.8 605 649 A Q G > S+ 0 0 3 1,-0.3 -221,-1.2 -4,-0.3 3,-0.8 0.627 86.4 70.9 -64.7 -9.6 37.7 80.2 30.1 606 650 A R G < S+ 0 0 25 -3,-3.0 -1,-0.3 1,-0.2 -2,-0.2 0.490 90.0 61.0 -86.8 1.3 38.0 76.7 31.3 607 651 A T G < S- 0 0 0 -3,-2.1 -1,-0.2 -4,-0.2 -2,-0.2 0.283 116.4-107.1-108.2 7.1 36.0 77.5 34.4 608 652 A G S < S+ 0 0 1 -3,-0.8 -13,-2.1 1,-0.3 2,-0.4 0.939 74.6 144.1 67.9 46.4 32.8 78.5 32.6 609 653 A S E -h 595 0I 5 -5,-0.5 2,-0.3 -15,-0.2 -1,-0.3 -0.937 41.3-158.8-123.8 140.8 33.6 82.1 33.5 610 654 A A E -h 596 0I 0 -15,-3.0 -13,-2.6 -2,-0.4 2,-0.3 -0.765 17.5-146.6-102.5 160.6 33.1 85.4 31.7 611 655 A I E -hi 597 641I 1 29,-1.6 31,-2.0 -2,-0.3 2,-0.3 -0.872 7.8-161.1-120.8 157.2 35.1 88.5 32.7 612 656 A W E - i 0 642I 0 -15,-0.8 31,-0.3 -2,-0.3 -469,-0.1 -0.934 32.0-113.7-134.5 164.9 34.2 92.2 32.7 613 657 A S - 0 0 0 29,-1.1 2,-0.2 -2,-0.3 30,-0.1 0.540 52.8-144.6 -81.1 -5.1 36.4 95.2 32.8 614 658 A G + 0 0 0 1,-0.1 2,-1.8 -451,-0.1 30,-0.3 -0.531 58.0 9.5 87.5-145.4 35.3 96.2 36.2 615 659 A D S S+ 0 0 8 -2,-0.2 2,-0.2 33,-0.1 -452,-0.1 -0.521 73.5 159.2 -81.6 80.7 34.8 99.7 37.7 616 660 A I - 0 0 0 -2,-1.8 33,-1.7 -454,-0.1 32,-0.8 -0.467 38.8-108.3 -91.0 172.7 35.1 102.0 34.6 617 661 A V B -p 649 0N 0 31,-0.2 2,-4.0 30,-0.2 5,-0.2 -0.855 23.4-107.5-113.9 142.2 33.6 105.5 34.6 618 662 A S S S+ 0 0 1 31,-1.4 2,-0.3 -2,-0.4 33,-0.3 -0.217 79.4 122.4 -61.4 62.3 30.5 106.9 32.8 619 663 A R > - 0 0 43 -2,-4.0 4,-1.7 1,-0.1 3,-0.2 -0.915 69.3-128.5-126.3 152.2 32.8 108.8 30.4 620 664 A W H > S+ 0 0 31 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.946 109.7 58.1 -66.3 -47.1 33.1 108.8 26.6 621 665 A S H > S+ 0 0 29 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.860 109.9 48.3 -47.4 -35.5 36.9 108.3 26.7 622 666 A D H > S+ 0 0 0 2,-0.2 4,-1.0 -5,-0.2 -1,-0.2 0.850 108.4 50.2 -78.7 -37.2 36.0 105.1 28.7 623 667 A M H X S+ 0 0 0 -4,-1.7 4,-0.6 -3,-0.3 3,-0.5 0.914 111.6 49.8 -66.4 -41.7 33.3 103.8 26.4 624 668 A K H >X S+ 0 0 65 -4,-2.9 3,-1.9 155,-0.2 4,-0.5 0.967 108.8 53.2 -58.4 -48.1 35.6 104.2 23.4 625 669 A D H 3X S+ 0 0 11 -4,-1.8 4,-1.9 -5,-0.3 -478,-0.3 0.702 93.1 70.0 -66.7 -18.5 38.4 102.4 25.2 626 670 A Q H 3X S+ 0 0 0 -4,-1.0 4,-2.8 -3,-0.5 -1,-0.3 0.771 88.4 67.8 -71.0 -20.0 36.3 99.4 26.0 627 671 A I H <>S+ 0 0 0 -4,-1.8 5,-1.9 -5,-0.3 3,-0.9 0.934 112.0 44.8 -65.7 -45.2 40.7 90.1 25.4 634 678 A N H ><5S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.926 111.4 50.8 -65.1 -43.4 39.1 88.1 22.5 635 679 A L T 3<5S+ 0 0 0 -4,-2.6 -494,-0.3 1,-0.3 -1,-0.2 0.470 102.4 64.8 -73.4 -1.2 42.3 88.0 20.5 636 680 A A T < 5S- 0 0 0 -3,-0.9 -1,-0.3 -496,-0.3 -2,-0.2 0.556 127.0 -98.6 -92.4 -12.4 44.0 86.7 23.7 637 681 A G T < 5S+ 0 0 0 -3,-1.7 2,-0.6 -4,-0.4 -3,-0.2 0.397 95.3 107.8 111.3 2.8 41.8 83.6 23.5 638 682 A V < + 0 0 2 -5,-1.9 -2,-0.2 -6,-0.2 -1,-0.1 -0.883 34.2 164.3-117.1 102.0 39.2 84.7 26.0 639 683 A T + 0 0 0 -2,-0.6 2,-1.6 105,-0.2 108,-0.2 0.896 50.7 83.1 -92.8 -40.7 35.9 85.5 24.3 640 684 A N + 0 0 3 -31,-0.2 -29,-1.6 51,-0.1 2,-0.3 -0.487 67.7 143.3 -71.8 90.7 33.1 85.6 26.9 641 685 A W E +i 611 0I 0 -2,-1.6 51,-1.6 -31,-0.2 2,-0.3 -0.905 20.5 161.9-132.1 151.7 33.8 89.2 27.9 642 686 A T E -i 612 0I 1 -31,-2.0 -29,-1.1 -2,-0.3 2,-0.2 -0.946 16.7-152.6-157.3-179.0 31.7 92.2 29.0 643 687 A F - 0 0 1 49,-0.4 2,-0.8 -2,-0.3 51,-0.2 -0.834 41.6 -75.9-145.3-177.8 31.6 95.6 30.7 644 688 A D > - 0 0 0 -30,-0.3 3,-2.8 -2,-0.2 2,-0.5 -0.800 43.7-132.4 -88.3 110.4 29.2 97.8 32.6 645 689 A I B 3 S+j 695 0I 0 49,-2.1 51,-0.6 -2,-0.8 39,-0.1 -0.477 98.8 15.0 -59.7 115.1 26.8 99.5 30.2 646 690 A G T 3 S- 0 0 0 -2,-0.5 -1,-0.3 33,-0.1 34,-0.1 0.272 126.0 -89.5 103.6 -8.2 26.9 103.1 31.2 647 691 A G < - 0 0 0 -3,-2.8 -30,-0.2 -29,-0.1 51,-0.2 0.288 34.7 -95.2 81.1 150.1 30.0 102.6 33.3 648 692 A F S S+ 0 0 5 -32,-0.8 50,-3.2 -34,-0.3 -31,-0.2 0.944 107.6 28.9 -63.1 -50.3 30.3 101.6 37.0 649 693 A T B -p 617 0N 5 -33,-1.7 -31,-1.4 48,-0.2 -348,-0.2 -0.942 68.1-161.3-123.2 115.9 30.6 105.1 38.4 650 694 A P - 0 0 2 0, 0.0 -31,-0.1 0, 0.0 5,-0.1 -0.479 37.0 -90.8 -80.1 160.6 29.2 108.4 37.0 651 695 A E >> - 0 0 6 -33,-0.3 3,-1.0 -2,-0.1 4,-0.6 -0.077 42.0-101.2 -56.4 169.9 30.5 111.8 38.0 652 696 A D H >> S+ 0 0 95 1,-0.2 4,-1.9 2,-0.2 3,-0.8 0.838 118.7 69.9 -66.6 -35.2 28.8 113.6 40.9 653 697 A R H 34 S+ 0 0 61 1,-0.2 16,-0.4 2,-0.2 -1,-0.2 0.768 106.6 42.8 -52.6 -21.8 26.8 115.8 38.5 654 698 A F H <4 S+ 0 0 0 -3,-1.0 -1,-0.2 14,-0.1 -2,-0.2 0.662 115.4 44.0 -98.9 -22.2 24.9 112.6 37.8 655 699 A R H << S+ 0 0 57 -3,-0.8 7,-2.6 -4,-0.6 2,-0.3 0.837 115.3 33.2 -94.5 -36.5 24.5 111.0 41.2 656 700 A H E < +Q 661 0O 131 -4,-1.9 2,-0.3 5,-0.2 13,-0.2 -0.874 68.9 153.5-123.5 145.6 23.4 113.9 43.5 657 701 A G E > -Q 660 0O 12 3,-1.5 3,-1.7 -2,-0.3 11,-0.1 -0.867 61.5 -69.5-152.7-168.2 21.3 116.9 42.5 658 702 A K T 3 S+ 0 0 183 1,-0.3 3,-0.1 -2,-0.3 10,-0.1 0.632 130.3 54.7 -64.2 -15.2 18.9 119.6 43.7 659 703 A K T 3 S- 0 0 150 8,-0.5 2,-0.3 1,-0.3 -1,-0.3 0.237 111.6-123.8-105.6 11.8 16.4 116.8 44.2 660 704 A G E < S+Q 657 0O 26 -3,-1.7 -3,-1.5 2,-0.1 2,-0.4 -0.640 75.5 21.2 92.2-139.2 18.7 114.7 46.4 661 705 A F E S-Q 656 0O 113 -2,-0.3 2,-1.0 -5,-0.2 -5,-0.2 -0.569 77.0-136.2 -69.4 124.1 19.7 111.1 45.7 662 706 A V + 0 0 0 -7,-2.6 39,-0.1 -2,-0.4 3,-0.1 -0.731 45.0 146.3 -87.4 102.0 19.2 110.5 42.0 663 707 A G + 0 0 8 -2,-1.0 38,-2.5 1,-0.2 -1,-0.2 0.855 69.1 30.8 -90.7 -70.5 17.6 107.1 41.4 664 708 A S S > S- 0 0 32 36,-0.2 3,-1.8 1,-0.1 -1,-0.2 -0.504 91.3-110.3 -82.8 157.7 15.4 107.7 38.4 665 709 A W G > S+ 0 0 54 41,-1.9 3,-1.8 1,-0.3 -1,-0.1 0.692 112.1 78.1 -60.3 -20.6 16.5 110.2 35.7 666 710 A T G 3 S+ 0 0 72 1,-0.3 -1,-0.3 40,-0.1 4,-0.1 0.706 88.5 57.0 -63.7 -21.1 13.6 112.3 36.9 667 711 A A G < S+ 0 0 16 -3,-1.8 -8,-0.5 2,-0.1 -1,-0.3 0.216 85.7 111.0 -95.0 10.5 15.8 113.4 39.8 668 712 A L S < S- 0 0 6 -3,-1.8 2,-0.4 -11,-0.1 -11,-0.1 -0.539 81.9 -96.3 -82.0 152.6 18.6 114.7 37.6 669 713 A D >> - 0 0 28 -16,-0.4 3,-3.6 -13,-0.2 4,-0.9 -0.570 41.7-117.0 -62.3 121.9 19.5 118.4 37.3 670 714 A A H >> S+ 0 0 87 -2,-0.4 3,-0.6 1,-0.3 4,-0.5 0.741 112.4 51.9 -27.7 -52.4 17.8 119.6 34.1 671 715 A E H 34 S+ 0 0 125 1,-0.2 4,-0.4 2,-0.1 -1,-0.3 0.668 107.0 54.9 -69.3 -16.0 21.0 120.4 32.2 672 716 A Q H <> S+ 0 0 25 -3,-3.6 4,-2.1 1,-0.1 3,-0.4 0.750 86.4 79.5 -89.3 -28.1 22.4 116.9 32.9 673 717 A V H S+ 0 0 29 -4,-0.4 4,-3.0 -3,-0.4 5,-0.3 0.894 113.2 53.2 -71.3 -39.0 24.1 113.7 28.3 676 720 A W H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.916 113.0 45.6 -62.3 -39.5 23.1 111.0 30.7 677 721 A Q H X S+ 0 0 30 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.876 115.0 46.0 -71.1 -35.3 20.5 109.8 28.2 678 722 A E H X S+ 0 0 1 -4,-2.0 4,-2.3 -5,-0.3 5,-0.3 0.878 110.9 52.8 -76.2 -35.3 22.8 110.0 25.2 679 723 A L H X S+ 0 0 1 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.943 113.8 43.0 -63.2 -46.1 25.6 108.3 27.0 680 724 A N H X S+ 0 0 0 -4,-1.9 4,-2.7 -5,-0.3 5,-0.2 0.893 111.5 54.7 -69.3 -35.6 23.4 105.4 27.9 681 725 A T H X S+ 0 0 2 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.968 113.9 40.3 -59.5 -52.0 21.7 105.3 24.5 682 726 A R H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.824 116.6 51.3 -64.9 -33.8 25.0 104.9 22.7 683 727 A W H X S+ 0 0 0 -4,-1.9 4,-2.8 -5,-0.3 -1,-0.2 0.870 107.2 51.2 -74.5 -36.8 26.4 102.5 25.4 684 728 A Y H X S+ 0 0 0 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.881 109.8 52.5 -64.5 -38.4 23.3 100.2 25.2 685 729 A Q H < S+ 0 0 2 -4,-1.9 4,-0.3 -5,-0.2 3,-0.3 0.931 112.7 43.1 -60.1 -48.0 23.9 100.1 21.4 686 730 A F H >< S+ 0 0 0 -4,-1.8 3,-1.6 1,-0.2 -2,-0.2 0.908 111.6 57.3 -63.4 -40.2 27.5 99.1 21.9 687 731 A G H >< S+ 0 0 0 -4,-2.8 3,-1.2 1,-0.3 -1,-0.2 0.775 95.7 60.6 -66.2 -29.0 26.5 96.7 24.7 688 732 A A T 3< S+ 0 0 3 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.606 104.3 54.4 -77.0 -9.5 24.1 94.7 22.6 689 733 A F T < S+ 0 0 2 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 -0.122 90.1 86.1-118.9 36.7 27.0 93.8 20.3 690 734 A V S < S- 0 0 0 -3,-1.2 -48,-0.1 1,-0.1 -50,-0.1 -0.812 95.1 -94.3-120.2 172.5 29.5 92.4 22.8 691 735 A P S S+ 0 0 1 0, 0.0 2,-0.4 0, 0.0 -49,-0.2 0.917 113.7 29.0 -57.5 -46.7 29.7 88.8 24.0 692 736 A L S S- 0 0 0 -51,-1.6 2,-0.7 2,-0.1 -49,-0.4 -0.957 77.1-144.4-113.0 136.5 27.6 89.4 27.1 693 737 A Y E +c 393 0I 0 -301,-0.6 -299,-2.3 -2,-0.4 2,-0.4 -0.839 36.4 158.7-101.4 108.8 24.9 92.1 27.1 694 738 A R E -c 394 0I 2 -2,-0.7 -49,-2.1 -51,-0.2 2,-0.5 -0.941 33.7-159.5-151.1 121.7 24.8 93.7 30.6 695 739 A S E +cj 395 645I 0 -301,-2.3 -299,-2.9 -2,-0.4 2,-0.3 -0.825 35.6 140.7 -95.7 125.6 23.6 96.9 32.4 696 740 A H + 0 0 0 -51,-0.6 2,-0.3 -2,-0.5 -299,-0.2 -0.984 9.7 103.4-157.6 155.1 25.2 97.5 35.8 697 741 A G - 0 0 0 -2,-0.3 -299,-2.6 -51,-0.1 -49,-0.2 -0.910 58.5 -61.2 161.1-178.8 26.5 100.3 38.0 698 742 A Q S S- 0 0 18 -50,-3.2 -299,-0.1 -2,-0.3 -2,-0.0 -0.328 82.9 -21.3 -79.9 170.5 26.2 102.7 40.9 699 743 A N S S+ 0 0 15 -301,-0.4 -1,-0.2 -2,-0.1 2,-0.2 -0.223 98.6 74.7 -56.4 143.9 23.4 105.3 41.0 700 744 A P S S- 0 0 0 0, 0.0 -37,-0.2 0, 0.0 -36,-0.2 0.386 97.8-108.5 -63.7 163.3 21.6 106.5 38.9 701 745 A Y - 0 0 59 -38,-2.5 -304,-0.1 -2,-0.2 -3,-0.1 -0.339 27.2-149.4 -65.9 152.0 19.6 103.4 38.5 702 746 A R + 0 0 0 -306,-0.2 -1,-0.1 -5,-0.2 5,-0.1 0.501 50.7 119.6-116.3 -0.9 20.2 101.6 35.2 703 747 A E S >> S- 0 0 0 1,-0.1 3,-2.5 2,-0.1 4,-0.9 -0.343 75.6-113.0 -55.2 144.7 17.1 99.8 34.1 704 748 A I H >> S+ 0 0 0 1,-0.3 4,-1.2 2,-0.2 3,-0.8 0.852 117.5 55.5 -50.6 -38.4 15.9 101.1 30.7 705 749 A F H 34 S+ 0 0 13 1,-0.2 -1,-0.3 2,-0.2 5,-0.1 0.517 106.4 51.4 -79.2 -3.5 12.8 102.6 32.3 706 750 A N H <4 S+ 0 0 23 -3,-2.5 -41,-1.9 -42,-0.1 -1,-0.2 0.506 104.5 56.4-102.9 -12.5 14.9 104.6 34.8 707 751 A I H << S- 0 0 0 -4,-0.9 2,-0.3 -3,-0.8 -2,-0.2 0.764 126.1 -13.6 -89.5 -29.2 17.1 106.1 32.2 708 752 A A S < S- 0 0 0 -4,-1.2 -1,-0.3 6,-0.1 2,-0.1 -0.979 79.1 -85.1-163.2 169.5 14.3 107.7 30.2 709 753 A D > - 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0 0 11 -3,-1.1 -4,-0.3 1,-0.1 -3,-0.2 0.899 60.8-173.7 45.5 45.2 37.2 77.1 19.5 744 788 A G - 0 0 8 -6,-2.6 2,-0.4 -7,-0.2 -105,-0.2 -0.172 29.9-147.5 -76.6 163.4 35.4 80.2 18.5 745 789 A T - 0 0 9 1,-0.1 25,-0.2 -3,-0.1 3,-0.1 -0.994 7.1-171.2-132.5 121.2 35.8 83.9 19.1 746 790 A I S S+ 0 0 5 -2,-0.4 24,-2.1 1,-0.2 2,-0.8 0.948 75.2 52.6 -83.0 -55.5 32.8 86.2 19.3 747 791 A M E S-R 769 0P 0 -108,-0.2 2,-0.5 22,-0.2 22,-0.2 -0.783 81.3-164.4 -89.4 111.1 34.2 89.8 19.5 748 792 A R E -R 768 0P 18 20,-3.2 20,-2.9 -2,-0.8 2,-0.2 -0.855 18.9-140.3-113.4 122.3 36.6 89.9 16.5 749 793 A G >> - 0 0 0 -2,-0.5 3,-2.6 -118,-0.3 4,-0.6 -0.506 37.1-110.5 -68.7 143.3 39.4 92.4 15.7 750 794 A L H 3> S+ 0 0 6 16,-0.3 4,-2.3 1,-0.3 3,-0.3 0.714 114.0 69.9 -53.9 -22.8 39.4 93.2 12.0 751 795 A V H 34 S+ 0 0 2 9,-0.2 -1,-0.3 1,-0.2 -382,-0.2 0.745 90.6 61.0 -67.8 -23.3 42.7 91.4 11.6 752 796 A M H <4 S+ 0 0 8 -3,-2.6 -383,-0.4 2,-0.2 -382,-0.2 0.902 119.9 23.9 -67.4 -41.6 40.9 88.0 12.2 753 797 A D H < S+ 0 0 45 -4,-0.6 -2,-0.2 -3,-0.3 -1,-0.2 0.635 135.6 33.1-104.2 -14.3 38.7 88.4 9.2 754 798 A F >< + 0 0 14 -4,-2.3 3,-1.9 -5,-0.2 6,-0.2 -0.375 66.6 152.4-135.5 54.2 40.7 90.8 7.0 755 799 A P T 3 S+ 0 0 43 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.641 71.1 58.0 -63.9 -18.4 44.4 89.8 7.8 756 800 A N T 3 S+ 0 0 168 36,-0.1 2,-0.7 -3,-0.1 -5,-0.1 0.425 88.3 87.5 -93.1 1.3 45.7 91.0 4.4 757 801 A D <> - 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