==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 02-FEB-10 2X4U . COMPND 2 MOLECULE: HLA CLASS I HISTOCOMPATIBILITY ANTIGEN, A-2 . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.H.N.CELIE,M.TOEBES,B.RODENKO,H.OVAA,A.PERRAKIS, . 768 6 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37012.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 504 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 271 35.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.6 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 . 1 0.1 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 . 52 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 114 14.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.0 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 1 0 0 0 0 0 2 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 4 14 3 5 0 8 0 4 6 2 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 4 4 0 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 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 1 A G 0 0 54 0, 0.0 106,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-178.3 20.5 19.9 17.4 2 2 A S - 0 0 76 104,-0.1 2,-0.3 103,-0.1 102,-0.2 -0.410 360.0-160.4 -84.9 163.4 17.0 18.4 17.0 3 3 A H E -A 103 0A 24 100,-2.0 100,-2.7 -2,-0.1 2,-0.3 -0.920 5.1-162.0-139.9 166.2 15.8 15.2 18.8 4 4 A S E -A 102 0A 7 -2,-0.3 25,-2.6 98,-0.2 2,-0.4 -0.988 12.0-154.0-146.5 152.1 13.1 12.6 18.5 5 5 A M E +AB 101 28A 0 96,-2.0 96,-1.6 -2,-0.3 2,-0.4 -1.000 26.4 175.6-123.9 134.2 11.3 9.9 20.5 6 6 A R E -AB 100 27A 74 21,-2.5 21,-3.1 -2,-0.4 2,-0.4 -0.999 20.3-157.0-143.6 139.9 9.9 7.0 18.5 7 7 A Y E -AB 99 26A 1 92,-2.8 92,-1.9 -2,-0.4 2,-0.4 -0.959 10.8-161.1-116.4 135.9 8.1 3.8 19.3 8 8 A F E -AB 98 25A 26 17,-3.1 17,-2.5 -2,-0.4 2,-0.4 -0.959 5.8-171.2-120.3 131.4 8.1 0.9 16.8 9 9 A F E -AB 97 24A 0 88,-2.9 88,-2.4 -2,-0.4 2,-0.4 -0.984 4.0-175.3-128.1 130.5 5.6 -2.0 17.0 10 10 A T E -AB 96 23A 3 13,-2.7 13,-2.9 -2,-0.4 2,-0.4 -0.994 1.9-176.5-127.1 129.5 5.6 -5.2 15.0 11 11 A S E -AB 95 22A 2 84,-2.8 84,-2.9 -2,-0.4 2,-0.5 -0.993 2.0-175.0-128.8 127.7 2.9 -7.8 15.1 12 12 A V E -AB 94 21A 5 9,-2.5 9,-2.4 -2,-0.4 82,-0.2 -0.963 19.1-137.0-130.5 116.5 3.0 -11.1 13.3 13 13 A S - 0 0 22 80,-2.0 6,-0.1 -2,-0.5 80,-0.0 -0.407 13.4-167.5 -66.8 146.1 0.3 -13.7 13.1 14 14 A R > - 0 0 47 4,-0.5 3,-2.2 78,-0.1 78,-0.1 -0.545 12.8-152.9-136.0 66.9 1.4 -17.3 13.5 15 15 A P T 3 S+ 0 0 40 0, 0.0 4,-0.1 0, 0.0 77,-0.1 -0.149 80.7 1.0 -51.4 125.0 -1.5 -19.6 12.4 16 16 A G T 3 S+ 0 0 89 2,-0.1 3,-0.1 1,-0.1 74,-0.0 0.077 118.0 82.9 86.6 -24.2 -1.4 -22.9 14.2 17 17 A R S < S- 0 0 149 -3,-2.2 2,-0.1 1,-0.3 -1,-0.1 -0.170 101.5-102.5-107.3 38.1 1.8 -21.9 16.1 18 18 A G S S+ 0 0 55 2,-0.0 -4,-0.5 3,-0.0 -1,-0.3 -0.351 71.3 1.7 88.3-160.3 0.0 -20.0 18.9 19 19 A E S S- 0 0 114 1,-0.1 2,-0.1 -2,-0.1 3,-0.0 -0.168 83.6 -89.2 -61.7 156.7 -0.5 -16.3 19.6 20 20 A P - 0 0 22 0, 0.0 -7,-0.3 0, 0.0 2,-0.2 -0.457 44.4-111.5 -65.6 139.8 0.7 -13.6 17.3 21 21 A R E -B 12 0A 63 -9,-2.4 -9,-2.5 -2,-0.1 2,-0.4 -0.516 36.4-169.1 -68.2 138.8 4.3 -12.4 18.0 22 22 A F E +B 11 0A 3 -11,-0.2 16,-2.6 -2,-0.2 2,-0.4 -0.971 7.8 178.4-136.8 121.6 4.3 -8.8 19.3 23 23 A I E -BC 10 37A 9 -13,-2.9 -13,-2.7 -2,-0.4 2,-0.4 -0.984 3.8-174.2-126.7 132.2 7.4 -6.7 19.6 24 24 A A E +BC 9 36A 2 12,-2.6 12,-2.2 -2,-0.4 2,-0.3 -0.979 4.0 178.7-124.8 137.4 7.7 -3.2 20.8 25 25 A V E -BC 8 35A 2 -17,-2.5 -17,-3.1 -2,-0.4 2,-0.4 -0.998 11.2-155.7-137.7 142.8 10.8 -1.0 20.9 26 26 A G E -BC 7 34A 0 8,-2.1 7,-2.7 -2,-0.3 8,-1.1 -0.956 11.0-172.2-120.9 139.8 11.4 2.6 22.0 27 27 A Y E -BC 6 32A 29 -21,-3.1 -21,-2.5 -2,-0.4 2,-0.5 -0.962 21.8-157.3-127.7 142.2 14.1 5.0 20.9 28 28 A V E > S-BC 5 31A 0 3,-2.6 3,-2.4 -2,-0.4 -23,-0.2 -0.994 82.5 -45.4-108.6 119.5 15.4 8.5 21.8 29 29 A D T 3 S- 0 0 23 -25,-2.6 -23,-0.1 -2,-0.5 -26,-0.1 -0.396 125.9 -24.0 53.1-123.9 17.2 9.6 18.7 30 30 A D T 3 S+ 0 0 55 -2,-0.1 2,-0.6 149,-0.1 -1,-0.3 0.154 119.4 98.7-101.5 21.2 19.3 6.6 17.7 31 31 A T E < -C 28 0A 18 -3,-2.4 -3,-2.6 148,-0.0 2,-0.2 -0.922 65.6-141.4-115.4 115.8 19.4 5.1 21.2 32 32 A Q E +C 27 0A 33 -2,-0.6 -5,-0.3 -5,-0.2 3,-0.1 -0.505 25.6 168.2 -71.5 138.5 17.0 2.3 22.2 33 33 A F E + 0 0 0 -7,-2.7 15,-2.5 1,-0.3 16,-0.7 0.587 57.4 23.6-127.2 -18.3 15.7 2.6 25.8 34 34 A V E -CD 26 47A 0 -8,-1.1 -8,-2.1 13,-0.3 -1,-0.3 -0.985 53.9-179.0-144.8 160.5 12.9 0.1 26.1 35 35 A R E -CD 25 46A 55 11,-1.8 11,-2.9 -2,-0.3 2,-0.3 -0.987 10.4-166.1-149.4 158.6 11.5 -3.2 24.7 36 36 A F E -C 24 0A 4 -12,-2.2 -12,-2.6 -2,-0.3 2,-0.4 -0.968 8.2-174.4-141.5 132.4 8.6 -5.6 25.1 37 37 A D E > -C 23 0A 25 7,-0.3 3,-1.2 -2,-0.3 6,-0.4 -0.978 19.7-152.2-129.5 120.3 8.6 -9.1 23.5 38 38 A S T 3 S+ 0 0 23 -16,-2.6 -15,-0.1 -2,-0.4 -1,-0.1 0.742 99.2 53.4 -58.3 -24.8 5.5 -11.3 23.7 39 39 A D T 3 S+ 0 0 83 -17,-0.2 -1,-0.3 -3,-0.1 -16,-0.1 0.646 89.5 93.7 -88.3 -16.8 7.8 -14.3 23.5 40 40 A A S < S- 0 0 35 -3,-1.2 3,-0.1 1,-0.1 -4,-0.0 -0.259 81.5-119.3 -72.3 167.3 10.1 -13.3 26.4 41 41 A A S S+ 0 0 105 1,-0.2 -1,-0.1 2,-0.1 -3,-0.0 0.824 100.0 63.3 -79.4 -33.7 9.4 -14.6 29.9 42 42 A S S S- 0 0 50 2,-0.1 -1,-0.2 1,-0.1 3,-0.1 0.840 75.8-154.4 -65.3 -37.1 8.9 -11.4 31.8 43 43 A Q + 0 0 81 -6,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.809 59.3 113.6 59.2 30.8 5.8 -10.1 30.0 44 44 A R S S- 0 0 85 -7,-0.1 -7,-0.3 23,-0.0 2,-0.3 -0.922 81.2-102.2-126.4 152.6 7.0 -6.7 31.1 45 45 A M - 0 0 4 15,-0.4 -9,-0.2 -2,-0.3 19,-0.2 -0.621 51.8-157.5 -63.4 131.7 8.3 -3.5 29.4 46 46 A E E -D 35 0A 47 -11,-2.9 -11,-1.8 -2,-0.3 2,-0.2 -0.896 14.4-109.1-123.3 149.8 12.0 -3.8 30.0 47 47 A P E +D 34 0A 49 0, 0.0 -13,-0.3 0, 0.0 -14,-0.1 -0.491 27.7 174.1 -76.0 143.7 14.9 -1.2 30.2 48 48 A R + 0 0 89 -15,-2.5 -14,-0.2 -2,-0.2 -16,-0.1 0.189 66.2 57.1-129.8 9.5 17.5 -1.2 27.4 49 49 A A S >> S- 0 0 4 -16,-0.7 3,-1.3 1,-0.1 4,-0.8 -0.995 77.1-129.2-143.5 144.7 19.4 1.9 28.5 50 50 A P G >4 S+ 0 0 90 0, 0.0 3,-0.5 0, 0.0 4,-0.4 0.833 104.5 59.3 -62.7 -34.5 21.1 2.7 31.8 51 51 A W G 34 S+ 0 0 30 1,-0.2 125,-0.1 2,-0.1 -18,-0.0 0.519 107.3 45.5 -78.5 -5.8 19.4 6.1 32.2 52 52 A I G X4 S+ 0 0 0 -3,-1.3 3,-1.6 -19,-0.1 -1,-0.2 0.564 90.7 85.6-106.1 -14.6 15.9 4.6 32.2 53 53 A E T << S+ 0 0 107 -4,-0.8 3,-0.4 -3,-0.5 -2,-0.1 0.752 87.4 51.1 -59.6 -30.1 16.8 1.8 34.6 54 54 A Q T 3 S+ 0 0 173 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.088 75.2 112.4 -99.8 25.6 16.2 3.8 37.8 55 55 A E S < S- 0 0 49 -3,-1.6 4,-0.2 1,-0.1 -1,-0.2 0.894 74.3-124.5 -66.1 -42.0 12.8 5.1 36.7 56 56 A G > - 0 0 27 -3,-0.4 4,-2.0 -4,-0.2 3,-0.4 -0.209 23.9 -72.2 112.6 155.8 10.8 3.1 39.4 57 57 A P H > S+ 0 0 102 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.814 124.5 57.6 -53.8 -39.4 8.0 0.6 39.7 58 58 A E H > S+ 0 0 154 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.937 108.9 46.1 -60.7 -46.5 5.3 3.1 38.8 59 59 A Y H > S+ 0 0 8 -3,-0.4 4,-2.7 -4,-0.2 5,-0.2 0.969 117.3 42.5 -56.6 -55.3 6.9 3.9 35.5 60 60 A W H X S+ 0 0 25 -4,-2.0 4,-2.5 1,-0.2 -15,-0.4 0.895 114.5 49.1 -65.0 -43.7 7.5 0.2 34.6 61 61 A D H X S+ 0 0 91 -4,-3.2 4,-2.5 2,-0.2 -1,-0.2 0.922 113.2 49.6 -58.0 -45.6 4.1 -1.0 35.7 62 62 A G H X S+ 0 0 8 -4,-2.4 4,-2.6 -5,-0.3 -2,-0.2 0.933 112.5 44.8 -61.3 -47.6 2.5 1.8 33.7 63 63 A E H X S+ 0 0 3 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.885 112.6 52.9 -66.3 -37.2 4.5 1.1 30.5 64 64 A T H X S+ 0 0 5 -4,-2.5 4,-1.8 -5,-0.2 -2,-0.2 0.929 109.7 48.2 -61.3 -46.7 3.8 -2.6 31.0 65 65 A R H X S+ 0 0 135 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.962 115.7 44.1 -57.3 -52.9 0.0 -1.9 31.3 66 66 A K H X S+ 0 0 15 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.900 111.1 52.0 -63.1 -41.7 0.0 0.3 28.2 67 67 A V H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.823 107.7 53.7 -68.2 -28.6 2.2 -2.0 26.0 68 68 A K H X S+ 0 0 107 -4,-1.8 4,-2.2 -5,-0.2 -1,-0.2 0.865 106.3 52.4 -68.3 -37.4 -0.1 -4.9 26.8 69 69 A A H X S+ 0 0 41 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.899 108.9 50.2 -64.0 -42.3 -3.0 -2.7 25.6 70 70 A H H X S+ 0 0 2 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.919 109.1 52.6 -57.3 -46.3 -1.1 -2.1 22.4 71 71 A S H X S+ 0 0 32 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.892 109.7 47.4 -59.9 -42.5 -0.5 -5.9 22.1 72 72 A Q H X S+ 0 0 143 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.941 110.2 51.3 -65.1 -48.3 -4.2 -6.7 22.4 73 73 A T H X S+ 0 0 22 -4,-2.3 4,-2.3 1,-0.2 313,-0.2 0.901 112.2 48.1 -54.9 -43.1 -5.3 -4.0 19.9 74 74 A H H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.889 105.5 57.0 -67.6 -38.8 -2.8 -5.4 17.4 75 75 A R H X S+ 0 0 117 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.927 112.2 43.1 -57.1 -43.0 -3.9 -9.0 18.0 76 76 A V H >X S+ 0 0 82 -4,-2.2 4,-2.2 1,-0.2 3,-0.6 0.888 107.4 60.3 -67.3 -42.6 -7.4 -7.9 17.0 77 77 A D H 3X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.3 5,-0.3 0.873 98.1 58.7 -52.5 -43.4 -6.1 -5.8 14.1 78 78 A L H 3X S+ 0 0 13 -4,-2.1 4,-1.5 1,-0.2 -1,-0.3 0.875 109.2 44.7 -56.0 -39.6 -4.6 -8.9 12.5 79 79 A G H S+ 0 0 88 -4,-1.5 5,-2.6 -5,-0.3 -1,-0.2 0.901 111.5 48.0 -58.0 -38.3 -7.5 -10.5 7.2 83 83 A G H ><5S+ 0 0 48 -4,-1.5 3,-1.1 3,-0.2 -2,-0.2 0.905 107.1 52.2 -69.1 -45.7 -11.2 -9.7 6.9 84 84 A Y H 3<5S+ 0 0 77 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.891 119.9 36.6 -56.9 -39.1 -10.9 -6.5 5.0 85 85 A Y T 3<5S- 0 0 71 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.311 105.4-127.8 -99.2 6.8 -8.7 -8.3 2.4 86 86 A N T < 5 + 0 0 152 -3,-1.1 2,-0.2 1,-0.2 -3,-0.2 0.912 49.3 166.3 43.2 55.8 -10.6 -11.6 2.5 87 87 A Q < - 0 0 52 -5,-2.6 -1,-0.2 -6,-0.1 2,-0.0 -0.663 40.8 -97.6 -98.4 155.3 -7.4 -13.6 3.2 88 88 A S > - 0 0 82 -2,-0.2 3,-0.8 1,-0.1 -1,-0.1 -0.354 23.3-129.7 -69.0 150.8 -7.2 -17.2 4.4 89 89 A E T 3 S+ 0 0 146 1,-0.2 -1,-0.1 -2,-0.0 -7,-0.0 0.428 100.0 72.2 -81.2 4.3 -6.7 -17.8 8.1 90 90 A A T 3 S+ 0 0 79 2,-0.1 -1,-0.2 -75,-0.0 2,-0.2 0.686 81.5 81.5 -92.5 -21.4 -3.8 -20.1 7.3 91 91 A G S < S- 0 0 27 -3,-0.8 2,-0.4 -77,-0.1 -4,-0.0 -0.471 77.8-118.0 -88.4 156.6 -1.2 -17.5 6.1 92 92 A S - 0 0 39 -2,-0.2 2,-0.3 -78,-0.1 -78,-0.1 -0.770 33.5-174.4 -92.4 136.9 1.1 -15.4 8.3 93 93 A H - 0 0 13 -2,-0.4 -80,-2.0 -80,-0.0 2,-0.4 -0.905 13.8-136.2-131.0 161.7 0.7 -11.6 8.1 94 94 A T E -A 12 0A 3 -2,-0.3 25,-3.4 -82,-0.2 2,-0.4 -0.951 10.8-171.8-124.5 132.2 2.5 -8.5 9.4 95 95 A V E -AE 11 118A 0 -84,-2.9 -84,-2.8 -2,-0.4 2,-0.4 -0.971 10.7-172.9-115.6 135.6 1.3 -5.3 11.0 96 96 A Q E -AE 10 117A 0 21,-2.4 21,-3.1 -2,-0.4 2,-0.4 -0.982 3.9-177.4-128.5 141.8 3.7 -2.5 11.8 97 97 A R E +AE 9 116A 7 -88,-2.4 -88,-2.9 -2,-0.4 2,-0.4 -1.000 2.3 179.2-137.5 136.1 3.1 0.8 13.6 98 98 A M E +AE 8 115A 24 17,-2.6 17,-3.4 -2,-0.4 2,-0.3 -0.997 8.5 162.6-135.7 132.9 5.4 3.7 14.3 99 99 A Y E +AE 7 114A 4 -92,-1.9 -92,-2.8 -2,-0.4 2,-0.3 -0.985 11.8 120.2-143.7 158.8 4.7 6.9 16.1 100 100 A G E -AE 6 113A 0 13,-2.0 13,-2.2 -2,-0.3 2,-0.3 -0.976 41.0-104.2 169.8-177.7 6.7 9.7 17.7 101 101 A a E -AE 5 112A 0 -96,-1.6 -96,-2.0 -2,-0.3 2,-0.4 -0.953 14.7-144.2-137.3 151.5 7.6 13.3 17.9 102 102 A D E -AE 4 111A 15 9,-3.2 8,-3.3 -2,-0.3 9,-1.3 -0.924 12.4-166.0-113.8 141.5 10.4 15.6 16.9 103 103 A V E -AE 3 109A 0 -100,-2.7 -100,-2.0 -2,-0.4 6,-0.2 -0.906 17.7-125.4-119.2 156.0 11.7 18.7 18.8 104 104 A G > - 0 0 7 4,-2.2 3,-2.4 -2,-0.3 -101,-0.1 -0.134 44.1 -82.1 -84.9-172.8 14.0 21.4 17.6 105 105 A S T 3 S+ 0 0 90 1,-0.3 -103,-0.1 2,-0.1 -1,-0.1 0.701 134.5 58.0 -65.5 -18.0 17.2 22.6 19.1 106 106 A D T 3 S- 0 0 106 2,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.338 115.7-120.8 -89.3 5.2 15.0 24.7 21.4 107 107 A W < + 0 0 36 -3,-2.4 2,-0.3 1,-0.2 -2,-0.1 0.697 68.5 139.7 60.4 20.4 13.4 21.4 22.5 108 108 A R - 0 0 81 1,-0.1 -4,-2.2 2,-0.0 -1,-0.2 -0.733 67.1 -83.3 -91.6 145.5 10.1 22.8 21.3 109 109 A F E +E 103 0A 52 -2,-0.3 -6,-0.3 -6,-0.2 -1,-0.1 -0.160 49.9 170.0 -47.5 128.3 7.6 20.6 19.4 110 110 A L E - 0 0 83 -8,-3.3 2,-0.3 1,-0.4 -7,-0.2 0.773 58.4 -32.0-107.9 -51.2 8.6 20.4 15.7 111 111 A R E -E 102 0A 131 -9,-1.3 -9,-3.2 49,-0.1 -1,-0.4 -0.979 48.5-146.7-168.0 158.4 6.3 17.6 14.3 112 112 A G E -E 101 0A 9 -2,-0.3 2,-0.3 16,-0.3 -11,-0.2 -0.877 13.8-170.1-130.8 164.0 4.6 14.4 15.2 113 113 A Y E -E 100 0A 29 -13,-2.2 -13,-2.0 -2,-0.3 2,-0.3 -0.995 15.4-173.9-155.7 152.5 3.8 11.3 13.2 114 114 A H E +E 99 0A 5 12,-0.4 12,-2.6 -2,-0.3 2,-0.3 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-80,-2.2 -80,-0.1 2,-0.4 -0.898 13.1-136.7-131.1 162.0 29.9 51.2 24.8 481 94 D T E -X 399 0H 3 -2,-0.3 25,-3.5 -82,-0.2 2,-0.4 -0.955 10.3-170.9-126.2 129.6 28.1 48.2 26.3 482 95 D V E -XB 398 505H 0 -84,-2.8 -84,-2.5 -2,-0.4 2,-0.4 -0.944 11.5-170.0-112.8 141.3 29.3 45.1 28.0 483 96 D Q E -XB 397 504H 0 21,-2.7 21,-3.0 -2,-0.4 2,-0.4 -0.991 6.2-178.5-133.4 140.0 27.0 42.2 28.8 484 97 D R E +XB 396 503H 6 -88,-2.4 -88,-3.2 -2,-0.4 2,-0.4 -1.000 1.8 178.9-139.1 133.4 27.4 39.1 30.9 485 98 D M E +XB 395 502H 22 17,-2.6 17,-3.3 -2,-0.4 2,-0.3 -0.999 10.2 160.1-133.2 129.3 25.0 36.2 31.6 486 99 D Y E +XB 394 501H 1 -92,-1.7 -92,-3.1 -2,-0.4 2,-0.3 -0.973 10.6 122.0-141.4 162.6 25.7 33.2 33.7 487 100 D G E -XB 393 500H 0 13,-1.8 13,-2.1 -2,-0.3 2,-0.3 -0.979 38.0-112.8 171.4-173.1 23.7 30.6 35.5 488 101 D d E -XB 392 499H 0 -96,-1.8 -96,-2.6 -2,-0.3 2,-0.3 -0.976 11.6-142.4-148.1 156.4 22.8 26.9 36.0 489 102 D D E -XB 391 498H 11 9,-2.6 8,-3.0 -2,-0.3 9,-1.2 -0.920 9.2-160.6-119.7 146.9 20.0 24.4 35.5 490 103 D V E -XB 390 496H 0 -100,-2.3 -100,-2.0 -2,-0.3 6,-0.2 -0.906 19.6-123.1-119.3 155.6 18.9 21.5 37.6 491 104 D G > - 0 0 2 4,-2.4 3,-1.0 -2,-0.3 -101,-0.2 -0.034 43.2 -82.1 -80.1-170.8 16.8 18.5 36.5 492 105 D S T 3 S+ 0 0 46 1,-0.3 -1,-0.1 2,-0.1 -103,-0.0 0.859 136.0 52.6 -60.2 -36.7 13.5 17.3 37.9 493 106 D D T 3 S- 0 0 78 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.607 119.3-116.9 -72.2 -12.3 15.6 15.5 40.5 494 107 D W < + 0 0 48 -3,-1.0 2,-0.2 1,-0.3 -2,-0.1 0.645 67.7 144.7 77.1 18.0 17.3 18.8 41.2 495 108 D R - 0 0 179 1,-0.1 -4,-2.4 2,-0.0 -1,-0.3 -0.578 65.1 -84.1 -77.7 149.3 20.6 17.4 40.1 496 109 D F E +B 490 0H 47 -6,-0.2 -6,-0.3 -2,-0.2 -1,-0.1 -0.299 51.5 172.1 -51.0 133.4 23.0 19.7 38.2 497 110 D L E - 0 0 15 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.742 56.0 -24.8-114.6 -49.3 22.0 19.7 34.5 498 111 D R E -B 489 0H 81 -9,-1.2 -9,-2.6 49,-0.1 -1,-0.4 -0.979 48.5-148.9-163.5 157.5 24.1 22.3 32.8 499 112 D G E -B 488 0H 8 16,-0.3 2,-0.3 -2,-0.3 -11,-0.2 -0.908 15.8-172.3-128.2 158.1 26.1 25.5 33.5 500 113 D Y E -B 487 0H 30 -13,-2.1 -13,-1.8 -2,-0.3 2,-0.3 -0.998 15.5-176.2-154.4 149.9 26.7 28.5 31.2 501 114 D H E +B 486 0H 1 12,-0.4 12,-2.9 -2,-0.3 2,-0.4 -0.888 14.9 177.0-150.0 112.3 28.7 31.7 31.1 502 115 D Q E -BC 485 512H 48 -17,-3.3 -17,-2.6 -2,-0.3 2,-0.4 -0.938 7.2-170.6-125.4 144.5 28.4 34.2 28.2 503 116 D Y E -BC 484 511H 0 8,-1.8 7,-2.5 -2,-0.4 8,-1.5 -0.990 5.3-175.3-136.6 136.8 30.0 37.6 27.6 504 117 D A E -BC 483 509H 0 -21,-3.0 -21,-2.7 -2,-0.4 2,-0.5 -0.984 14.2-152.1-137.3 147.0 29.2 40.1 24.9 505 118 D Y E > S-BC 482 508H 13 3,-2.2 3,-1.0 -2,-0.3 -23,-0.2 -0.979 80.8 -12.7-120.3 128.6 30.6 43.5 23.7 506 119 D D T 3 S- 0 0 14 -25,-3.5 159,-0.7 -2,-0.5 -1,-0.2 0.905 130.9 -49.3 46.8 50.5 28.4 46.1 22.0 507 120 D G T 3 S+ 0 0 2 -26,-0.3 2,-0.4 1,-0.2 -1,-0.2 0.591 117.9 105.7 77.3 13.0 25.6 43.7 21.5 508 121 D K E < S-C 505 0H 130 -3,-1.0 -3,-2.2 216,-0.1 -1,-0.2 -0.966 80.1 -95.4-131.2 139.8 27.7 40.9 20.0 509 122 D D E +C 504 0H 92 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.223 45.1 165.8 -45.2 132.8 29.1 37.6 21.2 510 123 D Y E - 0 0 2 -7,-2.5 13,-2.8 1,-0.3 14,-0.5 0.671 61.0 -12.0-118.7 -59.0 32.6 38.1 22.6 511 124 D I E -CD 503 522H 2 -8,-1.5 -8,-1.8 11,-0.2 2,-0.4 -0.987 60.0-171.6-150.8 141.0 33.5 35.0 24.6 512 125 D A E -CD 502 521H 14 9,-1.6 9,-2.3 -2,-0.3 2,-0.4 -0.988 26.9-120.5-136.9 140.9 31.6 32.0 25.9 513 126 D L E - D 0 520H 12 -12,-2.9 -12,-0.4 -2,-0.4 7,-0.2 -0.636 39.7-124.7 -72.8 129.1 32.2 29.0 28.2 514 127 D K > - 0 0 106 5,-2.3 3,-2.4 -2,-0.4 5,-0.1 -0.300 27.6 -98.1 -74.0 163.9 31.6 25.8 26.2 515 128 D E T 3 S+ 0 0 184 1,-0.3 -16,-0.3 2,-0.1 -1,-0.1 0.798 122.2 60.7 -52.3 -34.3 29.2 23.2 27.4 516 129 D D T 3 S- 0 0 83 1,-0.1 -1,-0.3 -18,-0.1 -3,-0.0 0.661 99.7-136.1 -69.8 -15.8 32.0 21.1 29.0 517 130 D L S < S+ 0 0 5 -3,-2.4 27,-0.3 2,-0.2 -2,-0.1 0.739 85.3 89.0 64.8 25.3 32.8 24.1 31.3 518 131 D R S S+ 0 0 156 1,-0.1 2,-0.2 -4,-0.1 22,-0.2 0.557 85.3 31.2-122.7 -20.0 36.5 23.4 30.6 519 132 D S - 0 0 37 -5,-0.1 -5,-2.3 21,-0.1 2,-0.3 -0.778 69.1-118.6-138.9 179.3 37.2 25.6 27.5 520 133 D W E -D 513 0H 9 -2,-0.2 2,-0.5 -7,-0.2 -7,-0.2 -0.845 2.7-145.0-128.3 155.7 36.2 28.8 25.7 521 134 D T E -D 512 0H 71 -9,-2.3 -9,-1.6 -2,-0.3 2,-0.4 -0.940 19.9-158.2-121.4 107.5 34.8 30.0 22.4 522 135 D A E -D 511 0H 23 -2,-0.5 -11,-0.2 -11,-0.2 6,-0.1 -0.712 8.2-154.2 -88.2 132.5 36.2 33.3 21.2 523 136 D A S S- 0 0 55 -13,-2.8 2,-0.2 -2,-0.4 -1,-0.1 0.797 70.2 -14.1 -76.6 -30.1 34.1 35.3 18.8 524 137 D D S > S- 0 0 61 -14,-0.5 4,-0.7 1,-0.0 -14,-0.0 -0.791 85.3 -68.8-154.0-164.1 37.0 37.2 17.1 525 138 D M H >> S+ 0 0 162 -2,-0.2 4,-0.9 2,-0.2 3,-0.7 0.908 126.6 47.9 -69.1 -45.0 40.7 38.2 17.3 526 139 D A H >> S+ 0 0 16 1,-0.3 4,-1.2 2,-0.2 3,-0.7 0.891 108.0 56.6 -61.5 -40.0 40.3 40.5 20.3 527 140 D A H 3> S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.717 96.5 66.9 -64.2 -21.4 38.4 37.8 22.1 528 141 D Q H S+ 0 0 1 -4,-3.0 5,-2.0 2,-0.2 6,-0.4 0.836 109.5 58.1 -78.0 -32.2 41.5 33.1 31.0 535 148 D E H <5S+ 0 0 80 -4,-2.3 3,-0.5 -5,-0.3 -1,-0.2 0.875 111.3 43.5 -61.1 -37.1 42.9 29.7 29.8 536 149 D A H <5S+ 0 0 74 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.769 111.6 52.8 -79.2 -27.8 46.1 30.5 31.7 537 150 D A T <5S- 0 0 34 -4,-1.2 -1,-0.2 -5,-0.1 -2,-0.2 0.388 105.3-128.2 -88.5 3.1 44.3 31.9 34.7 538 151 D H T >5 + 0 0 109 -3,-0.5 4,-1.2 -4,-0.4 -3,-0.2 0.862 55.7 152.0 50.5 40.7 42.3 28.7 35.0 539 152 D V H >< + 0 0 7 -5,-2.0 4,-2.3 1,-0.2 5,-0.2 0.847 64.6 61.6 -67.6 -34.6 39.1 30.8 35.1 540 153 D A H > S+ 0 0 3 -6,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.905 101.3 51.8 -58.4 -43.7 37.1 28.0 33.6 541 154 D E H > S+ 0 0 82 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.896 109.2 50.9 -59.9 -41.4 37.9 25.7 36.6 542 155 D Q H X S+ 0 0 72 -4,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.914 111.9 46.4 -63.2 -43.6 36.7 28.4 38.9 543 156 D L H X S+ 0 0 2 -4,-2.3 4,-3.4 2,-0.2 5,-0.3 0.901 109.2 53.7 -66.0 -43.7 33.4 28.8 37.0 544 157 D R H X S+ 0 0 44 -4,-2.7 4,-2.4 -27,-0.3 5,-0.2 0.888 108.5 51.3 -57.8 -39.8 32.8 25.1 36.9 545 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