==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PLASMA PROTEIN 05-OCT-01 1GNI . COMPND 2 MOLECULE: SERUM ALBUMIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR I.PETITPAS,T.GRUENE,A.A.BHATTACHARYA,S.CURRY . 582 1 17 17 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30249.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 430 73.9 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 . 12 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 347 59.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 3 1 1 1 2 2 0 0 0 0 5 0 1 4 2 2 0 1 0 0 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 0 219 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 119.7 62.4 13.3 7.9 2 4 A K - 0 0 71 1,-0.1 2,-0.4 4,-0.0 0, 0.0 0.049 360.0 -41.3 41.9-138.3 63.4 14.9 11.2 3 5 A S > - 0 0 3 1,-0.2 4,-2.2 48,-0.1 5,-0.2 -0.981 37.5-154.5-128.5 122.9 61.8 13.6 14.4 4 6 A E H > S+ 0 0 82 -2,-0.4 4,-2.8 56,-0.3 5,-0.3 0.952 96.3 48.3 -58.5 -52.8 58.1 12.7 14.8 5 7 A V H > S+ 0 0 6 57,-0.4 4,-2.6 55,-0.3 -1,-0.2 0.918 111.8 48.9 -54.1 -49.4 58.0 13.3 18.6 6 8 A A H > S+ 0 0 7 54,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.923 113.2 49.0 -57.5 -43.9 59.6 16.6 18.4 7 9 A H H X S+ 0 0 105 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.936 112.6 44.5 -62.0 -51.2 57.3 17.6 15.6 8 10 A R H X S+ 0 0 40 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.885 113.5 53.6 -61.3 -37.5 54.1 16.5 17.4 9 11 A F H X S+ 0 0 19 -4,-2.6 4,-2.1 -5,-0.3 -2,-0.2 0.898 109.5 46.2 -65.4 -41.6 55.4 18.2 20.5 10 12 A K H < S+ 0 0 134 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.937 116.6 45.5 -69.0 -43.3 56.0 21.5 18.8 11 13 A D H < S+ 0 0 80 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.989 120.1 37.4 -61.4 -60.1 52.5 21.4 17.1 12 14 A L H < S- 0 0 24 -4,-2.9 4,-0.4 -5,-0.2 -3,-0.2 0.866 103.9-130.3 -60.1 -42.3 50.5 20.3 20.2 13 15 A G X - 0 0 30 -4,-2.1 4,-2.3 -5,-0.3 5,-0.2 -0.101 31.5 -81.6 99.4 153.6 52.4 22.4 22.8 14 16 A E H > S+ 0 0 78 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.926 127.3 52.6 -57.6 -48.2 53.7 20.9 26.1 15 17 A E H > S+ 0 0 123 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.904 113.8 41.0 -55.5 -47.6 50.3 21.1 27.9 16 18 A N H > S+ 0 0 38 -4,-0.4 4,-2.4 1,-0.2 5,-0.2 0.919 112.5 56.0 -70.1 -39.9 48.3 19.3 25.2 17 19 A F H X S+ 0 0 13 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.881 108.8 46.8 -56.3 -45.1 51.1 16.7 24.6 18 20 A K H X S+ 0 0 38 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.873 112.5 48.6 -68.7 -39.6 51.1 15.6 28.2 19 21 A A H X S+ 0 0 8 -4,-1.6 4,-1.9 -5,-0.2 -2,-0.2 0.879 114.4 47.0 -70.2 -34.2 47.4 15.4 28.5 20 22 A L H X S+ 0 0 25 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.887 109.0 52.1 -74.9 -38.5 47.2 13.3 25.3 21 23 A V H X S+ 0 0 19 -4,-2.4 4,-2.0 -5,-0.2 5,-0.2 0.882 109.2 52.8 -64.0 -36.1 50.0 11.0 26.2 22 24 A L H X S+ 0 0 4 -4,-1.6 4,-2.7 2,-0.2 -2,-0.2 0.965 110.9 45.3 -62.6 -52.3 48.2 10.3 29.5 23 25 A I H X S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.902 111.0 53.6 -57.5 -44.3 44.9 9.4 27.7 24 26 A A H X S+ 0 0 12 -4,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.901 113.7 41.4 -59.8 -44.3 46.7 7.2 25.2 25 27 A F H >X S+ 0 0 5 -4,-2.0 4,-3.0 1,-0.2 3,-1.0 0.890 110.0 57.1 -72.7 -38.5 48.4 5.2 27.8 26 28 A A H 3< S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.859 103.5 56.2 -59.9 -34.4 45.3 5.0 30.0 27 29 A Q H 3< S+ 0 0 4 -4,-1.9 -1,-0.3 -5,-0.2 3,-0.2 0.704 117.3 33.4 -72.4 -19.5 43.4 3.4 27.1 28 30 A Y H << S+ 0 0 9 -3,-1.0 2,-1.3 -4,-0.6 77,-0.2 0.853 122.2 42.9 -99.8 -49.2 46.0 0.6 26.8 29 31 A L S >< S+ 0 0 1 -4,-3.0 3,-1.2 1,-0.2 -1,-0.2 -0.536 70.6 162.5 -98.7 69.0 47.1 0.0 30.4 30 32 A Q T 3 S+ 0 0 11 -2,-1.3 -1,-0.2 1,-0.3 -4,-0.1 0.567 70.6 46.7 -63.9 -15.6 43.6 0.3 31.8 31 33 A Q T 3 S+ 0 0 105 -3,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.451 85.5 107.0-109.3 -2.6 44.5 -1.4 35.1 32 34 A C S < S- 0 0 5 -3,-1.2 5,-0.0 -6,-0.1 -3,-0.0 -0.448 75.8 -98.0 -77.6 152.3 47.7 0.4 36.0 33 35 A P > - 0 0 59 0, 0.0 4,-1.9 0, 0.0 5,-0.2 -0.186 24.7-118.3 -65.2 157.1 47.7 3.0 38.8 34 36 A F H > S+ 0 0 22 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.940 114.6 52.0 -61.9 -48.4 47.4 6.7 38.3 35 37 A E H > S+ 0 0 130 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.803 106.1 57.0 -59.8 -30.3 50.8 7.5 39.8 36 38 A D H > S+ 0 0 79 2,-0.2 4,-2.0 1,-0.2 3,-0.2 0.967 108.3 44.8 -66.2 -50.5 52.3 4.9 37.5 37 39 A H H X S+ 0 0 1 -4,-1.9 4,-3.3 1,-0.2 -2,-0.2 0.875 109.2 56.4 -60.4 -39.7 51.0 6.6 34.3 38 40 A V H X S+ 0 0 51 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.895 106.1 51.0 -59.7 -38.7 52.1 10.0 35.6 39 41 A K H X S+ 0 0 50 -4,-1.5 4,-2.3 -3,-0.2 -1,-0.2 0.955 112.0 48.3 -60.9 -48.6 55.6 8.7 35.9 40 42 A L H X S+ 0 0 17 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.926 109.5 50.7 -54.6 -55.2 55.3 7.4 32.3 41 43 A V H X S+ 0 0 6 -4,-3.3 4,-3.4 1,-0.2 5,-0.2 0.925 111.4 48.4 -51.7 -50.2 54.0 10.7 30.9 42 44 A N H X S+ 0 0 86 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.899 111.6 50.3 -59.8 -42.1 56.8 12.6 32.6 43 45 A E H X S+ 0 0 95 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.921 114.8 42.4 -60.8 -49.1 59.3 10.2 31.2 44 46 A V H X S+ 0 0 20 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.921 114.7 51.3 -67.6 -41.1 58.0 10.5 27.7 45 47 A T H X S+ 0 0 3 -4,-3.4 4,-1.5 -5,-0.2 -2,-0.2 0.904 110.4 48.4 -60.9 -43.3 57.6 14.2 27.9 46 48 A E H X S+ 0 0 124 -4,-2.7 4,-1.3 -5,-0.2 -1,-0.2 0.901 111.9 50.3 -64.1 -40.2 61.2 14.6 29.1 47 49 A F H X S+ 0 0 49 -4,-2.0 4,-1.6 1,-0.2 3,-0.4 0.920 107.6 53.4 -62.3 -45.0 62.3 12.4 26.2 48 50 A A H X S+ 0 0 0 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.803 106.0 53.1 -60.1 -31.7 60.3 14.5 23.8 49 51 A K H X S+ 0 0 48 -4,-1.5 4,-1.4 2,-0.2 -1,-0.2 0.800 103.5 58.1 -74.3 -27.9 62.1 17.7 25.1 50 52 A T H X S+ 0 0 64 -4,-1.3 4,-1.7 -3,-0.4 -2,-0.2 0.905 108.4 45.5 -64.9 -42.8 65.3 15.9 24.4 51 53 A a H < S+ 0 0 1 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.797 107.4 56.5 -72.4 -31.3 64.3 15.6 20.8 52 54 A V H < S+ 0 0 49 -4,-1.4 3,-0.2 1,-0.2 -1,-0.2 0.814 111.5 45.5 -68.7 -29.9 63.1 19.2 20.5 53 55 A A H < S+ 0 0 89 -4,-1.4 2,-0.3 1,-0.3 -2,-0.2 0.829 132.9 12.7 -81.3 -34.9 66.6 20.2 21.6 54 56 A D >< - 0 0 86 -4,-1.7 3,-2.1 -5,-0.1 -1,-0.3 -0.836 58.6-165.6-148.8 105.3 68.4 17.8 19.3 55 57 A E T 3 S+ 0 0 127 -2,-0.3 -4,-0.1 1,-0.3 -1,-0.1 0.729 95.6 57.4 -60.4 -24.8 66.6 16.0 16.4 56 58 A S T 3 S+ 0 0 100 4,-0.1 -1,-0.3 -53,-0.0 3,-0.1 0.482 81.7 125.7 -87.1 -2.4 69.6 13.7 16.1 57 59 A A S X S- 0 0 4 -3,-2.1 3,-1.0 -7,-0.2 4,-0.4 -0.040 76.2 -72.3 -51.2 158.7 69.2 12.7 19.8 58 60 A E T 3 S- 0 0 139 1,-0.2 -1,-0.1 2,-0.2 -4,-0.1 -0.276 113.5 -1.9 -61.6 138.3 69.0 9.0 20.5 59 61 A N T > S+ 0 0 81 1,-0.1 3,-1.5 -3,-0.1 -1,-0.2 0.251 98.1 113.6 67.6 -14.4 65.8 7.2 19.6 60 62 A a T < S+ 0 0 0 -3,-1.0 -55,-0.3 1,-0.3 -56,-0.3 0.695 70.8 59.9 -60.1 -18.3 64.4 10.5 18.4 61 63 A D T 3 S+ 0 0 119 -4,-0.4 -1,-0.3 -58,-0.2 -57,-0.2 0.757 83.7 105.7 -80.7 -26.0 64.4 9.1 14.9 62 64 A K S < S- 0 0 77 -3,-1.5 -57,-0.4 1,-0.1 -58,-0.3 -0.124 77.7-104.2 -57.8 148.5 62.0 6.3 15.8 63 65 A S > - 0 0 39 -59,-0.1 4,-2.9 1,-0.1 5,-0.2 -0.287 28.8-111.2 -70.5 158.6 58.4 6.3 14.7 64 66 A L H > S+ 0 0 26 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.905 116.4 50.5 -58.5 -45.4 55.6 7.2 17.1 65 67 A H H > S+ 0 0 28 2,-0.2 4,-3.7 1,-0.2 5,-0.2 0.945 113.2 46.1 -58.9 -48.4 54.1 3.6 17.1 66 68 A T H > S+ 0 0 30 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.940 114.7 46.0 -60.7 -49.0 57.5 2.1 17.8 67 69 A L H X S+ 0 0 27 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.951 116.6 46.8 -58.8 -46.4 58.4 4.6 20.6 68 70 A F H X S+ 0 0 31 -4,-3.2 4,-2.0 -5,-0.2 -2,-0.2 0.908 113.7 47.2 -60.8 -46.2 54.9 4.1 22.0 69 71 A G H X S+ 0 0 2 -4,-3.7 4,-2.1 -5,-0.2 -1,-0.2 0.916 109.6 53.4 -63.6 -43.7 55.1 0.3 21.8 70 72 A D H X S+ 0 0 57 -4,-3.3 4,-0.7 -5,-0.2 -2,-0.2 0.934 108.2 51.6 -57.9 -44.1 58.6 0.3 23.3 71 73 A K H >< S+ 0 0 44 -4,-2.4 3,-0.8 -5,-0.2 -1,-0.2 0.907 108.0 50.4 -60.1 -44.5 57.2 2.3 26.3 72 74 A L H >< S+ 0 0 1 -4,-2.0 3,-1.8 1,-0.2 -1,-0.2 0.922 108.6 51.9 -59.3 -45.5 54.3 -0.1 26.9 73 75 A b H 3< S+ 0 0 37 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.647 95.7 72.3 -67.6 -12.1 56.6 -3.1 27.0 74 76 A T T << S+ 0 0 94 -3,-0.8 2,-0.5 -4,-0.7 -1,-0.3 0.499 71.8 111.8 -81.1 -4.0 58.8 -1.3 29.5 75 77 A V < - 0 0 21 -3,-1.8 4,-0.3 -4,-0.2 -3,-0.0 -0.615 59.6-150.0 -81.0 120.7 56.2 -1.8 32.2 76 78 A A S > S+ 0 0 101 -2,-0.5 3,-0.6 1,-0.2 4,-0.3 0.950 90.5 37.8 -48.6 -73.4 57.3 -4.2 34.9 77 79 A T T >> S+ 0 0 65 1,-0.2 3,-2.7 2,-0.1 4,-1.0 0.850 82.0 114.6 -51.4 -43.8 54.0 -5.8 36.1 78 80 A L H 3>>S+ 0 0 7 1,-0.3 4,-4.3 2,-0.2 5,-0.9 0.401 82.5 36.9 5.6 -69.5 52.5 -6.0 32.6 79 81 A R H <>5S+ 0 0 138 -3,-0.6 4,-1.1 -4,-0.3 -1,-0.3 0.922 117.5 50.7 -64.4 -47.1 52.4 -9.8 32.4 80 82 A E H <45S+ 0 0 90 -3,-2.7 -2,-0.2 -4,-0.3 -1,-0.2 0.929 124.5 31.5 -56.1 -43.7 51.5 -10.2 36.0 81 83 A T H <5S+ 0 0 65 -4,-1.0 -2,-0.2 2,-0.1 -3,-0.2 0.943 139.4 15.9 -80.4 -53.8 48.7 -7.7 35.5 82 84 A Y H ><5S- 0 0 44 -4,-4.3 2,-1.0 1,-0.2 3,-1.0 0.619 78.9-178.7 -98.6 -18.6 47.6 -8.2 31.8 83 85 A G G >X4 S+ 0 0 144 -2,-1.0 3,-2.5 1,-0.3 4,-0.3 0.905 109.2 59.3 -47.4 -54.1 48.3 -12.3 27.5 85 87 A M G X4 S+ 0 0 7 -3,-1.0 3,-2.1 1,-0.3 4,-0.3 0.809 94.8 66.2 -48.0 -34.8 48.9 -8.7 26.4 86 88 A A G X4 S+ 0 0 11 -3,-1.1 3,-1.2 1,-0.3 -1,-0.3 0.769 87.5 67.6 -62.3 -25.7 52.5 -9.1 27.6 87 89 A D G X< S+ 0 0 79 -3,-2.5 3,-0.9 -4,-0.5 -1,-0.3 0.593 84.9 73.2 -70.9 -7.2 53.2 -11.7 24.9 88 90 A c G X S+ 0 0 0 -3,-2.1 3,-1.8 -4,-0.3 -1,-0.2 0.788 81.6 69.9 -74.2 -27.4 52.8 -8.8 22.4 89 91 A b G < S+ 0 0 46 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.546 87.0 67.5 -66.5 -7.9 56.2 -7.5 23.4 90 92 A A G < S+ 0 0 94 -3,-0.9 -1,-0.3 -4,-0.1 2,-0.2 0.494 89.6 83.9 -91.1 -4.4 57.8 -10.5 21.8 91 93 A K S < S- 0 0 110 -3,-1.8 -3,-0.0 1,-0.1 0, 0.0 -0.551 78.2-112.1-101.3 163.8 56.8 -9.4 18.2 92 94 A Q > - 0 0 89 -2,-0.2 4,-3.0 4,-0.1 5,-0.2 -0.039 53.1 -76.5 -76.4-170.1 58.2 -7.0 15.6 93 95 A E H > S+ 0 0 43 2,-0.2 4,-2.0 1,-0.2 5,-0.4 0.979 119.8 40.5 -64.2 -78.0 56.5 -3.8 14.7 94 96 A P H > S+ 0 0 103 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.900 125.8 43.4 -36.0 -49.8 53.4 -4.1 12.5 95 97 A E H > S+ 0 0 113 1,-0.2 4,-2.8 2,-0.2 3,-0.3 0.967 109.3 53.4 -59.8 -60.8 52.6 -7.2 14.5 96 98 A R H X S+ 0 0 20 -4,-3.0 4,-1.4 1,-0.2 -1,-0.2 0.871 111.9 45.1 -43.8 -50.7 53.3 -5.9 18.0 97 99 A N H X S+ 0 0 11 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.894 113.4 49.1 -63.7 -41.2 51.1 -2.8 17.6 98 100 A E H X S+ 0 0 70 -4,-1.7 4,-1.8 -5,-0.4 -1,-0.2 0.844 107.8 56.9 -65.3 -35.6 48.2 -4.8 16.0 99 101 A c H X S+ 0 0 12 -4,-2.8 4,-0.7 1,-0.2 -1,-0.2 0.824 106.5 49.0 -66.2 -34.2 48.6 -7.3 18.9 100 102 A F H >< S+ 0 0 5 -4,-1.4 3,-0.8 -5,-0.3 4,-0.4 0.908 106.2 55.3 -73.4 -40.8 48.0 -4.4 21.4 101 103 A L H >< S+ 0 0 20 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.906 104.1 56.0 -57.5 -40.1 44.9 -3.2 19.6 102 104 A Q H 3< S+ 0 0 139 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.777 108.0 47.6 -61.9 -29.2 43.4 -6.7 19.9 103 105 A H T << S+ 0 0 54 -3,-0.8 2,-1.5 -4,-0.7 -1,-0.3 0.353 76.0 119.3 -94.4 2.2 43.8 -6.7 23.7 104 106 A K < - 0 0 30 -3,-1.3 2,-0.3 -4,-0.4 -76,-0.1 -0.562 64.4-141.1 -68.5 95.9 42.3 -3.3 24.1 105 107 A D - 0 0 80 -2,-1.5 2,-0.4 -77,-0.2 -2,-0.1 -0.452 14.5-161.2 -69.3 122.8 39.4 -4.4 26.3 106 108 A D S S+ 0 0 70 -2,-0.3 38,-0.1 1,-0.2 37,-0.1 -0.821 77.5 25.4 -98.5 140.1 36.2 -2.5 25.5 107 109 A N S S- 0 0 126 36,-0.4 -1,-0.2 -2,-0.4 37,-0.1 0.979 89.3-166.5 70.6 59.1 33.6 -2.7 28.4 108 110 A P - 0 0 32 0, 0.0 -2,-0.1 0, 0.0 35,-0.1 0.341 30.1-105.5 -60.7-163.6 36.1 -3.3 31.3 109 111 A N + 0 0 157 2,-0.0 34,-0.0 0, 0.0 -2,-0.0 -0.311 68.4 136.0-125.2 46.6 35.3 -4.4 34.8 110 112 A L - 0 0 41 1,-0.1 3,-0.1 33,-0.1 -79,-0.0 -0.669 58.7-102.2 -98.8 152.1 35.8 -1.1 36.6 111 113 A P - 0 0 93 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.264 45.3 -96.5 -65.7 155.5 33.6 0.5 39.3 112 114 A R - 0 0 210 1,-0.1 2,-0.6 0, 0.0 0, 0.0 -0.477 41.6-112.1 -71.9 145.4 31.2 3.2 38.2 113 115 A L - 0 0 54 -2,-0.1 2,-0.5 -3,-0.1 -1,-0.1 -0.730 30.6-146.2 -82.8 123.4 32.6 6.7 38.9 114 116 A V - 0 0 108 -2,-0.6 -1,-0.0 1,-0.0 0, 0.0 -0.785 13.3-124.3 -93.9 126.1 30.7 8.4 41.6 115 117 A R - 0 0 97 -2,-0.5 3,-0.1 1,-0.1 -1,-0.0 -0.528 29.6-139.3 -69.0 121.5 30.2 12.2 41.4 116 118 A P - 0 0 45 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.118 35.6 -71.1 -72.4 175.7 31.5 13.8 44.7 117 119 A E > - 0 0 128 1,-0.1 4,-2.9 4,-0.0 3,-0.4 -0.474 43.6-117.7 -70.6 140.1 29.9 16.6 46.5 118 120 A V H > S+ 0 0 11 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.860 114.8 50.4 -42.8 -43.6 30.1 20.0 44.7 119 121 A D H > S+ 0 0 85 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.885 111.2 43.4 -66.3 -46.3 32.1 21.3 47.7 120 122 A V H > S+ 0 0 85 -3,-0.4 4,-2.6 2,-0.2 5,-0.2 0.941 117.1 50.1 -65.4 -44.2 34.7 18.5 48.0 121 123 A M H X S+ 0 0 15 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.959 113.0 44.2 -56.2 -57.6 35.0 18.6 44.2 122 124 A d H X S+ 0 0 1 -4,-3.2 4,-1.6 -5,-0.3 -1,-0.2 0.833 113.9 51.4 -58.5 -35.4 35.5 22.4 44.1 123 125 A T H X S+ 0 0 78 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.868 110.1 47.5 -71.6 -37.1 37.9 22.2 47.1 124 126 A A H < S+ 0 0 37 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.858 110.0 56.2 -69.1 -34.0 40.0 19.5 45.4 125 127 A F H < S+ 0 0 9 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.840 105.6 48.8 -64.7 -37.8 39.9 21.8 42.3 126 128 A H H < S+ 0 0 123 -4,-1.6 3,-0.3 -5,-0.1 -1,-0.2 0.851 111.4 55.4 -72.4 -35.2 41.3 24.8 44.2 127 129 A D S < S- 0 0 105 -4,-1.6 2,-0.7 1,-0.3 5,-0.1 0.130 132.3 -11.5 -73.2-156.3 44.1 22.6 45.5 128 130 A N S > S+ 0 0 116 1,-0.2 4,-1.1 2,-0.1 -1,-0.3 -0.128 73.4 177.2 -44.3 90.5 46.1 20.7 42.8 129 131 A E H > S+ 0 0 74 -2,-0.7 4,-1.7 -3,-0.3 -1,-0.2 0.807 75.8 55.4 -70.6 -27.5 43.7 21.5 40.1 130 132 A E H > S+ 0 0 91 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.953 109.5 42.3 -71.1 -48.9 46.0 19.8 37.6 131 133 A T H > S+ 0 0 61 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.710 112.3 58.5 -70.7 -16.8 46.2 16.5 39.4 132 134 A F H X S+ 0 0 22 -4,-1.1 4,-1.2 2,-0.2 -1,-0.2 0.888 111.9 38.4 -76.3 -40.9 42.4 16.9 40.0 133 135 A L H X S+ 0 0 35 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.780 116.3 51.9 -79.6 -29.6 41.7 17.1 36.2 134 136 A K H X S+ 0 0 26 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.860 105.3 54.3 -76.3 -36.8 44.3 14.5 35.3 135 137 A K H X S+ 0 0 81 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.948 114.7 40.9 -61.1 -48.4 43.0 11.9 37.7 136 138 A Y H X S+ 0 0 62 -4,-1.2 4,-2.5 2,-0.2 5,-0.2 0.861 112.0 54.5 -67.7 -36.4 39.6 12.2 36.2 137 139 A L H X S+ 0 0 15 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.944 111.5 47.1 -60.2 -45.6 40.9 12.4 32.7 138 140 A Y H X S+ 0 0 9 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.910 111.0 51.6 -60.1 -45.6 42.7 9.1 33.5 139 141 A E H X S+ 0 0 19 -4,-2.5 4,-0.7 1,-0.2 -1,-0.2 0.867 114.1 42.3 -62.4 -39.6 39.5 7.6 35.0 140 142 A I H X S+ 0 0 58 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.877 113.1 52.1 -78.6 -34.9 37.4 8.4 32.0 141 143 A A H < S+ 0 0 0 -4,-2.5 -2,-0.2 -5,-0.2 6,-0.2 0.882 107.7 51.1 -68.0 -40.1 40.0 7.4 29.4 142 144 A R H < S+ 0 0 22 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.767 112.2 48.3 -68.6 -24.4 40.6 3.9 30.9 143 145 A R H < S+ 0 0 43 -4,-0.7 -36,-0.4 1,-0.2 -1,-0.2 0.728 118.1 40.2 -86.7 -23.3 36.9 3.3 30.9 144 146 A H >< + 0 0 60 -4,-1.3 3,-1.5 1,-0.1 -1,-0.2 -0.565 63.8 164.6-125.4 70.7 36.4 4.4 27.2 145 147 A P T 3 S+ 0 0 4 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.673 77.7 52.7 -57.9 -20.7 39.4 3.1 25.3 146 148 A Y T 3 S+ 0 0 53 -3,-0.1 2,-0.2 2,-0.1 100,-0.1 0.584 79.3 111.8 -92.3 -15.1 37.7 3.7 22.0 147 149 A F S < S- 0 0 10 -3,-1.5 2,-0.2 -6,-0.2 -3,-0.1 -0.426 82.1-106.3 -64.6 129.8 36.9 7.4 22.6 148 150 A Y > - 0 0 24 -2,-0.2 4,-1.9 1,-0.1 3,-0.5 -0.400 29.1-138.4 -59.4 121.6 38.9 9.6 20.3 149 151 A A H > S+ 0 0 0 1,-0.2 4,-2.2 -2,-0.2 5,-0.2 0.884 96.3 52.1 -53.3 -52.2 41.6 11.2 22.5 150 152 A P H > S+ 0 0 13 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.881 111.0 50.4 -55.5 -35.6 41.6 14.8 21.2 151 153 A E H > S+ 0 0 29 -3,-0.5 4,-1.8 2,-0.2 -2,-0.2 0.901 107.0 52.8 -67.7 -41.8 37.8 14.9 21.7 152 154 A L H X S+ 0 0 13 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.882 108.4 52.3 -60.6 -36.0 38.1 13.6 25.2 153 155 A L H X S+ 0 0 7 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.846 104.9 55.2 -68.9 -33.8 40.6 16.5 25.7 154 156 A F H X S+ 0 0 23 -4,-1.5 4,-1.1 1,-0.2 -1,-0.2 0.854 108.0 48.4 -68.0 -33.2 38.0 19.0 24.3 155 157 A F H X S+ 0 0 16 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.866 106.5 58.3 -71.7 -36.2 35.5 17.9 26.9 156 158 A A H X S+ 0 0 28 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.817 103.4 50.9 -62.9 -35.7 38.1 18.2 29.7 157 159 A K H X S+ 0 0 84 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.858 109.0 52.0 -72.0 -33.5 38.7 21.8 28.9 158 160 A R H X S+ 0 0 103 -4,-1.1 4,-1.1 2,-0.2 -2,-0.2 0.840 109.6 49.6 -70.3 -32.7 34.9 22.5 29.1 159 161 A Y H X S+ 0 0 68 -4,-1.8 4,-2.2 2,-0.2 3,-0.4 0.935 111.1 49.6 -69.0 -44.7 34.8 20.8 32.5 160 162 A K H X S+ 0 0 92 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.918 108.9 51.5 -58.9 -46.3 37.8 22.9 33.7 161 163 A A H X S+ 0 0 58 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.787 109.9 51.9 -62.6 -27.4 36.0 26.1 32.5 162 164 A A H X S+ 0 0 5 -4,-1.1 4,-1.6 -3,-0.4 5,-0.2 0.873 108.4 47.3 -78.3 -40.1 32.9 25.0 34.4 163 165 A F H X S+ 0 0 7 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.914 112.9 52.3 -67.4 -36.8 34.7 24.4 37.7 164 166 A T H < S+ 0 0 81 -4,-2.2 4,-0.3 -5,-0.2 -2,-0.2 0.926 115.0 39.1 -61.3 -47.5 36.4 27.8 37.3 165 167 A E H < S+ 0 0 135 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.679 125.0 39.0 -77.3 -21.3 33.2 29.7 36.6 166 168 A e H >< S+ 0 0 0 -4,-1.6 3,-1.4 2,-0.1 10,-0.2 0.817 101.2 63.5-101.1 -35.3 31.2 27.8 39.3 167 169 A d T 3< S+ 0 0 9 -4,-2.9 -3,-0.1 1,-0.3 -2,-0.1 0.537 106.3 51.0 -67.7 -6.4 33.5 27.2 42.3 168 170 A Q T 3 S+ 0 0 86 -4,-0.3 -1,-0.3 -5,-0.2 -2,-0.1 0.438 90.3 100.5-108.1 -6.0 33.7 31.0 42.7 169 171 A A S < S- 0 0 41 -3,-1.4 3,-0.3 1,-0.1 4,-0.1 -0.283 81.8-114.0 -78.7 165.7 29.9 31.7 42.7 170 172 A A S S+ 0 0 112 1,-0.3 2,-0.9 2,-0.1 -1,-0.1 0.985 114.2 32.0 -61.2 -60.1 27.7 32.2 45.7 171 173 A D S > S+ 0 0 100 1,-0.2 4,-1.0 2,-0.1 -1,-0.3 -0.855 74.1 178.5-102.6 99.4 25.7 29.1 45.2 172 174 A K H >> S+ 0 0 56 -2,-0.9 4,-3.4 -3,-0.3 3,-0.9 0.949 78.8 51.3 -64.9 -53.2 28.2 26.6 43.6 173 175 A A H 3> S+ 0 0 35 1,-0.3 4,-1.1 2,-0.2 -1,-0.2 0.897 106.6 56.3 -52.4 -43.5 25.9 23.6 43.3 174 176 A A H 34 S+ 0 0 53 1,-0.2 -1,-0.3 2,-0.1 -2,-0.2 0.812 117.8 34.3 -59.0 -32.9 23.3 25.8 41.5 175 177 A e H X S+ 0 0 0 -4,-3.4 4,-2.1 -10,-0.2 3,-1.0 0.962 106.6 54.2 -60.5 -64.4 28.0 23.5 38.6 177 179 A L H 3X S+ 0 0 60 -4,-1.1 4,-2.3 1,-0.3 5,-0.2 0.856 104.1 55.7 -41.1 -52.7 25.5 20.6 38.7 178 180 A P H 3> S+ 0 0 73 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.873 114.3 39.5 -53.7 -40.8 23.4 21.9 35.8 179 181 A K H S+ 0 0 25 -4,-2.6 4,-2.9 2,-0.2 5,-0.6 0.936 108.3 51.9 -60.3 -49.5 27.1 0.5 11.1 201 203 A L H X5S+ 0 0 24 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.946 117.4 41.0 -51.8 -50.0 30.2 0.5 8.9 202 204 A Q H <5S+ 0 0 63 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.977 120.3 40.0 -62.6 -60.4 30.8 -3.1 10.1 203 205 A K H <5S+ 0 0 118 -4,-3.8 -3,-0.2 1,-0.2 -2,-0.2 0.902 126.0 29.3 -60.7 -47.0 27.2 -4.4 9.9 204 206 A F H <5S- 0 0 70 -4,-2.9 4,-0.5 -5,-0.3 -1,-0.2 0.611 104.3-115.1 -98.0 -10.0 26.0 -2.7 6.7 205 207 A G X< - 0 0 29 -4,-1.5 4,-1.8 -5,-0.6 -1,-0.2 -0.026 29.1 -78.7 99.0 156.2 29.0 -2.3 4.5 206 208 A E H > S+ 0 0 112 1,-0.2 4,-2.6 2,-0.2 -1,-0.1 0.710 122.8 62.4 -66.7 -22.2 31.0 0.5 2.9 207 209 A R H > S+ 0 0 129 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.967 106.4 42.6 -67.8 -53.8 28.4 1.1 0.2 208 210 A A H > S+ 0 0 44 -4,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.905 115.4 51.2 -58.2 -44.1 25.7 2.0 2.7 209 211 A F H X S+ 0 0 17 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.937 108.2 50.9 -59.8 -48.5 28.2 4.1 4.6 210 212 A K H X S+ 0 0 66 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.848 109.6 52.1 -57.5 -36.1 29.2 5.9 1.4 211 213 A A H X S+ 0 0 31 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.928 110.2 47.4 -66.1 -45.7 25.6 6.6 0.7 212 214 A W H X S+ 0 0 77 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.905 112.9 50.0 -60.9 -42.9 25.1 8.1 4.1 213 215 A A H X S+ 0 0 2 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.846 107.3 52.7 -66.7 -37.2 28.2 10.2 3.7 214 216 A V H X S+ 0 0 12 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.949 112.8 44.4 -63.4 -50.3 27.2 11.6 0.3 215 217 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.963 116.6 46.6 -58.0 -54.1 23.9 12.8 1.6 216 218 A R H X S+ 0 0 53 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.897 114.8 45.5 -56.4 -47.3 25.4 14.2 4.8 217 219 A L H X S+ 0 0 25 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.903 109.8 54.9 -66.7 -40.0 28.2 16.0 3.0 218 220 A S H < S+ 0 0 0 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.870 105.2 52.4 -63.5 -35.1 26.0 17.4 0.3 219 221 A Q H < S+ 0 0 9 -4,-1.9 -1,-0.2 -5,-0.2 75,-0.2 0.918 116.0 41.4 -64.6 -41.9 23.6 19.0 2.9 220 222 A R H < S+ 0 0 45 -4,-1.4 74,-2.3 1,-0.2 -2,-0.2 0.863 125.7 32.7 -71.4 -42.8 26.6 20.7 4.6 221 223 A F >< + 0 0 9 -4,-2.8 3,-1.2 72,-0.2 -1,-0.2 -0.490 66.3 158.4-116.0 59.9 28.5 21.7 1.4 222 224 A P T 3 S+ 0 0 3 0, 0.0 -1,-0.1 0, 0.0 48,-0.1 0.720 75.6 55.5 -57.2 -20.4 25.7 22.4 -1.1 223 225 A K T 3 S+ 0 0 95 46,-0.4 47,-0.1 -3,-0.1 -2,-0.1 0.776 85.3 98.9 -82.4 -29.2 28.1 24.6 -3.1 224 226 A A S < S- 0 0 1 -3,-1.2 2,-0.1 45,-0.7 45,-0.1 -0.221 78.4-115.8 -58.1 149.1 30.7 21.9 -3.6 225 227 A E > - 0 0 137 43,-0.4 4,-2.2 1,-0.1 3,-0.3 -0.469 24.7-109.0 -83.5 160.2 30.6 20.0 -6.9 226 228 A F H > S+ 0 0 35 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.833 119.2 55.7 -58.1 -35.1 29.9 16.2 -7.0 227 229 A A H > S+ 0 0 70 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.897 109.1 48.0 -64.6 -39.4 33.5 15.4 -7.9 228 230 A E H > S+ 0 0 27 -3,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.898 111.6 49.5 -65.9 -43.8 34.6 17.2 -4.8 229 231 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.848 109.5 50.8 -65.6 -36.2 32.0 15.4 -2.6 230 232 A S H X S+ 0 0 36 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.858 108.2 54.0 -71.6 -33.1 33.0 12.0 -3.9 231 233 A K H X S+ 0 0 72 -4,-1.5 4,-2.3 -5,-0.2 -2,-0.2 0.981 112.3 43.0 -61.0 -56.1 36.5 12.8 -3.2 232 234 A L H X S+ 0 0 4 -4,-2.3 4,-3.2 1,-0.2 5,-0.2 0.839 110.7 54.8 -58.6 -40.7 35.6 13.7 0.5 233 235 A V H X S+ 0 0 6 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.933 109.2 50.0 -61.1 -44.6 33.3 10.7 0.9 234 236 A T H X S+ 0 0 74 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.969 115.8 39.6 -57.8 -56.7 36.2 8.4 -0.2 235 237 A D H X S+ 0 0 50 -4,-2.3 4,-2.2 1,-0.2 3,-0.3 0.907 113.8 54.9 -60.6 -42.4 38.7 9.9 2.2 236 238 A L H X S+ 0 0 41 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.855 106.6 53.0 -59.8 -34.1 36.1 10.2 5.0 237 239 A T H X S+ 0 0 7 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.840 108.5 48.4 -71.9 -31.6 35.4 6.5 4.5 238 240 A K H X S+ 0 0 71 -4,-1.5 4,-2.0 -3,-0.3 5,-0.2 0.840 110.3 53.0 -74.8 -34.0 39.1 5.6 4.9 239 241 A V H X S+ 0 0 12 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.939 108.3 48.8 -66.2 -46.8 39.2 7.8 8.0 240 242 A H H X S+ 0 0 34 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.883 108.8 54.5 -62.9 -37.2 36.3 6.0 9.6 241 243 A T H X S+ 0 0 74 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.965 114.9 36.9 -61.3 -54.2 37.8 2.6 8.9 242 244 A E H X>S+ 0 0 23 -4,-2.0 4,-0.9 1,-0.2 5,-0.7 0.936 116.7 52.4 -67.9 -41.7 41.1 3.2 10.6 243 245 A g H <5S+ 0 0 37 -4,-2.8 3,-0.4 -5,-0.2 -1,-0.2 0.833 110.9 48.7 -62.9 -28.4 39.6 5.3 13.4 244 246 A f H <5S+ 0 0 44 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.833 99.3 66.0 -76.7 -31.7 37.1 2.4 14.1 245 247 A H H <5S- 0 0 102 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.748 111.8-123.1 -59.5 -24.6 40.0 -0.1 14.1 246 248 A G T <5 + 0 0 25 -4,-0.9 2,-1.4 -3,-0.4 -3,-0.1 0.263 64.5 138.8 100.5 -12.1 41.2 1.8 17.2 247 249 A D >< - 0 0 13 -5,-0.7 4,-2.7 1,-0.2 5,-0.2 -0.534 33.5-167.8 -71.5 93.3 44.7 2.8 16.2 248 250 A L H > S+ 0 0 29 -2,-1.4 4,-3.0 1,-0.2 5,-0.2 0.883 81.0 51.5 -47.5 -52.4 44.8 6.4 17.7 249 251 A L H > S+ 0 0 35 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.911 113.6 42.3 -57.0 -47.4 48.0 7.4 15.9 250 252 A E H > S+ 0 0 75 -3,-0.2 4,-2.7 2,-0.2 5,-0.2 0.943 114.4 52.9 -64.9 -45.5 46.8 6.4 12.4 251 253 A g H X S+ 0 0 7 -4,-2.7 4,-2.5 -9,-0.2 -2,-0.2 0.919 109.2 48.2 -54.6 -49.1 43.4 7.8 13.1 252 254 A A H X S+ 0 0 18 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.890 111.4 50.1 -62.7 -41.0 44.8 11.2 14.1 253 255 A D H X S+ 0 0 55 -4,-2.0 4,-2.7 -5,-0.2 -1,-0.2 0.938 111.2 48.1 -64.4 -45.3 47.0 11.4 11.1 254 256 A D H X S+ 0 0 40 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.929 113.0 48.6 -61.9 -41.5 44.2 10.6 8.7 255 257 A R H X S+ 0 0 49 -4,-2.5 4,-2.5 -5,-0.2 5,-0.2 0.931 112.3 47.8 -63.2 -44.7 42.0 13.2 10.4 256 258 A A H X S+ 0 0 30 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.939 110.7 51.7 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-80.3 143.8 22.7 26.7 -1.4 297 299 A P - 0 0 48 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.670 30.2-148.5 -35.4 -39.2 23.5 28.4 -4.7 298 300 A A S S+ 0 0 96 1,-0.1 -2,-0.0 0, 0.0 2,-0.0 0.135 84.2 86.0 81.9 -19.1 19.9 29.6 -5.4 299 301 A D + 0 0 148 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.286 63.0 137.9-104.8 43.7 20.7 29.2 -9.0 300 302 A L - 0 0 40 1,-0.1 -4,-0.0 -4,-0.1 0, 0.0 -0.779 44.9-139.1-100.8 134.3 19.8 25.5 -9.1 301 303 A P - 0 0 97 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.377 39.6 -76.8 -63.5-153.9 17.8 23.7 -11.9 302 304 A S >> - 0 0 72 1,-0.1 4,-0.9 0, 0.0 3,-0.5 -0.906 18.4-138.0-118.3 145.5 15.1 21.1 -11.2 303 305 A L H 3> S+ 0 0 16 -2,-0.4 4,-2.0 1,-0.2 5,-0.5 0.827 104.8 63.5 -65.2 -33.0 15.5 17.5 -10.2 304 306 A A H 3>>S+ 0 0 19 3,-0.2 5,-3.2 1,-0.2 4,-1.6 0.848 96.3 62.3 -59.9 -34.7 12.7 16.5 -12.6 305 307 A A H <4>S+ 0 0 34 -3,-0.5 5,-2.1 3,-0.2 4,-0.2 0.977 115.4 22.4 -55.9 -69.5 14.9 17.7 -15.4 306 308 A D H <5S+ 0 0 110 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.690 134.5 34.0 -76.7 -19.7 17.9 15.3 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4.8 -15.1 318 320 A A H 3< S+ 0 0 70 -4,-3.0 3,-0.4 1,-0.2 -2,-0.2 0.788 102.9 66.7 -64.5 -27.0 23.3 1.5 -16.6 319 321 A E H 3< S- 0 0 150 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.818 130.8 -10.4 -64.1 -33.7 26.6 3.1 -17.4 320 322 A A S+ 0 0 86 -3,-0.4 4,-3.2 1,-0.2 5,-0.3 0.892 84.2 43.4 -45.2 -61.5 24.6 2.7 -11.3 322 324 A D H > S+ 0 0 90 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.886 115.8 49.5 -56.5 -42.9 26.1 3.7 -7.9 323 325 A V H > S+ 0 0 75 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.937 113.0 46.1 -64.1 -44.4 27.6 6.9 -9.4 324 326 A F H >X S+ 0 0 16 -4,-2.9 4,-2.1 -7,-0.2 3,-0.5 0.972 115.1 47.1 -60.2 -53.9 24.4 7.9 -11.0 325 327 A L H 3X S+ 0 0 15 -4,-3.2 4,-2.1 1,-0.3 -1,-0.2 0.861 109.6 53.9 -54.3 -39.1 22.5 7.1 -7.8 326 328 A G H 3X S+ 0 0 13 -4,-2.6 4,-2.6 -5,-0.3 -1,-0.3 0.856 106.4 52.9 -64.3 -34.5 25.1 9.0 -5.8 327 329 A M H < S+ 0 0 0 -4,-4.0 3,-1.0 1,-0.2 -2,-0.2 0.893 105.8 52.8 -67.1 -42.6 20.5 16.4 -0.5 334 336 A R H 3< S+ 0 0 25 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.721 111.4 49.5 -69.0 -14.6 22.0 19.8 -1.2 335 337 A R H 3< S+ 0 0 42 -4,-0.5 -1,-0.3 -3,-0.5 -2,-0.2 0.578 113.4 50.3 -94.7 -11.5 18.5 21.0 -2.0 336 338 A H X< + 0 0 41 -3,-1.0 3,-1.2 -4,-0.6 -1,-0.2 -0.601 47.4 150.7-133.0 76.0 17.2 19.6 1.2 337 339 A P T 3 S+ 0 0 42 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.681 79.1 67.3 -73.0 -17.3 19.1 20.5 4.5 338 340 A D T 3 S+ 0 0 45 -3,-0.1 106,-0.4 106,-0.1 2,-0.2 0.538 85.5 85.0 -81.3 -8.5 15.7 20.1 6.1 339 341 A Y S < S- 0 0 18 -3,-1.2 2,-0.1 -6,-0.2 -3,-0.0 -0.651 82.5-116.2 -93.7 153.3 15.5 16.4 5.5 340 342 A S > - 0 0 6 -2,-0.2 4,-1.7 1,-0.1 5,-0.1 -0.484 29.6-116.7 -77.0 157.3 17.1 13.7 7.8 341 343 A V H > S+ 0 0 1 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.911 114.4 55.5 -65.2 -40.3 19.8 11.7 6.0 342 344 A V H > S+ 0 0 24 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.855 104.8 53.4 -62.6 -32.8 17.8 8.4 6.3 343 345 A L H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.944 107.8 51.5 -63.7 -45.5 14.8 10.1 4.5 344 346 A L H X S+ 0 0 1 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.885 111.0 47.7 -57.3 -40.8 17.2 11.0 1.7 345 347 A L H X S+ 0 0 23 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.877 107.7 54.8 -69.8 -38.7 18.4 7.4 1.5 346 348 A R H X S+ 0 0 21 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.891 108.9 48.8 -61.7 -36.8 14.9 6.1 1.5 347 349 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.885 112.5 48.7 -68.2 -37.9 14.1 8.3 -1.5 348 350 A A H X S+ 0 0 13 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.864 110.7 48.7 -70.2 -37.6 17.3 7.1 -3.2 349 351 A K H X S+ 0 0 64 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.927 112.4 50.5 -68.2 -40.0 16.5 3.4 -2.6 350 352 A T H X S+ 0 0 31 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.931 111.4 47.1 -60.1 -48.0 13.0 4.1 -3.9 351 353 A Y H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.893 111.5 51.5 -61.1 -41.3 14.4 5.7 -7.0 352 354 A E H X S+ 0 0 46 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.920 107.9 52.2 -59.5 -47.6 16.9 2.9 -7.5 353 355 A T H X S+ 0 0 85 -4,-2.5 4,-0.6 1,-0.2 -1,-0.2 0.875 111.7 47.4 -55.0 -43.5 14.1 0.4 -7.3 354 356 A T H >X S+ 0 0 2 -4,-1.9 4,-3.2 2,-0.2 3,-0.8 0.896 110.8 48.4 -68.2 -46.2 12.2 2.3 -10.0 355 357 A L H 3X S+ 0 0 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0.929 109.3 58.4 -65.6 -43.1 5.4 8.3 25.6 406 408 A L H X S+ 0 0 1 -4,-2.6 4,-1.9 1,-0.2 5,-0.2 0.906 109.4 41.8 -51.1 -51.3 5.5 6.0 28.6 407 409 A V H X S+ 0 0 17 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.924 114.0 54.3 -64.5 -44.1 1.9 4.8 28.2 408 410 A R H X S+ 0 0 85 -4,-2.1 4,-0.6 -5,-0.2 -2,-0.2 0.881 114.9 35.6 -58.1 -45.8 2.4 4.6 24.4 409 411 A Y H X S+ 0 0 56 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.817 110.9 58.3 -83.3 -32.9 5.4 2.3 24.4 410 412 A T H < S+ 0 0 1 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.932 107.4 51.7 -60.8 -43.3 4.6 0.1 27.4 411 413 A K H < S+ 0 0 36 -4,-1.8 81,-2.3 -5,-0.2 -1,-0.2 0.794 111.8 46.5 -62.9 -28.6 1.4 -0.7 25.5 412 414 A K H < S+ 0 0 34 -4,-0.6 -2,-0.2 79,-0.3 -1,-0.2 0.815 130.8 16.8 -86.5 -30.7 3.4 -1.6 22.4 413 415 A V >< + 0 0 16 -4,-2.4 3,-1.7 1,-0.1 -1,-0.2 -0.573 66.0 165.7-141.9 73.6 6.1 -3.8 24.1 414 416 A P T 3 + 0 0 6 0, 0.0 -3,-0.1 0, 0.0 -1,-0.1 0.673 69.5 75.0 -61.9 -19.8 4.8 -4.8 27.6 415 417 A Q T 3 S+ 0 0 67 -3,-0.1 2,-0.1 2,-0.1 3,-0.1 0.597 75.2 103.9 -70.6 -13.7 7.5 -7.4 27.8 416 418 A V S < S- 0 0 27 -3,-1.7 2,-0.1 -6,-0.2 -3,-0.0 -0.381 84.5 -96.5 -74.1 150.9 10.2 -4.8 28.4 417 419 A S > - 0 0 63 1,-0.1 4,-2.2 -2,-0.1 3,-0.4 -0.377 28.5-128.5 -63.8 139.5 11.6 -4.1 31.8 418 420 A T H > S+ 0 0 10 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.913 108.3 51.7 -58.8 -45.1 10.0 -1.2 33.7 419 421 A P H > S+ 0 0 89 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.821 110.9 49.4 -63.1 -27.2 13.3 0.5 34.4 420 422 A T H > S+ 0 0 44 -3,-0.4 4,-2.7 2,-0.2 -2,-0.2 0.865 109.3 50.5 -77.4 -38.8 14.2 0.3 30.8 421 423 A L H X S+ 0 0 8 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.897 111.8 49.3 -65.2 -40.6 10.8 1.7 29.6 422 424 A V H X S+ 0 0 6 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.951 112.3 46.7 -63.9 -49.9 11.2 4.6 32.0 423 425 A E H X S+ 0 0 113 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.925 114.2 48.3 -58.8 -46.0 14.8 5.4 30.9 424 426 A V H X S+ 0 0 18 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.942 112.0 48.0 -59.8 -49.5 13.7 5.2 27.2 425 427 A S H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.877 111.8 50.3 -62.1 -38.0 10.7 7.4 27.6 426 428 A R H X S+ 0 0 27 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.920 110.9 48.1 -67.3 -44.1 12.7 10.0 29.6 427 429 A N H X S+ 0 0 54 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.902 109.5 53.3 -63.0 -40.4 15.4 10.2 26.9 428 430 A L H X S+ 0 0 26 -4,-2.5 4,-2.3 1,-0.2 3,-0.3 0.917 105.9 54.7 -60.4 -42.1 12.9 10.5 24.2 429 431 A G H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.3 -1,-0.2 0.904 104.1 53.1 -58.5 -42.8 11.3 13.4 26.0 430 432 A K H X S+ 0 0 73 -4,-1.8 4,-1.9 1,-0.2 -1,-0.3 0.833 106.8 53.8 -62.9 -30.8 14.7 15.3 26.2 431 433 A V H X S+ 0 0 17 -4,-1.4 4,-3.0 -3,-0.3 5,-0.3 0.946 108.6 48.6 -67.6 -45.0 14.9 14.8 22.4 432 434 A G H X S+ 0 0 10 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.892 112.6 49.3 -59.8 -37.3 11.5 16.4 22.1 433 435 A S H < S+ 0 0 33 -4,-2.5 -1,-0.2 2,-0.2 4,-0.2 0.798 116.0 40.9 -73.4 -28.6 12.7 19.2 24.4 434 436 A K H < S+ 0 0 122 -4,-1.9 3,-0.3 -3,-0.2 -2,-0.2 0.899 123.1 37.2 -83.0 -46.4 15.9 19.8 22.4 435 437 A m H >< S+ 0 0 7 -4,-3.0 3,-1.1 -5,-0.2 -2,-0.2 0.723 105.1 62.7 -83.6 -24.9 14.5 19.5 18.9 436 438 A l T 3< S+ 0 0 11 -4,-2.0 -1,-0.2 -5,-0.3 -3,-0.1 0.685 92.1 67.7 -76.7 -13.9 11.1 21.1 19.2 437 439 A K T 3 S+ 0 0 157 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.565 89.3 89.3 -78.4 -7.1 12.6 24.4 20.1 438 440 A H S < S- 0 0 76 -3,-1.1 2,-0.1 1,-0.1 5,-0.1 -0.456 88.5-101.8 -86.9 160.2 13.9 24.4 16.5 439 441 A P >> - 0 0 92 0, 0.0 3,-2.3 0, 0.0 4,-0.7 -0.414 44.2 -95.4 -76.6 163.4 12.2 25.8 13.5 440 442 A E T 34 S+ 0 0 149 1,-0.3 4,-0.4 2,-0.2 3,-0.2 0.700 121.9 59.7 -51.9 -23.0 10.5 23.4 11.1 441 443 A A T 34 S+ 0 0 65 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.642 109.9 39.3 -83.6 -13.7 13.5 23.3 8.8 442 444 A K T <> S+ 0 0 50 -3,-2.3 4,-1.5 -7,-0.1 -1,-0.2 0.388 94.7 86.7-114.4 1.1 15.9 22.0 11.4 443 445 A R H X S+ 0 0 57 -4,-0.7 4,-2.4 2,-0.2 5,-0.2 0.887 84.5 47.8 -72.8 -43.8 13.7 19.6 13.2 444 446 A M H > S+ 0 0 12 -4,-0.4 4,-2.7 -106,-0.4 5,-0.3 0.947 113.2 49.4 -65.0 -46.8 14.0 16.3 11.2 445 447 A P H > S+ 0 0 25 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.931 112.2 49.5 -57.5 -41.1 17.8 16.6 11.2 446 448 A m H X S+ 0 0 14 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.921 112.3 46.0 -61.4 -48.0 17.8 17.2 15.0 447 449 A A H X S+ 0 0 18 -4,-2.4 4,-3.3 2,-0.2 5,-0.3 0.889 110.7 53.0 -63.7 -42.1 15.5 14.2 15.7 448 450 A E H X S+ 0 0 20 -4,-2.7 4,-2.4 1,-0.2 5,-0.3 0.975 106.2 55.3 -56.9 -54.2 17.5 11.9 13.4 449 451 A D H X S+ 0 0 49 -4,-2.4 4,-0.8 -5,-0.3 -2,-0.2 0.896 119.7 29.0 -42.3 -56.3 20.6 12.9 15.3 450 452 A Y H X S+ 0 0 73 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.863 116.0 56.8 -78.7 -39.4 19.3 11.9 18.7 451 453 A L H X S+ 0 0 44 -4,-3.3 4,-2.6 1,-0.2 5,-0.2 0.842 101.4 58.9 -63.4 -34.2 16.8 9.2 17.8 452 454 A S H X S+ 0 0 38 -4,-2.4 4,-2.0 -5,-0.3 -1,-0.2 0.923 108.3 42.8 -63.3 -45.2 19.5 7.1 16.1 453 455 A V H X S+ 0 0 12 -4,-0.8 4,-2.3 -5,-0.3 -1,-0.2 0.850 116.0 49.6 -70.9 -32.1 21.8 6.8 19.1 454 456 A V H X S+ 0 0 22 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.892 112.7 46.3 -71.1 -40.7 18.8 6.1 21.3 455 457 A L H X S+ 0 0 19 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.831 114.1 49.6 -71.2 -32.6 17.4 3.4 19.0 456 458 A N H X S+ 0 0 8 -4,-2.0 4,-2.7 -5,-0.2 5,-0.3 0.948 109.3 48.7 -71.7 -48.6 20.9 1.9 18.7 457 459 A Q H X S+ 0 0 70 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.901 110.8 55.3 -54.8 -40.0 21.5 1.8 22.5 458 460 A L H X S+ 0 0 42 -4,-1.7 4,-2.7 -5,-0.2 -1,-0.2 0.955 110.5 43.4 -57.1 -52.8 18.1 0.2 22.6 459 461 A n H X S+ 0 0 8 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.865 109.0 53.3 -65.7 -41.5 19.1 -2.6 20.2 460 462 A V H X S+ 0 0 58 -4,-2.7 4,-1.3 2,-0.2 -1,-0.2 0.923 112.4 49.6 -60.1 -38.9 22.5 -3.4 21.5 461 463 A L H >X S+ 0 0 85 -4,-1.9 4,-1.8 -5,-0.3 3,-1.6 0.991 112.0 45.0 -59.5 -61.6 20.7 -3.9 24.8 462 464 A H H 3< S+ 0 0 23 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.813 104.2 65.1 -53.0 -32.3 18.0 -6.1 23.3 463 465 A E H 3< S+ 0 0 149 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.902 108.1 41.8 -58.8 -37.8 20.7 -8.0 21.5 464 466 A K H << S+ 0 0 126 -3,-1.6 -2,-0.2 -4,-1.3 -1,-0.2 0.979 130.2 22.4 -72.6 -61.0 21.9 -9.1 25.0 465 467 A T S < S- 0 0 100 -4,-1.8 -1,-0.3 0, 0.0 -2,-0.1 -0.739 85.4-155.6-112.3 83.2 18.6 -9.8 26.7 466 468 A P + 0 0 88 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.167 25.5 160.3 -54.4 148.2 16.1 -10.5 23.8 467 469 A V + 0 0 66 1,-0.3 2,-0.4 -51,-0.0 3,-0.1 0.538 57.7 30.2-141.4 -39.4 12.5 -9.9 24.7 468 470 A S > - 0 0 10 1,-0.1 4,-2.5 -6,-0.0 -1,-0.3 -0.992 52.7-148.0-136.3 133.1 10.4 -9.5 21.5 469 471 A D H > S+ 0 0 132 -2,-0.4 4,-2.3 1,-0.2 5,-0.1 0.894 105.0 59.0 -60.7 -34.9 10.7 -10.9 18.0 470 472 A R H > S+ 0 0 59 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.919 106.2 44.9 -60.6 -44.7 9.2 -7.6 16.9 471 473 A V H > S+ 0 0 14 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.973 112.5 52.1 -62.2 -52.5 11.9 -5.5 18.4 472 474 A T H X S+ 0 0 51 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.843 106.9 54.8 -51.0 -38.0 14.6 -7.8 17.1 473 475 A K H X S+ 0 0 119 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.944 113.1 40.2 -62.9 -47.9 13.0 -7.5 13.6 474 476 A o H < S+ 0 0 2 -4,-1.9 -2,-0.2 -3,-0.2 -1,-0.2 0.865 117.7 50.7 -67.5 -36.9 13.3 -3.7 13.7 475 477 A n H < S+ 0 0 12 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.817 116.5 37.2 -71.3 -35.8 16.7 -3.9 15.3 476 478 A T H < S+ 0 0 105 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.577 102.7 89.7 -95.0 -11.0 18.2 -6.3 12.8 477 479 A E S < S- 0 0 64 -4,-1.2 5,-0.1 -5,-0.2 -3,-0.1 0.038 94.7 -43.5 -73.9-172.2 16.5 -4.9 9.8 478 480 A S >> - 0 0 50 1,-0.1 4,-0.8 3,-0.1 3,-0.6 -0.170 44.0-132.1 -55.7 144.2 17.8 -2.1 7.5 479 481 A L T 34 S+ 0 0 50 1,-0.2 4,-0.3 2,-0.2 -1,-0.1 0.701 109.8 57.1 -70.2 -17.9 19.4 0.9 9.2 480 482 A V T 34 S+ 0 0 22 1,-0.2 -1,-0.2 2,-0.1 -134,-0.1 0.717 113.4 35.8 -85.1 -24.1 17.1 2.9 6.8 481 483 A N T <> S+ 0 0 70 -3,-0.6 4,-2.5 2,-0.1 5,-0.2 0.365 87.4 103.5-109.2 3.5 13.9 1.3 8.0 482 484 A R H X S+ 0 0 15 -4,-0.8 4,-1.4 1,-0.2 5,-0.1 0.940 86.9 37.8 -49.0 -59.4 14.9 1.0 11.7 483 485 A R H > S+ 0 0 42 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.863 115.2 52.3 -65.1 -41.1 12.8 3.9 12.9 484 486 A P H > S+ 0 0 29 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.878 107.5 54.3 -63.8 -35.5 9.8 3.4 10.6 485 487 A o H < S+ 0 0 22 -4,-2.5 -2,-0.2 2,-0.2 4,-0.2 0.861 111.0 45.5 -64.5 -38.0 9.6 -0.3 11.8 486 488 A F H >< S+ 0 0 30 -4,-1.4 3,-1.3 -5,-0.2 -1,-0.2 0.875 109.7 54.0 -73.5 -36.7 9.5 1.0 15.4 487 489 A S H 3< S+ 0 0 49 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.836 106.1 55.2 -64.5 -30.2 6.9 3.6 14.5 488 490 A A T 3< S+ 0 0 67 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.491 76.9 122.9 -82.3 -4.5 4.8 0.8 13.0 489 491 A L < - 0 0 22 -3,-1.3 2,-0.2 -4,-0.2 -76,-0.1 -0.358 52.1-149.2 -59.2 137.1 4.8 -1.3 16.2 490 492 A E - 0 0 150 -78,-0.2 -1,-0.1 1,-0.1 -2,-0.0 -0.670 30.0 -78.7-106.4 162.4 1.2 -1.9 17.2 491 493 A V - 0 0 82 -2,-0.2 2,-1.3 1,-0.1 -79,-0.3 -0.375 55.3-108.1 -59.3 137.5 -0.3 -2.3 20.7 492 494 A D + 0 0 27 -81,-2.3 -1,-0.1 1,-0.2 -79,-0.1 -0.577 41.2 175.3 -75.5 92.0 0.5 -5.9 21.8 493 495 A E S S+ 0 0 113 -2,-1.3 -1,-0.2 1,-0.2 -2,-0.0 0.811 78.1 58.8 -65.1 -32.7 -2.9 -7.6 21.7 494 496 A T S S+ 0 0 122 -3,-0.1 -1,-0.2 2,-0.1 -2,-0.1 0.968 80.0 108.4 -59.2 -61.0 -1.2 -10.9 22.6 495 497 A Y - 0 0 45 1,-0.1 -82,-0.0 40,-0.0 0, 0.0 0.302 62.2-137.7 -22.3 140.5 0.2 -9.7 26.0 496 498 A V - 0 0 116 1,-0.0 -1,-0.1 39,-0.0 3,-0.1 -0.931 28.1-104.7-112.0 122.7 -1.3 -11.1 29.2 497 499 A P - 0 0 73 0, 0.0 2,-0.5 0, 0.0 36,-0.2 -0.044 31.6-113.0 -46.4 140.7 -1.8 -8.7 32.1 498 500 A K - 0 0 94 34,-2.1 3,-0.1 31,-0.1 0, 0.0 -0.626 41.2-107.4 -77.4 125.1 0.6 -8.8 35.0 499 501 A E - 0 0 112 -2,-0.5 -1,-0.1 1,-0.1 34,-0.0 -0.150 46.6 -84.7 -52.9 143.6 -1.3 -10.0 38.1 500 502 A F - 0 0 80 33,-0.1 2,-0.3 -3,-0.0 -1,-0.1 -0.044 45.2-177.3 -50.4 149.4 -2.1 -7.4 40.7 501 503 A N > - 0 0 80 -3,-0.1 4,-0.6 1,-0.1 -1,-0.0 -0.931 17.6-162.4-152.6 123.2 0.5 -6.6 43.4 502 504 A A T >4 S+ 0 0 51 -2,-0.3 3,-0.9 2,-0.2 -1,-0.1 0.872 90.6 62.9 -76.1 -39.0 -0.0 -4.1 46.2 503 505 A E G >4 S+ 0 0 79 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.862 102.6 55.2 -51.4 -37.6 3.7 -3.6 47.1 504 506 A T G 34 S+ 0 0 49 1,-0.3 -1,-0.3 25,-0.0 -2,-0.2 0.791 115.5 35.1 -66.9 -33.8 3.9 -2.2 43.5 505 507 A F G << S+ 0 0 36 -3,-0.9 2,-0.6 -4,-0.6 -1,-0.3 -0.020 91.8 113.2-113.8 31.1 1.2 0.4 44.1 506 508 A T < - 0 0 75 -3,-1.0 2,-0.3 68,-0.0 61,-0.1 -0.901 47.6-166.7-106.1 115.3 2.0 1.1 47.7 507 509 A F - 0 0 31 -2,-0.6 2,-0.3 59,-0.3 63,-0.1 -0.754 4.5-160.9-106.3 151.4 3.3 4.6 48.4 508 510 A H > - 0 0 122 -2,-0.3 3,-1.8 59,-0.0 4,-0.1 -0.836 36.3-103.3-123.9 161.9 5.0 6.1 51.5 509 511 A A T >> S+ 0 0 25 -2,-0.3 3,-3.2 1,-0.3 4,-0.6 0.695 104.7 85.5 -57.1 -22.2 5.6 9.6 52.7 510 512 A D H >> S+ 0 0 71 1,-0.3 4,-1.7 2,-0.2 3,-0.5 0.789 73.8 72.7 -51.7 -29.1 9.2 9.5 51.6 511 513 A I H <4 S+ 0 0 11 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.653 93.2 57.0 -64.0 -8.2 8.0 10.6 48.2 512 514 A p H <4 S+ 0 0 38 -3,-3.2 -1,-0.3 1,-0.1 -2,-0.2 0.864 105.9 45.2 -91.1 -33.7 7.5 13.9 49.9 513 515 A T H << S+ 0 0 124 -4,-0.6 -2,-0.2 -3,-0.5 -1,-0.1 0.706 97.0 108.1 -77.3 -17.9 11.2 14.3 51.0 514 516 A L S < S- 0 0 42 -4,-1.7 2,-0.1 1,-0.1 -3,-0.0 -0.093 73.5-112.0 -60.8 156.7 12.3 13.2 47.6 515 517 A S > - 0 0 68 1,-0.1 4,-2.3 0, 0.0 5,-0.3 -0.465 35.6 -98.9 -85.1 160.6 13.8 15.4 44.9 516 518 A E H > S+ 0 0 116 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.860 123.8 46.7 -47.1 -44.5 12.1 16.3 41.7 517 519 A K H > S+ 0 0 134 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.913 111.8 49.9 -68.6 -41.8 14.0 13.7 39.7 518 520 A E H > S+ 0 0 54 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.850 111.8 45.4 -66.9 -37.4 13.5 10.9 42.3 519 521 A R H X S+ 0 0 81 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.718 110.2 55.7 -80.4 -19.1 9.7 11.3 42.7 520 522 A Q H X S+ 0 0 32 -4,-1.1 4,-4.0 -5,-0.3 5,-0.3 0.967 110.0 44.8 -71.3 -53.8 9.3 11.5 38.9 521 523 A I H X S+ 0 0 50 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.840 114.1 52.9 -55.7 -34.4 11.1 8.2 38.5 522 524 A K H X S+ 0 0 109 -4,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.952 115.0 38.2 -66.8 -51.3 8.9 7.0 41.4 523 525 A K H X S+ 0 0 63 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.920 117.1 50.8 -66.3 -45.2 5.7 8.0 39.8 524 526 A Q H X S+ 0 0 0 -4,-4.0 4,-2.2 1,-0.2 -1,-0.2 0.895 106.8 54.6 -61.7 -38.7 6.7 7.1 36.3 525 527 A T H X S+ 0 0 52 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.895 110.9 46.1 -60.4 -40.6 7.8 3.6 37.4 526 528 A A H X S+ 0 0 14 -4,-1.5 4,-2.8 2,-0.2 -1,-0.2 0.900 107.9 56.9 -68.1 -42.2 4.3 3.1 38.9 527 529 A L H X S+ 0 0 15 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.892 107.1 48.7 -57.0 -41.6 2.7 4.5 35.7 528 530 A V H X S+ 0 0 1 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.954 111.9 48.9 -64.5 -47.1 4.5 1.8 33.7 529 531 A E H X S+ 0 0 24 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.861 108.1 55.5 -59.6 -36.8 3.4 -0.9 36.2 530 532 A L H X S+ 0 0 24 -4,-2.8 4,-2.2 1,-0.2 3,-0.2 0.922 110.0 44.5 -63.0 -43.9 -0.2 0.4 36.0 531 533 A V H < S+ 0 0 3 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.867 110.7 54.5 -70.8 -33.7 -0.3 0.0 32.2 532 534 A K H < S+ 0 0 10 -4,-2.4 -34,-2.1 1,-0.2 -1,-0.2 0.765 112.7 44.8 -69.9 -22.2 1.3 -3.4 32.4 533 535 A H H < S+ 0 0 40 -4,-1.3 -2,-0.2 -3,-0.2 -1,-0.2 0.844 129.5 22.0 -87.6 -37.3 -1.5 -4.5 34.8 534 536 A K >< + 0 0 37 -4,-2.2 3,-1.4 -5,-0.1 -1,-0.2 -0.621 69.1 163.6-132.1 71.5 -4.4 -3.0 32.9 535 537 A P T 3 S+ 0 0 25 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.642 72.1 63.1 -62.4 -21.3 -3.2 -2.6 29.2 536 538 A K T 3 S+ 0 0 192 45,-0.1 2,-0.1 2,-0.0 -5,-0.1 0.256 77.2 121.6 -91.2 10.1 -6.8 -2.2 27.9 537 539 A A < - 0 0 6 -3,-1.4 2,-0.1 -6,-0.2 44,-0.0 -0.468 63.5-116.2 -75.4 148.6 -7.3 1.0 29.8 538 540 A T > - 0 0 71 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.349 20.9-113.1 -80.4 162.7 -8.2 4.2 27.9 539 541 A K H > S+ 0 0 179 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.819 124.3 47.9 -61.2 -27.7 -6.1 7.3 27.7 540 542 A E H > S+ 0 0 149 2,-0.2 4,-2.2 3,-0.2 -1,-0.2 0.858 107.4 48.9 -81.5 -41.8 -9.0 8.7 29.7 541 543 A Q H > S+ 0 0 73 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.894 116.1 48.1 -64.4 -38.4 -9.4 6.0 32.3 542 544 A L H X S+ 0 0 2 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.900 107.9 52.9 -68.2 -42.6 -5.6 6.4 32.8 543 545 A K H X S+ 0 0 43 -4,-1.5 4,-1.6 -5,-0.2 -2,-0.2 0.906 110.4 49.7 -59.5 -41.2 -5.9 10.2 33.0 544 546 A A H X S+ 0 0 51 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.930 111.6 46.2 -64.0 -48.6 -8.5 9.9 35.7 545 547 A V H X S+ 0 0 14 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.894 112.7 51.0 -63.1 -38.4 -6.5 7.5 37.8 546 548 A M H X S+ 0 0 69 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.816 110.5 50.0 -67.9 -30.1 -3.4 9.7 37.4 547 549 A D H X S+ 0 0 115 -4,-1.6 4,-1.8 -5,-0.2 5,-0.3 0.909 108.0 51.4 -74.3 -41.8 -5.5 12.6 38.5 548 550 A D H X S+ 0 0 91 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.874 112.5 48.1 -60.6 -36.2 -6.8 10.8 41.6 549 551 A F H X S+ 0 0 33 -4,-1.9 4,-2.4 -5,-0.2 5,-0.2 0.866 104.9 60.3 -71.2 -39.5 -3.1 10.0 42.4 550 552 A A H X S+ 0 0 52 -4,-1.7 4,-1.5 1,-0.2 3,-0.3 0.974 110.0 38.8 -52.6 -63.2 -2.0 13.6 41.9 551 553 A A H X S+ 0 0 48 -4,-1.8 4,-3.9 1,-0.2 5,-0.2 0.855 110.5 64.7 -56.7 -35.7 -4.3 15.0 44.6 552 554 A F H < S+ 0 0 17 -4,-1.3 4,-0.4 -5,-0.3 -1,-0.2 0.949 103.5 43.8 -51.8 -55.7 -3.5 11.9 46.7 553 555 A V H X S+ 0 0 21 -4,-2.4 4,-1.5 -3,-0.3 3,-0.3 0.835 119.4 46.2 -60.0 -33.1 0.2 12.9 46.9 554 556 A E H X S+ 0 0 120 -4,-1.5 4,-1.7 -5,-0.2 3,-0.4 0.973 109.9 48.1 -74.7 -56.7 -0.8 16.5 47.6 555 557 A K H < S+ 0 0 80 -4,-3.9 -1,-0.2 1,-0.2 -2,-0.2 0.398 123.0 39.4 -66.7 4.7 -3.6 15.9 50.2 556 558 A q H 4 S+ 0 0 0 -4,-0.4 3,-0.5 -3,-0.3 -1,-0.2 0.523 111.4 52.0-125.0 -29.3 -1.1 13.6 52.0 557 559 A p H < S+ 0 0 49 -4,-1.5 -2,-0.2 -3,-0.4 -3,-0.2 0.650 117.0 42.8 -84.2 -18.4 2.3 15.4 51.6 558 560 A K S < S+ 0 0 92 -4,-1.7 2,-0.4 -5,-0.1 -1,-0.2 0.032 97.1 105.1-113.5 25.2 0.7 18.6 53.0 559 561 A A S S- 0 0 38 -3,-0.5 2,-0.4 -5,-0.0 6,-0.1 -0.875 81.8-104.4-112.4 141.0 -1.2 16.7 55.8 560 562 A D S S+ 0 0 169 -2,-0.4 5,-0.1 1,-0.1 -2,-0.1 -0.461 105.6 14.3 -61.0 114.9 -0.4 16.6 59.5 561 563 A D S > S- 0 0 88 -2,-0.4 4,-0.7 -4,-0.1 3,-0.2 0.818 74.9-166.9 79.0 104.4 1.1 13.2 60.0 562 564 A K H >> S+ 0 0 29 2,-0.2 4,-1.9 1,-0.1 2,-0.9 0.976 70.1 64.8 -85.0 -73.3 2.1 11.6 56.6 563 565 A E H 34 S+ 0 0 159 1,-0.3 -1,-0.1 2,-0.2 4,-0.0 0.423 109.8 47.2 -36.7 -2.6 2.9 7.8 56.8 564 566 A T H >> S+ 0 0 62 -2,-0.9 4,-3.0 -3,-0.2 3,-2.0 0.772 105.4 51.5-106.8 -58.2 -0.8 7.3 57.8 565 567 A q H S+ 0 0 18 -4,-0.7 4,-2.1 -3,-0.6 5,-0.8 0.875 109.9 57.8 -46.5 -37.2 -2.7 9.4 55.3 566 568 A F H 3<5S+ 0 0 5 -4,-1.9 -59,-0.3 1,-0.2 -1,-0.3 0.781 111.6 37.1 -65.0 -31.3 -0.6 7.4 52.9 567 569 A A H <>5S+ 0 0 59 -3,-2.0 4,-1.1 -5,-0.3 -2,-0.2 0.735 122.9 43.9 -92.3 -27.4 -1.8 4.1 54.1 568 570 A E H X5S+ 0 0 51 -4,-3.0 4,-1.5 2,-0.2 3,-0.2 0.972 123.7 31.4 -78.7 -67.3 -5.4 5.2 54.7 569 571 A E H X5S+ 0 0 79 -4,-2.1 4,-2.8 1,-0.2 -3,-0.2 0.823 118.1 60.8 -60.4 -31.0 -6.1 7.3 51.6 570 572 A G H >< S+ 0 0 72 -4,-1.2 3,-1.8 1,-0.2 -1,-0.2 0.909 109.6 52.5 -69.0 -45.1 -13.1 -0.5 40.3 580 582 A A H 3< S+ 0 0 66 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.955 108.8 49.7 -55.5 -52.5 -12.7 2.3 37.7 581 583 A L T 3< 0 0 22 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.193 360.0 360.0 -73.3 19.0 -10.4 0.2 35.6 582 584 A G < 0 0 92 -3,-1.8 -1,-0.2 -5,-0.1 -2,-0.1 0.177 360.0 360.0 24.8 360.0 -13.2 -2.5 35.9