==== 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 ISOMERASE 01-DEC-08 3FF1 . COMPND 2 MOLECULE: GLUCOSE-6-PHOSPHATE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS; . AUTHOR S.M.ANDERSON,J.S.BRUNZELLE,O.ONOPRIYENKO,S.PETERSON,W.F.ANDE . 888 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40496.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 648 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 85 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.4 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 . 0 0.0 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 . 57 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 97 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 360 40.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.8 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 2 2 1 2 5 6 1 0 2 4 2 0 2 3 0 0 0 2 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 4 5 5 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 . 2 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 0 A A 0 0 132 0, 0.0 2,-0.3 0, 0.0 234,-0.0 0.000 360.0 360.0 360.0 141.5 15.4 40.7 -30.4 2 1 A X - 0 0 74 4,-0.0 2,-0.3 2,-0.0 781,-0.1 -0.722 360.0-156.0 -99.2 151.7 13.4 38.9 -27.7 3 2 A T - 0 0 36 -2,-0.3 229,-0.1 1,-0.1 233,-0.0 -0.870 28.1-112.9-128.7 162.5 14.8 35.9 -26.0 4 3 A H S S+ 0 0 28 -2,-0.3 2,-0.3 224,-0.1 -1,-0.1 0.859 105.9 19.7 -65.0 -35.3 13.3 32.9 -24.1 5 4 A I S S- 0 0 0 376,-0.1 2,-0.4 386,-0.1 376,-0.2 -0.854 83.1-138.2-124.7 162.5 14.7 34.0 -20.8 6 5 A Q E -A 380 0A 86 374,-2.2 374,-2.7 -2,-0.3 2,-0.6 -0.931 3.3-141.6-128.1 148.4 15.9 37.6 -19.9 7 6 A L E -A 379 0A 18 -2,-0.4 2,-0.7 372,-0.2 372,-0.2 -0.950 15.9-166.6-108.6 118.0 18.8 39.0 -18.0 8 7 A D E +A 378 0A 51 370,-3.0 370,-2.2 -2,-0.6 3,-0.2 -0.894 23.1 157.0-108.3 105.6 18.0 42.0 -15.9 9 8 A F > + 0 0 27 -2,-0.7 4,-1.2 368,-0.2 -1,-0.1 0.089 37.9 115.8-109.3 23.7 21.1 43.9 -14.7 10 9 A S T 4 S+ 0 0 62 1,-0.3 3,-0.2 2,-0.2 -1,-0.1 0.863 82.7 40.0 -64.7 -36.2 19.3 47.2 -14.2 11 10 A K T >4 S+ 0 0 58 365,-0.2 3,-1.5 1,-0.2 -1,-0.3 0.734 105.5 66.6 -81.1 -22.2 19.9 47.1 -10.4 12 11 A T G >4 S+ 0 0 0 1,-0.3 3,-2.2 364,-0.2 4,-0.3 0.775 83.5 76.3 -67.2 -25.2 23.4 45.8 -10.9 13 12 A L G 3< S+ 0 0 57 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.1 0.550 73.8 78.7 -66.0 -5.9 24.3 49.2 -12.6 14 13 A E G < S+ 0 0 126 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.1 0.539 104.5 35.8 -70.1 -7.1 24.3 50.6 -9.1 15 14 A F S < S+ 0 0 40 -3,-2.2 2,-0.3 1,-0.3 -2,-0.2 0.395 124.2 27.0-127.8 -3.9 27.8 49.0 -9.0 16 15 A F S S- 0 0 11 -4,-0.3 2,-0.3 -3,-0.1 -1,-0.3 -0.981 70.8-120.7-155.3 158.5 29.2 49.3 -12.5 17 16 A G >> - 0 0 20 -2,-0.3 3,-2.0 1,-0.1 4,-0.7 -0.743 24.8-118.6-103.9 155.0 28.9 51.6 -15.5 18 17 A E H >> S+ 0 0 113 -2,-0.3 4,-1.9 1,-0.3 3,-0.8 0.808 111.4 67.5 -57.3 -30.2 27.8 50.8 -19.1 19 18 A H H 3> S+ 0 0 106 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.776 90.5 64.1 -62.0 -24.9 31.2 51.9 -20.3 20 19 A E H <4 S+ 0 0 39 -3,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.854 104.6 45.1 -67.7 -34.1 32.7 48.9 -18.5 21 20 A L H X< S+ 0 0 9 -3,-0.8 3,-1.8 -4,-0.7 4,-0.5 0.911 110.3 53.5 -71.6 -43.3 30.7 46.6 -20.8 22 21 A K H >< S+ 0 0 143 -4,-1.9 3,-1.7 1,-0.3 4,-0.4 0.929 104.7 57.1 -54.3 -41.4 31.7 48.7 -23.9 23 22 A Q T 3< S+ 0 0 142 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.538 107.9 47.4 -70.6 -6.6 35.4 48.2 -22.8 24 23 A Q T <> S+ 0 0 64 -3,-1.8 4,-2.2 -4,-0.1 -1,-0.3 0.375 82.5 96.8-107.7 -1.6 34.9 44.4 -22.9 25 24 A Q H <> S+ 0 0 73 -3,-1.7 4,-2.1 -4,-0.5 216,-0.2 0.899 83.3 49.5 -59.3 -43.1 33.3 44.2 -26.3 26 25 A E H > S+ 0 0 150 -4,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.919 111.4 47.4 -63.1 -43.9 36.5 43.4 -28.2 27 26 A I H > S+ 0 0 65 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.888 110.1 54.1 -65.8 -37.7 37.6 40.6 -25.9 28 27 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.932 109.2 48.0 -59.9 -44.7 34.0 39.2 -26.1 29 28 A K H X S+ 0 0 101 -4,-2.1 4,-1.6 -5,-0.2 -2,-0.2 0.923 112.5 49.3 -60.7 -41.9 34.2 39.1 -29.9 30 29 A S H X S+ 0 0 61 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.934 113.0 46.2 -62.8 -48.0 37.7 37.4 -29.7 31 30 A I H X S+ 0 0 9 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.852 103.7 61.6 -69.9 -34.0 36.5 34.8 -27.2 32 31 A H H X S+ 0 0 29 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.940 109.1 44.2 -52.8 -46.4 33.4 34.0 -29.2 33 32 A K H X S+ 0 0 91 -4,-1.6 4,-2.9 2,-0.2 5,-0.3 0.926 109.2 55.7 -64.4 -42.9 35.8 33.0 -32.0 34 33 A T H X>S+ 0 0 25 -4,-2.2 5,-1.3 1,-0.2 4,-1.0 0.912 112.2 44.8 -52.6 -44.4 38.0 31.1 -29.6 35 34 A I H <5S+ 0 0 4 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.938 118.8 39.0 -65.1 -48.4 34.9 29.1 -28.5 36 35 A H H <5S+ 0 0 82 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.766 122.0 42.1 -84.4 -21.6 33.5 28.4 -32.0 37 36 A E H <5S- 0 0 120 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.511 101.4-129.7 -99.3 -8.9 36.8 27.7 -33.7 38 37 A G T <5 + 0 0 25 -4,-1.0 -3,-0.2 -5,-0.3 -4,-0.1 0.916 61.7 136.4 68.7 41.0 38.3 25.7 -30.9 39 38 A T < + 0 0 93 -5,-1.3 2,-0.2 -6,-0.3 -4,-0.1 0.382 49.2 69.2-105.6 2.2 41.5 27.7 -30.7 40 39 A G S > S- 0 0 22 -6,-0.7 3,-1.3 1,-0.2 370,-0.1 -0.475 95.9 -54.7-112.1-173.2 42.0 28.0 -27.0 41 40 A A T 3 S+ 0 0 51 1,-0.2 -1,-0.2 -2,-0.2 371,-0.1 -0.308 120.8 19.0 -61.5 142.6 42.7 25.9 -24.0 42 41 A G T > S+ 0 0 14 368,-0.1 3,-2.3 369,-0.1 -1,-0.2 0.628 76.0 145.3 74.1 14.5 40.5 22.8 -23.5 43 42 A S G X + 0 0 44 -3,-1.3 3,-0.7 1,-0.3 -2,-0.1 0.607 60.1 71.2 -66.2 -12.2 39.3 22.9 -27.1 44 43 A D G 3 S+ 0 0 124 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.498 95.8 56.0 -74.0 -5.1 39.1 19.1 -27.2 45 44 A F G < S+ 0 0 77 -3,-2.3 156,-0.4 1,-0.1 3,-0.3 -0.196 70.6 105.4-123.3 45.6 36.0 19.4 -24.8 46 45 A L X> + 0 0 25 -3,-0.7 3,-2.0 1,-0.2 4,-0.5 0.159 37.7 114.0-109.0 17.0 33.7 21.7 -26.9 47 46 A G H 3> + 0 0 14 152,-2.7 4,-1.0 1,-0.3 3,-0.3 0.777 68.5 66.4 -61.2 -26.1 31.2 19.0 -28.0 48 47 A W H 34 S+ 0 0 1 151,-0.5 -1,-0.3 -3,-0.3 -2,-0.1 0.692 85.6 72.1 -68.9 -19.6 28.5 20.6 -25.9 49 48 A V H <4 S+ 0 0 7 -3,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.938 115.3 19.1 -65.0 -48.3 28.4 23.8 -28.1 50 49 A D H >X S+ 0 0 57 -4,-0.5 4,-2.5 -3,-0.3 3,-2.2 0.466 95.2 106.4-101.9 -0.0 26.8 22.1 -31.1 51 50 A L H 3X + 0 0 22 -4,-1.0 4,-1.8 1,-0.3 -1,-0.2 0.834 69.7 64.8 -43.4 -44.0 25.3 19.1 -29.2 52 51 A P H 34 S+ 0 0 5 0, 0.0 -1,-0.3 0, 0.0 178,-0.2 0.730 119.4 24.1 -61.9 -21.3 21.7 20.4 -29.3 53 52 A V H <4 S+ 0 0 65 -3,-2.2 -2,-0.2 176,-0.1 -3,-0.1 0.654 126.8 45.4-108.8 -25.3 21.8 20.1 -33.1 54 53 A D H < S+ 0 0 118 -4,-2.5 -3,-0.2 2,-0.1 3,-0.1 0.398 77.4 129.3-101.5 0.3 24.4 17.4 -33.7 55 54 A Y S < S- 0 0 37 -4,-1.8 2,-0.7 -5,-0.3 153,-0.0 -0.146 73.8 -92.4 -57.6 152.2 23.4 14.8 -31.1 56 55 A D > - 0 0 88 1,-0.2 4,-2.1 2,-0.1 -1,-0.1 -0.538 36.3-166.1 -68.9 109.2 23.0 11.2 -32.3 57 56 A K H > S+ 0 0 141 -2,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.805 85.4 55.8 -71.6 -29.7 19.3 10.8 -33.1 58 57 A E H > S+ 0 0 153 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.928 110.2 45.5 -66.4 -45.2 19.4 7.0 -33.2 59 58 A E H > S+ 0 0 23 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.915 110.1 55.7 -61.4 -43.5 20.8 6.9 -29.7 60 59 A F H X S+ 0 0 14 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.933 106.8 49.5 -55.2 -45.9 18.2 9.5 -28.6 61 60 A S H X S+ 0 0 73 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.901 109.1 52.1 -61.0 -39.7 15.4 7.2 -29.9 62 61 A R H X S+ 0 0 86 -4,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.846 106.5 54.6 -63.9 -34.6 16.9 4.3 -28.0 63 62 A I H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.929 109.0 47.5 -62.5 -46.1 16.9 6.5 -24.8 64 63 A V H X S+ 0 0 37 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.959 113.1 48.4 -62.6 -45.7 13.2 7.2 -25.2 65 64 A E H X S+ 0 0 95 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.921 111.1 50.4 -59.9 -45.1 12.4 3.5 -25.8 66 65 A A H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.923 106.0 55.9 -60.5 -41.1 14.5 2.4 -22.8 67 66 A S H X S+ 0 0 14 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.884 109.0 47.8 -58.4 -36.1 12.7 4.9 -20.6 68 67 A K H X S+ 0 0 115 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.878 109.2 52.0 -71.5 -41.2 9.4 3.3 -21.6 69 68 A R H X S+ 0 0 105 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.905 109.5 50.6 -61.7 -40.1 10.6 -0.2 -21.0 70 69 A I H X S+ 0 0 1 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.900 106.3 54.3 -64.8 -42.4 11.7 0.8 -17.5 71 70 A K H < S+ 0 0 63 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.917 109.9 49.8 -54.1 -42.9 8.3 2.4 -16.7 72 71 A E H < S+ 0 0 146 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.861 123.6 25.4 -66.5 -33.8 6.8 -1.0 -17.6 73 72 A N H < S+ 0 0 44 -4,-1.6 2,-0.3 -5,-0.1 -1,-0.2 0.355 113.2 62.4-115.1 2.4 9.0 -3.2 -15.5 74 73 A S < - 0 0 11 -4,-1.7 59,-0.2 -3,-0.2 3,-0.1 -0.979 42.7-167.4-138.3 144.3 10.2 -1.0 -12.6 75 74 A D S S+ 0 0 81 57,-2.4 33,-2.7 -2,-0.3 2,-0.3 0.638 89.8 29.1 -88.9 -24.8 9.0 1.0 -9.6 76 75 A V E -ef 108 133B 0 56,-1.4 58,-1.8 31,-0.3 2,-0.5 -0.997 60.9-152.0-138.2 139.2 12.5 2.6 -9.2 77 76 A L E -ef 109 134B 0 31,-2.8 33,-2.4 -2,-0.3 2,-0.7 -0.979 19.3-152.9-105.5 120.0 15.5 3.6 -11.5 78 77 A V E -ef 110 135B 0 56,-2.9 58,-2.9 -2,-0.5 2,-0.6 -0.861 7.3-158.4 -91.7 118.8 18.7 3.5 -9.5 79 78 A V E -ef 111 136B 1 31,-3.1 33,-2.3 -2,-0.7 2,-0.6 -0.861 3.7-164.4 -99.2 121.8 21.2 5.9 -11.0 80 79 A I E +ef 112 137B 0 56,-2.7 58,-3.0 -2,-0.6 2,-0.3 -0.927 42.6 98.3-109.3 112.5 24.8 5.1 -10.1 81 80 A G - 0 0 2 31,-1.5 2,-0.3 -2,-0.6 58,-0.1 -0.960 48.7-143.1 177.0 163.9 27.1 8.0 -10.9 82 81 A I > - 0 0 41 56,-0.4 3,-2.1 -2,-0.3 32,-0.1 -0.943 62.3 -1.1-144.1 158.9 28.9 11.0 -9.3 83 82 A G G >> S+ 0 0 26 -2,-0.3 4,-2.5 1,-0.3 3,-2.0 -0.358 135.2 2.5 64.0-131.2 29.8 14.6 -10.4 84 83 A G G 34 S+ 0 0 10 1,-0.3 4,-0.4 2,-0.2 -1,-0.3 0.691 132.5 61.4 -63.1 -18.9 28.6 15.4 -13.9 85 84 A S G <4 S+ 0 0 19 -3,-2.1 -1,-0.3 53,-0.1 -2,-0.2 0.340 118.4 25.0 -87.9 7.9 27.1 11.9 -14.0 86 85 A Y T <> S+ 0 0 26 -3,-2.0 4,-2.3 -4,-0.1 5,-0.2 0.584 111.0 57.3-131.4 -54.2 24.8 12.7 -11.1 87 86 A L H X S+ 0 0 19 -4,-2.5 4,-2.8 1,-0.2 192,-0.2 0.823 100.3 53.0 -71.3 -37.7 23.9 16.3 -10.6 88 87 A G H > S+ 0 0 3 -4,-0.4 4,-2.5 -5,-0.3 -1,-0.2 0.939 113.5 45.3 -66.1 -41.5 22.5 17.4 -14.0 89 88 A A H > S+ 0 0 3 -5,-0.2 4,-2.9 2,-0.2 5,-0.3 0.942 115.1 46.8 -61.1 -48.0 19.9 14.5 -13.9 90 89 A R H X S+ 0 0 48 -4,-2.3 4,-2.6 1,-0.2 5,-0.3 0.928 112.1 51.2 -65.2 -38.7 19.0 15.2 -10.3 91 90 A A H X S+ 0 0 0 -4,-2.8 4,-2.1 184,-0.3 185,-0.3 0.942 114.2 43.6 -57.7 -50.6 18.7 19.0 -10.9 92 91 A A H X S+ 0 0 0 -4,-2.5 4,-1.5 -5,-0.2 -2,-0.2 0.928 114.3 48.9 -61.7 -48.0 16.4 18.4 -13.9 93 92 A I H X S+ 0 0 14 -4,-2.9 4,-1.0 1,-0.2 3,-0.3 0.938 115.1 43.0 -63.2 -43.9 14.3 15.8 -12.2 94 93 A E H < S+ 0 0 59 -4,-2.6 -1,-0.2 -5,-0.3 3,-0.2 0.864 114.3 50.6 -70.7 -32.8 13.7 17.8 -9.0 95 94 A X H < S+ 0 0 5 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.749 119.3 36.7 -74.8 -20.6 13.1 21.0 -10.9 96 95 A L H < S+ 0 0 18 -4,-1.5 2,-0.3 -3,-0.3 -1,-0.2 0.398 112.0 56.1-116.4 -1.4 10.5 19.4 -13.2 97 96 A T S < S- 0 0 46 -4,-1.0 4,-0.1 -3,-0.2 122,-0.0 -0.894 94.7 -70.5-131.8 167.7 8.7 16.9 -11.0 98 97 A S - 0 0 66 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.1 -0.113 27.4-134.8 -61.1 150.1 6.8 17.1 -7.7 99 98 A S S S+ 0 0 83 -4,-0.1 2,-0.4 2,-0.1 -1,-0.1 0.643 96.9 46.9 -74.9 -15.5 8.5 17.8 -4.4 100 99 A F S S- 0 0 149 0, 0.0 2,-1.3 0, 0.0 3,-0.2 -0.975 96.2-111.4-126.6 140.7 6.3 14.9 -2.9 101 100 A R + 0 0 125 -2,-0.4 3,-0.1 1,-0.2 -2,-0.1 -0.599 55.4 149.7 -77.7 98.8 5.8 11.6 -4.5 102 101 A N + 0 0 119 -2,-1.3 2,-0.4 1,-0.2 -1,-0.2 0.536 58.4 42.7-108.3 -14.1 2.1 11.9 -5.4 103 102 A S - 0 0 36 -3,-0.2 3,-0.3 3,-0.1 -1,-0.2 -0.999 52.2-162.4-135.1 139.8 1.9 9.7 -8.4 104 103 A N + 0 0 126 -2,-0.4 4,-0.1 1,-0.2 -1,-0.0 0.198 62.9 110.9-101.1 19.0 3.4 6.3 -9.2 105 104 A E S S+ 0 0 37 2,-0.1 -1,-0.2 1,-0.0 114,-0.1 0.896 81.7 34.2 -56.7 -41.2 2.9 6.7 -13.0 106 105 A Y S S- 0 0 80 -3,-0.3 112,-0.1 112,-0.1 -3,-0.1 -0.853 101.8 -91.0-115.9 151.5 6.7 7.0 -13.6 107 106 A P - 0 0 6 0, 0.0 -31,-0.3 0, 0.0 2,-0.3 -0.194 41.9-111.0 -57.2 144.6 9.5 5.2 -11.7 108 107 A E E -e 76 0B 50 -33,-2.7 -31,-2.8 -4,-0.1 2,-0.6 -0.594 31.1-136.6 -68.8 137.9 10.9 7.0 -8.7 109 108 A I E +e 77 0B 23 -2,-0.3 2,-0.3 -33,-0.2 -31,-0.2 -0.898 27.0 178.4-101.2 125.1 14.6 8.0 -9.5 110 109 A V E -e 78 0B 18 -33,-2.4 -31,-3.1 -2,-0.6 2,-0.4 -0.870 15.7-140.9-122.8 159.1 17.1 7.4 -6.8 111 110 A F E +e 79 0B 10 -2,-0.3 2,-0.3 -33,-0.2 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112.9 31.9 16.4 -23.6 201 200 A G > - 0 0 17 -2,-0.5 3,-1.9 -156,-0.4 4,-0.1 -0.406 30.4-102.5 -73.3 159.9 33.2 16.8 -20.1 202 201 A G G > S+ 0 0 33 1,-0.3 3,-2.1 2,-0.2 4,-0.2 0.860 118.3 51.3 -52.0 -51.3 31.1 15.7 -17.1 203 202 A R G 3 S+ 0 0 7 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.685 115.2 44.7 -68.6 -10.5 29.8 19.1 -15.9 204 203 A Y G < S+ 0 0 3 -3,-1.9 3,-0.3 1,-0.1 -1,-0.3 0.140 94.9 88.4-106.8 14.6 28.8 19.9 -19.5 205 204 A S X + 0 0 1 -3,-2.1 3,-2.1 1,-0.2 6,-0.8 0.384 44.2 104.7-101.3 5.8 27.1 16.5 -20.1 206 205 A V T 3 S+ 0 0 2 1,-0.3 6,-0.3 -3,-0.2 5,-0.3 0.832 83.0 51.4 -61.9 -30.9 23.6 16.8 -18.9 207 206 A L T 3 S+ 0 0 4 -3,-0.3 -1,-0.3 4,-0.2 2,-0.1 0.417 98.2 81.4 -88.2 3.4 22.1 16.9 -22.5 208 207 A T S X> S- 0 0 7 -3,-2.1 4,-2.5 -153,-0.0 3,-1.1 -0.358 113.4 -81.5 -86.4-175.9 24.0 13.7 -23.5 209 208 A A H 3> S+ 0 0 0 -14,-0.6 4,-2.1 1,-0.3 -13,-0.1 0.811 124.0 79.0 -59.1 -25.6 22.6 10.3 -22.5 210 209 A V H 34 S+ 0 0 3 -15,-0.3 -1,-0.3 -5,-0.2 -4,-0.2 0.918 112.5 16.5 -44.8 -55.1 24.2 11.0 -19.1 211 210 A G H <> S+ 0 0 0 -3,-1.1 4,-2.2 -6,-0.8 5,-0.2 0.853 120.1 65.6 -87.5 -35.4 21.3 13.2 -18.2 212 211 A L H X S+ 0 0 6 -4,-2.5 4,-2.6 -6,-0.3 5,-0.2 0.805 96.3 53.0 -64.1 -37.6 18.7 12.2 -20.8 213 212 A L H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.980 114.8 38.9 -67.2 -49.5 18.1 8.6 -19.8 214 213 A P H > S+ 0 0 0 0, 0.0 4,-1.6 0, 0.0 -2,-0.2 0.914 117.9 51.2 -64.7 -36.9 17.3 9.2 -16.1 215 214 A I H <>S+ 0 0 0 -4,-2.2 5,-1.7 1,-0.2 3,-0.2 0.944 112.1 45.5 -62.9 -46.5 15.3 12.4 -17.0 216 215 A A H ><5S+ 0 0 10 -4,-2.6 3,-1.9 1,-0.2 -1,-0.2 0.880 107.8 58.9 -62.1 -38.2 13.2 10.6 -19.6 217 216 A T H 3<5S+ 0 0 1 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.875 98.2 59.5 -63.7 -32.9 12.6 7.7 -17.2 218 217 A A T 3<5S- 0 0 11 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.465 125.9-100.9 -72.2 -1.1 11.0 10.2 -14.8 219 218 A G T < 5S+ 0 0 29 -3,-1.9 2,-0.2 1,-0.3 -3,-0.2 0.556 75.6 143.7 96.6 6.2 8.4 11.1 -17.4 220 219 A I < - 0 0 11 -5,-1.7 2,-1.1 1,-0.1 -1,-0.3 -0.588 58.0-113.9 -88.7 144.6 10.0 14.3 -18.5 221 220 A N > + 0 0 84 -2,-0.2 4,-1.6 1,-0.2 -1,-0.1 -0.615 34.1 178.3 -85.8 96.2 9.9 15.3 -22.2 222 221 A I H > S+ 0 0 5 -2,-1.1 4,-2.3 2,-0.2 5,-0.2 0.788 77.4 60.8 -72.5 -27.3 13.6 15.1 -23.4 223 222 A E H > S+ 0 0 123 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.964 107.5 44.7 -62.2 -44.0 12.7 16.0 -27.0 224 223 A A H > S+ 0 0 14 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.860 111.0 55.3 -67.5 -34.7 11.3 19.3 -25.8 225 224 A X H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.933 108.5 47.2 -60.6 -45.8 14.3 19.8 -23.5 226 225 A X H X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.889 109.2 53.9 -65.8 -38.9 16.7 19.4 -26.5 227 226 A I H X S+ 0 0 107 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.886 106.3 53.0 -60.8 -37.7 14.7 21.8 -28.6 228 227 A G H X S+ 0 0 3 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.881 109.0 49.7 -63.8 -38.8 15.0 24.4 -25.8 229 228 A A H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.913 110.5 49.6 -68.7 -38.2 18.8 24.0 -25.8 230 229 A A H X S+ 0 0 20 -4,-2.4 4,-2.1 -178,-0.2 -2,-0.2 0.855 107.0 55.2 -67.0 -33.0 18.8 24.4 -29.6 231 230 A K H X S+ 0 0 41 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.915 108.8 48.1 -66.4 -41.1 16.7 27.5 -29.2 232 231 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.927 108.4 53.8 -61.7 -43.4 19.3 29.0 -26.9 233 232 A R H < S+ 0 0 78 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.923 113.4 44.3 -56.9 -42.0 22.1 28.0 -29.3 234 233 A E H >< S+ 0 0 142 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.911 116.5 44.8 -67.2 -44.0 20.2 30.0 -32.0 235 234 A E H 3< S+ 0 0 41 -4,-2.8 3,-0.3 1,-0.2 -2,-0.2 0.704 114.7 48.6 -75.4 -19.6 19.4 33.0 -29.7 236 235 A L T 3< S+ 0 0 3 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.1 -0.060 78.2 105.7-112.0 30.7 22.9 33.2 -28.3 237 236 A S < + 0 0 78 -3,-0.9 2,-0.2 6,-0.1 -1,-0.2 0.548 51.0 104.8 -88.1 -8.1 24.9 33.0 -31.6 238 237 A S - 0 0 21 5,-0.3 -3,-0.0 -3,-0.3 5,-0.0 -0.533 57.6-154.7 -78.1 138.9 25.9 36.7 -31.8 239 238 A D + 0 0 44 -2,-0.2 2,-0.6 8,-0.0 -207,-0.2 0.412 69.6 103.6 -85.3 -0.0 29.5 37.8 -31.0 240 239 A K > - 0 0 98 1,-0.2 3,-1.7 3,-0.1 4,-0.2 -0.760 67.9-146.7 -85.0 118.8 28.1 41.2 -30.0 241 240 A L G > S+ 0 0 4 -2,-0.6 3,-1.9 1,-0.3 7,-0.3 0.914 99.0 54.2 -49.9 -45.3 28.0 41.6 -26.2 242 241 A E G 3 S+ 0 0 102 1,-0.3 -1,-0.3 5,-0.1 3,-0.1 0.731 111.2 47.5 -68.8 -14.0 24.9 43.8 -26.3 243 242 A E G < S+ 0 0 112 -3,-1.7 2,-0.4 1,-0.1 -5,-0.3 0.196 102.7 68.4-105.2 10.9 23.1 41.1 -28.4 244 243 A N <> - 0 0 0 -3,-1.9 4,-2.1 -4,-0.2 3,-0.2 -0.867 54.1-169.7-141.1 103.4 24.0 38.1 -26.2 245 244 A I H > S+ 0 0 19 -2,-0.4 4,-2.5 1,-0.2 5,-0.1 0.794 90.0 56.7 -67.3 -28.5 22.6 37.7 -22.7 246 245 A A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.905 110.8 45.0 -66.5 -37.7 25.0 34.7 -21.9 247 246 A Y H > S+ 0 0 0 2,-0.2 4,-2.6 -3,-0.2 -2,-0.2 0.864 110.0 54.2 -73.8 -34.8 27.9 37.0 -22.7 248 247 A Q H X S+ 0 0 24 -4,-2.1 4,-2.5 -7,-0.3 5,-0.2 0.942 110.7 46.5 -60.7 -48.0 26.5 39.8 -20.7 249 248 A Y H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.952 114.7 46.9 -57.4 -50.1 26.1 37.6 -17.7 250 249 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.898 113.5 48.7 -58.4 -43.9 29.7 36.3 -18.1 251 250 A T H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.910 110.0 49.8 -68.7 -40.7 31.1 39.8 -18.6 252 251 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.896 107.0 55.5 -66.3 -38.6 29.4 41.3 -15.6 253 252 A R H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.934 111.6 45.1 -56.1 -46.6 30.6 38.4 -13.3 254 253 A N H X S+ 0 0 24 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.854 110.5 53.3 -69.0 -34.6 34.2 39.3 -14.4 255 254 A I H X S+ 0 0 8 -4,-2.2 4,-0.8 2,-0.2 -1,-0.2 0.914 111.9 45.3 -61.5 -44.1 33.6 43.0 -14.0 256 255 A L H ><>S+ 0 0 0 -4,-2.7 5,-2.3 1,-0.2 3,-0.8 0.893 108.5 55.8 -71.0 -36.5 32.5 42.5 -10.4 257 256 A Y H ><5S+ 0 0 67 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.906 103.0 56.8 -59.1 -38.2 35.3 40.1 -9.7 258 257 A A H 3<5S+ 0 0 88 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.753 104.5 53.1 -66.5 -24.1 37.8 42.9 -10.7 259 258 A K T <<5S- 0 0 89 -4,-0.8 -1,-0.3 -3,-0.8 -2,-0.2 0.424 129.5 -94.5 -89.7 -0.4 36.2 45.1 -8.1 260 259 A G T < 5S+ 0 0 40 -3,-1.8 2,-1.1 -4,-0.3 -3,-0.2 0.590 79.3 138.3 100.6 8.8 36.7 42.5 -5.3 261 260 A Y < + 0 0 34 -5,-2.3 -1,-0.2 1,-0.2 59,-0.2 -0.781 21.9 167.4 -87.3 105.0 33.4 40.7 -5.3 262 261 A T + 0 0 57 -2,-1.1 34,-2.9 57,-0.5 2,-0.4 0.412 49.5 57.7-107.4 -0.8 34.7 37.2 -4.9 263 262 A T E -bc 296 320A 21 56,-1.9 58,-1.9 32,-0.2 2,-0.4 -0.997 60.0-163.6-132.3 127.1 31.7 35.0 -4.1 264 263 A E E -bc 297 321A 0 32,-2.0 34,-3.4 -2,-0.4 2,-0.6 -0.916 6.8-154.6-105.4 137.2 28.6 34.7 -6.2 265 264 A X E -bc 298 322A 8 56,-2.9 58,-2.2 -2,-0.4 2,-0.5 -0.944 7.1-149.5-107.6 116.4 25.3 33.3 -4.7 266 265 A L E -bc 299 323A 0 32,-2.1 34,-2.3 -2,-0.6 2,-0.4 -0.758 24.8-160.1 -78.7 126.5 23.0 31.7 -7.2 267 266 A I E -bc 300 324A 0 56,-2.8 58,-2.9 -2,-0.5 2,-0.3 -0.861 16.1-177.0-113.3 139.1 19.5 32.2 -5.7 268 267 A N E -bc 301 325A 0 32,-1.7 34,-3.0 -2,-0.4 58,-0.1 -0.866 23.4-151.3-120.3 167.2 16.2 30.5 -6.3 269 268 A Y S S+ 0 0 9 56,-0.5 32,-0.1 -2,-0.3 3,-0.1 -0.015 78.9 74.0-120.9 28.2 12.8 31.2 -4.9 270 269 A E S > S- 0 0 53 1,-0.1 3,-2.3 33,-0.0 4,-0.1 -0.973 70.7-143.4-142.5 127.3 11.6 27.5 -5.3 271 270 A P G > S+ 0 0 80 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.793 100.1 67.3 -59.9 -31.6 12.7 24.6 -3.0 272 271 A S G 3 S+ 0 0 14 1,-0.3 3,-0.4 2,-0.1 4,-0.2 0.601 90.3 65.7 -65.5 -10.2 12.7 22.3 -6.1 273 272 A X G <> + 0 0 1 -3,-2.3 4,-2.2 1,-0.2 -1,-0.3 0.279 67.4 103.9 -96.8 10.0 15.7 24.3 -7.5 274 273 A Q H <> S+ 0 0 85 -3,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.919 84.7 43.3 -55.5 -45.6 18.1 23.2 -4.8 275 274 A Y H > S+ 0 0 46 -3,-0.4 4,-2.4 1,-0.2 -184,-0.3 0.830 106.7 60.1 -76.8 -27.4 19.8 20.7 -7.0 276 275 A F H > S+ 0 0 0 -185,-0.3 4,-2.4 -4,-0.2 -1,-0.2 0.928 103.4 53.0 -56.9 -43.7 19.9 23.1 -9.9 277 276 A N H X S+ 0 0 2 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.900 109.2 49.2 -57.0 -40.3 21.9 25.4 -7.6 278 277 A E H X S+ 0 0 67 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.896 108.7 52.4 -67.5 -39.8 24.3 22.4 -7.1 279 278 A W H X S+ 0 0 7 -4,-2.4 4,-2.4 -192,-0.2 -1,-0.2 0.917 109.9 48.4 -59.6 -45.8 24.6 21.8 -10.8 280 279 A W H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 5,-0.4 0.887 108.1 55.4 -63.9 -38.3 25.5 25.4 -11.4 281 280 A K H X S+ 0 0 52 -4,-2.1 4,-2.4 -5,-0.2 5,-0.4 0.894 109.8 45.4 -63.6 -42.3 28.1 25.3 -8.6 282 281 A Q H X>S+ 0 0 32 -4,-2.0 4,-2.4 3,-0.2 5,-0.5 0.940 113.0 52.1 -63.6 -44.9 29.9 22.4 -10.2 283 282 A L H X5S+ 0 0 0 -4,-2.4 4,-1.3 -5,-0.2 -2,-0.2 0.962 122.6 27.7 -57.6 -54.1 29.7 24.1 -13.7 284 283 A F H X5S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 5,-0.3 0.931 122.6 50.4 -78.2 -40.1 31.3 27.4 -12.5 285 284 A G H X5S+ 0 0 23 -4,-2.4 4,-1.7 -5,-0.4 -3,-0.2 0.888 116.2 39.9 -65.1 -41.9 33.4 26.1 -9.6 286 285 A E H <5S+ 0 0 55 -4,-2.4 -1,-0.2 -5,-0.4 -2,-0.2 0.825 118.4 48.0 -81.2 -27.5 35.1 23.3 -11.6 287 286 A S H < + 0 0 16 -2,-2.2 3,-1.8 3,-0.3 -3,-0.0 -0.960 60.8 12.0-137.1 145.9 42.0 27.0 -11.5 291 290 A D T 3 S- 0 0 110 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.783 127.7 -62.1 58.8 28.1 45.5 28.5 -11.0 292 291 A F T 3 S+ 0 0 228 1,-0.3 -1,-0.3 -3,-0.1 2,-0.2 0.748 115.1 107.7 65.5 31.2 44.5 29.9 -7.6 293 292 A K < + 0 0 93 -3,-1.8 -3,-0.3 -5,-0.2 -1,-0.3 -0.731 33.9 82.3-123.5 170.0 41.8 32.1 -9.3 294 293 A G - 0 0 18 -2,-0.2 2,-0.2 -5,-0.2 -5,-0.1 0.100 68.6 -75.5 118.5 145.9 38.1 32.4 -9.6 295 294 A I - 0 0 9 -11,-0.1 -32,-0.2 1,-0.1 -7,-0.1 -0.534 50.6-121.9 -63.5 131.2 34.8 33.5 -8.1 296 295 A Y E -b 263 0A 157 -34,-2.9 -32,-2.0 -2,-0.2 2,-0.7 -0.687 25.9-134.0 -77.3 123.9 33.7 31.1 -5.4 297 296 A P E +b 264 0A 16 0, 0.0 2,-0.2 0, 0.0 -32,-0.2 -0.749 36.7 159.3 -88.5 118.8 30.3 29.7 -6.3 298 297 A S E -b 265 0A 34 -34,-3.4 -32,-2.1 -2,-0.7 2,-0.3 -0.553 14.3-168.7-121.1-173.9 27.8 29.7 -3.4 299 298 A S E -b 266 0A 17 -34,-0.3 2,-0.3 -2,-0.2 -32,-0.2 -0.989 9.0-160.5-169.6 161.5 24.0 29.5 -3.5 300 299 A A E -b 267 0A 1 -34,-2.3 -32,-1.7 -2,-0.3 2,-0.6 -0.989 18.8-132.7-154.2 159.3 20.8 29.8 -1.5 301 300 A N E > -b 268 0A 34 -2,-0.3 4,-3.1 -34,-0.2 2,-0.2 -0.958 46.6-115.3-113.0 112.5 17.1 28.8 -1.5 302 301 A Y T 4 S+ 0 0 5 -34,-3.0 60,-0.0 -2,-0.6 -2,-0.0 -0.669 81.2 9.9-102.3 158.4 14.8 31.8 -0.7 303 302 A T T >> S+ 0 0 52 -2,-0.2 3,-1.8 -33,-0.1 4,-0.5 -0.989 125.0 60.6 -80.8 -3.0 12.9 32.9 1.2 304 303 A T G >4 S+ 0 0 90 1,-0.3 3,-1.6 2,-0.2 -2,-0.2 0.907 107.6 45.3 -42.5 -57.1 14.0 29.9 3.4 305 304 A D G >X>S+ 0 0 29 -4,-3.1 4,-2.7 1,-0.3 3,-1.3 0.517 90.8 78.8 -77.2 -6.4 17.6 31.1 3.6 306 305 A L G <45S+ 0 0 40 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.661 97.1 53.2 -64.5 -15.2 16.7 34.7 4.2 307 306 A H G <<5S+ 0 0 162 -3,-1.6 -1,-0.2 -4,-0.5 -2,-0.2 0.272 121.9 25.9-100.4 8.0 16.2 33.2 7.7 308 307 A S T <45S+ 0 0 82 -3,-1.3 4,-0.2 0, 0.0 -2,-0.2 0.560 141.3 14.6-126.7 -49.6 19.7 31.6 7.9 309 308 A L T X5S+ 0 0 66 -4,-2.7 4,-3.0 2,-0.1 5,-0.2 0.498 101.2 92.1-104.2 -10.4 22.0 33.6 5.6 310 309 A G H > S+ 0 0 127 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.949 113.2 43.1 -56.0 -50.8 21.4 38.6 8.1 312 311 A Y H > S+ 0 0 100 -4,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.909 110.3 54.5 -66.6 -40.2 24.9 38.0 6.5 313 312 A V H < S+ 0 0 1 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.927 116.5 39.3 -63.7 -36.4 23.8 38.9 3.0 314 313 A Q H < S+ 0 0 58 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.863 137.9 9.0 -73.8 -36.6 22.5 42.3 4.3 315 314 A E H < S+ 0 0 143 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.248 101.8 92.3-140.3 11.5 25.2 43.1 6.8 316 315 A G S < S- 0 0 23 -4,-2.9 -4,-0.0 1,-0.3 -3,-0.0 -0.010 92.2 -33.2 -83.7-157.7 28.2 40.7 6.5 317 316 A R - 0 0 166 1,-0.1 2,-1.2 2,-0.1 3,-0.4 -0.345 57.8-127.3 -63.4 143.2 31.4 41.3 4.4 318 317 A R S S+ 0 0 83 1,-0.2 -1,-0.1 -3,-0.1 -5,-0.0 -0.368 82.7 100.5 -91.8 58.3 30.7 43.1 1.2 319 318 A F + 0 0 56 -2,-1.2 -56,-1.9 -58,-0.1 -57,-0.5 0.170 61.9 98.3-121.1 19.8 32.4 40.6 -1.2 320 319 A L E -c 263 0A 10 -3,-0.4 2,-0.3 -58,-0.2 -56,-0.2 -0.757 43.5-178.5-106.4 147.5 29.1 38.9 -2.3 321 320 A F E -c 264 0A 1 -58,-1.9 -56,-2.9 -2,-0.3 2,-0.4 -0.972 16.7-142.3-135.5 158.8 26.9 39.3 -5.4 322 321 A E E -cd 265 376A 0 53,-2.8 55,-2.3 -2,-0.3 2,-0.5 -0.943 10.9-166.7-120.2 139.3 23.6 37.5 -6.1 323 322 A T E -cd 266 377A 0 -58,-2.2 -56,-2.8 -2,-0.4 2,-0.5 -0.987 19.2-158.5-120.8 114.1 22.2 36.1 -9.4 324 323 A V E -cd 267 378A 3 53,-2.9 55,-3.5 -2,-0.5 2,-0.8 -0.833 9.2-155.4 -98.8 124.4 18.5 35.3 -8.9 325 324 A V E -cd 268 379A 2 -58,-2.9 -56,-0.5 -2,-0.5 2,-0.5 -0.887 23.8-170.7 -97.8 111.5 16.8 32.8 -11.2 326 325 A K E - d 0 380A 11 53,-2.2 55,-2.7 -2,-0.8 2,-0.4 -0.915 15.6-145.0-115.8 127.5 13.2 33.9 -10.9 327 326 A V E - d 0 381A 12 -2,-0.5 56,-0.1 53,-0.2 53,-0.1 -0.719 5.4-160.5 -93.6 132.5 10.3 31.9 -12.4 328 327 A N S S+ 0 0 108 53,-2.4 55,-0.2 -2,-0.4 -1,-0.1 0.908 74.7 39.4 -83.0 -40.8 7.4 34.0 -13.7 329 328 A H S S- 0 0 12 53,-2.0 55,-0.5 52,-0.2 -1,-0.2 -0.952 78.0-141.3-116.7 121.9 4.5 31.5 -13.8 330 329 A P - 0 0 12 0, 0.0 3,-0.1 0, 0.0 25,-0.0 -0.484 15.2-129.2 -81.8 153.1 4.0 28.9 -11.0 331 330 A K S S+ 0 0 102 1,-0.2 2,-0.3 -2,-0.2 52,-0.0 0.908 95.5 7.6 -66.3 -39.9 2.9 25.3 -11.6 332 331 A Y S S- 0 0 187 2,-0.0 2,-0.3 -3,-0.0 -1,-0.2 -0.978 70.6-163.4-133.1 153.4 0.2 25.7 -8.9 333 332 A D - 0 0 15 -2,-0.3 2,-0.4 -3,-0.1 441,-0.0 -0.926 4.0-154.4-132.3 167.2 -1.0 28.7 -7.0 334 333 A I - 0 0 105 -2,-0.3 20,-2.8 494,-0.0 2,-0.2 -1.000 16.3-128.1-143.3 129.5 -3.0 29.1 -3.8 335 334 A T B -I 353 0C 13 -2,-0.4 2,-0.6 18,-0.2 18,-0.2 -0.603 15.7-132.7 -81.3 140.3 -5.3 32.1 -2.7 336 335 A I - 0 0 38 16,-2.9 15,-3.1 13,-0.3 16,-0.2 -0.830 32.8-143.1 -88.9 123.6 -4.8 33.6 0.7 337 336 A E - 0 0 38 -2,-0.6 2,-0.5 13,-0.2 12,-0.1 -0.476 16.9-101.9 -89.3 159.1 -8.4 33.9 2.1 338 337 A K - 0 0 70 -2,-0.1 2,-0.4 12,-0.1 111,-0.1 -0.726 38.8-146.6 -76.2 124.4 -10.0 36.6 4.3 339 338 A D - 0 0 72 -2,-0.5 8,-0.1 1,-0.1 11,-0.1 -0.788 8.7-135.2 -94.4 139.4 -10.0 35.2 7.8 340 339 A S S S+ 0 0 87 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.845 102.0 31.2 -64.6 -32.3 -13.0 36.3 10.0 341 340 A D S S- 0 0 118 -3,-0.0 -1,-0.2 0, 0.0 4,-0.1 0.797 81.3-159.2 -96.2 -33.4 -10.9 37.1 13.2 342 341 A D > + 0 0 54 1,-0.1 3,-1.6 2,-0.1 5,-0.1 0.821 29.5 157.6 58.8 36.9 -7.7 38.3 11.6 343 342 A L T 3 S+ 0 0 162 1,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.885 72.6 51.3 -58.9 -35.7 -5.7 37.6 14.8 344 343 A D T 3 S- 0 0 108 1,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.470 107.0-127.0 -81.5 -2.6 -2.4 37.3 12.7 345 344 A G S X S+ 0 0 35 -3,-1.6 3,-0.7 1,-0.1 -2,-0.1 0.616 73.1 124.0 67.7 15.0 -3.1 40.7 11.0 346 345 A L G > + 0 0 71 1,-0.2 3,-2.6 2,-0.1 4,-0.3 0.408 32.4 102.2 -91.0 3.5 -2.6 39.1 7.5 347 346 A N G > + 0 0 33 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.733 67.2 75.0 -61.3 -15.9 -6.0 40.1 6.0 348 347 A Y G < S+ 0 0 169 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.1 0.746 97.5 51.2 -62.1 -16.6 -4.1 42.8 4.1 349 348 A L G X S+ 0 0 21 -3,-2.6 3,-2.6 -12,-0.1 -13,-0.3 0.517 80.9 126.3 -92.9 -7.5 -3.0 39.8 2.1 350 349 A A T < S+ 0 0 12 -3,-1.5 -13,-0.2 -4,-0.3 3,-0.1 -0.271 75.9 20.8 -58.5 135.2 -6.5 38.4 1.5 351 350 A G T 3 S+ 0 0 35 -15,-3.1 -1,-0.3 1,-0.5 2,-0.2 0.217 102.5 104.7 90.4 -18.2 -7.2 37.9 -2.2 352 351 A K < - 0 0 91 -3,-2.6 -16,-2.9 -16,-0.2 -1,-0.5 -0.508 69.5-124.9 -82.6 166.8 -3.5 37.8 -3.0 353 352 A T B > -I 335 0C 16 -18,-0.2 4,-2.0 -2,-0.2 -18,-0.2 -0.729 18.1-112.1-111.0 164.0 -2.0 34.4 -3.8 354 353 A I H > S+ 0 0 90 -20,-2.8 4,-2.5 -2,-0.3 5,-0.2 0.912 119.7 51.8 -60.4 -41.9 1.0 32.7 -2.2 355 354 A D H > S+ 0 0 22 -21,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.877 106.6 54.0 -61.9 -36.3 3.0 33.1 -5.4 356 355 A E H > S+ 0 0 97 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.880 109.0 48.5 -64.7 -36.9 2.2 36.8 -5.5 357 356 A V H X S+ 0 0 52 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.905 108.3 54.1 -67.7 -40.7 3.6 37.1 -2.0 358 357 A N H X S+ 0 0 29 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.921 107.5 52.2 -55.8 -42.1 6.7 35.2 -3.1 359 358 A T H X S+ 0 0 39 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.901 109.4 47.4 -65.4 -38.1 7.1 37.8 -5.9 360 359 A K H X S+ 0 0 137 -4,-1.7 4,-2.7 2,-0.2 5,-0.2 0.853 110.0 53.2 -72.6 -31.4 6.9 40.7 -3.5 361 360 A A H X S+ 0 0 30 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.949 111.0 48.1 -59.6 -48.9 9.4 39.0 -1.2 362 361 A F H X S+ 0 0 17 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.940 114.4 44.8 -57.3 -48.4 11.7 38.7 -4.2 363 362 A E H X S+ 0 0 77 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.917 114.2 48.2 -64.2 -44.8 11.3 42.3 -5.2 364 363 A G H X S+ 0 0 41 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.870 114.2 47.4 -62.7 -38.6 11.7 43.7 -1.6 365 364 A T H X S+ 0 0 19 -4,-2.5 4,-3.2 -5,-0.2 5,-0.4 0.901 107.0 56.1 -69.9 -43.5 14.8 41.5 -1.2 366 365 A L H X S+ 0 0 10 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.926 115.0 39.8 -52.1 -48.3 16.3 42.6 -4.6 367 366 A L H X S+ 0 0 91 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.920 115.4 50.5 -73.3 -41.3 16.0 46.2 -3.4 368 367 A A H X S+ 0 0 37 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.924 113.6 44.6 -60.7 -45.3 17.1 45.6 0.2 369 368 A H H <>S+ 0 0 6 -4,-3.2 5,-2.4 2,-0.2 4,-0.3 0.907 111.7 52.8 -72.1 -39.8 20.2 43.7 -0.8 370 369 A T H ><5S+ 0 0 4 -4,-2.0 3,-1.8 -5,-0.4 -1,-0.2 0.947 110.8 48.0 -52.2 -51.0 21.1 46.3 -3.5 371 370 A D H 3<5S+ 0 0 124 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.760 107.6 57.0 -62.8 -23.4 20.9 49.0 -0.8 372 371 A G T 3<5S- 0 0 21 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.394 127.8 -94.9 -89.9 3.2 23.0 46.9 1.5 373 372 A G T < 5S+ 0 0 18 -3,-1.8 -3,-0.2 -4,-0.3 -53,-0.2 0.694 83.3 128.5 94.2 22.7 25.9 46.7 -1.1 374 373 A V < - 0 0 0 -5,-2.4 -1,-0.2 -6,-0.1 -53,-0.2 -0.912 55.1-135.3-111.3 107.7 25.2 43.4 -2.8 375 374 A P - 0 0 0 0, 0.0 -53,-2.8 0, 0.0 2,-0.4 -0.421 26.3-161.5 -57.4 138.2 25.1 43.6 -6.6 376 375 A N E - d 0 322A 3 -55,-0.2 2,-0.3 -2,-0.1 -364,-0.2 -0.984 15.2-177.1-131.4 128.3 22.0 41.7 -7.9 377 376 A X E - d 0 323A 2 -55,-2.3 -53,-2.9 -2,-0.4 2,-0.5 -0.886 15.4-147.6-116.4 150.2 21.3 40.3 -11.4 378 377 A V E -Ad 8 324A 2 -370,-2.2 -370,-3.0 -2,-0.3 2,-0.7 -0.989 8.0-160.6-121.3 128.4 18.0 38.5 -12.3 379 378 A V E -Ad 7 325A 0 -55,-3.5 -53,-2.2 -2,-0.5 2,-0.5 -0.942 21.1-155.9-100.5 106.0 17.7 35.7 -14.8 380 379 A N E -Ad 6 326A 48 -374,-2.7 -374,-2.2 -2,-0.7 -53,-0.2 -0.767 13.6-177.1 -87.2 124.8 13.9 35.8 -15.5 381 380 A I E - d 0 327A 2 -55,-2.7 -53,-2.4 -2,-0.5 -52,-0.2 -0.911 26.1-133.4-124.0 148.2 12.6 32.5 -16.8 382 381 A P S S- 0 0 14 0, 0.0 -53,-2.0 0, 0.0 2,-0.3 0.906 71.0 -32.6 -75.3 -38.3 8.9 31.9 -17.9 383 382 A Q - 0 0 30 -55,-0.2 2,-1.4 -56,-0.1 5,-0.1 -0.959 65.7 -87.9-168.8 166.5 8.0 28.6 -16.2 384 383 A L S S+ 0 0 36 -55,-0.5 2,-0.3 -2,-0.3 -57,-0.0 -0.679 73.9 127.6 -90.8 83.3 9.5 25.3 -15.0 385 384 A D S > S- 0 0 22 -2,-1.4 4,-2.5 1,-0.1 5,-0.1 -0.778 71.9 -99.3-129.3 176.5 9.1 23.2 -18.2 386 385 A E H > S+ 0 0 44 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.893 118.7 52.1 -67.4 -41.0 11.4 21.1 -20.3 387 386 A E H > S+ 0 0 78 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.888 112.7 45.3 -62.2 -41.0 12.0 23.7 -23.0 388 387 A T H > S+ 0 0 1 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.889 111.5 53.7 -72.1 -40.1 13.0 26.4 -20.5 389 388 A F H X S+ 0 0 2 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.956 109.9 46.4 -58.5 -49.6 15.2 23.9 -18.6 390 389 A G H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.897 113.9 49.4 -57.5 -42.8 17.1 23.0 -21.8 391 390 A Y H X S+ 0 0 0 -4,-1.9 4,-2.8 -5,-0.2 -1,-0.2 0.935 111.7 47.8 -61.4 -49.0 17.4 26.7 -22.7 392 391 A V H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.898 109.5 52.6 -62.8 -43.9 18.7 27.6 -19.2 393 392 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.940 113.2 44.3 -56.6 -46.0 21.3 24.8 -19.1 394 393 A Y H X S+ 0 0 3 -4,-1.9 4,-2.9 1,-0.2 5,-0.3 0.934 110.9 54.6 -68.1 -45.4 22.7 25.9 -22.5 395 394 A F H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.927 112.7 42.5 -48.4 -52.5 22.7 29.5 -21.5 396 395 A F H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.901 112.0 53.2 -71.0 -34.7 24.8 28.8 -18.4 397 396 A E H X S+ 0 0 2 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.936 114.1 43.8 -59.5 -46.9 27.2 26.4 -20.2 398 397 A L H X S+ 0 0 2 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.917 113.2 50.3 -68.0 -41.6 27.9 29.0 -22.8 399 398 A A H X S+ 0 0 0 -4,-2.6 4,-3.0 -5,-0.3 -1,-0.2 0.911 109.1 53.6 -62.2 -37.0 28.2 31.8 -20.2 400 399 A C H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.913 107.4 50.0 -63.9 -43.5 30.6 29.6 -18.2 401 400 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.933 114.1 44.8 -58.3 -49.2 32.8 29.1 -21.3 402 401 A X H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.927 114.4 49.4 -61.6 -45.6 32.9 32.9 -22.0 403 402 A S H X S+ 0 0 0 -4,-3.0 4,-2.2 -5,-0.2 -2,-0.2 0.916 110.4 49.0 -61.5 -42.8 33.5 33.7 -18.3 404 403 A G H X>S+ 0 0 0 -4,-2.7 5,-2.1 1,-0.2 4,-1.5 0.913 111.5 49.1 -69.9 -41.4 36.4 31.2 -17.8 405 404 A Y H <5S+ 0 0 29 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.902 109.8 52.1 -63.5 -38.1 38.2 32.4 -20.9 406 405 A Q H <5S+ 0 0 33 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.905 108.0 52.2 -61.1 -40.0 37.8 36.0 -19.7 407 406 A L H <5S- 0 0 27 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.789 118.6-115.4 -63.9 -28.5 39.3 34.9 -16.4 408 407 A G T <5S+ 0 0 52 -4,-1.5 -3,-0.2 1,-0.3 2,-0.2 0.608 72.9 120.4 100.0 19.0 42.3 33.5 -18.3 409 408 A V S - 0 0 34 -2,-0.2 3,-0.7 1,-0.1 -368,-0.1 -0.843 35.1-164.7 -81.7 108.0 41.1 26.5 -19.2 411 410 A P T 3 S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -369,-0.1 0.579 77.7 52.9 -70.8 -7.9 37.3 26.2 -18.6 412 411 A F T 3 S+ 0 0 4 -371,-0.1 2,-0.2 -124,-0.0 -125,-0.1 0.394 92.9 69.4-118.8 4.1 37.2 22.6 -19.6 413 412 A N < - 0 0 46 -3,-0.7 -372,-0.0 -126,-0.2 -212,-0.0 -0.482 52.6-157.9-112.1-176.7 39.8 20.6 -17.5 414 413 A Q > + 0 0 78 -2,-0.2 3,-1.1 1,-0.0 4,-0.2 -0.294 25.5 155.7-160.3 64.7 40.0 19.7 -13.8 415 414 A P G > + 0 0 82 0, 0.0 3,-1.1 0, 0.0 4,-0.3 0.755 66.6 71.7 -72.8 -17.8 43.6 18.9 -12.7 416 415 A G G > S+ 0 0 65 1,-0.2 3,-0.7 2,-0.2 4,-0.5 0.704 83.5 66.6 -72.3 -20.9 42.9 19.8 -9.1 417 416 A V G <> S+ 0 0 39 -3,-1.1 4,-1.2 1,-0.2 -1,-0.2 0.667 85.6 74.8 -75.6 -11.0 40.8 16.7 -8.3 418 417 A E H <> S+ 0 0 88 -3,-1.1 4,-2.8 -4,-0.2 5,-0.3 0.835 82.9 66.2 -68.9 -32.3 43.8 14.4 -8.8 419 418 A A H <> S+ 0 0 64 -3,-0.7 4,-2.0 -4,-0.3 -1,-0.2 0.939 104.6 38.6 -63.3 -51.2 45.5 15.3 -5.5 420 419 A Y H > S+ 0 0 114 -4,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.890 116.2 54.8 -68.1 -32.5 42.9 13.8 -3.1 421 420 A K H X S+ 0 0 52 -4,-1.2 4,-3.0 2,-0.2 5,-0.2 0.933 108.4 46.9 -64.5 -47.5 42.4 10.8 -5.4 422 421 A Q H X S+ 0 0 52 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.903 114.0 48.3 -64.2 -37.8 46.1 9.9 -5.5 423 422 A N H X S+ 0 0 63 -4,-2.0 4,-2.7 -5,-0.3 -1,-0.2 0.917 112.0 48.7 -64.5 -43.5 46.3 10.2 -1.8 424 423 A X H X S+ 0 0 38 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.947 111.7 49.6 -62.4 -46.1 43.2 8.1 -1.2 425 424 A F H <>S+ 0 0 34 -4,-3.0 5,-2.5 1,-0.2 4,-0.3 0.922 112.0 49.0 -60.0 -45.1 44.6 5.4 -3.7 426 425 A A H ><5S+ 0 0 0 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 0.954 111.5 47.5 -59.3 -49.7 47.9 5.4 -1.8 427 426 A L H 3<5S+ 0 0 66 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.777 108.3 56.0 -64.2 -26.4 46.4 5.1 1.6 428 427 A L T 3<5S- 0 0 127 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.422 119.2-110.4 -85.4 0.6 44.1 2.2 0.4 429 428 A G T < 5 + 0 0 40 -3,-1.8 -3,-0.2 -4,-0.3 -2,-0.1 0.733 49.4 177.4 77.1 26.4 47.2 0.3 -0.8 430 429 A K > < - 0 0 94 -5,-2.5 3,-2.1 -6,-0.2 -1,-0.2 -0.384 40.9-100.9 -60.7 128.4 46.7 0.6 -4.5 431 430 A P T 3 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.249 108.3 29.0 -51.1 135.3 49.6 -1.1 -6.3 432 431 A G T 3 S+ 0 0 65 -3,-0.1 3,-0.3 -6,-0.0 4,-0.2 0.169 101.9 82.8 100.2 -17.6 52.2 1.4 -7.6 433 432 A F <> + 0 0 48 -3,-2.1 4,-2.5 1,-0.2 5,-0.2 0.109 52.0 115.5-105.4 22.4 51.4 4.0 -4.8 434 433 A E H > S+ 0 0 115 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.859 74.6 49.7 -62.7 -39.9 53.7 2.5 -2.1 435 434 A D H > S+ 0 0 137 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.930 114.1 46.0 -64.4 -45.7 56.1 5.4 -1.8 436 435 A L H > S+ 0 0 44 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.902 108.6 57.2 -63.0 -41.6 53.3 7.9 -1.5 437 436 A K H X S+ 0 0 67 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.936 107.1 47.3 -57.2 -47.7 51.5 5.7 1.1 438 437 A K H X S+ 0 0 137 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.929 112.2 50.2 -60.5 -45.0 54.5 5.7 3.4 439 438 A E H X S+ 0 0 119 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.892 113.6 44.9 -58.7 -44.9 54.9 9.4 3.1 440 439 A L H >< S+ 0 0 18 -4,-2.6 3,-1.2 1,-0.2 4,-0.5 0.885 107.1 58.1 -71.0 -36.1 51.3 10.1 3.9 441 440 A E H >< S+ 0 0 83 -4,-2.4 3,-1.3 1,-0.3 -1,-0.2 0.864 98.2 61.1 -62.0 -37.5 51.1 7.7 6.8 442 441 A E H 3< S+ 0 0 142 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.758 105.6 50.0 -56.5 -26.7 53.9 9.6 8.5 443 442 A R T << 0 0 202 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.511 360.0 360.0 -94.8 -6.3 51.6 12.6 8.5 444 443 A L < 0 0 177 -3,-1.3 -3,-0.0 -4,-0.5 0, 0.0 -0.527 360.0 360.0 -99.7 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S+ 0 0 0 -4,-2.5 4,-3.3 -5,-0.3 -1,-0.2 0.905 108.8 53.1 -62.4 -39.1 -28.2 33.6 -6.0 845 399 B C H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.3 0.932 107.8 49.0 -62.1 -44.4 -30.7 31.3 -7.7 846 400 B A H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.947 115.1 45.3 -59.6 -46.5 -32.8 30.9 -4.5 847 401 B X H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.933 114.7 47.7 -63.5 -46.1 -32.8 34.7 -4.0 848 402 B S H X S+ 0 0 0 -4,-3.3 4,-2.2 2,-0.2 -1,-0.2 0.894 111.2 50.1 -61.2 -44.9 -33.6 35.3 -7.7 849 403 B G H X>S+ 0 0 0 -4,-3.0 5,-2.2 1,-0.2 4,-1.4 0.924 111.0 48.6 -64.6 -44.0 -36.5 32.8 -7.8 850 404 B Y H <5S+ 0 0 30 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.880 110.3 52.1 -64.0 -35.5 -38.1 34.2 -4.7 851 405 B Q H <5S+ 0 0 33 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.909 108.1 51.7 -63.4 -38.5 -37.8 37.8 -6.2 852 406 B L H <5S- 0 0 28 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.812 117.6-117.2 -67.1 -25.7 -39.5 36.5 -9.4 853 407 B G T <5S+ 0 0 53 -4,-1.4 -3,-0.2 1,-0.3 2,-0.2 0.570 72.0 119.9 97.3 22.6 -42.3 35.1 -7.3 854 408 B V S - 0 0 34 -2,-0.2 3,-0.7 1,-0.1 -368,-0.1 -0.845 35.3-163.1 -81.6 108.3 -41.1 28.2 -6.2 856 410 B P T 3 S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -369,-0.1 0.596 78.5 52.5 -69.8 -7.4 -37.3 27.9 -6.9 857 411 B F T 3 S+ 0 0 5 -371,-0.1 2,-0.2 -124,-0.1 -125,-0.1 0.357 92.6 69.4-120.2 0.5 -37.2 24.3 -5.8 858 412 B N < - 0 0 48 -3,-0.7 -212,-0.0 -126,-0.2 -372,-0.0 -0.514 52.3-157.4-107.8-178.0 -39.8 22.2 -7.7 859 413 B Q > + 0 0 76 -2,-0.2 3,-1.0 1,-0.0 4,-0.3 -0.323 26.2 155.4-159.7 63.4 -40.2 21.2 -11.3 860 414 B P G > + 0 0 82 0, 0.0 3,-1.1 0, 0.0 4,-0.3 0.738 66.3 71.6 -69.0 -19.6 -43.8 20.4 -12.2 861 415 B G G > S+ 0 0 64 1,-0.3 3,-0.7 2,-0.2 4,-0.5 0.692 84.1 65.8 -73.1 -19.1 -43.4 21.1 -15.9 862 416 B V G <> S+ 0 0 38 -3,-1.0 4,-1.2 1,-0.2 -1,-0.3 0.669 85.6 74.9 -79.4 -12.4 -41.3 18.0 -16.6 863 417 B E H <> S+ 0 0 89 -3,-1.1 4,-2.6 -4,-0.3 5,-0.2 0.836 83.3 66.1 -65.3 -30.0 -44.3 15.7 -15.8 864 418 B A H <> S+ 0 0 65 -3,-0.7 4,-1.8 -4,-0.3 -1,-0.2 0.932 104.6 39.6 -64.8 -48.7 -46.1 16.5 -19.1 865 419 B Y H > S+ 0 0 115 -4,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.902 115.7 54.1 -69.1 -34.4 -43.7 14.9 -21.6 866 420 B K H X S+ 0 0 45 -4,-1.2 4,-3.0 1,-0.2 5,-0.2 0.930 107.7 48.1 -64.1 -47.5 -43.1 12.0 -19.2 867 421 B Q H X S+ 0 0 76 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.880 113.8 48.0 -61.4 -37.3 -46.8 11.1 -18.9 868 422 B N H X S+ 0 0 63 -4,-1.8 4,-2.5 -5,-0.2 -1,-0.2 0.912 112.1 49.1 -69.7 -40.6 -47.2 11.3 -22.7 869 423 B X H X S+ 0 0 38 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.952 111.7 48.9 -63.1 -44.8 -44.1 9.1 -23.2 870 424 B F H <>S+ 0 0 33 -4,-3.0 5,-2.7 1,-0.2 4,-0.2 0.914 112.7 48.7 -59.6 -43.2 -45.4 6.5 -20.6 871 425 B A H ><5S+ 0 0 0 -4,-2.2 3,-1.7 -5,-0.2 -1,-0.2 0.950 111.7 47.5 -62.1 -49.2 -48.8 6.4 -22.3 872 426 B L H 3<5S+ 0 0 66 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.775 108.5 56.3 -66.2 -24.7 -47.4 6.0 -25.8 873 427 B L T 3<5S- 0 0 133 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.419 119.8-110.2 -86.5 -0.9 -45.1 3.2 -24.6 874 428 B G T < 5 + 0 0 40 -3,-1.7 -3,-0.2 -4,-0.2 -2,-0.1 0.761 49.7 177.0 80.3 25.6 -48.1 1.3 -23.3 875 429 B K > < - 0 0 95 -5,-2.7 3,-1.9 -6,-0.2 -1,-0.2 -0.419 41.6-100.4 -61.8 131.0 -47.4 1.8 -19.5 876 430 B P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.261 107.8 29.2 -53.7 136.1 -50.3 0.1 -17.6 877 431 B G T 3 S+ 0 0 64 -3,-0.1 3,-0.2 -6,-0.0 4,-0.1 0.266 101.4 82.7 98.9 -10.8 -52.8 2.7 -16.4 878 432 B F <> + 0 0 37 -3,-1.9 4,-2.5 -8,-0.1 5,-0.2 0.062 51.5 118.1-113.2 22.8 -52.2 5.2 -19.2 879 433 B E H > S+ 0 0 113 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.864 74.1 48.1 -63.3 -39.4 -54.5 3.5 -21.8 880 434 B D H > S+ 0 0 130 2,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.947 113.7 47.0 -69.2 -44.8 -57.0 6.4 -22.2 881 435 B L H > S+ 0 0 44 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.905 108.4 57.0 -58.7 -42.2 -54.2 9.0 -22.6 882 436 B K H X S+ 0 0 60 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.921 108.0 47.3 -53.6 -45.4 -52.4 6.6 -25.1 883 437 B K H X S+ 0 0 148 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.934 112.1 49.5 -62.9 -46.4 -55.6 6.6 -27.3 884 438 B E H X S+ 0 0 121 -4,-2.2 4,-0.5 1,-0.2 -2,-0.2 0.920 114.2 45.3 -58.1 -47.8 -55.9 10.4 -27.1 885 439 B L H >X S+ 0 0 16 -4,-2.9 3,-1.4 1,-0.2 4,-0.5 0.889 106.5 56.8 -68.5 -39.8 -52.3 10.9 -28.1 886 440 B E H >< S+ 0 0 87 -4,-2.5 3,-1.2 1,-0.3 -1,-0.2 0.861 98.9 62.6 -63.1 -31.3 -52.2 8.4 -30.9 887 441 B E H 3< S+ 0 0 154 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.772 103.9 50.1 -56.7 -31.6 -55.1 10.3 -32.6 888 442 B R H << 0 0 201 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.506 360.0 360.0 -90.6 -7.8 -52.8 13.3 -32.9 889 443 B L << 0 0 177 -3,-1.2 -1,-0.2 -4,-0.5 -2,-0.2 0.441 360.0 360.0-100.8 360.0 -49.8 11.5 -34.4