==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-APR-08 3CZL . COMPND 2 MOLECULE: SUCROSE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOMONAS AXONOPODIS PV. GLYCINES; . AUTHOR M.I.KIM,S.RHEE . 612 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23409.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 440 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 7.8 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 38 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 89 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 189 30.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.1 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 3 3 2 3 1 3 0 0 0 2 0 0 1 2 1 0 1 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 2 3 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 2 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 6 A I 0 0 198 0, 0.0 47,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 39.0 -9.8 87.4 37.6 2 7 A D >> - 0 0 91 1,-0.2 4,-1.7 46,-0.1 3,-1.0 -0.669 360.0-178.9-118.6 76.7 -10.1 90.1 34.9 3 8 A P H 3> S+ 0 0 80 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.810 78.9 51.2 -41.5 -50.9 -8.9 88.5 31.6 4 9 A P H 3> S+ 0 0 83 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.872 111.2 49.2 -61.9 -34.7 -9.4 91.5 29.3 5 10 A A H <> S+ 0 0 48 -3,-1.0 4,-1.6 2,-0.2 5,-0.1 0.842 112.6 47.6 -70.7 -34.9 -7.4 93.7 31.6 6 11 A L H X S+ 0 0 18 -4,-1.7 4,-2.0 2,-0.2 5,-0.2 0.909 112.0 49.8 -71.9 -41.9 -4.6 91.2 31.8 7 12 A R H X S+ 0 0 80 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.906 109.7 51.9 -62.2 -39.6 -4.6 90.8 28.0 8 13 A A H X S+ 0 0 61 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.868 106.5 53.9 -65.3 -35.7 -4.5 94.6 27.8 9 14 A A H < S+ 0 0 26 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.904 113.0 42.8 -62.6 -43.6 -1.5 94.7 30.1 10 15 A F H < S+ 0 0 2 -4,-2.0 4,-0.3 1,-0.2 -2,-0.2 0.858 115.0 50.8 -68.9 -38.8 0.4 92.2 27.9 11 16 A A H >< S+ 0 0 26 -4,-2.5 3,-1.2 -5,-0.2 -2,-0.2 0.806 90.1 78.7 -72.7 -32.9 -0.7 93.9 24.7 12 17 A G T 3< S+ 0 0 59 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.1 0.892 94.7 43.4 -42.2 -63.9 0.3 97.4 25.5 13 18 A P T 3 S+ 0 0 32 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.603 93.1 99.9 -62.6 -16.0 4.1 97.1 24.9 14 19 A L S < S- 0 0 13 -3,-1.2 5,-0.1 -4,-0.3 46,-0.1 -0.345 75.7-121.9 -69.1 152.3 3.7 95.2 21.6 15 20 A D > - 0 0 54 3,-0.3 3,-1.3 1,-0.1 -1,-0.1 -0.770 18.4-120.0 -97.3 146.0 4.0 97.2 18.4 16 21 A P G >> S+ 0 0 127 0, 0.0 3,-1.2 0, 0.0 4,-0.5 0.821 110.1 61.5 -47.9 -39.2 1.0 97.2 15.9 17 22 A Q G 34 S+ 0 0 137 1,-0.3 3,-0.1 2,-0.1 -3,-0.0 0.836 120.2 25.2 -59.7 -34.2 3.1 95.6 13.1 18 23 A H G <4 S+ 0 0 42 -3,-1.3 -3,-0.3 1,-0.1 -1,-0.3 -0.322 96.0 93.6-127.5 50.6 3.6 92.6 15.2 19 24 A A T <> S+ 0 0 18 -3,-1.2 4,-3.1 -5,-0.1 5,-0.3 0.738 73.7 62.8-109.8 -31.3 0.8 92.4 17.6 20 25 A E H X S+ 0 0 169 -4,-0.5 4,-2.2 2,-0.2 5,-0.2 0.908 104.3 44.9 -62.9 -46.9 -1.7 90.2 15.9 21 26 A V H > S+ 0 0 73 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.972 117.9 45.6 -63.4 -48.6 0.3 87.0 15.7 22 27 A L H > S+ 0 0 8 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.930 113.9 47.5 -57.8 -50.1 1.4 87.4 19.4 23 28 A L H X S+ 0 0 24 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.852 107.4 58.0 -63.0 -32.5 -2.1 88.2 20.6 24 29 A S H X S+ 0 0 70 -4,-2.2 4,-1.2 -5,-0.3 -1,-0.2 0.923 109.3 44.3 -63.3 -41.4 -3.5 85.2 18.7 25 30 A R H X S+ 0 0 36 -4,-1.8 4,-1.6 2,-0.2 5,-0.3 0.864 111.1 54.1 -70.2 -36.1 -1.1 82.9 20.6 26 31 A Y H X S+ 0 0 11 -4,-2.3 4,-3.1 1,-0.2 3,-0.5 0.950 105.3 55.0 -60.6 -48.4 -1.9 84.7 23.9 27 32 A D H < S+ 0 0 77 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.841 112.7 41.3 -57.1 -32.7 -5.6 84.1 23.2 28 33 A Q H < S+ 0 0 151 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.724 128.8 25.0 -90.9 -15.9 -5.1 80.3 22.8 29 34 A H H >X S+ 0 0 46 -4,-1.6 4,-1.8 -3,-0.5 3,-0.6 0.629 94.7 87.0-118.5 -21.8 -2.6 79.7 25.6 30 35 A A H 3X S+ 0 0 7 -4,-3.1 4,-2.9 -5,-0.3 5,-0.2 0.833 85.2 59.0 -52.6 -38.2 -3.1 82.4 28.3 31 36 A S H 3> S+ 0 0 85 -5,-0.3 4,-2.5 -4,-0.3 -1,-0.2 0.910 105.3 48.8 -60.1 -42.9 -5.9 80.5 30.1 32 37 A R H <> S+ 0 0 38 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.933 112.6 50.2 -63.1 -41.9 -3.6 77.5 30.8 33 38 A L H X S+ 0 0 4 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.941 112.1 45.5 -58.3 -53.0 -0.9 80.0 32.0 34 39 A L H X S+ 0 0 31 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.855 111.1 53.2 -62.1 -36.6 -3.3 81.8 34.4 35 40 A D H X S+ 0 0 117 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.913 111.4 46.3 -64.6 -41.9 -4.7 78.5 35.7 36 41 A A H X S+ 0 0 8 -4,-2.2 4,-1.5 -5,-0.2 -2,-0.2 0.955 114.7 46.3 -64.2 -49.0 -1.2 77.3 36.5 37 42 A L H X>S+ 0 0 0 -4,-2.8 4,-3.3 1,-0.2 5,-0.8 0.858 110.7 53.8 -63.9 -34.9 -0.3 80.7 38.2 38 43 A H H X5S+ 0 0 89 -4,-2.5 4,-1.7 3,-0.2 5,-0.3 0.928 106.5 51.7 -63.8 -44.3 -3.6 80.7 40.1 39 44 A A H <5S+ 0 0 74 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.841 119.6 37.0 -60.1 -34.0 -2.9 77.3 41.5 40 45 A L H <5S+ 0 0 21 -4,-1.5 -2,-0.2 -5,-0.1 -1,-0.2 0.876 141.2 3.2 -86.6 -42.8 0.6 78.4 42.6 41 46 A Y H ><5S+ 0 0 2 -4,-3.3 3,-2.4 -5,-0.1 -3,-0.2 0.436 91.6 111.1-125.6 -7.2 0.0 82.0 43.8 42 47 A G T 3< S+ 0 0 67 1,-0.2 4,-2.2 2,-0.1 -1,-0.2 0.384 84.4 100.8 -85.6 2.9 -0.5 90.7 46.0 47 52 A Y H <> S+ 0 0 26 -3,-1.1 4,-2.8 -6,-0.2 -1,-0.2 0.896 76.8 46.9 -55.1 -54.2 -1.3 88.2 43.2 48 53 A A H > S+ 0 0 62 -3,-0.3 4,-2.0 -4,-0.3 -1,-0.2 0.895 116.2 43.5 -59.9 -44.6 -3.5 90.3 40.9 49 54 A S H > S+ 0 0 81 -4,-0.3 4,-2.0 2,-0.2 5,-0.2 0.901 114.5 49.8 -70.2 -40.7 -1.2 93.4 40.9 50 55 A W H X S+ 0 0 27 -4,-2.2 4,-3.2 1,-0.2 5,-0.3 0.953 111.3 51.3 -59.7 -49.7 1.9 91.3 40.5 51 56 A L H X S+ 0 0 8 -4,-2.8 4,-2.7 -5,-0.2 -2,-0.2 0.902 111.1 44.8 -53.4 -51.0 0.3 89.4 37.6 52 57 A A H X S+ 0 0 38 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.841 115.7 48.3 -66.2 -34.3 -0.8 92.5 35.6 53 58 A Q H X S+ 0 0 92 -4,-2.0 4,-1.7 2,-0.2 3,-0.3 0.965 113.5 46.1 -70.0 -51.9 2.6 94.1 36.2 54 59 A W H X S+ 0 0 1 -4,-3.2 4,-2.8 1,-0.2 -2,-0.2 0.907 108.5 55.7 -58.0 -44.5 4.6 91.0 35.1 55 60 A L H X S+ 0 0 3 -4,-2.7 4,-2.8 -5,-0.3 -1,-0.2 0.890 105.0 53.7 -57.9 -36.2 2.4 90.5 32.0 56 61 A G H X S+ 0 0 18 -4,-1.3 4,-2.2 -3,-0.3 -1,-0.2 0.916 110.1 47.1 -61.8 -43.8 3.2 94.0 30.9 57 62 A E H X S+ 0 0 68 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.881 109.9 53.1 -63.8 -40.9 6.9 93.1 31.2 58 63 A V H X S+ 0 0 7 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.946 109.0 49.9 -60.3 -47.0 6.3 89.9 29.4 59 64 A G H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.903 108.1 53.1 -57.7 -42.9 4.7 91.9 26.6 60 65 A D H X S+ 0 0 62 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.909 111.5 45.2 -60.2 -42.8 7.6 94.3 26.5 61 66 A I H X S+ 0 0 10 -4,-2.2 4,-0.8 2,-0.2 -2,-0.2 0.905 108.9 55.8 -68.1 -41.7 10.1 91.4 26.1 62 67 A A H >< S+ 0 0 2 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.922 106.5 52.7 -52.3 -46.2 7.9 89.7 23.4 63 68 A R H 3< S+ 0 0 89 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.857 105.6 54.2 -57.2 -41.7 8.1 93.0 21.5 64 69 A Q H 3< S+ 0 0 102 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.589 75.6 121.0 -73.7 -11.9 11.9 93.0 21.7 65 70 A R S << S- 0 0 5 -3,-1.2 5,-0.1 -4,-0.8 197,-0.1 -0.343 75.7-106.4 -56.6 121.5 12.3 89.5 20.2 66 71 A P >> - 0 0 58 0, 0.0 4,-2.2 0, 0.0 3,-0.7 -0.112 24.2-117.4 -48.0 149.6 14.4 90.0 17.0 67 72 A Q H 3> S+ 0 0 89 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.881 112.8 57.9 -57.2 -43.8 12.5 89.7 13.7 68 73 A A H 3> S+ 0 0 58 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.851 110.7 44.4 -58.0 -34.2 14.5 86.6 12.6 69 74 A L H <> S+ 0 0 2 -3,-0.7 4,-2.9 2,-0.2 -1,-0.2 0.854 109.5 53.9 -80.0 -34.7 13.4 84.8 15.7 70 75 A Q H X S+ 0 0 21 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.893 109.7 51.0 -63.1 -33.7 9.8 86.0 15.4 71 76 A T H X S+ 0 0 68 -4,-2.6 4,-1.8 2,-0.2 3,-0.2 0.944 109.0 49.1 -66.9 -47.1 9.9 84.5 11.9 72 77 A L H X S+ 0 0 24 -4,-1.8 4,-2.7 1,-0.2 3,-0.5 0.929 106.8 57.6 -54.9 -48.2 11.3 81.2 13.2 73 78 A D H < S+ 0 0 9 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.880 112.8 40.1 -50.1 -43.1 8.5 81.3 15.8 74 79 A S H < S+ 0 0 73 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.694 120.2 41.0 -82.9 -22.3 5.9 81.5 13.0 75 80 A T H < S+ 0 0 87 -4,-1.8 -2,-0.2 -3,-0.5 -3,-0.2 0.757 90.0 92.5-100.0 -27.1 7.5 79.0 10.5 76 81 A R < - 0 0 56 -4,-2.7 2,-0.2 -5,-0.2 3,-0.1 -0.444 69.8-134.4 -70.7 137.1 8.7 76.2 12.7 77 82 A H > - 0 0 153 -2,-0.2 3,-1.6 1,-0.1 -1,-0.1 -0.632 27.0 -95.2 -92.3 152.8 6.3 73.3 13.1 78 83 A A T 3 S+ 0 0 68 1,-0.3 294,-0.1 -2,-0.2 -1,-0.1 -0.331 113.3 28.4 -60.7 144.4 5.5 71.6 16.4 79 84 A G T > S+ 0 0 14 293,-0.3 3,-2.3 292,-0.1 -1,-0.3 0.491 76.3 136.4 81.6 3.8 7.7 68.5 16.9 80 85 A W G X + 0 0 31 -3,-1.6 3,-1.5 1,-0.3 6,-0.1 0.844 64.3 62.2 -51.2 -39.5 10.5 69.9 14.7 81 86 A F G 3 S+ 0 0 2 1,-0.3 -1,-0.3 291,-0.1 -3,-0.1 0.562 97.8 58.7 -67.4 -9.6 13.1 68.7 17.2 82 87 A G G < S+ 0 0 1 -3,-2.3 464,-2.3 392,-0.1 391,-0.3 0.315 74.8 120.5-103.6 8.9 12.1 65.1 16.7 83 88 A Q S X S- 0 0 74 -3,-1.5 3,-2.1 462,-0.2 459,-0.1 -0.406 75.6-110.9 -71.9 151.3 12.8 64.9 12.9 84 89 A P T 3 S+ 0 0 12 0, 0.0 456,-0.1 0, 0.0 -1,-0.1 0.696 113.4 62.9 -54.1 -26.8 15.4 62.3 11.7 85 90 A H T 3 S+ 0 0 77 454,-0.2 2,-0.2 453,-0.1 454,-0.1 0.653 78.6 109.6 -75.6 -14.7 17.9 64.9 10.6 86 91 A M < + 0 0 4 -3,-2.1 2,-0.3 -6,-0.1 29,-0.1 -0.444 39.0 162.5 -65.6 128.0 18.2 66.1 14.2 87 92 A L - 0 0 1 -2,-0.2 29,-3.4 27,-0.1 30,-1.3 -0.983 21.2-148.4-144.7 135.3 21.6 65.2 15.8 88 93 A G E -ab 117 476A 0 387,-3.6 389,-2.8 -2,-0.3 2,-0.3 -0.704 11.5-166.1-111.9 165.8 23.0 66.8 18.9 89 94 A Y E -ab 118 477A 0 28,-2.2 30,-3.5 387,-0.3 2,-0.5 -0.992 7.0-159.2-145.0 135.6 26.3 67.7 20.3 90 95 A S E +ab 119 478A 5 387,-2.5 389,-2.5 -2,-0.3 2,-0.3 -0.981 26.4 144.7-123.9 126.9 27.1 68.7 23.9 91 96 A A E -a 120 0A 1 28,-2.7 30,-2.8 -2,-0.5 2,-0.5 -0.984 50.5-107.4-155.5 160.1 30.3 70.6 24.9 92 97 A Y > - 0 0 13 -2,-0.3 4,-2.9 28,-0.2 5,-0.2 -0.796 31.4-138.2 -84.8 133.1 31.9 73.2 27.1 93 98 A A H > S+ 0 0 2 -2,-0.5 4,-2.7 28,-0.4 5,-0.4 0.913 103.4 47.8 -61.4 -40.0 32.5 76.3 25.0 94 99 A D H > S+ 0 0 77 3,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.937 114.7 43.4 -68.2 -42.7 35.9 76.8 26.6 95 100 A R H 4 S+ 0 0 50 2,-0.2 414,-2.6 1,-0.1 -2,-0.2 0.901 119.0 46.8 -67.8 -36.9 37.0 73.1 26.2 96 101 A F H < S- 0 0 1 -4,-2.9 -2,-0.2 412,-0.2 -3,-0.2 0.971 142.6 -18.5 -67.7 -58.8 35.6 73.1 22.7 97 102 A A H < S- 0 0 22 -4,-2.7 2,-2.2 -5,-0.2 -3,-0.2 0.067 83.7-113.4-143.9 26.8 37.0 76.3 21.2 98 103 A G S < S+ 0 0 34 -4,-1.8 2,-0.3 -5,-0.4 -3,-0.1 -0.293 88.5 20.8 76.6 -58.9 38.0 78.6 24.1 99 104 A T S > S- 0 0 58 -2,-2.2 4,-2.6 -6,-0.1 49,-0.2 -0.861 86.4 -98.1-137.4 171.9 35.5 81.4 23.7 100 105 A L H > S+ 0 0 1 47,-3.3 4,-2.4 -2,-0.3 5,-0.1 0.880 126.0 50.8 -63.0 -35.9 32.1 81.9 22.0 101 106 A Q H > S+ 0 0 126 46,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.879 109.6 53.3 -67.5 -33.5 33.7 83.5 19.0 102 107 A G H > S+ 0 0 9 2,-0.2 4,-0.7 1,-0.2 -2,-0.2 0.943 107.4 49.3 -64.3 -46.9 35.9 80.4 18.9 103 108 A V H >< S+ 0 0 0 -4,-2.6 3,-1.8 1,-0.2 4,-0.3 0.945 108.3 54.3 -57.4 -46.7 32.9 78.1 18.9 104 109 A A H >< S+ 0 0 18 -4,-2.4 3,-1.2 1,-0.3 -1,-0.2 0.866 104.4 54.4 -57.7 -35.8 31.4 80.1 16.1 105 110 A E H 3< S+ 0 0 136 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.637 106.2 53.9 -74.8 -9.3 34.5 79.6 14.0 106 111 A R T XX S+ 0 0 80 -3,-1.8 4,-1.5 -4,-0.7 3,-0.6 0.298 74.3 104.5-102.6 5.9 34.2 75.8 14.5 107 112 A V H <> S+ 0 0 0 -3,-1.2 4,-3.0 -4,-0.3 5,-0.2 0.873 71.8 63.3 -55.0 -36.9 30.7 75.6 13.2 108 113 A P H 3> S+ 0 0 53 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.938 102.3 51.5 -54.0 -42.9 31.9 74.1 9.9 109 114 A Y H <> S+ 0 0 7 -3,-0.6 4,-1.5 1,-0.2 -2,-0.2 0.913 110.8 46.1 -58.1 -47.2 33.2 71.2 12.0 110 115 A L H X>S+ 0 0 0 -4,-1.5 5,-2.3 1,-0.2 4,-1.1 0.885 111.4 54.1 -63.7 -38.1 29.8 70.8 13.6 111 116 A Q H <5S+ 0 0 93 -4,-3.0 3,-0.4 1,-0.2 -2,-0.2 0.907 106.2 50.6 -63.2 -43.3 28.1 71.1 10.2 112 117 A E H <5S+ 0 0 92 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.841 106.9 54.7 -65.4 -33.4 30.2 68.3 8.6 113 118 A L H <5S- 0 0 0 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.764 117.9-114.7 -70.0 -25.2 29.3 66.0 11.5 114 119 A G T <5 + 0 0 13 -4,-1.1 -3,-0.2 -3,-0.4 -27,-0.1 0.567 54.9 167.3 99.9 15.0 25.6 66.7 10.8 115 120 A V < + 0 0 1 -5,-2.3 -1,-0.2 -6,-0.2 -27,-0.2 -0.355 16.0 163.8 -65.4 136.5 25.0 68.4 14.1 116 121 A R + 0 0 81 -29,-3.4 50,-1.9 1,-0.3 2,-0.3 0.290 67.5 50.2-131.9 1.9 21.6 70.3 14.3 117 122 A Y E -ac 88 166A 0 -30,-1.3 -28,-2.2 48,-0.2 2,-0.6 -0.925 65.1-169.8-147.5 113.3 21.4 70.8 18.1 118 123 A L E -ac 89 167A 0 48,-2.3 50,-3.1 -2,-0.3 2,-0.8 -0.920 4.0-166.6-113.4 111.8 24.3 72.2 20.1 119 124 A H E -ac 90 168A 1 -30,-3.5 -28,-2.7 -2,-0.6 2,-0.5 -0.845 7.0-166.6 -94.8 111.4 24.2 72.1 23.8 120 125 A L E -ac 91 169A 0 48,-1.8 50,-0.5 -2,-0.8 3,-0.2 -0.876 24.2-122.1 -96.9 130.5 26.9 74.4 25.3 121 126 A L - 0 0 2 -30,-2.8 -28,-0.4 -2,-0.5 13,-0.1 -0.182 64.6 -37.0 -65.2 163.3 27.5 73.7 29.0 122 127 A P + 0 0 21 0, 0.0 -1,-0.2 0, 0.0 14,-0.1 0.116 67.2 157.9 -27.5 104.6 27.0 76.7 31.5 123 128 A F + 0 0 4 -3,-0.2 21,-2.6 47,-0.2 2,-0.2 0.230 38.6 103.1-117.9 8.1 28.3 79.8 29.8 124 129 A L E S-I 143 0B 13 19,-0.3 19,-0.3 1,-0.2 16,-0.1 -0.503 93.3 -64.0 -87.6 163.2 26.5 82.5 31.7 125 130 A R E -I 139 0B 84 17,-3.3 13,-2.7 14,-0.5 14,-1.2 -0.211 64.1-160.6 -48.7 127.9 28.3 84.5 34.5 126 131 A A E -I 137 0B 9 11,-0.3 11,-0.2 12,-0.2 3,-0.1 -0.770 26.2 -74.8-117.8 161.4 29.3 82.1 37.2 127 132 A R - 0 0 50 9,-2.3 7,-0.1 -2,-0.3 -1,-0.1 -0.155 55.6-101.3 -54.4 138.4 30.3 82.5 40.9 128 133 A A S S- 0 0 74 3,-0.0 2,-0.3 10,-0.0 -1,-0.1 -0.358 93.3 -6.5 -59.9 139.0 33.8 83.9 41.6 129 134 A G S S+ 0 0 70 -3,-0.1 2,-0.2 2,-0.1 -3,-0.0 -0.599 132.0 26.1 76.3-131.5 36.2 81.0 42.4 130 135 A D + 0 0 103 -2,-0.3 -3,-0.0 1,-0.1 108,-0.0 -0.464 61.3 152.0 -69.4 134.0 34.5 77.7 42.8 131 136 A N > > - 0 0 32 -2,-0.2 5,-1.6 -5,-0.1 3,-0.5 0.100 62.7-104.1-151.6 26.8 31.2 77.4 40.7 132 137 A D G > 5S- 0 0 21 1,-0.3 3,-1.7 2,-0.2 -2,-0.1 0.908 82.6 -50.0 45.4 57.1 30.9 73.7 39.9 133 138 A G G 3 5S- 0 0 20 1,-0.3 -1,-0.3 2,-0.1 -3,-0.1 0.855 116.2 -44.6 54.2 35.6 31.9 74.0 36.3 134 139 A G G < 5S+ 0 0 7 -3,-0.5 -1,-0.3 -7,-0.1 -2,-0.2 0.226 110.0 114.8 96.5 -11.6 29.5 76.9 35.8 135 140 A F T < 5 + 0 0 11 -3,-1.7 2,-1.0 -4,-0.3 -3,-0.2 0.503 59.8 78.2 -72.4 -4.1 26.4 75.5 37.6 136 141 A A S -I 125 0B 60 -14,-1.2 3,-1.0 3,-0.2 -14,-0.5 -0.809 54.0-169.2-155.9 111.5 23.8 86.4 36.2 140 145 A Y E 3 S+ 0 0 7 -2,-0.3 -1,-0.1 1,-0.2 3,-0.0 0.620 91.0 54.7 -76.9 -10.0 21.2 84.7 34.0 141 146 A G E 3 S+ 0 0 30 1,-0.1 2,-0.4 2,-0.0 -1,-0.2 0.317 101.5 60.2-106.4 12.7 21.3 87.6 31.7 142 147 A Q E < S- 0 0 62 -3,-1.0 -17,-3.3 -17,-0.1 -3,-0.2 -0.990 73.7-119.7-148.2 136.9 25.1 87.8 30.9 143 148 A V E -I 124 0B 1 -2,-0.4 -19,-0.3 -19,-0.3 7,-0.1 -0.321 44.7 -96.8 -66.1 147.2 27.8 85.7 29.4 144 149 A E >> - 0 0 46 -21,-2.6 3,-2.0 1,-0.2 4,-1.1 -0.519 35.2-132.1 -62.9 126.5 30.8 84.7 31.5 145 150 A P G >4 S+ 0 0 70 0, 0.0 3,-0.6 0, 0.0 -1,-0.2 0.864 104.7 60.2 -53.9 -38.8 33.4 87.4 30.5 146 151 A S G 34 S+ 0 0 93 1,-0.2 3,-0.1 -47,-0.1 -2,-0.1 0.719 110.1 45.2 -61.9 -18.8 36.2 84.8 30.0 147 152 A L G <4 S- 0 0 13 -3,-2.0 -47,-3.3 1,-0.3 -46,-0.4 0.652 122.2 -95.6 -96.4 -19.2 33.9 83.2 27.4 148 153 A G << - 0 0 19 -4,-1.1 -1,-0.3 -3,-0.6 2,-0.2 -0.971 45.1 -60.9 141.2-156.9 32.9 86.4 25.6 149 154 A S > - 0 0 44 -2,-0.3 4,-1.7 -3,-0.1 5,-0.1 -0.698 45.2-100.7-123.0 174.6 30.0 88.9 25.6 150 155 A N H > S+ 0 0 41 1,-0.2 4,-2.6 -2,-0.2 5,-0.2 0.831 125.0 58.5 -65.6 -29.8 26.3 88.9 24.9 151 156 A D H > S+ 0 0 130 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.905 104.1 49.4 -64.7 -42.3 27.2 90.3 21.5 152 157 A D H > S+ 0 0 27 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.860 109.8 52.8 -64.1 -34.3 29.3 87.2 20.9 153 158 A L H X S+ 0 0 2 -4,-1.7 4,-2.7 2,-0.2 5,-0.3 0.928 110.6 46.2 -66.3 -45.1 26.4 85.1 22.0 154 159 A V H X S+ 0 0 55 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.919 113.4 49.1 -64.5 -40.3 24.1 86.8 19.5 155 160 A A H X S+ 0 0 58 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.896 112.5 49.8 -66.2 -36.1 26.7 86.4 16.7 156 161 A L H X S+ 0 0 2 -4,-2.4 4,-3.4 2,-0.2 5,-0.2 0.951 112.1 44.6 -67.7 -50.3 27.1 82.7 17.6 157 162 A T H X S+ 0 0 3 -4,-2.7 4,-3.2 106,-0.3 -2,-0.2 0.905 112.7 52.8 -63.7 -36.1 23.4 81.9 17.6 158 163 A S H X S+ 0 0 44 -4,-2.3 4,-1.5 -5,-0.3 -1,-0.2 0.924 113.7 43.8 -62.6 -41.9 23.0 83.9 14.3 159 164 A R H X S+ 0 0 77 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.927 114.1 49.6 -67.3 -46.7 25.8 81.8 12.8 160 165 A L H <>S+ 0 0 1 -4,-3.4 5,-2.7 1,-0.2 4,-0.3 0.926 107.5 55.4 -56.3 -47.0 24.5 78.6 14.3 161 166 A R H ><5S+ 0 0 60 -4,-3.2 3,-1.4 1,-0.2 -1,-0.2 0.881 104.2 54.0 -57.0 -38.5 21.0 79.4 12.9 162 167 A E H 3<5S+ 0 0 148 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.903 108.5 48.9 -62.6 -41.1 22.5 79.8 9.4 163 168 A A T 3<5S- 0 0 13 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.373 123.1-106.2 -80.6 5.9 24.1 76.3 9.6 164 169 A G T < 5S+ 0 0 23 -3,-1.4 2,-0.5 -4,-0.3 -3,-0.2 0.872 74.5 140.1 72.1 36.6 20.8 74.9 10.8 165 170 A I < - 0 0 3 -5,-2.7 2,-0.6 -8,-0.2 -48,-0.2 -0.953 42.3-149.2-118.7 132.5 21.9 74.5 14.4 166 171 A S E -c 117 0A 6 -50,-1.9 -48,-2.3 -2,-0.5 2,-0.5 -0.849 18.2-133.5 -99.4 122.0 19.7 75.2 17.5 167 172 A L E -cd 118 265A 3 -2,-0.6 99,-2.2 97,-0.5 100,-1.6 -0.618 16.8-161.8 -78.9 126.1 21.6 76.3 20.6 168 173 A C E -cd 119 267A 0 -50,-3.1 -48,-1.8 -2,-0.5 2,-0.3 -0.912 12.4-174.8-104.8 131.1 20.6 74.6 23.7 169 174 A A E -cd 120 268A 0 98,-2.8 100,-2.5 -2,-0.5 2,-0.3 -0.933 28.1-108.8-126.0 152.6 21.5 76.4 27.0 170 175 A D E - d 0 269A 8 -50,-0.5 2,-0.5 -2,-0.3 100,-0.2 -0.570 21.9-163.9 -75.8 138.1 21.3 75.4 30.6 171 176 A F E - d 0 270A 0 98,-2.9 2,-2.1 -2,-0.3 100,-1.3 -0.925 6.7-161.6-122.8 97.3 18.7 77.3 32.6 172 177 A V + 0 0 2 -2,-0.5 3,-0.3 1,-0.2 -35,-0.1 -0.516 27.3 157.8 -82.0 75.6 19.7 76.6 36.2 173 178 A L + 0 0 0 -2,-2.1 -1,-0.2 98,-0.2 69,-0.1 0.516 54.9 67.9 -84.0 -5.4 16.4 77.5 37.6 174 179 A N S S- 0 0 0 97,-0.5 68,-2.8 1,-0.2 2,-0.3 0.881 113.5 -0.5 -79.2 -34.7 16.4 75.7 41.0 175 180 A H E -J 241 0C 1 -3,-0.3 -38,-0.3 66,-0.3 2,-0.3 -0.973 59.9-142.3-150.7 161.8 19.2 77.8 42.5 176 181 A T E -J 240 0C 0 64,-1.8 64,-2.2 -2,-0.3 -38,-0.2 -0.803 38.2 -89.3-122.7 163.3 21.6 80.6 41.9 177 182 A A E > -J 239 0C 0 -40,-3.0 3,-1.4 -2,-0.3 6,-0.3 -0.316 41.3-116.7 -63.8 155.9 25.3 81.3 42.9 178 183 A D T 3 S+ 0 0 19 60,-1.7 -1,-0.1 1,-0.3 61,-0.1 0.324 114.8 56.8 -83.1 12.7 25.5 83.0 46.3 179 184 A D T 3 S+ 0 0 40 59,-0.2 -1,-0.3 -42,-0.1 -41,-0.1 0.099 77.2 127.4-122.1 16.3 27.1 86.0 44.7 180 185 A H S <> S- 0 0 9 -3,-1.4 4,-3.0 -43,-0.2 5,-0.3 -0.420 78.1-108.0 -67.0 150.0 24.1 86.5 42.2 181 186 A A H > S+ 0 0 68 -43,-0.9 4,-2.8 1,-0.2 5,-0.2 0.854 122.2 52.0 -49.2 -41.3 22.8 90.1 42.4 182 187 A W H > S+ 0 0 34 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.925 111.9 45.4 -61.3 -46.5 19.7 88.8 44.2 183 188 A A H > S+ 0 0 0 -6,-0.3 4,-3.3 -3,-0.2 -2,-0.2 0.898 113.4 49.6 -64.6 -42.3 21.8 87.0 46.8 184 189 A Q H X S+ 0 0 89 -4,-3.0 4,-1.6 2,-0.2 -2,-0.2 0.907 111.3 49.3 -64.2 -40.4 24.1 90.1 47.2 185 190 A A H <>S+ 0 0 25 -4,-2.8 5,-2.5 -5,-0.3 4,-0.3 0.859 112.0 49.3 -65.2 -36.4 21.0 92.3 47.7 186 191 A A H ><5S+ 0 0 3 -4,-2.0 3,-2.2 7,-0.2 -2,-0.2 0.958 109.4 51.0 -65.7 -50.3 19.8 89.7 50.2 187 192 A R H 3<5S+ 0 0 50 -4,-3.3 -2,-0.2 1,-0.3 -1,-0.2 0.763 105.9 57.6 -57.2 -28.0 23.3 89.8 51.9 188 193 A A T 3<5S- 0 0 88 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.537 126.6 -97.9 -81.4 -8.0 23.0 93.6 52.0 189 194 A G T < 5 + 0 0 65 -3,-2.2 2,-0.8 -4,-0.3 -3,-0.2 0.585 69.5 149.7 104.0 11.3 19.7 93.4 54.0 190 195 A D >< - 0 0 73 -5,-2.5 4,-1.9 1,-0.2 3,-0.3 -0.697 31.9-160.9 -82.4 113.2 17.1 93.8 51.3 191 196 A A H > S+ 0 0 65 -2,-0.8 4,-1.4 1,-0.2 -1,-0.2 0.741 86.8 64.0 -65.1 -21.8 14.0 91.9 52.5 192 197 A R H 4 S+ 0 0 148 1,-0.2 -1,-0.2 2,-0.2 -6,-0.1 0.954 112.4 31.2 -67.8 -48.5 12.7 91.8 48.9 193 198 A Y H >4 S+ 0 0 45 -3,-0.3 3,-1.4 1,-0.2 -7,-0.2 0.695 110.2 65.1 -84.3 -19.4 15.5 89.7 47.6 194 199 A L H >< S+ 0 0 21 -4,-1.9 3,-1.7 1,-0.3 -1,-0.2 0.931 99.6 56.7 -65.3 -40.8 16.1 87.8 50.7 195 200 A D T 3< S+ 0 0 75 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.421 85.7 78.3 -68.4 1.6 12.6 86.5 50.1 196 201 A Y T < S+ 0 0 4 -3,-1.4 47,-2.8 -14,-0.1 -1,-0.3 0.515 100.6 47.7 -85.2 -3.1 13.8 85.2 46.6 197 202 A Y B < S-K 242 0D 1 -3,-1.7 2,-0.8 45,-0.3 45,-0.2 -0.763 96.9 -99.9-128.8 171.4 15.3 82.4 48.6 198 203 A H + 0 0 16 43,-1.1 34,-2.0 -2,-0.2 2,-0.4 -0.869 54.1 170.9 -94.4 110.5 14.3 79.9 51.4 199 204 A H E -L 231 0E 41 -2,-0.8 2,-0.3 32,-0.2 32,-0.2 -0.971 14.9-175.0-128.8 142.2 15.8 81.5 54.5 200 205 A F E -L 230 0E 38 30,-2.0 30,-3.7 -2,-0.4 -2,-0.0 -0.993 23.2-148.9-139.4 142.4 15.4 80.7 58.2 201 206 A A S S+ 0 0 63 -2,-0.3 2,-0.2 28,-0.2 -1,-0.1 0.875 85.6 20.8 -73.1 -44.1 16.6 82.3 61.4 202 207 A D S S- 0 0 101 28,-0.1 28,-0.2 27,-0.1 3,-0.2 -0.564 83.9-107.5-115.8-178.5 16.9 79.1 63.5 203 208 A R S > S+ 0 0 68 -2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.242 94.5 102.6 -93.4 12.7 17.2 75.4 62.7 204 209 A T H > S+ 0 0 72 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.988 89.1 28.9 -57.2 -64.2 13.6 75.2 63.8 205 210 A V H > S+ 0 0 46 1,-0.2 4,-2.3 -3,-0.2 5,-0.2 0.918 117.5 58.7 -66.1 -44.7 12.1 75.0 60.4 206 211 A P H > S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.881 103.9 51.5 -54.3 -40.0 15.0 73.4 58.7 207 212 A D H X S+ 0 0 90 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.911 107.0 52.9 -65.7 -39.9 14.9 70.4 61.0 208 213 A R H >< S+ 0 0 152 -4,-1.3 3,-0.9 -5,-0.2 4,-0.5 0.967 114.5 42.9 -56.3 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-1,-0.2 -0.942 75.1-138.2-118.9 119.3 14.9 39.5 32.2 401 410 A P - 0 0 74 0, 0.0 -5,-0.2 0, 0.0 -3,-0.0 -0.227 43.5 -83.3 -63.3 160.9 16.8 37.8 35.1 402 411 A P - 0 0 85 0, 0.0 2,-0.3 0, 0.0 -7,-0.2 -0.127 44.5-158.1 -62.7 161.1 18.3 40.3 37.7 403 412 A F - 0 0 19 -9,-1.8 2,-0.7 -3,-0.1 3,-0.1 -0.964 20.0-108.5-138.5 160.3 21.6 41.9 37.1 404 413 A S > - 0 0 38 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 -0.795 19.5-174.9 -98.2 109.7 24.2 43.5 39.5 405 414 A L H > S+ 0 0 8 -2,-0.7 4,-2.6 2,-0.2 5,-0.2 0.867 91.7 57.6 -63.4 -35.9 24.7 47.3 39.5 406 415 A R H > S+ 0 0 180 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.952 108.7 43.6 -57.9 -53.7 27.5 46.7 41.9 407 416 A D H > S+ 0 0 90 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.881 111.3 54.1 -64.2 -38.9 29.3 44.5 39.4 408 417 A V H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.938 111.3 45.5 -61.1 -45.3 28.6 46.8 36.5 409 418 A A H X S+ 0 0 13 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.906 113.3 49.6 -64.0 -42.4 30.2 49.7 38.3 410 419 A R H <>S+ 0 0 124 -4,-2.4 5,-2.9 1,-0.2 6,-0.5 0.853 108.2 54.7 -65.5 -34.5 33.2 47.7 39.4 411 420 A F H ><5S+ 0 0 36 -4,-2.3 3,-1.2 1,-0.2 10,-0.3 0.936 110.6 44.1 -63.6 -47.5 33.7 46.5 35.9 412 421 A Y H 3<5S+ 0 0 0 -4,-2.0 11,-1.9 1,-0.3 -1,-0.2 0.670 109.9 55.9 -74.4 -14.5 33.9 50.0 34.5 413 422 A A T 3<5S- 0 0 25 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.402 110.5-124.5 -91.1 1.6 36.1 51.1 37.4 414 423 A N T < 5S+ 0 0 65 -3,-1.2 -3,-0.2 -4,-0.2 -2,-0.1 0.881 70.9 136.3 56.4 36.7 38.5 48.3 36.3 415 424 A A < + 0 0 47 -5,-2.9 -4,-0.2 -6,-0.2 -1,-0.1 0.365 55.9 69.5 -92.8 5.3 38.2 47.1 39.9 416 425 A V S > S- 0 0 55 -6,-0.5 3,-1.6 -5,-0.2 -1,-0.0 -0.985 91.3-110.6-129.0 136.6 37.8 43.5 38.5 417 426 A P T 3 S+ 0 0 129 0, 0.0 -1,-0.1 0, 0.0 -6,-0.0 0.730 103.8 35.8 -24.6 -73.2 40.5 41.3 36.8 418 427 A G T 3 S+ 0 0 78 2,-0.0 -7,-0.0 0, 0.0 2,-0.0 0.425 81.3 135.8 -79.6 6.2 39.5 40.9 33.2 419 428 A S < - 0 0 7 -3,-1.6 -7,-0.0 1,-0.1 22,-0.0 -0.184 40.1-166.0 -62.6 134.8 38.0 44.4 32.4 420 429 A Y + 0 0 42 19,-0.1 24,-0.5 20,-0.0 25,-0.2 0.431 64.2 104.0 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A G - 0 0 4 -2,-0.1 -5,-2.7 -6,-0.1 2,-0.4 -0.083 29.8-116.7 -65.6 172.2 28.7 56.5 39.7 432 445 A T E -NO 385 425F 1 -47,-1.5 -47,-2.7 -7,-0.2 2,-0.2 -0.962 19.9-159.3-120.4 129.0 31.4 56.0 37.1 433 446 A N E + O 0 424F 2 -9,-3.2 -9,-1.7 -2,-0.4 2,-0.1 -0.650 41.0 91.9 -98.2 158.7 33.7 58.7 35.5 434 447 A G - 0 0 0 -2,-0.2 71,-0.2 -11,-0.2 -11,-0.1 -0.402 70.0 -78.6 132.9 151.9 35.4 58.3 32.2 435 448 A M > - 0 0 0 69,-0.3 4,-2.3 -13,-0.2 5,-0.2 -0.371 42.3-112.7 -75.7 155.2 35.1 59.0 28.5 436 449 A A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 6,-0.2 0.933 119.2 48.7 -54.7 -48.7 33.0 56.7 26.3 437 450 A A H >>S+ 0 0 0 48,-0.6 5,-1.5 1,-0.2 6,-1.3 0.867 109.9 52.7 -62.9 -32.0 36.2 55.4 24.5 438 451 A A H 45S+ 0 0 0 47,-0.4 -16,-1.5 4,-0.2 3,-0.4 0.899 113.9 43.5 -69.2 -36.2 37.9 54.8 27.8 439 452 A L H <5S+ 0 0 0 -4,-2.3 -2,-0.2 -18,-0.2 -1,-0.2 0.838 109.5 54.6 -78.1 -32.0 34.9 52.7 29.0 440 453 A A H <5S- 0 0 0 -4,-2.4 -1,-0.2 -5,-0.2 20,-0.2 0.511 121.5 -96.8 -81.3 -5.7 34.3 50.8 25.8 441 454 A G T X5S+ 0 0 4 -4,-0.6 4,-2.1 -3,-0.4 16,-0.2 0.344 92.9 113.7 109.9 -5.2 37.9 49.4 25.6 442 455 A I H > S+ 0 0 22 -6,-1.3 4,-2.6 1,-0.2 5,-0.2 0.956 113.0 48.0 -63.8 -51.1 41.9 53.4 25.8 444 457 A A H > S+ 0 0 12 -24,-0.5 4,-1.4 -6,-0.3 -1,-0.2 0.894 112.4 50.3 -54.6 -45.0 43.0 50.0 27.2 445 458 A A H <>S+ 0 0 7 -4,-2.1 5,-2.5 1,-0.2 4,-0.3 0.861 111.4 47.1 -63.4 -38.8 43.6 48.7 23.7 446 459 A Q H ><5S+ 0 0 91 -4,-2.1 3,-0.6 1,-0.2 -1,-0.2 0.879 110.9 52.4 -70.2 -38.2 45.7 51.7 22.7 447 460 A E H 3<5S+ 0 0 131 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.757 114.8 42.3 -69.2 -25.1 47.7 51.4 26.0 448 461 A A T 3<5S- 0 0 75 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.430 104.3-131.4 -97.5 -1.8 48.4 47.8 25.2 449 462 A G T < 5 + 0 0 67 -3,-0.6 2,-0.8 -4,-0.3 -3,-0.2 0.905 53.8 154.3 50.6 41.1 49.1 48.5 21.5 450 463 A D >< - 0 0 76 -5,-2.5 4,-2.0 1,-0.2 -1,-0.2 -0.834 26.7-172.4-104.7 92.5 46.7 45.6 20.8 451 464 A A H > S+ 0 0 81 -2,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.807 83.0 52.2 -54.6 -38.1 45.2 46.3 17.3 452 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