==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PLASMA PROTEIN 29-AUG-00 1E7G . COMPND 2 MOLECULE: SERUM ALBUMIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.A.BHATTACHARYA,T.GRUENE,S.CURRY . 582 1 17 17 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30186.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 457 78.5 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 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 . 13 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 15.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 341 58.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 1 1 0 2 1 3 2 0 0 0 1 3 3 1 2 3 1 0 0 0 1 1 0 0 0 0 1 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A H 0 0 162 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-175.5 61.9 15.2 9.7 2 4 A K + 0 0 133 1,-0.2 2,-0.4 2,-0.0 4,-0.0 0.689 360.0 40.5 -87.7 -22.2 64.8 13.5 11.6 3 5 A S > - 0 0 1 1,-0.1 4,-1.2 2,-0.1 -1,-0.2 -0.952 55.0-176.0-134.8 114.3 62.7 13.4 14.8 4 6 A E H > S+ 0 0 74 56,-0.5 4,-2.3 58,-0.5 5,-0.2 0.885 91.1 49.2 -70.4 -42.1 59.0 12.6 14.9 5 7 A V H > S+ 0 0 5 55,-0.4 4,-2.9 57,-0.3 5,-0.2 0.968 110.4 47.4 -61.1 -59.2 58.9 13.2 18.7 6 8 A A H > S+ 0 0 4 54,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.861 113.4 53.0 -51.7 -36.1 60.6 16.6 18.6 7 9 A H H X S+ 0 0 95 -4,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.921 109.3 44.7 -67.2 -47.6 58.2 17.4 15.8 8 10 A R H X S+ 0 0 43 -4,-2.3 4,-1.4 2,-0.2 5,-0.4 0.892 113.4 53.0 -63.8 -41.2 55.0 16.5 17.6 9 11 A F H >X S+ 0 0 18 -4,-2.9 4,-3.4 1,-0.2 3,-1.0 0.985 106.8 51.2 -55.9 -61.6 56.3 18.4 20.7 10 12 A K H 3< S+ 0 0 135 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.836 120.3 32.1 -46.9 -46.9 57.0 21.6 18.8 11 13 A D H 3< S+ 0 0 73 -4,-1.8 -1,-0.3 -5,-0.1 270,-0.2 0.548 124.0 46.4 -94.6 -3.6 53.6 21.9 17.1 12 14 A L H << S- 0 0 36 -4,-1.4 4,-0.3 -3,-1.0 -3,-0.2 0.856 102.7-132.4 -96.4 -51.5 51.6 20.3 19.9 13 15 A G X - 0 0 25 -4,-3.4 4,-2.8 -5,-0.4 5,-0.3 -0.032 22.4 -89.7 108.0 146.4 53.1 22.1 22.9 14 16 A E H > S+ 0 0 74 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.884 124.5 52.3 -54.6 -41.3 54.4 20.9 26.2 15 17 A E H > S+ 0 0 123 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.943 116.9 34.1 -61.0 -54.9 50.9 21.2 27.8 16 18 A N H > S+ 0 0 33 -4,-0.3 4,-2.2 2,-0.2 5,-0.2 0.823 113.8 60.4 -72.9 -32.4 48.9 19.3 25.2 17 19 A F H X S+ 0 0 13 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.947 107.9 44.9 -58.5 -49.8 51.8 16.8 24.6 18 20 A K H X S+ 0 0 44 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 0.891 110.8 52.3 -62.8 -43.7 51.7 15.7 28.2 19 21 A A H X S+ 0 0 5 -4,-1.6 4,-2.5 1,-0.2 -1,-0.2 0.912 114.5 44.1 -60.4 -41.6 47.9 15.4 28.4 20 22 A L H X S+ 0 0 26 -4,-2.2 4,-3.2 2,-0.2 -2,-0.2 0.887 108.1 54.3 -72.6 -42.7 47.9 13.2 25.3 21 23 A V H X S+ 0 0 19 -4,-2.6 4,-2.3 -5,-0.2 5,-0.2 0.920 113.0 48.5 -57.9 -38.1 50.9 11.0 26.3 22 24 A L H X S+ 0 0 6 -4,-2.0 4,-2.7 -5,-0.2 5,-0.2 0.983 112.0 44.9 -63.2 -60.0 48.9 10.4 29.5 23 25 A I H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.905 113.1 54.2 -50.8 -44.8 45.6 9.6 27.8 24 26 A A H X S+ 0 0 14 -4,-3.2 4,-0.8 1,-0.2 3,-0.4 0.941 112.1 40.1 -55.5 -57.6 47.5 7.4 25.3 25 27 A F H >X S+ 0 0 6 -4,-2.3 4,-3.4 1,-0.2 3,-0.7 0.873 111.8 58.7 -61.9 -37.6 49.2 5.2 27.9 26 28 A A H 3< S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.828 103.3 53.0 -62.2 -31.2 46.0 5.2 30.1 27 29 A Q H 3< S+ 0 0 4 -4,-1.6 3,-0.3 -3,-0.4 -1,-0.3 0.734 118.7 34.9 -77.2 -21.6 44.1 3.7 27.2 28 30 A Y H << S+ 0 0 11 -4,-0.8 2,-0.9 -3,-0.7 -2,-0.2 0.866 123.7 39.3 -96.5 -50.5 46.7 0.8 26.8 29 31 A L >< + 0 0 0 -4,-3.4 3,-0.6 1,-0.1 -1,-0.2 -0.605 69.6 161.3-100.5 70.3 47.7 0.2 30.4 30 32 A Q T 3 + 0 0 14 -2,-0.9 -1,-0.1 -3,-0.3 -4,-0.1 0.303 68.3 53.1 -75.4 10.3 44.3 0.6 32.0 31 33 A Q T 3 S+ 0 0 105 2,-0.1 -1,-0.2 -3,-0.0 -2,-0.1 0.617 81.8 101.0-115.6 -23.5 45.3 -1.3 35.2 32 34 A C S < S- 0 0 8 -3,-0.6 2,-0.1 1,-0.1 5,-0.1 -0.304 80.1-101.1 -65.8 147.0 48.4 0.6 36.3 33 35 A P >> - 0 0 52 0, 0.0 3,-2.0 0, 0.0 4,-1.1 -0.382 27.8-114.8 -70.1 147.4 48.1 3.2 39.1 34 36 A F H >> S+ 0 0 23 1,-0.3 4,-2.3 2,-0.2 3,-1.3 0.903 114.5 58.0 -44.3 -56.7 47.9 6.9 38.2 35 37 A E H 34 S+ 0 0 128 1,-0.3 4,-0.4 2,-0.2 -1,-0.3 0.719 103.5 56.9 -50.6 -22.4 51.3 7.7 39.9 36 38 A D H <> S+ 0 0 79 -3,-2.0 4,-1.1 2,-0.2 -1,-0.3 0.849 107.7 44.4 -79.7 -35.8 52.8 5.2 37.6 37 39 A H H XX S+ 0 0 1 -3,-1.3 4,-2.5 -4,-1.1 3,-0.7 0.931 105.6 61.1 -72.0 -46.6 51.6 6.9 34.4 38 40 A V H 3X S+ 0 0 52 -4,-2.3 4,-1.1 1,-0.3 -1,-0.2 0.739 104.6 52.4 -52.1 -23.2 52.6 10.3 35.7 39 41 A K H 3> S+ 0 0 86 -4,-0.4 4,-2.4 -5,-0.3 -1,-0.3 0.863 108.2 47.6 -82.2 -38.6 56.1 8.9 35.8 40 42 A L H X S+ 0 0 54 -4,-1.2 3,-2.3 -5,-0.3 4,-1.5 0.990 107.8 51.0 -66.8 -63.0 63.0 12.6 26.2 48 50 A A H 3X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.3 -2,-0.2 0.839 108.9 53.3 -43.9 -41.4 61.0 14.7 23.7 49 51 A K H 3X S+ 0 0 80 -4,-1.9 4,-0.9 1,-0.2 -1,-0.3 0.775 103.5 58.4 -68.5 -24.2 62.8 17.8 25.1 50 52 A T H < - 0 0 84 -4,-1.1 3,-2.0 -5,-0.1 -1,-0.3 -0.787 58.2-165.1-152.2 100.6 69.2 17.9 19.2 55 57 A E T 3 S+ 0 0 61 1,-0.3 -4,-0.1 -2,-0.3 -3,-0.1 0.680 96.2 56.0 -59.1 -17.2 67.3 16.0 16.5 56 58 A S T 3 S+ 0 0 101 -5,-0.1 -1,-0.3 4,-0.1 5,-0.1 0.554 76.0 125.1 -92.2 -11.6 70.4 13.7 16.3 57 59 A A S X S- 0 0 24 -3,-2.0 3,-2.3 -7,-0.2 4,-0.2 -0.228 80.5 -76.7 -50.9 134.6 70.3 12.8 20.0 58 60 A E T 3 S+ 0 0 154 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.094 114.4 6.7 -35.9 139.0 70.2 9.0 20.3 59 61 A N T > S+ 0 0 70 -3,-0.1 3,-1.3 1,-0.1 -1,-0.3 0.246 94.2 111.3 68.7 -12.0 66.8 7.3 19.6 60 62 A a T < S+ 0 0 0 -3,-2.3 -56,-0.5 1,-0.3 -55,-0.4 0.685 72.3 60.5 -64.2 -17.6 65.3 10.6 18.4 61 63 A D T 3 S+ 0 0 117 -4,-0.2 -1,-0.3 -58,-0.2 -3,-0.1 0.684 81.7 105.9 -82.9 -21.0 65.2 9.1 14.9 62 64 A K S < S- 0 0 70 -3,-1.3 -58,-0.5 1,-0.1 -57,-0.3 -0.184 78.0-104.2 -60.6 152.1 62.9 6.2 15.9 63 65 A S > - 0 0 43 1,-0.1 4,-2.5 -59,-0.1 5,-0.2 -0.345 27.4-114.4 -74.1 158.5 59.2 6.2 14.8 64 66 A L H > S+ 0 0 30 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.904 116.7 53.4 -61.0 -43.2 56.5 7.0 17.4 65 67 A H H > S+ 0 0 31 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.865 112.0 47.2 -60.1 -35.0 55.0 3.5 17.2 66 68 A T H > S+ 0 0 26 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.911 114.8 43.6 -73.4 -44.1 58.5 2.1 17.9 67 69 A L H X S+ 0 0 29 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.936 115.7 49.7 -66.3 -45.8 59.3 4.4 20.8 68 70 A F H X S+ 0 0 40 -4,-3.4 4,-2.3 1,-0.2 3,-0.4 0.972 112.7 44.4 -57.2 -59.9 55.8 3.9 22.3 69 71 A G H X S+ 0 0 0 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.822 110.2 58.9 -55.9 -31.0 55.8 0.1 22.1 70 72 A D H < S+ 0 0 63 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.921 108.1 43.3 -65.0 -44.8 59.4 0.2 23.5 71 73 A K H >X S+ 0 0 57 -4,-2.1 3,-2.3 -3,-0.4 4,-0.6 0.904 108.9 57.8 -67.9 -42.0 58.3 2.0 26.6 72 74 A L H >< S+ 0 0 1 -4,-2.3 3,-1.3 1,-0.3 -1,-0.2 0.892 102.2 55.9 -54.7 -40.7 55.2 -0.2 27.1 73 75 A b T 3< S+ 0 0 43 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.309 95.2 69.7 -76.1 10.0 57.5 -3.2 27.2 74 76 A T T <4 + 0 0 84 -3,-2.3 2,-0.5 -5,-0.1 -1,-0.3 0.682 67.1 106.2 -97.7 -25.0 59.4 -1.5 30.0 75 77 A V X< - 0 0 24 -3,-1.3 3,-1.4 -4,-0.6 4,-0.3 -0.423 58.9-160.3 -58.7 107.9 56.5 -2.0 32.5 76 78 A A T 3 S+ 0 0 98 -2,-0.5 3,-0.5 1,-0.3 4,-0.3 0.834 88.2 51.9 -63.0 -36.9 58.0 -4.8 34.6 77 79 A T T 3> S+ 0 0 74 1,-0.2 4,-3.4 2,-0.1 5,-0.4 0.161 80.9 105.4 -87.4 20.2 54.6 -5.9 36.0 78 80 A L H <>>S+ 0 0 7 -3,-1.4 4,-2.9 2,-0.2 5,-1.5 0.953 80.8 43.5 -62.5 -53.0 53.3 -6.1 32.5 79 81 A R H 45S+ 0 0 144 -3,-0.5 -1,-0.2 -4,-0.3 4,-0.2 0.891 120.6 42.3 -60.5 -43.3 53.4 -9.9 32.3 80 82 A E H 45S+ 0 0 86 -4,-0.3 -2,-0.2 2,-0.1 -1,-0.2 0.951 123.9 34.9 -70.4 -50.3 51.9 -10.2 35.8 81 83 A T H <5S+ 0 0 68 -4,-3.4 -3,-0.2 1,-0.1 -2,-0.2 0.923 140.3 12.8 -71.3 -47.7 49.3 -7.5 35.5 82 84 A Y T ><5S+ 0 0 39 -4,-2.9 3,-1.0 -5,-0.4 2,-0.6 0.628 81.4 174.0-106.0 -20.0 48.3 -7.9 31.8 83 85 A G G >>< + 0 0 21 -5,-1.5 3,-2.3 1,-0.3 4,-0.6 -0.272 69.7 46.0 54.7 -99.4 49.9 -11.3 31.0 84 86 A E G >4 S+ 0 0 135 -2,-0.6 3,-0.6 1,-0.3 4,-0.3 0.737 110.1 58.7 -47.5 -27.3 48.8 -12.2 27.5 85 87 A M G X4 S+ 0 0 12 -3,-1.0 3,-1.2 1,-0.2 4,-0.4 0.780 92.4 65.6 -76.1 -27.0 49.6 -8.7 26.4 86 88 A A G X4 S+ 0 0 14 -3,-2.3 3,-0.6 -8,-0.3 -1,-0.2 0.662 88.0 71.7 -68.0 -15.3 53.3 -9.0 27.5 87 89 A D G X< S+ 0 0 72 -3,-0.6 3,-2.0 -4,-0.6 4,-0.4 0.830 83.7 69.0 -68.0 -32.6 53.6 -11.6 24.8 88 90 A c G X S+ 0 0 0 -3,-1.2 3,-2.0 -4,-0.3 -1,-0.2 0.821 82.6 72.0 -54.5 -36.4 53.4 -8.8 22.2 89 91 A b G < S+ 0 0 42 -3,-0.6 -1,-0.3 -4,-0.4 -2,-0.2 0.664 87.8 64.6 -57.5 -15.6 56.8 -7.6 23.2 90 92 A A G < S+ 0 0 93 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.773 90.7 80.7 -78.5 -26.7 58.3 -10.6 21.5 91 93 A K S < S- 0 0 94 -3,-2.0 2,-0.5 -4,-0.4 6,-0.0 -0.429 86.6-111.6 -81.5 156.0 57.1 -9.4 18.1 92 94 A Q > - 0 0 161 -2,-0.1 3,-1.8 4,-0.1 4,-0.2 -0.799 48.2 -85.1 -95.8 124.3 58.9 -6.8 16.0 93 95 A E T 3>>S+ 0 0 33 -2,-0.5 4,-1.9 1,-0.3 5,-0.5 0.209 121.9 55.9 12.2 -72.0 57.1 -3.5 15.5 94 96 A P H 3>5S+ 0 0 99 0, 0.0 4,-1.0 0, 0.0 -1,-0.3 0.940 124.5 28.4 -43.5 -51.6 54.7 -4.1 12.6 95 97 A E H <>5S+ 0 0 106 -3,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.943 114.9 63.1 -72.9 -51.1 53.2 -7.0 14.5 96 98 A R H >5S+ 0 0 22 1,-0.3 4,-2.0 2,-0.2 3,-0.4 0.885 107.1 41.7 -39.3 -62.5 53.9 -5.7 18.0 97 99 A N H X5S+ 0 0 8 -4,-1.9 4,-2.0 1,-0.3 -1,-0.3 0.891 112.6 54.6 -56.4 -43.1 51.7 -2.6 17.7 98 100 A E H X< S+ 0 0 8 -4,-2.0 3,-0.7 1,-0.2 -1,-0.3 0.876 106.6 52.4 -56.8 -37.4 45.6 -3.0 19.7 102 104 A Q H 3< S+ 0 0 140 -4,-1.1 2,-1.1 -3,-0.4 -1,-0.2 0.922 106.9 50.3 -64.2 -48.5 44.2 -6.6 19.9 103 105 A H T 3< S+ 0 0 58 -4,-1.8 2,-0.6 -18,-0.1 -1,-0.3 -0.329 80.7 121.7 -89.4 51.9 44.6 -6.9 23.7 104 106 A K < - 0 0 10 -2,-1.1 2,-0.1 -3,-0.7 -76,-0.1 -0.888 61.7-135.9-118.7 98.8 42.9 -3.6 24.4 105 107 A D - 0 0 94 -2,-0.6 -2,-0.1 -77,-0.2 -75,-0.0 -0.344 12.1-160.3 -57.1 121.1 39.9 -4.1 26.6 106 108 A D S S+ 0 0 59 1,-0.3 40,-0.3 -2,-0.1 -1,-0.1 0.918 85.6 12.7 -69.7 -49.1 37.0 -2.0 25.2 107 109 A N S S- 0 0 83 37,-0.1 -1,-0.3 38,-0.1 36,-0.1 -0.711 86.8-165.8-131.8 79.7 34.8 -1.9 28.4 108 110 A P - 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0 0 45 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 0.091 46.0 -80.2 -71.9-167.8 5.5 19.6 29.5 398 400 A E H > S+ 0 0 81 2,-0.2 4,-2.5 3,-0.2 5,-0.1 0.940 131.4 44.0 -60.5 -47.7 8.5 17.4 29.2 399 401 A Y H > S+ 0 0 61 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.958 115.2 45.2 -62.2 -55.8 7.4 15.3 32.2 400 402 A K H > S+ 0 0 64 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.833 114.9 51.3 -57.8 -33.4 3.7 15.0 31.3 401 403 A F H >X S+ 0 0 6 -4,-2.0 4,-1.8 1,-0.2 3,-0.6 0.921 104.0 55.9 -70.4 -45.2 4.8 14.2 27.7 402 404 A Q H 3X S+ 0 0 4 -4,-2.5 4,-2.1 1,-0.3 -1,-0.2 0.807 105.8 54.0 -56.1 -31.7 7.2 11.5 28.9 403 405 A N H 3X S+ 0 0 18 -4,-1.5 4,-2.5 2,-0.2 -1,-0.3 0.821 102.2 55.5 -74.3 -32.3 4.2 9.8 30.6 404 406 A A H < + 0 0 15 -4,-2.3 3,-1.5 1,-0.1 -1,-0.2 -0.674 67.7 162.9-124.2 76.8 5.9 -4.0 23.9 414 416 A P T 3 S+ 0 0 5 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 0.871 70.7 73.5 -58.2 -41.6 4.6 -4.9 27.4 415 417 A Q T 3 S+ 0 0 63 -3,-0.1 3,-0.1 52,-0.1 -5,-0.1 0.731 79.8 102.9 -45.3 -27.6 7.0 -7.8 27.6 416 418 A V S < S- 0 0 15 -3,-1.5 5,-0.1 -6,-0.1 -3,-0.0 -0.312 86.6 -92.9 -67.7 143.2 9.7 -5.2 28.0 417 419 A S > - 0 0 58 1,-0.1 4,-2.2 2,-0.1 3,-0.2 -0.110 26.4-133.7 -50.0 144.6 11.3 -4.5 31.4 418 420 A T H > S+ 0 0 9 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.902 105.6 52.3 -71.9 -42.5 9.7 -1.7 33.4 419 421 A P H > S+ 0 0 90 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.679 114.6 45.9 -66.8 -15.8 13.0 -0.0 34.4 420 422 A T H > S+ 0 0 29 2,-0.2 4,-2.9 -3,-0.2 5,-0.3 0.829 108.8 51.5 -92.2 -42.8 13.9 -0.1 30.6 421 423 A L H X S+ 0 0 6 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.919 112.9 49.7 -59.1 -41.0 10.5 1.2 29.4 422 424 A V H X S+ 0 0 6 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.938 113.1 43.7 -63.9 -48.8 11.0 4.0 31.9 423 425 A E H X S+ 0 0 85 -4,-1.0 4,-2.6 2,-0.2 3,-0.4 0.954 115.5 47.6 -61.6 -52.7 14.5 4.9 30.8 424 426 A V H X S+ 0 0 17 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.913 113.2 48.7 -54.5 -47.7 13.8 4.7 27.1 425 427 A S H X S+ 0 0 1 -4,-2.4 4,-1.9 -5,-0.3 -1,-0.2 0.765 110.3 51.9 -65.9 -27.0 10.7 6.8 27.5 426 428 A R H X S+ 0 0 47 -4,-1.5 4,-1.5 -3,-0.4 -2,-0.2 0.939 110.6 46.7 -74.6 -46.9 12.6 9.4 29.5 427 429 A N H X S+ 0 0 30 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.858 112.4 51.8 -61.8 -36.5 15.3 9.7 26.9 428 430 A L H X S+ 0 0 20 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.938 106.7 51.9 -66.6 -45.6 12.7 10.0 24.2 429 431 A G H X S+ 0 0 0 -4,-1.9 4,-1.0 1,-0.2 -1,-0.2 0.818 108.7 54.0 -59.7 -28.8 10.9 12.7 26.0 430 432 A K H X S+ 0 0 75 -4,-1.5 4,-2.7 2,-0.2 3,-0.5 0.894 103.5 52.7 -71.9 -42.1 14.2 14.5 26.2 431 433 A V H X S+ 0 0 13 -4,-1.9 4,-1.4 1,-0.2 5,-0.3 0.880 105.6 58.6 -60.7 -34.9 14.8 14.3 22.4 432 434 A G H X S+ 0 0 13 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.829 111.2 39.0 -63.9 -33.5 11.3 15.9 22.2 433 435 A S H X S+ 0 0 37 -4,-1.0 4,-0.7 -3,-0.5 -2,-0.2 0.903 112.9 53.4 -83.8 -43.9 12.4 18.9 24.1 434 436 A K H < S+ 0 0 108 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.734 124.0 28.0 -63.4 -22.4 15.9 19.3 22.7 435 437 A m H >< S+ 0 0 5 -4,-1.4 3,-1.5 -5,-0.2 -1,-0.2 0.743 107.9 64.3-110.7 -33.3 14.5 19.4 19.2 436 438 A l H 3< S+ 0 0 16 -4,-1.5 -2,-0.1 -5,-0.3 -3,-0.1 0.590 93.2 69.2 -69.0 -8.5 11.0 20.7 19.3 437 439 A K T 3< S+ 0 0 88 -4,-0.7 -1,-0.3 2,-0.1 -2,-0.1 0.760 90.0 82.0 -76.4 -26.4 12.5 24.0 20.5 438 440 A H S < S- 0 0 72 -3,-1.5 2,-0.2 1,-0.1 -3,-0.1 -0.330 90.4-105.2 -76.8 158.6 14.0 24.3 16.9 439 441 A P >> - 0 0 90 0, 0.0 3,-2.7 0, 0.0 4,-0.8 -0.581 43.9 -92.0 -85.8 150.4 12.0 25.6 13.9 440 442 A E H >> S+ 0 0 153 1,-0.3 3,-1.0 -2,-0.2 4,-0.6 0.720 121.4 66.7 -23.1 -49.3 10.7 23.2 11.3 441 443 A A H 34 S+ 0 0 60 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.808 112.0 28.2 -49.8 -40.8 13.9 23.6 9.2 442 444 A K H <> S+ 0 0 61 -3,-2.7 4,-1.3 2,-0.1 -1,-0.2 0.405 97.6 92.9-106.0 3.2 16.2 22.0 11.8 443 445 A R H S+ 0 0 23 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.896 113.5 51.5 -59.8 -34.2 18.1 16.4 11.3 446 448 A m H >X S+ 0 0 15 -4,-1.3 4,-1.7 2,-0.2 3,-0.6 0.979 108.2 47.5 -62.3 -61.0 18.0 16.9 15.1 447 449 A A H 3X S+ 0 0 13 -4,-2.4 4,-3.1 1,-0.3 5,-0.3 0.853 110.3 54.0 -50.1 -42.2 15.7 14.1 16.0 448 450 A E H 3X S+ 0 0 37 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.3 0.871 104.4 55.9 -62.3 -38.5 17.6 11.7 13.8 449 451 A D H X S+ 0 0 64 -4,-1.7 4,-1.9 2,-0.2 3,-1.7 0.960 116.8 55.7 -74.8 -57.6 19.4 11.7 19.0 451 453 A L H 3X S+ 0 0 44 -4,-3.1 4,-2.6 1,-0.3 5,-0.2 0.802 100.9 63.9 -46.7 -33.3 16.9 9.0 18.1 452 454 A S H 3X S+ 0 0 43 -4,-1.6 4,-0.6 -5,-0.3 -1,-0.3 0.840 107.7 37.9 -63.9 -36.1 19.8 7.2 16.4 453 455 A V H X S+ 0 0 60 -4,-1.0 4,-1.0 1,-0.2 3,-0.6 0.938 108.3 47.5 -67.8 -47.6 19.9 -4.2 25.7 462 464 A H H 3< S+ 0 0 17 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.706 102.6 69.9 -65.4 -17.6 17.6 -6.5 23.8 463 465 A E H 3< S+ 0 0 150 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.937 109.1 30.1 -64.8 -46.7 20.9 -8.0 22.4 464 466 A K H << S+ 0 0 108 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.503 136.3 28.5 -91.6 -5.8 21.8 -9.4 25.8 465 467 A T S < S- 0 0 92 -4,-1.0 -1,-0.2 -5,-0.1 -2,-0.2 -0.322 76.3-165.2-153.2 63.4 18.2 -10.0 26.9 466 468 A P + 0 0 91 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.107 21.3 157.4 -49.7 149.5 15.7 -10.6 24.1 467 469 A V + 0 0 71 1,-0.4 2,-0.4 -50,-0.0 3,-0.1 0.439 60.5 38.8-143.7 -39.0 12.1 -10.3 25.1 468 470 A S > - 0 0 8 1,-0.1 4,-1.1 -55,-0.0 -1,-0.4 -0.970 55.8-151.8-126.6 138.9 10.2 -9.5 21.9 469 471 A D H > S+ 0 0 128 -2,-0.4 4,-1.4 2,-0.2 -1,-0.1 0.848 100.1 57.5 -72.2 -33.7 10.6 -10.9 18.4 470 472 A R H >> S+ 0 0 56 2,-0.2 4,-1.6 1,-0.2 3,-0.6 0.953 105.0 46.5 -60.5 -56.5 9.2 -7.6 17.1 471 473 A V H 3> S+ 0 0 6 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.849 114.3 51.0 -55.9 -34.0 11.7 -5.3 18.7 472 474 A T H 3X S+ 0 0 54 -4,-1.1 4,-1.4 2,-0.2 -1,-0.3 0.770 102.0 61.2 -75.0 -26.8 14.3 -7.7 17.4 473 475 A K H > - 0 0 39 1,-0.1 4,-1.6 3,-0.1 3,-1.5 -0.217 41.5-116.2 -61.7 150.3 18.6 -1.9 8.0 479 481 A L T 34 S+ 0 0 54 1,-0.3 4,-0.4 2,-0.2 -1,-0.1 0.693 118.3 58.0 -60.2 -17.3 19.5 1.4 9.6 480 482 A V T 34 S+ 0 0 30 1,-0.2 -1,-0.3 2,-0.1 -134,-0.1 0.708 116.2 31.8 -86.1 -21.3 17.2 2.9 7.0 481 483 A N T <> S+ 0 0 66 -3,-1.5 4,-1.5 2,-0.1 -2,-0.2 0.426 94.3 95.9-111.5 -3.8 14.2 0.9 8.2 482 484 A R H X S+ 0 0 35 -4,-1.6 4,-0.7 1,-0.2 -3,-0.1 0.859 92.6 34.7 -54.6 -41.4 15.3 0.8 11.8 483 485 A R H >> S+ 0 0 39 -4,-0.4 4,-1.7 2,-0.2 3,-0.5 0.909 113.3 53.4 -84.2 -47.3 13.2 3.8 12.8 484 486 A P H 3> S+ 0 0 32 0, 0.0 4,-0.7 0, 0.0 -2,-0.2 0.757 105.3 60.5 -61.2 -19.7 10.1 3.4 10.6 485 487 A o H 3X S+ 0 0 24 -4,-1.5 4,-0.5 2,-0.2 3,-0.3 0.897 103.1 48.3 -71.5 -42.3 9.8 -0.1 12.0 486 488 A F H X< S+ 0 0 29 -4,-0.7 3,-0.9 -3,-0.5 -1,-0.2 0.861 108.6 53.4 -66.7 -36.6 9.4 1.0 15.5 487 489 A S H 3< S+ 0 0 53 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.736 105.7 56.5 -70.2 -21.4 6.8 3.6 14.6 488 490 A A H 3< S+ 0 0 66 -4,-0.7 -1,-0.2 -3,-0.3 -2,-0.2 0.576 77.2 118.3 -85.9 -12.8 4.8 0.8 12.9 489 491 A L << - 0 0 23 -3,-0.9 2,-0.3 -4,-0.5 -76,-0.1 -0.267 54.0-150.2 -54.6 138.8 4.6 -1.4 16.0 490 492 A E - 0 0 156 -78,-0.1 3,-0.1 1,-0.1 -1,-0.1 -0.808 29.4 -77.5-114.5 157.3 1.0 -1.9 17.0 491 493 A V - 0 0 62 -2,-0.3 2,-0.5 1,-0.1 -79,-0.2 -0.202 52.2-114.3 -50.4 137.2 -0.5 -2.5 20.5 492 494 A D + 0 0 25 -81,-2.3 -1,-0.1 1,-0.2 -79,-0.0 -0.667 38.7 170.3 -80.3 123.7 0.0 -6.0 21.7 493 495 A E S S+ 0 0 148 -2,-0.5 -1,-0.2 1,-0.1 -2,-0.1 0.568 75.0 68.6-104.2 -18.2 -3.3 -8.0 21.9 494 496 A T S S+ 0 0 127 2,-0.1 -1,-0.1 0, 0.0 -2,-0.1 0.803 79.3 106.6 -68.4 -30.6 -1.5 -11.3 22.5 495 497 A Y - 0 0 33 1,-0.1 -82,-0.0 40,-0.0 0, 0.0 -0.250 62.1-149.5 -57.8 130.4 -0.4 -9.9 25.9 496 498 A V - 0 0 120 1,-0.1 -1,-0.1 -2,-0.0 -2,-0.1 -0.917 29.9-110.0-105.9 114.2 -2.1 -11.3 28.9 497 499 A P - 0 0 73 0, 0.0 36,-0.2 0, 0.0 2,-0.2 0.235 31.5-106.3 -36.6 156.9 -2.2 -8.8 31.8 498 500 A K - 0 0 121 34,-2.0 2,-0.4 31,-0.2 3,-0.1 -0.508 34.7-102.2 -88.6 160.1 -0.2 -9.1 35.0 499 501 A E - 0 0 95 -2,-0.2 -1,-0.1 1,-0.1 34,-0.0 -0.682 44.9 -97.4 -86.6 134.4 -1.6 -10.1 38.4 500 502 A F - 0 0 85 -2,-0.4 2,-0.3 33,-0.1 -1,-0.1 -0.086 36.7-173.2 -49.2 142.1 -2.2 -7.3 40.9 501 503 A N >> - 0 0 87 1,-0.1 3,-2.5 -3,-0.1 4,-0.7 -0.788 14.4-159.5-143.7 93.4 0.5 -6.8 43.5 502 504 A A G >4 S+ 0 0 52 1,-0.3 3,-1.3 -2,-0.3 -1,-0.1 0.783 92.8 65.4 -42.3 -36.1 -0.5 -4.3 46.2 503 505 A E G >4 S+ 0 0 72 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.896 97.3 55.3 -56.2 -39.7 3.3 -3.9 47.0 504 506 A T G <4 S+ 0 0 53 -3,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.688 115.6 38.2 -66.7 -19.3 3.6 -2.4 43.5 505 507 A F G << S+ 0 0 27 -3,-1.3 2,-0.6 -4,-0.7 -1,-0.3 -0.051 90.9 105.8-123.4 31.2 1.0 0.2 44.4 506 508 A T < - 0 0 69 -3,-1.5 2,-0.6 -5,-0.2 61,-0.1 -0.956 47.5-174.3-114.4 112.2 2.0 0.8 48.0 507 509 A F - 0 0 35 -2,-0.6 56,-0.1 59,-0.3 2,-0.1 -0.917 4.0-164.6-115.7 110.9 3.7 4.2 48.4 508 510 A H > - 0 0 92 -2,-0.6 2,-2.6 1,-0.1 3,-1.1 -0.367 44.4 -81.8 -84.9 169.4 5.1 5.1 51.7 509 511 A A T 3 S+ 0 0 25 1,-0.2 4,-0.1 2,-0.1 -1,-0.1 -0.303 103.2 93.6 -72.4 61.4 6.1 8.7 52.7 510 512 A D T > S+ 0 0 83 -2,-2.6 3,-0.7 2,-0.1 -1,-0.2 0.629 72.2 66.6-115.3 -34.0 9.6 8.7 51.0 511 513 A I G X S+ 0 0 22 -3,-1.1 3,-1.4 1,-0.2 -2,-0.1 0.796 92.4 63.6 -57.6 -31.8 8.4 10.3 47.8 512 514 A p G 3 S+ 0 0 44 1,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.904 108.9 39.4 -61.0 -42.0 7.6 13.5 49.7 513 515 A T G < S+ 0 0 120 -3,-0.7 2,-0.3 -4,-0.1 -1,-0.3 -0.028 98.0 105.5 -99.0 29.4 11.3 14.0 50.6 514 516 A L S < S- 0 0 57 -3,-1.4 5,-0.1 1,-0.1 -3,-0.0 -0.796 76.1 -98.5-112.0 155.2 12.7 12.8 47.3 515 517 A S >> - 0 0 68 -2,-0.3 4,-2.6 1,-0.1 3,-1.1 -0.246 39.4-106.2 -63.7 154.9 14.3 14.8 44.4 516 518 A E H 3> S+ 0 0 110 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.906 124.2 58.8 -47.8 -43.6 12.1 15.6 41.4 517 519 A K H 3> S+ 0 0 48 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.870 111.1 40.5 -53.9 -40.8 14.2 13.0 39.6 518 520 A E H <> S+ 0 0 78 -3,-1.1 4,-2.2 2,-0.2 5,-0.2 0.869 110.9 54.4 -78.7 -40.0 13.1 10.4 42.2 519 521 A R H X S+ 0 0 92 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.953 114.3 43.3 -58.4 -49.4 9.5 11.4 42.6 520 522 A Q H X S+ 0 0 38 -4,-2.5 4,-4.1 -5,-0.2 5,-0.3 0.968 112.8 48.7 -60.4 -59.5 9.0 11.1 38.8 521 523 A I H X S+ 0 0 58 -4,-1.8 4,-2.1 -5,-0.3 -1,-0.2 0.851 114.3 48.5 -51.4 -37.7 10.9 7.8 38.3 522 524 A K H X S+ 0 0 59 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.943 116.0 42.3 -68.9 -46.3 8.9 6.3 41.2 523 525 A K H X S+ 0 0 73 -4,-2.5 4,-1.8 -5,-0.2 -2,-0.2 0.892 115.6 49.8 -65.2 -42.6 5.6 7.6 39.8 524 526 A Q H X S+ 0 0 1 -4,-4.1 4,-2.4 2,-0.2 -1,-0.2 0.874 105.8 55.8 -64.9 -40.3 6.5 6.6 36.3 525 527 A T H X S+ 0 0 50 -4,-2.1 4,-1.6 -5,-0.3 -1,-0.2 0.881 110.0 46.8 -60.7 -37.7 7.6 3.1 37.3 526 528 A A H X S+ 0 0 23 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.864 108.6 55.8 -71.1 -36.8 4.1 2.6 38.8 527 529 A L H X S+ 0 0 12 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.926 106.8 48.8 -60.3 -47.0 2.5 4.0 35.7 528 530 A V H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.907 113.2 48.2 -59.4 -43.1 4.2 1.5 33.5 529 531 A E H X S+ 0 0 50 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.813 105.9 57.6 -67.3 -32.6 3.0 -1.2 35.9 530 532 A L H X S+ 0 0 20 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.920 109.6 44.9 -64.2 -42.9 -0.5 0.1 35.9 531 533 A V H < S+ 0 0 2 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.899 109.9 54.4 -66.5 -42.8 -0.6 -0.3 32.1 532 534 A K H < S+ 0 0 15 -4,-2.1 -34,-2.0 1,-0.2 -1,-0.2 0.762 113.3 44.5 -63.8 -24.1 0.9 -3.8 32.4 533 535 A H H < S+ 0 0 51 -4,-1.3 -2,-0.2 -36,-0.2 -1,-0.2 0.908 131.0 20.3 -85.4 -47.2 -1.9 -4.7 34.8 534 536 A K S >< S+ 0 0 25 -4,-2.7 3,-1.5 -5,-0.1 -1,-0.2 -0.692 70.4 166.6-123.6 77.4 -4.8 -3.1 32.9 535 537 A P T 3 S+ 0 0 25 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.527 73.9 60.0 -68.1 -8.9 -3.5 -2.8 29.2 536 538 A K T 3 S+ 0 0 173 45,-0.1 2,-0.3 -3,-0.1 -5,-0.1 0.227 74.7 129.5-104.7 13.4 -7.0 -2.1 27.9 537 539 A A < - 0 0 2 -3,-1.5 44,-0.0 -6,-0.2 -3,-0.0 -0.522 59.5-120.4 -72.2 129.6 -7.4 1.0 30.0 538 540 A T > - 0 0 71 -2,-0.3 4,-1.7 1,-0.1 -1,-0.1 0.073 21.4-111.4 -57.9 175.0 -8.6 4.1 28.0 539 541 A K H > S+ 0 0 80 2,-0.2 4,-1.1 3,-0.1 -1,-0.1 0.725 125.5 49.1 -78.8 -22.3 -6.6 7.3 27.8 540 542 A E H > S+ 0 0 125 2,-0.2 4,-2.5 3,-0.1 5,-0.2 0.960 109.1 46.2 -77.1 -61.2 -9.5 8.5 29.8 541 543 A Q H > S+ 0 0 76 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.945 115.9 49.1 -46.3 -54.7 -9.7 5.7 32.4 542 544 A L H X S+ 0 0 4 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.849 108.4 52.0 -54.8 -42.2 -5.9 6.1 32.9 543 545 A K H X S+ 0 0 131 -4,-1.1 4,-1.1 2,-0.2 -1,-0.2 0.923 107.8 53.0 -63.4 -43.7 -6.1 9.9 33.2 544 546 A A H >X S+ 0 0 49 -4,-2.5 4,-2.2 1,-0.2 3,-0.9 0.945 110.6 45.7 -55.6 -53.0 -8.7 9.6 35.9 545 547 A V H 3X S+ 0 0 14 -4,-2.1 4,-0.5 1,-0.3 -1,-0.2 0.867 110.7 54.0 -60.2 -36.7 -6.6 7.2 38.0 546 548 A M H 3X S+ 0 0 74 -4,-2.0 4,-1.4 -5,-0.2 -1,-0.3 0.709 109.0 51.9 -71.0 -18.8 -3.6 9.4 37.5 547 549 A D H X S+ 0 0 20 -4,-2.6 4,-1.5 1,-0.2 3,-0.6 0.865 113.6 47.5 -46.3 -43.0 0.4 12.5 47.0 554 556 A E H >X S+ 0 0 52 -4,-1.5 3,-1.2 1,-0.2 4,-0.6 0.995 105.9 54.3 -62.6 -65.6 -0.5 16.1 48.0 555 557 A K H 3< S+ 0 0 74 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.547 118.6 39.0 -48.2 -7.6 -3.1 15.3 50.6 556 558 A q H << S+ 0 0 1 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.618 113.4 47.7-119.5 -20.7 -0.5 13.0 52.3 557 559 A p H << S+ 0 0 47 -4,-1.5 -2,-0.2 -3,-1.2 -3,-0.1 0.092 118.3 44.7-106.3 20.7 2.9 14.9 52.0 558 560 A K S < S+ 0 0 188 -4,-0.6 2,-0.3 -5,-0.1 -1,-0.2 0.120 97.2 97.9-142.7 10.1 1.2 18.1 53.2 559 561 A A S > S- 0 0 44 -3,-0.2 3,-0.5 -5,-0.2 6,-0.1 -0.813 82.0-115.6-109.4 148.8 -0.7 16.4 56.1 560 562 A D T 3 S+ 0 0 121 -2,-0.3 2,-0.1 1,-0.2 -1,-0.1 0.594 107.9 42.4 -55.4 -16.0 0.2 16.3 59.8 561 563 A D T >> - 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