==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN/HYDROLASE 13-OCT-09 3K7V . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN PHOSPHATASE 2A 65 KDA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.D.JEFFREY,J.HUHN,Y.SHI . 869 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36335.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 660 75.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 26 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 141 16.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 399 45.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.6 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 4 2 8 7 9 5 2 2 0 0 4 2 3 3 0 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 PARALLEL BRIDGES PER LADDER . 1 0 1 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 . 0 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 9 A S 0 0 98 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 159.8 56.6 28.0 4.2 2 10 A L > - 0 0 137 0, 0.0 4,-4.1 0, 0.0 5,-0.2 -0.973 360.0 -77.7-139.3 149.9 60.1 29.5 4.6 3 11 A Y T 4 S+ 0 0 178 -2,-0.3 2,-0.0 1,-0.3 0, 0.0 -0.546 102.7 24.8 -82.5 154.4 63.6 29.2 3.2 4 12 A P T >4 S+ 0 0 35 0, 0.0 3,-1.9 0, 0.0 -1,-0.3 -0.973 131.7 40.2 -81.1 -16.1 65.8 27.4 3.7 5 13 A I G >> S+ 0 0 18 1,-0.3 3,-3.1 2,-0.2 4,-0.5 0.883 102.1 73.0 -55.5 -40.9 63.5 24.7 5.0 6 14 A A G 3< S+ 0 0 3 -4,-4.1 -1,-0.3 1,-0.3 5,-0.2 0.613 79.1 76.5 -50.5 -13.2 60.9 25.4 2.3 7 15 A V G <4 S+ 0 0 50 -3,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.786 89.4 57.1 -70.5 -24.9 63.3 23.8 -0.2 8 16 A L T <4 S+ 0 0 0 -3,-3.1 12,-3.1 -4,-0.2 -1,-0.2 0.906 92.5 87.8 -69.8 -41.8 62.2 20.4 1.1 9 17 A I B < S-A 19 0A 24 -4,-0.5 2,-0.7 10,-0.2 10,-0.2 -0.147 74.7-135.3 -60.2 150.9 58.5 21.2 0.4 10 18 A D > + 0 0 36 8,-1.8 3,-1.2 1,-0.1 5,-0.3 -0.748 23.1 178.0-112.1 85.7 56.9 20.3 -3.0 11 19 A E T 3 + 0 0 117 -2,-0.7 -1,-0.1 1,-0.2 -2,-0.0 0.435 68.6 70.3 -66.5 0.9 54.9 23.4 -4.0 12 20 A L T 3 S+ 0 0 164 2,-0.0 -1,-0.2 0, 0.0 -2,-0.0 0.653 89.6 53.9 -98.2 -11.7 53.9 21.9 -7.3 13 21 A R S < S- 0 0 136 -3,-1.2 -2,-0.1 5,-0.1 0, 0.0 0.807 85.3-107.2 -84.7-111.2 51.5 19.0 -6.5 14 22 A N + 0 0 166 -4,-0.1 -3,-0.1 0, 0.0 2,-0.0 0.031 67.5 124.9 173.2 47.2 48.3 18.9 -4.4 15 23 A E S S- 0 0 68 -5,-0.3 -4,-0.0 3,-0.1 0, 0.0 0.074 71.9 -92.6 -98.6-150.5 49.3 17.0 -1.2 16 24 A D S S- 0 0 85 -2,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.260 96.0 -46.2-127.4 46.0 49.0 17.8 2.5 17 25 A V S S+ 0 0 84 1,-0.1 35,-0.2 -7,-0.1 2,-0.1 0.786 88.7 179.2 91.3 40.4 52.5 19.4 3.1 18 26 A Q - 0 0 9 -8,-0.2 -8,-1.8 1,-0.1 2,-0.2 -0.381 18.9-129.3 -73.4 151.7 54.2 16.7 1.2 19 27 A L B -A 9 0A 8 -10,-0.2 2,-0.5 -2,-0.1 -10,-0.2 -0.598 23.3 -98.7-102.5 160.1 58.0 16.7 0.7 20 28 A R >> - 0 0 120 -12,-3.1 4,-2.1 -2,-0.2 3,-1.2 -0.653 27.9-151.0 -76.9 124.3 60.2 16.4 -2.4 21 29 A L H 3> S+ 0 0 46 -2,-0.5 4,-1.0 1,-0.3 3,-0.4 0.971 95.9 51.1 -60.8 -55.6 61.5 12.8 -2.6 22 30 A N H 34 S+ 0 0 135 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.469 115.0 50.2 -62.3 3.3 64.7 13.6 -4.4 23 31 A S H X4 S+ 0 0 15 -3,-1.2 3,-1.5 2,-0.1 -1,-0.2 0.766 92.7 63.9-110.4 -40.4 65.2 16.1 -1.7 24 32 A I H >< S+ 0 0 0 -4,-2.1 3,-0.5 -3,-0.4 -2,-0.2 0.777 104.8 55.0 -57.8 -21.3 64.6 14.4 1.6 25 33 A K T 3< S+ 0 0 106 -4,-1.0 2,-0.5 1,-0.3 3,-0.4 0.742 102.0 55.6 -81.6 -24.5 67.7 12.4 0.5 26 34 A K T <> S+ 0 0 140 -3,-1.5 4,-0.5 1,-0.2 -1,-0.3 -0.427 77.3 116.8-100.5 53.9 69.6 15.7 0.2 27 35 A L H <> + 0 0 0 -3,-0.5 4,-2.1 -2,-0.5 3,-0.5 0.816 57.2 67.1 -90.5 -37.7 68.7 16.5 3.8 28 36 A S H > S+ 0 0 42 -3,-0.4 4,-0.9 1,-0.2 -1,-0.1 0.726 100.2 57.2 -56.8 -19.5 72.2 16.6 5.3 29 37 A T H > S+ 0 0 79 2,-0.2 4,-1.7 1,-0.1 -1,-0.2 0.890 103.2 46.7 -81.6 -41.5 72.7 19.7 3.1 30 38 A I H X S+ 0 0 16 -4,-0.5 4,-1.5 -3,-0.5 -2,-0.2 0.885 110.7 56.4 -66.2 -36.2 69.8 21.8 4.4 31 39 A A H < S+ 0 0 2 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.872 107.5 48.4 -60.6 -37.4 71.1 20.9 7.9 32 40 A L H < S+ 0 0 128 -4,-0.9 -1,-0.2 -5,-0.2 -2,-0.2 0.834 105.3 59.9 -73.2 -31.5 74.4 22.3 6.8 33 41 A A H < S+ 0 0 69 -4,-1.7 -2,-0.2 2,-0.1 -3,-0.1 0.990 111.7 35.2 -57.6 -78.5 72.7 25.5 5.5 34 42 A L S < S- 0 0 5 -4,-1.5 2,-0.0 1,-0.1 0, 0.0 -0.398 108.8-105.6 -67.7 159.4 71.2 26.6 8.8 35 43 A G > - 0 0 30 1,-0.1 4,-2.7 4,-0.0 5,-0.2 -0.130 31.4 -85.9 -84.1-176.8 73.6 25.7 11.5 36 44 A V H > S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.907 128.5 52.2 -52.6 -43.7 73.5 23.0 14.1 37 45 A E H > S+ 0 0 120 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.926 114.5 41.4 -61.0 -46.0 71.4 25.2 16.5 38 46 A R H >>S+ 0 0 103 2,-0.2 4,-2.2 1,-0.2 5,-1.7 0.758 106.5 62.6 -75.9 -21.6 68.9 25.9 13.8 39 47 A T H <>S+ 0 0 0 -4,-2.7 5,-2.9 3,-0.2 -1,-0.2 0.937 114.8 35.7 -65.0 -41.8 68.9 22.2 12.6 40 48 A R H <5S+ 0 0 57 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.1 0.949 120.4 46.1 -72.9 -52.6 67.6 21.4 16.1 41 49 A S H <5S+ 0 0 79 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.781 135.9 2.5 -65.6 -29.8 65.4 24.4 16.7 42 50 A E T X5S+ 0 0 71 -4,-2.2 4,-1.6 -5,-0.2 -3,-0.2 0.709 122.9 53.8-129.8 -35.2 63.7 24.3 13.3 43 51 A L H >> S+ 0 0 53 0, 0.0 4,-1.5 0, 0.0 5,-0.4 0.918 110.1 50.8 -47.2 -48.8 60.7 20.0 14.7 46 54 A F H 3X S+ 0 0 37 -4,-1.6 4,-1.1 1,-0.2 -2,-0.2 0.857 114.4 44.6 -58.1 -35.4 59.5 20.5 11.1 47 55 A L H << S+ 0 0 0 -4,-1.9 -1,-0.2 -3,-0.8 -3,-0.2 0.844 105.2 63.8 -77.5 -34.5 60.3 16.9 10.3 48 56 A T H < S+ 0 0 37 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.1 0.947 118.2 20.1 -52.9 -61.7 58.8 15.5 13.5 49 57 A D H < S+ 0 0 120 -4,-1.5 2,-2.7 1,-0.2 -1,-0.2 0.729 102.9 85.5 -87.5 -24.5 55.1 16.5 12.9 50 58 A T < + 0 0 28 -4,-1.1 2,-0.5 -5,-0.4 -1,-0.2 -0.469 57.2 141.9 -77.4 72.9 55.2 16.9 9.1 51 59 A I + 0 0 44 -2,-2.7 -1,-0.1 -33,-0.0 -33,-0.1 -0.755 19.6 167.4-120.3 81.9 54.7 13.2 8.6 52 60 A Y - 0 0 78 -2,-0.5 -35,-0.0 -35,-0.2 -34,-0.0 0.305 50.5-102.1 -67.6-154.3 52.3 12.7 5.7 53 61 A D S S+ 0 0 89 38,-0.0 2,-1.7 39,-0.0 3,-0.1 0.178 72.3 135.1-123.0 14.5 52.0 9.2 4.4 54 62 A E >> - 0 0 39 1,-0.2 4,-2.6 2,-0.1 3,-0.6 -0.501 39.0-169.3 -64.6 94.1 54.3 9.6 1.4 55 63 A D H 3> S+ 0 0 46 -2,-1.7 4,-2.7 2,-0.2 5,-0.3 0.894 77.4 58.4 -59.6 -48.2 56.0 6.3 2.2 56 64 A E H 3> S+ 0 0 130 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.860 116.2 43.0 -51.2 -30.7 59.0 6.5 -0.2 57 65 A V H <> S+ 0 0 10 -3,-0.6 4,-3.2 2,-0.2 5,-0.3 0.943 108.1 54.1 -77.9 -56.0 59.7 9.7 1.8 58 66 A L H X S+ 0 0 5 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.854 109.1 53.0 -46.8 -40.3 58.9 8.4 5.3 59 67 A L H X S+ 0 0 48 -4,-2.7 4,-2.4 2,-0.2 3,-0.3 0.977 110.8 43.7 -61.3 -58.2 61.4 5.7 4.7 60 68 A A H X S+ 0 0 9 -4,-1.3 4,-3.4 -5,-0.3 5,-0.3 0.922 111.1 55.2 -54.7 -47.7 64.2 8.0 3.6 61 69 A L H X S+ 0 0 3 -4,-3.2 4,-1.5 1,-0.2 -1,-0.2 0.894 110.5 46.6 -54.5 -39.3 63.4 10.4 6.5 62 70 A A H < S+ 0 0 0 -4,-1.9 4,-0.4 -3,-0.3 -1,-0.2 0.910 116.5 43.3 -68.7 -43.3 63.9 7.4 8.9 63 71 A E H >< S+ 0 0 100 -4,-2.4 3,-1.6 1,-0.2 -2,-0.2 0.946 112.9 51.5 -65.2 -51.3 67.1 6.2 7.2 64 72 A Q H >< S+ 0 0 32 -4,-3.4 3,-1.5 1,-0.3 -1,-0.2 0.810 101.5 62.1 -56.4 -37.1 68.6 9.7 6.9 65 73 A L G >< S+ 0 0 0 -4,-1.5 3,-0.8 -5,-0.3 -1,-0.3 0.651 91.7 67.0 -67.7 -14.7 68.0 10.5 10.6 66 74 A G G < S+ 0 0 16 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.454 103.8 44.6 -85.1 -1.1 70.3 7.7 11.6 67 75 A T G < S+ 0 0 92 -3,-1.5 -1,-0.2 -4,-0.1 -2,-0.1 -0.249 90.4 86.8-131.5 40.4 73.2 9.6 10.2 68 76 A F <> + 0 0 0 -3,-0.8 4,-0.5 2,-0.1 6,-0.3 0.332 49.8 107.4-120.9 1.8 72.4 13.0 11.6 69 77 A T T >4>S+ 0 0 6 1,-0.2 5,-1.7 2,-0.2 3,-1.3 0.940 87.2 40.1 -45.4 -57.7 74.1 12.6 15.0 70 78 A T G >45S+ 0 0 112 1,-0.3 3,-0.9 3,-0.2 -1,-0.2 0.784 107.8 59.0 -66.2 -31.2 76.9 15.0 14.0 71 79 A L G 345S+ 0 0 33 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.2 0.414 105.6 54.4 -78.3 4.0 74.8 17.5 12.1 72 80 A V G <<5S- 0 0 0 -3,-1.3 -1,-0.2 -4,-0.5 -2,-0.2 0.457 137.5 -73.5-113.6 -8.8 72.8 18.1 15.3 73 81 A G T < 5S- 0 0 34 -3,-0.9 3,-0.3 -4,-0.3 -3,-0.2 0.363 72.4 -94.6 129.2 1.6 75.7 18.9 17.6 74 82 A G S >>4 S+ 0 0 78 0, 0.0 3,-2.5 0, 0.0 4,-0.4 0.888 127.2 67.7 -42.3 -54.9 76.7 13.1 20.9 76 84 A E G 34 S+ 0 0 164 -3,-0.3 -2,-0.1 1,-0.3 3,-0.1 0.692 116.2 28.5 -44.3 -19.8 75.7 15.8 23.5 77 85 A Y G X4 S+ 0 0 89 -3,-2.3 3,-2.9 -8,-0.1 4,-0.3 0.366 81.9 115.8-123.6 4.7 72.6 16.4 21.4 78 86 A V G X< + 0 0 0 -3,-2.5 3,-1.7 -4,-0.7 4,-0.2 0.775 68.3 70.2 -45.2 -31.5 72.0 13.0 19.7 79 87 A H G > S+ 0 0 48 -4,-0.4 3,-1.1 1,-0.3 -1,-0.3 0.581 77.1 77.7 -68.2 -7.2 68.7 12.7 21.6 80 88 A C G < S+ 0 0 27 -3,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.699 88.2 62.5 -71.7 -18.2 67.1 15.5 19.5 81 89 A L G <> S+ 0 0 0 -3,-1.7 4,-1.3 -4,-0.3 -1,-0.3 0.640 84.7 78.9 -80.0 -15.6 66.8 12.8 16.9 82 90 A L H X> S+ 0 0 6 -3,-1.1 4,-3.7 -4,-0.2 3,-0.5 0.960 84.0 56.9 -59.4 -58.1 64.5 10.7 19.1 83 91 A P H 3> S+ 0 0 68 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.897 110.2 41.5 -42.3 -61.0 61.2 12.6 18.6 84 92 A P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -2,-0.2 0.857 119.2 47.5 -61.0 -30.6 61.0 12.3 14.8 85 93 A L H X S+ 0 0 41 -4,-3.7 4,-1.0 2,-0.2 3,-0.7 0.962 112.8 45.9 -51.4 -51.7 59.8 7.7 17.8 87 95 A S H >< S+ 0 0 48 -4,-2.2 3,-2.0 -5,-0.3 4,-0.4 0.975 109.6 50.4 -53.5 -67.1 57.0 8.9 15.5 88 96 A L H >< S+ 0 0 0 -4,-2.4 3,-0.7 1,-0.3 12,-0.3 0.705 103.8 64.7 -46.2 -22.4 58.3 7.2 12.4 89 97 A A H << S+ 0 0 0 -4,-1.7 -1,-0.3 -3,-0.7 -2,-0.2 0.852 101.4 47.1 -71.1 -36.3 58.5 3.9 14.5 90 98 A T T << S+ 0 0 29 -3,-2.0 -1,-0.2 -4,-1.0 45,-0.2 0.277 89.7 112.7 -89.5 7.3 54.7 3.8 15.0 91 99 A V < - 0 0 21 -3,-0.7 43,-0.1 -4,-0.4 3,-0.1 0.390 70.0-109.9 -61.4-155.7 53.8 4.4 11.4 92 100 A E S S+ 0 0 149 1,-0.2 5,-0.4 42,-0.0 -1,-0.1 0.529 88.2 70.3-105.8-107.1 52.1 1.8 9.1 93 101 A E S >> S- 0 0 91 1,-0.2 3,-2.0 3,-0.1 4,-1.0 0.224 77.7-137.8 -19.5 104.8 54.0 0.2 6.3 94 102 A T H 3> S+ 0 0 75 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.825 96.0 74.2 -44.0 -43.8 56.4 -1.9 8.3 95 103 A V H 3> S+ 0 0 64 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.849 102.1 43.9 -39.1 -43.6 59.3 -1.1 6.0 96 104 A V H <> S+ 0 0 0 -3,-2.0 4,-3.1 2,-0.2 -1,-0.2 0.934 109.2 52.8 -71.1 -49.2 59.3 2.4 7.7 97 105 A R H X S+ 0 0 14 -4,-1.0 4,-1.9 -5,-0.4 -2,-0.2 0.863 110.4 53.4 -56.0 -33.0 58.9 1.1 11.3 98 106 A D H X S+ 0 0 97 -4,-3.0 4,-3.0 2,-0.2 3,-0.2 0.977 109.1 44.1 -66.1 -55.8 61.9 -1.1 10.6 99 107 A K H X S+ 0 0 45 -4,-2.0 4,-2.7 1,-0.2 5,-0.3 0.918 110.4 57.9 -54.4 -43.5 64.1 1.8 9.4 100 108 A A H X S+ 0 0 0 -4,-3.1 4,-2.4 -12,-0.3 -1,-0.2 0.933 111.8 41.0 -52.1 -45.4 62.9 3.8 12.3 101 109 A V H X S+ 0 0 19 -4,-1.9 4,-2.7 -3,-0.2 5,-0.3 0.927 110.3 55.3 -70.4 -45.9 64.2 1.0 14.6 102 110 A E H X S+ 0 0 101 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.919 113.6 43.8 -53.2 -44.8 67.4 0.3 12.8 103 111 A S H X S+ 0 0 6 -4,-2.7 4,-3.0 2,-0.2 5,-0.3 0.912 110.3 53.5 -66.7 -47.5 68.3 4.1 13.2 104 112 A L H X S+ 0 0 0 -4,-2.4 4,-0.9 -5,-0.3 -1,-0.2 0.884 111.7 47.4 -55.4 -37.3 67.1 4.2 16.8 105 113 A R H X S+ 0 0 67 -4,-2.7 4,-0.8 2,-0.2 -1,-0.2 0.880 110.9 52.7 -70.4 -39.6 69.5 1.2 17.4 106 114 A A H >< S+ 0 0 47 -4,-2.0 3,-0.9 -5,-0.3 4,-0.3 0.968 113.1 40.8 -60.4 -55.8 72.3 3.0 15.6 107 115 A I H >X S+ 0 0 0 -4,-3.0 4,-1.5 1,-0.2 3,-0.9 0.636 95.9 80.9 -72.8 -10.8 72.1 6.2 17.5 108 116 A S H 3< S+ 0 0 0 -4,-0.9 3,-0.3 -5,-0.3 -1,-0.2 0.906 90.9 53.5 -58.8 -40.6 71.6 4.4 20.8 109 117 A H T << S+ 0 0 116 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.733 103.8 56.7 -65.0 -24.6 75.4 3.9 20.9 110 118 A E T <4 S+ 0 0 82 -3,-0.9 -1,-0.2 -4,-0.3 -2,-0.2 0.795 89.0 88.3 -76.1 -35.3 75.9 7.6 20.4 111 119 A H S < S- 0 0 1 -4,-1.5 -35,-0.1 -3,-0.3 -34,-0.0 -0.376 85.7-121.1 -62.0 146.6 73.8 8.4 23.5 112 120 A S > - 0 0 46 -37,-0.1 4,-2.3 1,-0.1 3,-0.5 -0.517 28.1-102.9 -85.4 160.7 76.0 8.4 26.6 113 121 A P H > S+ 0 0 69 0, 0.0 4,-1.6 0, 0.0 3,-0.2 0.924 126.3 48.9 -48.3 -47.6 75.2 6.0 29.4 114 122 A S H > S+ 0 0 78 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.835 111.4 47.9 -60.6 -37.9 73.6 8.9 31.3 115 123 A D H >>S+ 0 0 33 -3,-0.5 4,-2.9 2,-0.2 5,-1.3 0.741 103.9 62.1 -76.1 -25.4 71.6 10.1 28.2 116 124 A L H <>S+ 0 0 0 -4,-2.3 5,-2.5 -3,-0.2 4,-0.3 0.962 109.5 40.9 -61.6 -51.9 70.4 6.6 27.6 117 125 A E H <5S+ 0 0 79 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.919 118.7 46.9 -61.5 -47.2 68.7 6.6 31.0 118 126 A A H <5S- 0 0 59 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.849 135.4 -1.2 -69.4 -35.9 67.5 10.2 30.6 119 127 A H T X5S+ 0 0 72 -4,-2.9 4,-0.9 -5,-0.1 -3,-0.2 0.743 124.7 51.1-124.4 -40.2 66.0 10.0 27.1 120 128 A F H >>> S+ 0 0 35 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.858 105.6 49.8 -53.2 -34.9 62.1 6.5 28.5 123 131 A L H > S+ 0 0 90 2,-0.2 3,-2.9 1,-0.1 4,-2.5 0.916 101.9 54.3 -86.2 -47.8 50.1 -2.0 18.9 134 142 A T H 3> S+ 0 0 19 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.878 100.1 67.0 -54.9 -35.0 52.7 -1.2 16.2 135 143 A S H 34 S+ 0 0 11 1,-0.2 -1,-0.3 -45,-0.2 -2,-0.2 0.724 110.9 34.6 -57.5 -19.1 54.1 1.1 18.9 136 144 A R H X> S+ 0 0 43 -3,-2.9 4,-1.4 2,-0.2 3,-0.9 0.797 105.0 65.7-103.4 -41.7 54.9 -2.1 20.8 137 145 A T H 3< S+ 0 0 25 -4,-2.5 4,-0.3 1,-0.3 -2,-0.2 0.862 112.7 41.2 -46.5 -34.9 55.8 -4.4 17.9 138 146 A S T 3< S+ 0 0 7 -4,-2.0 3,-0.5 -5,-0.2 -1,-0.3 0.644 99.4 70.0 -90.9 -17.1 58.7 -2.0 17.6 139 147 A A T X4 S+ 0 0 0 -3,-0.9 3,-1.7 -12,-0.3 4,-0.2 0.833 89.2 67.8 -69.1 -28.0 59.6 -1.5 21.2 140 148 A C G >< S+ 0 0 3 -4,-1.4 3,-1.0 1,-0.3 4,-0.3 0.851 92.7 57.0 -60.1 -36.2 60.8 -5.1 21.3 141 149 A G G 3 S+ 0 0 7 -3,-0.5 -1,-0.3 -4,-0.3 4,-0.2 0.353 98.9 62.5 -79.8 9.3 63.7 -4.3 19.0 142 150 A L G <> S+ 0 0 0 -3,-1.7 4,-0.6 2,-0.1 -1,-0.2 0.355 79.5 79.4-116.6 8.3 65.1 -1.6 21.3 143 151 A F H <> S+ 0 0 1 -3,-1.0 4,-1.9 -4,-0.2 3,-0.2 0.882 85.5 55.3 -83.6 -37.7 66.0 -3.5 24.5 144 152 A S H 4 S+ 0 0 13 -4,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.806 103.3 55.0 -68.6 -27.6 69.3 -5.1 23.6 145 153 A V H 4 S+ 0 0 13 -4,-0.2 4,-0.3 1,-0.2 -1,-0.2 0.866 117.0 33.1 -75.4 -33.4 71.1 -2.0 22.6 146 154 A C H X S+ 0 0 0 -4,-0.6 4,-1.5 -3,-0.2 3,-0.4 0.756 99.5 78.5 -94.6 -23.2 70.5 -0.1 25.9 147 155 A Y T < S+ 0 0 1 -4,-1.9 3,-0.5 1,-0.2 -2,-0.1 0.920 91.2 50.5 -52.2 -54.2 70.5 -2.8 28.5 148 156 A P T 4 S+ 0 0 65 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.850 114.6 43.2 -55.9 -35.1 74.3 -3.3 28.8 149 157 A R T 4 S+ 0 0 83 -3,-0.4 -2,-0.2 -4,-0.3 -3,-0.1 0.714 96.7 81.7 -89.9 -19.9 75.0 0.3 29.3 150 158 A V S < S- 0 0 4 -4,-1.5 -36,-0.1 -3,-0.5 5,-0.0 -0.224 89.0 -73.0 -80.2 173.8 72.4 1.5 31.7 151 159 A S > - 0 0 39 -38,-0.2 4,-3.2 1,-0.1 5,-0.2 -0.193 37.6-111.3 -67.2 155.8 72.3 1.2 35.6 152 160 A S H > S+ 0 0 100 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.896 121.4 52.0 -51.0 -41.3 71.7 -2.0 37.5 153 161 A A H > S+ 0 0 71 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.909 112.0 42.7 -64.6 -45.0 68.4 -0.4 38.6 154 162 A V H > S+ 0 0 15 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.825 105.6 64.0 -72.2 -30.3 67.3 0.5 35.1 155 163 A K H X S+ 0 0 30 -4,-3.2 4,-2.4 2,-0.2 -2,-0.2 0.970 104.0 49.0 -54.4 -50.6 68.4 -3.0 33.8 156 164 A A H X S+ 0 0 41 -4,-1.8 4,-2.3 1,-0.2 3,-0.3 0.950 109.5 50.6 -49.6 -59.2 65.8 -4.4 36.1 157 165 A E H X S+ 0 0 84 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.903 109.4 51.3 -46.6 -50.3 63.1 -2.0 34.8 158 166 A L H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.901 107.5 53.5 -57.0 -42.7 64.0 -2.9 31.2 159 167 A R H X S+ 0 0 31 -4,-2.4 4,-2.7 -3,-0.3 -1,-0.2 0.944 107.4 51.2 -57.4 -50.6 63.6 -6.7 32.1 160 168 A Q H X S+ 0 0 90 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.936 110.3 47.5 -53.8 -51.9 60.2 -6.1 33.5 161 169 A Y H X S+ 0 0 63 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.898 110.4 52.7 -60.3 -39.5 58.9 -4.2 30.4 162 170 A F H X S+ 0 0 0 -4,-2.5 4,-1.4 -5,-0.2 -1,-0.2 0.947 109.7 49.9 -60.9 -44.1 60.4 -6.9 28.2 163 171 A R H >X S+ 0 0 121 -4,-2.7 3,-2.1 1,-0.2 4,-1.9 0.983 108.5 51.0 -52.7 -62.6 58.4 -9.5 30.3 164 172 A N H 3< S+ 0 0 79 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.776 107.6 56.0 -47.3 -30.0 55.2 -7.6 29.9 165 173 A L H >< S+ 0 0 4 -4,-1.6 3,-0.8 -5,-0.3 12,-0.3 0.836 105.3 49.8 -74.6 -29.8 55.8 -7.5 26.2 166 174 A C H << S+ 0 0 10 -3,-2.1 -2,-0.2 -4,-1.4 -1,-0.2 0.830 114.7 44.4 -74.8 -34.0 56.1 -11.3 26.1 167 175 A S T 3< S+ 0 0 72 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.076 85.4 144.1 -96.8 21.8 52.8 -11.7 28.0 168 176 A D < - 0 0 19 -3,-0.8 -3,-0.1 -5,-0.2 6,-0.0 -0.230 59.2-124.6 -58.4 152.0 51.1 -9.0 25.9 169 177 A D S S+ 0 0 154 4,-0.0 -1,-0.1 5,-0.0 3,-0.1 0.640 91.3 79.9 -75.3 -13.6 47.4 -9.7 25.2 170 178 A T S > S- 0 0 52 1,-0.2 4,-0.8 -37,-0.0 5,-0.2 -0.815 76.4-141.2 -99.6 129.7 48.0 -9.3 21.5 171 179 A P H >> S+ 0 0 43 0, 0.0 4,-2.8 0, 0.0 3,-1.1 0.924 101.9 51.7 -51.6 -44.9 49.5 -12.3 19.6 172 180 A M H 3> S+ 0 0 60 1,-0.3 4,-3.0 2,-0.3 5,-0.3 0.936 103.5 52.8 -60.4 -50.9 51.6 -10.0 17.5 173 181 A V H 3> S+ 0 0 0 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.693 116.3 47.2 -59.3 -10.2 53.2 -8.0 20.3 174 182 A R H X S+ 0 0 0 -4,-1.0 3,-1.1 -12,-0.3 4,-0.5 0.919 112.1 52.1 -57.6 -41.3 58.8 -10.2 21.8 178 186 A A H >X S+ 0 0 2 -4,-2.7 3,-1.3 1,-0.3 4,-0.6 0.927 105.0 52.4 -61.3 -48.8 59.6 -13.9 21.1 179 187 A S H 3< S+ 0 0 53 -4,-2.4 -1,-0.3 1,-0.3 4,-0.2 0.531 116.7 41.3 -69.9 -1.4 61.7 -13.2 17.9 180 188 A K H S+ 0 0 60 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.883 114.9 50.6 -61.8 -38.5 69.2 -11.2 21.2 184 192 A F H >< S+ 0 0 2 -4,-1.8 3,-1.4 1,-0.2 -1,-0.2 0.920 107.3 56.4 -64.4 -40.4 68.0 -9.7 24.5 185 193 A A H >< S+ 0 0 1 -4,-2.5 3,-2.0 1,-0.3 -2,-0.2 0.910 98.5 60.7 -55.2 -47.2 69.0 -12.9 26.3 186 194 A K H 3< S+ 0 0 143 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.681 103.5 50.6 -59.3 -18.9 72.6 -12.5 25.0 187 195 A V T << S+ 0 0 39 -3,-1.4 -1,-0.3 -4,-0.6 2,-0.3 0.298 92.8 90.5-105.1 14.6 73.0 -9.2 26.7 188 196 A L S < S- 0 0 17 -3,-2.0 2,-0.1 -4,-0.1 5,-0.0 -0.725 86.2 -98.4-104.4 159.0 71.9 -10.2 30.2 189 197 A E > - 0 0 84 -2,-0.3 4,-1.3 1,-0.1 3,-0.4 -0.435 40.3-108.8 -69.4 148.8 74.1 -11.6 33.0 190 198 A L H >> S+ 0 0 78 1,-0.2 4,-2.2 2,-0.2 3,-0.8 0.881 117.1 59.4 -45.3 -48.0 73.9 -15.4 33.2 191 199 A D H 3> S+ 0 0 125 1,-0.3 4,-2.9 2,-0.2 3,-0.3 0.919 107.4 43.2 -46.0 -58.9 71.9 -15.2 36.5 192 200 A N H 3>>S+ 0 0 31 -3,-0.4 4,-2.1 1,-0.2 5,-1.8 0.667 107.9 60.5 -67.2 -18.0 69.1 -13.2 35.0 193 201 A V H <<>S+ 0 0 3 -4,-1.3 5,-2.4 -3,-0.8 -1,-0.2 0.899 112.4 39.4 -74.2 -38.8 69.1 -15.5 31.9 194 202 A K H <5S+ 0 0 72 -4,-2.2 -2,-0.2 -3,-0.3 -3,-0.1 0.944 126.4 34.7 -72.5 -47.5 68.3 -18.4 34.2 195 203 A S H <5S+ 0 0 65 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.745 135.3 16.9 -81.2 -27.1 65.9 -16.5 36.5 196 204 A E T X5S+ 0 0 50 -4,-2.1 4,-1.6 -5,-0.2 -3,-0.2 0.771 124.2 45.7-113.1 -46.5 64.2 -14.2 33.9 197 205 A I H > S+ 0 0 64 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.911 114.1 46.3 -60.9 -42.2 60.5 -18.3 32.5 200 208 A M H X S+ 0 0 9 -4,-1.6 4,-2.8 -3,-0.2 5,-0.2 0.943 115.3 48.0 -63.0 -45.5 59.7 -15.9 29.6 201 209 A F H X S+ 0 0 4 -4,-3.6 4,-2.1 2,-0.2 5,-0.2 0.967 111.1 49.3 -57.4 -54.7 61.0 -18.6 27.2 202 210 A S H X S+ 0 0 45 -4,-3.9 4,-1.1 1,-0.2 -1,-0.2 0.905 112.7 49.3 -50.1 -47.4 59.0 -21.4 29.0 203 211 A N H >< S+ 0 0 102 -4,-2.5 3,-0.7 1,-0.2 -1,-0.2 0.929 110.8 47.1 -61.3 -49.5 55.9 -19.3 28.8 204 212 A L H >< S+ 0 0 2 -4,-2.8 3,-0.9 1,-0.2 12,-0.2 0.793 107.3 58.4 -65.3 -26.8 56.2 -18.4 25.1 205 213 A A H 3< S+ 0 0 22 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.784 110.3 43.5 -72.9 -26.5 56.9 -22.1 24.2 206 214 A S T << S+ 0 0 84 -4,-1.1 -1,-0.3 -3,-0.7 2,-0.3 -0.429 86.4 150.1-111.3 50.6 53.5 -23.0 25.8 207 215 A D < - 0 0 17 -3,-0.9 6,-0.1 2,-0.2 -3,-0.1 -0.639 55.4-130.1 -87.2 145.2 51.6 -20.1 24.2 208 216 A E S S+ 0 0 169 -2,-0.3 2,-0.5 1,-0.1 -1,-0.1 0.867 98.9 69.0 -57.8 -34.7 47.9 -20.6 23.4 209 217 A Q >> - 0 0 66 1,-0.1 4,-1.6 -5,-0.0 3,-1.0 -0.751 69.6-160.6 -90.1 120.1 48.9 -19.3 20.0 210 218 A D H 3> S+ 0 0 28 -2,-0.5 4,-2.6 1,-0.3 5,-0.3 0.789 89.5 69.4 -73.1 -23.5 51.0 -21.5 17.9 211 219 A S H 34 S+ 0 0 25 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.801 107.9 41.7 -62.2 -23.2 52.1 -18.7 15.7 212 220 A V H X> S+ 0 0 0 -3,-1.0 4,-0.9 2,-0.1 3,-0.7 0.834 111.2 55.5 -87.4 -38.9 53.9 -17.6 18.8 213 221 A R H >X S+ 0 0 36 -4,-1.6 3,-1.7 1,-0.3 4,-0.5 0.950 101.2 55.4 -61.2 -50.1 55.1 -21.1 19.8 214 222 A L H 3< S+ 0 0 30 -4,-2.6 3,-0.5 1,-0.3 4,-0.5 0.728 104.2 58.4 -57.1 -19.4 56.9 -21.9 16.5 215 223 A L H X> S+ 0 0 46 -3,-0.7 4,-1.0 -5,-0.3 3,-0.6 0.788 91.8 66.3 -82.8 -22.9 58.9 -18.8 17.1 216 224 A A H S+ 0 0 72 -3,-0.6 4,-1.4 -4,-0.5 -1,-0.2 0.852 111.3 51.8 -61.1 -36.7 64.6 -20.0 17.4 219 227 A A H X S+ 0 0 3 -4,-1.0 4,-3.0 1,-0.2 -1,-0.2 0.842 102.3 60.6 -70.4 -31.8 64.7 -18.5 20.8 220 228 A C H X S+ 0 0 2 -4,-1.9 4,-3.3 2,-0.2 -1,-0.2 0.889 99.3 55.7 -63.0 -39.2 65.7 -21.8 22.2 221 229 A V H X S+ 0 0 8 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.966 112.0 43.3 -58.3 -49.8 68.8 -22.0 20.1 222 230 A N H >X S+ 0 0 48 -4,-1.4 4,-1.9 2,-0.2 3,-0.5 0.964 116.7 44.3 -62.7 -51.5 70.0 -18.7 21.5 223 231 A I H 3X S+ 0 0 0 -4,-3.0 4,-1.1 1,-0.2 -1,-0.2 0.929 110.7 56.5 -59.6 -43.3 69.1 -19.4 25.1 224 232 A A H 3< S+ 0 0 2 -4,-3.3 -1,-0.2 -5,-0.2 -2,-0.2 0.800 106.4 49.6 -58.8 -32.5 70.6 -22.9 24.8 225 233 A Q H << S+ 0 0 111 -4,-1.6 -1,-0.2 -3,-0.5 -2,-0.2 0.932 106.3 55.7 -72.5 -44.6 74.0 -21.5 23.7 226 234 A L H < S+ 0 0 56 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.721 98.3 77.3 -60.1 -22.9 74.1 -19.0 26.6 227 235 A L S < S- 0 0 9 -4,-1.1 5,-0.1 -3,-0.1 -37,-0.0 -0.705 88.0-107.1 -97.4 142.2 73.7 -21.8 29.2 228 236 A P >> - 0 0 44 0, 0.0 3,-2.0 0, 0.0 4,-0.9 -0.301 37.1-108.8 -61.4 143.0 76.3 -24.2 30.5 229 237 A Q H >> S+ 0 0 76 1,-0.3 3,-1.0 2,-0.2 4,-0.6 0.826 115.5 55.5 -41.7 -46.3 75.8 -27.8 29.3 230 238 A E H 34 S+ 0 0 140 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.759 103.7 55.3 -65.1 -22.8 74.7 -29.2 32.7 231 239 A D H <> S+ 0 0 32 -3,-2.0 4,-2.6 1,-0.2 5,-0.4 0.708 88.9 80.0 -80.5 -19.5 71.9 -26.6 33.0 232 240 A L H S+ 0 0 2 -3,-1.0 4,-2.6 -4,-0.9 5,-2.0 0.928 86.9 52.8 -54.3 -52.1 70.4 -27.6 29.7 233 241 A E H <5S+ 0 0 82 -4,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.831 117.8 36.6 -56.4 -35.3 68.5 -30.8 30.9 234 242 A A H 45S+ 0 0 79 -4,-0.4 -1,-0.2 -3,-0.4 -2,-0.2 0.909 127.5 30.2 -84.1 -44.8 66.8 -28.9 33.8 235 243 A L H <5S+ 0 0 50 -4,-2.6 -3,-0.2 3,-0.1 -2,-0.2 0.647 133.7 8.4 -94.3 -13.4 66.0 -25.6 32.3 236 244 A V T >X5S+ 0 0 0 -4,-2.6 4,-1.8 -5,-0.4 3,-0.7 0.710 103.6 71.0-133.4 -52.8 65.6 -26.2 28.6 237 245 A M H 3> S+ 0 0 59 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.964 111.5 45.5 -57.3 -46.0 62.0 -30.6 28.6 239 247 A T H <> S+ 0 0 30 -3,-0.7 4,-2.0 1,-0.2 -2,-0.2 0.882 116.2 45.4 -60.1 -43.0 60.7 -27.6 26.7 240 248 A L H X S+ 0 0 8 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.869 110.6 51.5 -71.2 -39.5 62.5 -28.5 23.5 241 249 A R H < S+ 0 0 80 -4,-3.3 4,-0.4 -5,-0.2 -1,-0.2 0.873 110.3 52.1 -66.1 -32.4 61.6 -32.1 23.6 242 250 A Q H >X S+ 0 0 104 -4,-1.9 3,-1.7 -5,-0.3 4,-0.9 0.931 104.1 56.4 -67.6 -44.0 58.0 -30.9 24.0 243 251 A A H >< S+ 0 0 16 -4,-2.0 3,-0.7 1,-0.3 -1,-0.2 0.861 102.4 54.2 -55.4 -40.9 58.4 -28.6 20.9 244 252 A A T 3< S+ 0 0 14 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.634 115.2 42.0 -70.4 -10.4 59.4 -31.5 18.7 245 253 A E T <4 S+ 0 0 120 -3,-1.7 -1,-0.2 -4,-0.4 -2,-0.2 0.455 87.9 141.7-108.9 -10.8 56.2 -33.3 19.9 246 254 A D << - 0 0 13 -4,-0.9 6,-0.1 -3,-0.7 -3,-0.1 0.130 60.5-123.9 -37.9 143.9 54.0 -30.2 19.7 247 255 A K S S+ 0 0 190 1,-0.1 2,-0.6 4,-0.1 -1,-0.1 0.869 96.3 74.8 -58.8 -38.9 50.4 -30.5 18.4 248 256 A S S >> S- 0 0 17 1,-0.2 4,-1.7 2,-0.0 3,-1.3 -0.670 70.2-154.4 -82.0 115.8 51.1 -27.9 15.7 249 257 A W H 3> S+ 0 0 90 -2,-0.6 4,-3.5 1,-0.3 5,-0.2 0.778 95.8 67.8 -59.5 -22.2 53.1 -29.3 12.9 250 258 A R H 3> S+ 0 0 107 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.908 101.5 45.6 -63.7 -39.0 54.2 -25.6 12.3 251 259 A V H <> S+ 0 0 3 -3,-1.3 4,-1.1 2,-0.2 -1,-0.2 0.858 113.9 48.1 -71.6 -34.8 56.0 -25.8 15.6 252 260 A R H >X S+ 0 0 25 -4,-1.7 4,-2.5 2,-0.2 3,-0.7 0.936 106.8 57.6 -69.6 -41.7 57.5 -29.2 14.7 253 261 A Y H 3X S+ 0 0 86 -4,-3.5 4,-2.5 1,-0.3 -2,-0.2 0.891 104.5 52.0 -53.2 -43.9 58.5 -27.8 11.3 254 262 A M H 3X S+ 0 0 31 -4,-1.7 4,-2.4 2,-0.2 -1,-0.3 0.816 107.4 53.1 -65.8 -28.7 60.5 -25.1 13.1 255 263 A V H << S+ 0 0 2 -4,-1.1 -2,-0.2 -3,-0.7 -1,-0.2 0.949 112.0 42.8 -71.6 -47.2 62.2 -27.8 15.1 256 264 A A H >< S+ 0 0 0 -4,-2.5 3,-0.9 1,-0.2 4,-0.3 0.872 114.7 54.0 -64.1 -32.6 63.3 -29.7 12.0 257 265 A D H 3< S+ 0 0 52 -4,-2.5 3,-0.3 -5,-0.3 -2,-0.2 0.936 116.4 34.9 -66.8 -45.9 64.2 -26.4 10.4 258 266 A K T 3X S+ 0 0 36 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.082 86.2 115.9 -95.1 24.4 66.5 -25.2 13.2 259 267 A F H X> S+ 0 0 1 -3,-0.9 4,-2.6 1,-0.2 3,-0.5 0.954 74.3 46.6 -59.8 -54.5 67.8 -28.8 14.0 260 268 A T H 3> S+ 0 0 6 -4,-0.3 4,-1.7 -3,-0.3 -1,-0.2 0.869 112.9 51.9 -56.9 -35.7 71.4 -28.3 13.0 261 269 A E H 3> S+ 0 0 82 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.832 109.7 48.8 -69.0 -32.8 71.5 -25.0 15.0 262 270 A L H S+ 0 0 77 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.862 121.2 54.9 -50.1 -47.6 77.3 -33.5 21.4 269 277 A E H > S+ 0 0 131 1,-0.2 4,-2.3 2,-0.2 -2,-0.1 0.945 113.6 40.3 -55.0 -53.8 76.3 -35.4 24.5 270 278 A I H >>S+ 0 0 9 -4,-0.3 4,-2.1 1,-0.2 5,-1.8 0.818 111.3 59.9 -66.3 -29.3 72.7 -34.1 24.5 271 279 A T H <>S+ 0 0 3 -4,-2.0 5,-1.7 3,-0.2 -1,-0.2 0.919 109.6 41.5 -65.1 -42.1 72.6 -34.6 20.7 272 280 A K H <5S+ 0 0 107 -4,-2.5 -2,-0.2 3,-0.2 -1,-0.2 0.888 124.2 39.4 -70.7 -39.0 73.3 -38.3 21.1 273 281 A T H <5S+ 0 0 89 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.994 134.6 6.9 -72.5 -68.7 70.9 -38.6 24.0 274 282 A D T X5S+ 0 0 26 -4,-2.1 4,-1.5 2,-0.1 -3,-0.2 0.889 125.1 51.2 -88.3 -43.9 67.9 -36.4 23.2 275 283 A L H > S+ 0 0 50 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.909 113.1 52.6 -69.5 -41.2 65.5 -39.8 18.8 278 286 A A H X S+ 0 0 12 -4,-1.5 4,-2.8 1,-0.2 5,-0.2 0.956 108.0 51.8 -57.4 -49.1 63.8 -36.5 18.1 279 287 A F H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.904 108.7 50.2 -56.1 -43.3 65.3 -36.4 14.6 280 288 A Q H < S+ 0 0 36 -4,-1.8 4,-0.5 1,-0.2 -1,-0.2 0.877 110.5 49.9 -64.0 -37.4 64.0 -40.0 13.9 281 289 A N H >< S+ 0 0 102 -4,-2.3 3,-1.2 1,-0.2 -2,-0.2 0.929 110.2 50.2 -65.9 -44.8 60.5 -38.9 15.1 282 290 A L H >< S+ 0 0 1 -4,-2.8 3,-1.2 1,-0.3 12,-0.2 0.858 105.4 56.4 -62.8 -34.4 60.6 -35.9 12.8 283 291 A M T 3< S+ 0 0 2 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.651 112.8 42.8 -72.2 -11.8 61.6 -38.0 9.8 284 292 A K T < S+ 0 0 118 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.283 84.4 140.9-114.2 9.0 58.5 -40.1 10.4 285 293 A D < - 0 0 16 -3,-1.2 6,-0.1 -4,-0.2 -3,-0.1 -0.078 58.3-127.2 -50.0 147.6 56.1 -37.2 11.1 286 294 A C S S+ 0 0 98 4,-0.1 2,-0.4 5,-0.0 -1,-0.1 0.911 93.1 74.2 -67.4 -41.2 52.7 -37.6 9.6 287 295 A E S > S- 0 0 78 1,-0.1 4,-1.7 4,-0.0 3,-0.4 -0.596 76.4-145.3 -76.5 125.7 52.8 -34.2 7.9 288 296 A A H > S+ 0 0 8 -2,-0.4 4,-2.1 1,-0.2 5,-0.2 0.694 95.3 66.7 -64.9 -19.6 55.1 -34.3 4.8 289 297 A E H > S+ 0 0 71 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.973 106.1 42.5 -64.3 -48.8 56.3 -30.7 5.4 290 298 A V H > S+ 0 0 0 -3,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.904 112.3 51.5 -62.9 -45.8 58.0 -31.8 8.6 291 299 A R H X S+ 0 0 27 -4,-1.7 4,-3.3 1,-0.2 -1,-0.2 0.933 113.0 47.9 -57.0 -43.9 59.4 -35.0 7.1 292 300 A A H X S+ 0 0 4 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.888 108.5 51.8 -63.6 -44.4 60.9 -33.0 4.3 293 301 A A H X S+ 0 0 10 -4,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.934 114.7 45.3 -57.8 -46.2 62.4 -30.3 6.5 294 302 A A H >X S+ 0 0 0 -4,-2.4 3,-1.9 -12,-0.2 4,-0.7 0.966 108.6 53.2 -61.5 -57.8 64.0 -33.1 8.5 295 303 A S H >< S+ 0 0 0 -4,-3.3 3,-1.2 1,-0.3 4,-0.4 0.858 103.7 60.6 -47.3 -37.6 65.3 -35.1 5.5 296 304 A H H 3< S+ 0 0 94 -4,-2.0 4,-0.3 1,-0.3 3,-0.3 0.840 103.9 49.2 -60.9 -33.4 66.9 -31.9 4.3 297 305 A K H S+ 0 0 53 -4,-0.4 4,-1.4 -3,-0.3 -1,-0.2 0.917 116.4 47.4 -62.7 -46.6 73.7 -34.6 5.8 300 308 A E H > S+ 0 0 91 -4,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.886 113.0 50.9 -61.6 -40.7 74.4 -31.6 8.0 301 309 A F H >< S+ 0 0 0 -4,-2.8 3,-1.2 2,-0.2 4,-0.4 0.971 109.9 45.0 -62.6 -58.1 73.3 -33.4 11.1 302 310 A C H >< S+ 0 0 0 -4,-2.2 3,-0.9 1,-0.3 -1,-0.2 0.796 108.1 61.9 -56.3 -30.2 75.4 -36.6 10.7 303 311 A E H 3< S+ 0 0 73 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.848 105.6 46.2 -62.5 -37.6 78.3 -34.4 9.9 304 312 A N T << S+ 0 0 47 -3,-1.2 -1,-0.2 -4,-1.0 -2,-0.2 0.344 81.5 116.4 -91.7 2.4 78.0 -32.8 13.4 305 313 A L S < S- 0 0 4 -3,-0.9 5,-0.1 -4,-0.4 6,-0.1 -0.499 86.4 -82.2 -72.0 145.5 77.7 -35.9 15.5 306 314 A S >> - 0 0 25 -38,-0.2 4,-2.6 1,-0.2 3,-1.0 -0.244 40.0-122.0 -49.7 123.8 80.6 -36.4 17.9 307 315 A A T 34 S+ 0 0 84 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.779 108.9 54.6 -37.5 -39.8 83.5 -38.0 15.9 308 316 A D T 34 S+ 0 0 138 1,-0.2 -1,-0.2 2,-0.1 4,-0.2 0.894 119.8 26.0 -68.8 -44.2 83.5 -40.9 18.4 309 317 A C T X> S+ 0 0 7 -3,-1.0 4,-2.1 2,-0.1 3,-0.6 0.564 99.8 100.5 -96.0 -9.0 79.9 -42.0 18.2 310 318 A R H >X S+ 0 0 75 -4,-2.6 4,-1.9 1,-0.2 3,-1.0 0.893 79.4 40.1 -38.2 -91.4 79.3 -40.7 14.7 311 319 A E H 3> S+ 0 0 106 -4,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.680 117.1 54.4 -37.5 -27.8 79.6 -43.6 12.3 312 320 A N H <> S+ 0 0 100 -3,-0.6 4,-1.6 2,-0.2 5,-0.3 0.926 106.0 44.8 -78.1 -48.5 77.6 -45.8 14.8 313 321 A V H S+ 0 0 5 -4,-2.1 4,-3.7 -3,-1.0 5,-1.8 0.869 114.4 56.5 -62.8 -33.1 74.5 -43.7 15.4 314 322 A I H <>S+ 0 0 3 -4,-1.9 5,-3.9 -5,-0.3 -2,-0.2 0.968 111.1 36.8 -61.8 -59.4 74.4 -43.3 11.6 315 323 A M H <5S+ 0 0 52 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.722 131.1 34.5 -68.1 -19.7 74.4 -46.9 10.5 316 324 A S H <5S+ 0 0 64 -4,-1.6 -2,-0.2 -5,-0.1 -3,-0.2 0.768 133.2 16.1-106.4 -33.6 72.2 -47.8 13.5 317 325 A Q T X5S+ 0 0 68 -4,-3.7 4,-0.5 -5,-0.3 -3,-0.2 0.825 130.6 31.8-108.0 -50.3 69.8 -44.8 14.0 318 326 A I H >> S+ 0 0 58 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.862 109.2 50.0 -64.2 -31.1 67.4 -47.2 8.6 321 329 A C H < S+ 0 0 127 -4,-0.9 3,-1.6 -5,-0.2 -2,-0.2 0.952 107.0 48.9 -65.8 -52.5 62.4 -45.4 4.7 325 333 A L H >< S+ 0 0 5 -4,-1.9 3,-1.5 1,-0.3 -2,-0.2 0.786 96.3 68.5 -61.0 -32.6 62.3 -41.9 3.2 326 334 A V T 3< S+ 0 0 10 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.716 108.6 42.0 -61.5 -14.8 63.6 -43.0 -0.2 327 335 A S T < S+ 0 0 97 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.376 85.4 132.7-109.6 -1.7 60.2 -44.8 -0.5 328 336 A D < - 0 0 27 -3,-1.5 6,-0.1 -4,-0.2 -3,-0.1 -0.042 59.0-129.9 -49.2 154.1 58.0 -42.0 1.0 329 337 A A S S+ 0 0 87 4,-0.0 -1,-0.1 2,-0.0 2,-0.1 0.976 85.0 79.3 -71.9 -58.8 54.8 -41.1 -1.0 330 338 A N >> - 0 0 72 1,-0.2 4,-2.0 2,-0.1 3,-0.5 -0.291 64.7-155.0 -56.1 126.4 55.3 -37.3 -1.1 331 339 A Q H 3> S+ 0 0 78 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.652 94.5 72.4 -76.3 -14.4 57.7 -36.3 -3.8 332 340 A H H 3> S+ 0 0 93 2,-0.2 4,-1.5 3,-0.2 -1,-0.2 0.902 106.5 35.9 -62.6 -40.6 58.1 -33.2 -1.6 333 341 A V H <> S+ 0 0 0 -3,-0.5 4,-2.3 2,-0.2 5,-0.2 0.939 114.5 49.8 -80.0 -54.5 60.0 -35.5 0.8 334 342 A K H X S+ 0 0 10 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.886 112.0 58.3 -51.9 -32.7 61.9 -37.8 -1.6 335 343 A S H X S+ 0 0 37 -4,-1.6 4,-1.4 -5,-0.2 -1,-0.2 0.941 104.3 45.1 -59.2 -57.1 62.8 -34.4 -3.1 336 344 A A H < S+ 0 0 13 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.891 114.6 50.3 -58.5 -40.9 64.5 -33.0 -0.0 337 345 A L H >X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 3,-2.2 0.959 106.2 53.3 -64.5 -51.7 66.4 -36.2 0.6 338 346 A A H 3< S+ 0 0 1 -4,-2.5 4,-0.4 1,-0.3 -1,-0.2 0.769 99.0 64.2 -56.0 -29.6 67.8 -36.6 -2.9 339 347 A S T 3< S+ 0 0 34 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.428 124.4 12.2 -77.8 4.6 69.2 -33.1 -2.8 340 348 A V T X4 S+ 0 0 27 -3,-2.2 3,-2.0 -4,-0.1 -2,-0.2 0.461 96.6 96.3-151.2 -16.4 71.6 -34.1 0.0 341 349 A I G >< S+ 0 0 0 -4,-2.8 3,-1.4 1,-0.3 -3,-0.1 0.843 84.6 54.4 -54.0 -41.4 71.7 -37.8 0.5 342 350 A M G > S+ 0 0 5 -4,-0.4 3,-1.1 1,-0.3 -1,-0.3 0.607 90.0 79.2 -73.0 -4.6 74.7 -38.5 -1.5 343 351 A G G < S+ 0 0 14 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.441 77.3 75.4 -79.1 2.8 76.6 -35.9 0.6 344 352 A L G X + 0 0 3 -3,-1.4 3,-1.6 1,-0.1 -1,-0.2 0.591 69.6 87.8 -86.9 -15.1 76.9 -38.6 3.3 345 353 A S G X> S+ 0 0 0 -3,-1.1 3,-2.5 1,-0.3 4,-2.3 0.930 81.9 54.4 -51.8 -54.7 79.7 -40.5 1.5 346 354 A P G 34 S+ 0 0 63 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.246 110.7 51.4 -68.3 21.6 82.6 -38.6 2.9 347 355 A I G <4 S+ 0 0 17 -3,-1.6 -2,-0.2 2,-0.1 -3,-0.1 0.134 116.5 35.0-139.5 11.9 81.2 -39.5 6.4 348 356 A L T <> S- 0 0 6 -3,-2.5 4,-0.8 -34,-0.0 -3,-0.1 0.388 106.6-127.7-139.3 -18.0 80.8 -43.2 5.9 349 357 A G H X - 0 0 34 -4,-2.3 4,-2.6 -5,-0.2 5,-0.3 -0.018 33.5 -64.6 88.2 167.3 83.8 -43.9 3.7 350 358 A K H > S+ 0 0 110 36,-0.2 4,-2.7 1,-0.2 5,-0.2 0.953 132.9 45.8 -54.1 -53.3 84.4 -45.6 0.4 351 359 A D H > S+ 0 0 117 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.925 114.8 44.5 -58.8 -51.2 83.4 -49.0 1.7 352 360 A N H X>S+ 0 0 32 -4,-0.8 4,-3.3 2,-0.2 5,-0.7 0.907 114.8 48.9 -61.5 -44.8 80.2 -47.9 3.5 353 361 A T H X>S+ 0 0 0 -4,-2.6 5,-2.4 -8,-0.2 4,-1.6 0.973 110.8 51.0 -58.5 -54.8 79.1 -45.7 0.6 354 362 A I H <5S+ 0 0 47 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.840 120.6 34.1 -53.1 -37.1 79.6 -48.5 -1.9 355 363 A E H <5S+ 0 0 137 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.842 132.5 19.9 -92.0 -33.4 77.6 -51.0 0.2 356 364 A H H X5S+ 0 0 48 -4,-3.3 4,-0.5 -5,-0.2 -3,-0.2 0.730 127.0 36.0-109.6 -27.0 74.8 -48.9 1.8 357 365 A L H >X S+ 0 0 66 0, 0.0 4,-2.2 0, 0.0 -1,-0.3 0.952 111.2 41.9 -71.0 -46.1 71.8 -48.8 -3.5 360 368 A L H < S+ 0 0 0 -4,-1.3 3,-1.7 -3,-0.3 -1,-0.2 0.708 104.4 65.5 -98.2 -26.7 66.2 -42.6 -6.7 365 373 A L H 3< S+ 0 0 7 -4,-1.3 -2,-0.2 1,-0.3 -3,-0.1 0.647 111.2 42.8 -70.3 -11.5 68.1 -42.4 -10.0 366 374 A K T 3< S+ 0 0 117 -4,-0.9 -1,-0.3 -5,-0.1 2,-0.2 -0.182 90.1 125.4-124.6 36.2 65.2 -44.5 -11.2 367 375 A D < - 0 0 23 -3,-1.7 6,-0.1 2,-0.2 -3,-0.1 -0.529 65.3-123.4 -91.6 163.3 62.4 -42.6 -9.3 368 376 A E S S+ 0 0 133 -2,-0.2 -1,-0.1 4,-0.1 5,-0.1 0.984 88.9 83.6 -70.5 -60.1 59.3 -41.2 -11.1 369 377 A C S > S- 0 0 7 1,-0.2 4,-1.3 2,-0.1 3,-0.4 -0.254 70.8-150.3 -49.8 118.5 59.6 -37.6 -10.0 370 378 A P H > S+ 0 0 61 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.843 95.3 59.6 -60.2 -39.7 62.1 -35.9 -12.5 371 379 A E H > S+ 0 0 118 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.866 101.5 57.4 -59.9 -36.2 63.3 -33.5 -9.9 372 380 A V H > S+ 0 0 0 -3,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.934 109.2 39.8 -64.4 -49.4 64.4 -36.5 -7.7 373 381 A R H X S+ 0 0 46 -4,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.833 114.9 55.9 -72.3 -23.5 66.7 -38.1 -10.2 374 382 A L H X S+ 0 0 62 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.888 103.7 52.6 -72.1 -39.1 68.0 -34.7 -11.2 375 383 A N H < S+ 0 0 44 -4,-2.3 4,-0.5 2,-0.2 -1,-0.2 0.880 111.8 47.1 -62.2 -39.4 68.9 -33.8 -7.6 376 384 A I H >< S+ 0 0 1 -4,-1.5 3,-0.9 1,-0.2 -2,-0.2 0.903 113.0 48.9 -67.3 -43.7 70.9 -37.1 -7.4 377 385 A I H 3< S+ 0 0 0 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.764 105.1 58.0 -68.9 -27.4 72.6 -36.3 -10.7 378 386 A S T 3< S+ 0 0 54 -4,-2.0 -1,-0.2 1,-0.2 2,-0.2 0.605 106.7 51.6 -77.6 -12.7 73.5 -32.7 -9.7 379 387 A N < + 0 0 73 -3,-0.9 4,-0.4 -4,-0.5 -1,-0.2 -0.545 63.8 114.9-125.6 68.4 75.5 -34.0 -6.7 380 388 A L > + 0 0 0 -3,-0.4 4,-2.9 -2,-0.2 5,-0.3 0.633 55.3 87.5-105.4 -18.9 77.9 -36.7 -7.9 381 389 A D H > S+ 0 0 72 1,-0.2 4,-1.8 -3,-0.2 -1,-0.1 0.860 93.3 41.2 -48.6 -43.9 81.0 -34.7 -7.0 382 390 A C H 4 S+ 0 0 42 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.943 114.9 46.4 -76.7 -45.2 81.1 -35.9 -3.5 383 391 A V H >> S+ 0 0 0 -4,-0.4 4,-2.4 1,-0.2 3,-0.7 0.898 117.0 49.6 -60.1 -35.5 80.3 -39.6 -4.0 384 392 A N H 3< S+ 0 0 29 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.847 107.7 50.7 -70.2 -37.8 82.8 -39.5 -6.8 385 393 A E T 3< S+ 0 0 144 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.428 118.3 42.4 -80.8 2.1 85.5 -37.8 -4.7 386 394 A V T <4 S+ 0 0 38 -3,-0.7 -2,-0.2 -4,-0.5 -36,-0.2 0.761 119.4 30.5-109.0 -71.3 85.0 -40.5 -2.1 387 395 A I S < S- 0 0 3 -4,-2.4 -1,-0.2 -5,-0.2 2,-0.2 -0.350 106.5 -79.2 -81.5 172.2 84.5 -43.9 -3.9 388 396 A G > - 0 0 32 1,-0.1 4,-2.5 -3,-0.1 5,-0.3 -0.504 26.6-121.5 -81.7 144.1 86.4 -44.3 -7.2 389 397 A I H > S+ 0 0 68 1,-0.3 4,-2.5 -5,-0.2 -1,-0.1 0.800 119.7 48.9 -44.9 -29.9 85.3 -42.9 -10.6 390 398 A R H > S+ 0 0 171 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.915 108.3 49.6 -78.2 -42.8 85.4 -46.6 -11.6 391 399 A Q H 4 S+ 0 0 50 -3,-0.3 -2,-0.2 2,-0.2 -1,-0.2 0.776 118.6 42.0 -65.1 -24.9 83.4 -47.8 -8.7 392 400 A L H >X S+ 0 0 0 -4,-2.5 3,-2.2 2,-0.2 4,-1.6 0.895 111.9 51.0 -84.6 -50.0 80.8 -45.0 -9.4 393 401 A S H 3X S+ 0 0 14 -4,-2.5 4,-1.1 -5,-0.3 -2,-0.2 0.804 108.3 57.8 -56.3 -27.0 80.9 -45.5 -13.2 394 402 A Q H 3< S+ 0 0 113 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.631 115.4 33.3 -79.1 -14.8 80.3 -49.1 -12.3 395 403 A S H <4 S+ 0 0 22 -3,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.442 128.6 33.6-120.3 -4.4 77.1 -48.2 -10.4 396 404 A L H >X S+ 0 0 0 -4,-1.6 4,-1.9 3,-0.1 3,-0.7 0.695 103.1 67.5-116.8 -44.5 75.8 -45.3 -12.5 397 405 A L H 3X S+ 0 0 21 -4,-1.1 4,-2.5 -5,-0.4 5,-0.3 0.839 99.5 50.8 -52.2 -43.4 76.8 -45.9 -16.1 398 406 A P H 3> S+ 0 0 79 0, 0.0 4,-1.2 0, 0.0 -1,-0.3 0.866 107.5 55.7 -67.2 -28.1 74.5 -48.9 -16.6 399 407 A A H <> S+ 0 0 5 -3,-0.7 4,-0.7 2,-0.2 -2,-0.2 0.957 114.6 39.1 -62.7 -48.9 71.6 -46.8 -15.2 400 408 A I H >X S+ 0 0 5 -4,-1.9 4,-3.0 2,-0.2 3,-1.9 0.975 114.3 49.4 -64.2 -61.8 72.3 -44.1 -17.9 401 409 A V H 3X S+ 0 0 47 -4,-2.5 4,-0.5 1,-0.3 -1,-0.2 0.753 109.4 57.0 -51.3 -27.2 73.1 -46.4 -20.9 402 410 A E H 3< S+ 0 0 110 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.745 114.0 36.6 -78.1 -25.2 69.9 -48.3 -20.1 403 411 A L H << S+ 0 0 36 -3,-1.9 -2,-0.2 -4,-0.7 12,-0.2 0.789 106.0 65.1 -95.5 -33.6 67.8 -45.1 -20.3 404 412 A A H < S+ 0 0 4 -4,-3.0 2,-0.5 1,-0.3 -2,-0.2 0.728 111.9 42.0 -59.8 -21.6 69.7 -43.5 -23.2 405 413 A E S < S+ 0 0 138 -4,-0.5 2,-0.3 -5,-0.3 -1,-0.3 -0.932 93.3 127.5-126.9 101.1 68.4 -46.5 -25.1 406 414 A D - 0 0 71 -2,-0.5 6,-0.1 1,-0.2 -3,-0.1 -0.907 66.7 -90.4-149.2 175.7 64.8 -47.1 -24.1 407 415 A A S S+ 0 0 86 -2,-0.3 -1,-0.2 1,-0.1 2,-0.2 0.963 102.0 45.0 -50.7 -85.9 61.2 -47.6 -25.3 408 416 A K S >> S- 0 0 136 -3,-0.1 4,-1.2 2,-0.0 3,-0.9 -0.376 74.4-135.2 -70.7 131.7 59.8 -44.0 -25.4 409 417 A W T 34 S+ 0 0 27 1,-0.2 2,-0.3 2,-0.2 -4,-0.0 -0.534 100.9 53.7 -70.9 158.0 61.7 -41.1 -26.8 410 418 A R T 3> S+ 0 0 86 -2,-0.1 4,-1.6 1,-0.0 -1,-0.2 -0.428 104.6 57.3 105.6 -53.0 61.1 -38.4 -24.1 411 419 A V H <> S+ 0 0 54 -3,-0.9 4,-0.9 -2,-0.3 -2,-0.2 0.855 112.6 41.6 -72.0 -35.6 62.5 -40.9 -21.6 412 420 A R H >X S+ 0 0 25 -4,-1.2 4,-1.4 2,-0.2 3,-0.8 0.934 109.6 57.4 -74.0 -45.9 65.5 -40.8 -23.9 413 421 A L H 3> S+ 0 0 42 1,-0.3 4,-0.9 2,-0.2 -2,-0.2 0.831 102.3 58.2 -50.5 -35.8 65.2 -37.0 -24.3 414 422 A A H 3< S+ 0 0 17 -4,-1.6 3,-0.4 1,-0.2 -1,-0.3 0.873 103.5 49.3 -64.3 -40.6 65.5 -36.8 -20.5 415 423 A I H XX S+ 0 0 3 -4,-0.9 3,-1.4 -3,-0.8 4,-0.7 0.783 103.0 62.7 -71.1 -25.5 68.9 -38.6 -20.4 416 424 A I H 3< S+ 0 0 4 -4,-1.4 3,-0.4 1,-0.3 -1,-0.2 0.815 99.2 55.6 -68.1 -28.1 70.2 -36.2 -23.1 417 425 A E T 3< S+ 0 0 112 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.211 98.1 61.1 -90.9 14.6 69.6 -33.3 -20.7 418 426 A Y T X> S+ 0 0 15 -3,-1.4 4,-3.2 2,-0.1 3,-0.6 0.587 85.3 82.8-105.1 -25.6 71.8 -34.9 -18.0 419 427 A M H 3X S+ 0 0 0 -4,-0.7 4,-3.3 -3,-0.4 5,-0.2 0.907 85.3 49.9 -49.2 -57.7 74.9 -34.9 -20.2 420 428 A P H 3> S+ 0 0 22 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.872 117.4 46.8 -54.3 -29.6 76.1 -31.3 -19.7 421 429 A L H <> S+ 0 0 60 -3,-0.6 4,-1.9 2,-0.2 -2,-0.2 0.978 112.2 45.2 -72.7 -59.4 75.7 -32.1 -16.0 422 430 A L H X S+ 0 0 1 -4,-3.2 4,-2.1 1,-0.2 5,-0.3 0.882 115.2 52.7 -51.7 -38.4 77.5 -35.4 -16.0 423 431 A A H X S+ 0 0 1 -4,-3.3 4,-1.9 -5,-0.3 -2,-0.2 0.994 108.3 45.8 -59.0 -67.7 80.1 -33.8 -18.1 424 432 A G H < S+ 0 0 50 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.700 122.3 38.6 -49.5 -27.8 80.9 -30.8 -15.9 425 433 A Q H < S+ 0 0 26 -4,-1.9 -2,-0.2 2,-0.1 -1,-0.2 0.941 118.6 38.4 -88.8 -64.5 81.0 -33.1 -12.8 426 434 A L H < S- 0 0 16 -4,-2.1 4,-0.3 -5,-0.2 -2,-0.2 0.549 111.3-116.7 -67.5 -11.1 82.7 -36.3 -13.7 427 435 A G X - 0 0 29 -4,-1.9 4,-1.8 -5,-0.3 3,-0.2 0.060 19.0 -81.1 95.9 158.0 85.3 -34.6 -16.0 428 436 A V H > S+ 0 0 58 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.771 122.1 57.2 -69.2 -29.0 86.4 -34.5 -19.6 429 437 A E H > S+ 0 0 165 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.853 109.6 44.7 -72.8 -33.1 88.5 -37.7 -19.4 430 438 A F H >> S+ 0 0 14 -4,-0.3 4,-1.2 -3,-0.2 3,-0.5 0.887 113.4 51.6 -74.6 -39.3 85.5 -39.7 -18.2 431 439 A F H 3X>S+ 0 0 1 -4,-1.8 5,-2.8 1,-0.2 4,-1.2 0.841 105.4 54.1 -65.1 -38.9 83.2 -38.2 -20.9 432 440 A D H 3<5S+ 0 0 65 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.696 118.1 37.0 -71.7 -16.1 85.6 -38.9 -23.7 433 441 A E H <<5S+ 0 0 134 -3,-0.5 -2,-0.2 -4,-0.5 -1,-0.2 0.506 132.5 15.2-115.3 -5.8 85.6 -42.6 -22.7 434 442 A K H <5S+ 0 0 87 -4,-1.2 4,-0.2 -3,-0.2 -3,-0.2 0.523 129.7 33.5-141.5 -13.3 82.1 -43.5 -21.6 435 443 A L T X5S+ 0 0 1 -4,-1.2 4,-1.8 -5,-0.5 5,-0.2 0.697 96.4 72.8-118.6 -30.9 79.8 -40.7 -22.7 436 444 A N H >> S+ 0 0 77 -6,-0.2 4,-2.5 1,-0.2 3,-0.6 0.948 106.2 47.3 -59.4 -50.3 79.8 -42.5 -27.7 438 446 A L H 3> S+ 0 0 21 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.839 109.3 53.7 -60.2 -37.2 76.2 -42.1 -26.5 439 447 A C H 3< S+ 0 0 0 -4,-1.8 4,-0.4 2,-0.2 -1,-0.2 0.738 111.0 46.1 -72.1 -23.4 76.0 -38.5 -27.5 440 448 A M H XX S+ 0 0 25 -4,-1.2 3,-1.1 -3,-0.6 4,-0.6 0.876 107.2 57.5 -84.3 -42.2 77.1 -39.3 -31.0 441 449 A A H >< S+ 0 0 57 -4,-2.5 3,-1.3 1,-0.3 -2,-0.2 0.892 102.5 55.1 -55.9 -40.2 74.7 -42.2 -31.3 442 450 A W G >< S+ 0 0 7 -4,-1.7 3,-1.8 1,-0.3 -1,-0.3 0.763 92.4 71.3 -65.4 -24.8 71.7 -39.9 -30.6 443 451 A L G <4 S+ 0 0 4 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.796 106.7 38.9 -60.8 -22.4 72.7 -37.6 -33.4 444 452 A V G << S+ 0 0 55 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.182 87.1 140.3-115.5 17.4 71.5 -40.4 -35.7 445 453 A D < - 0 0 26 -3,-1.8 6,-0.1 2,-0.1 -3,-0.1 -0.084 59.4-122.6 -57.3 158.0 68.5 -41.5 -33.7 446 454 A H S S+ 0 0 135 4,-0.0 2,-0.4 5,-0.0 -1,-0.1 0.902 94.2 74.7 -72.1 -41.8 65.3 -42.4 -35.6 447 455 A V S > S- 0 0 16 1,-0.1 4,-1.7 2,-0.0 3,-0.3 -0.596 75.0-146.4 -76.2 128.0 63.1 -39.9 -33.8 448 456 A Y H > S+ 0 0 22 200,-1.7 4,-3.1 -2,-0.4 5,-0.3 0.935 96.0 57.2 -58.8 -53.1 63.7 -36.3 -34.9 449 457 A A H > S+ 0 0 9 198,-2.4 4,-2.3 1,-0.3 -1,-0.2 0.833 107.8 50.8 -49.4 -36.4 63.2 -34.6 -31.6 450 458 A I H > S+ 0 0 0 -3,-0.3 4,-2.6 2,-0.2 -1,-0.3 0.925 109.9 48.2 -68.4 -44.5 65.9 -36.8 -30.2 451 459 A R H X S+ 0 0 8 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.939 112.9 49.7 -59.1 -45.9 68.3 -35.9 -32.9 452 460 A E H X S+ 0 0 81 -4,-3.1 4,-2.0 2,-0.2 5,-0.3 0.912 109.8 50.8 -58.3 -46.3 67.5 -32.2 -32.3 453 461 A A H X S+ 0 0 14 -4,-2.3 4,-1.5 -5,-0.3 -2,-0.2 0.952 111.5 46.6 -58.0 -52.3 68.0 -32.6 -28.6 454 462 A A H X S+ 0 0 0 -4,-2.6 4,-0.7 -12,-0.2 -1,-0.2 0.750 107.6 59.7 -63.6 -25.0 71.4 -34.2 -29.1 455 463 A T H >X S+ 0 0 9 -4,-1.7 3,-1.4 -5,-0.2 4,-0.7 0.978 111.0 37.2 -67.8 -57.0 72.4 -31.5 -31.7 456 464 A S H 3X S+ 0 0 55 -4,-2.0 4,-1.3 1,-0.3 3,-0.2 0.738 106.4 71.4 -67.7 -20.1 72.0 -28.5 -29.3 457 465 A N H 3X S+ 0 0 8 -4,-1.5 4,-1.2 -5,-0.3 -1,-0.3 0.781 89.4 61.5 -65.0 -25.8 73.4 -30.8 -26.6 458 466 A L H S+ 0 0 108 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.760 126.9 54.6 -61.4 -28.6 86.7 -25.1 -28.5 468 476 A E H > S+ 0 0 128 2,-0.2 4,-1.3 1,-0.2 5,-0.2 0.967 105.7 50.8 -70.9 -50.1 89.8 -27.2 -28.6 469 477 A W H X S+ 0 0 23 -4,-0.5 4,-3.3 1,-0.2 5,-0.5 0.839 111.0 51.9 -53.5 -35.3 88.1 -30.3 -27.2 470 478 A A H X>S+ 0 0 0 -4,-1.6 5,-2.5 1,-0.2 4,-2.0 0.964 106.0 51.2 -65.8 -55.1 85.4 -29.8 -29.9 471 479 A H H <5S+ 0 0 59 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.714 123.0 33.2 -57.6 -19.6 87.9 -29.6 -32.8 472 480 A A H <5S+ 0 0 70 -4,-1.3 -2,-0.2 -5,-0.1 -1,-0.2 0.854 129.0 27.6-105.0 -44.1 89.4 -32.9 -31.6 473 481 A T H <5S+ 0 0 32 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.2 0.721 131.1 17.0 -92.8 -25.3 86.6 -34.9 -30.0 474 482 A I T X5S+ 0 0 0 -4,-2.0 4,-2.0 -5,-0.5 3,-0.2 0.793 108.2 62.7-120.5 -41.1 83.4 -33.9 -31.7 475 483 A I H > S+ 0 0 72 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.928 111.6 39.4 -59.4 -45.3 85.5 -35.0 -36.7 477 485 A K H 4 S+ 0 0 123 -3,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.836 113.6 54.8 -74.8 -31.6 82.6 -37.4 -36.0 478 486 A V H >< S+ 0 0 2 -4,-2.0 3,-1.1 1,-0.2 -1,-0.2 0.907 108.1 49.0 -66.5 -42.7 79.9 -34.9 -36.8 479 487 A L H >< S+ 0 0 31 -4,-2.3 3,-2.5 1,-0.2 4,-0.3 0.816 95.6 73.2 -67.1 -31.1 81.4 -34.1 -40.2 480 488 A A G >< S+ 0 0 75 -4,-1.1 3,-1.0 1,-0.3 -1,-0.2 0.734 85.0 68.8 -56.9 -20.1 81.6 -37.8 -41.0 481 489 A M G X S+ 0 0 23 -3,-1.1 3,-1.6 -4,-0.4 -1,-0.3 0.665 76.2 80.2 -76.4 -12.1 77.8 -37.8 -41.4 482 490 A S G < S+ 0 0 24 -3,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.782 90.0 55.2 -66.4 -20.6 77.9 -35.7 -44.5 483 491 A G G < S+ 0 0 68 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.2 0.552 82.0 121.3 -86.1 -6.7 78.8 -38.9 -46.5 484 492 A D < - 0 0 44 -3,-1.6 6,-0.2 -4,-0.2 -3,-0.0 -0.309 63.2-139.1 -60.4 131.8 75.6 -40.6 -45.1 485 493 A P S S+ 0 0 90 0, 0.0 2,-0.5 0, 0.0 372,-0.2 0.769 82.9 83.0 -63.8 -27.0 73.2 -41.9 -47.8 486 494 A N S >> S- 0 0 24 1,-0.1 4,-1.8 370,-0.1 3,-1.2 -0.676 71.7-148.4 -82.1 122.2 70.1 -40.8 -45.8 487 495 A Y H 3> S+ 0 0 5 -2,-0.5 4,-2.3 1,-0.3 5,-0.2 0.779 95.9 66.4 -63.0 -23.0 69.3 -37.1 -46.2 488 496 A L H 3> S+ 0 0 6 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.837 106.6 41.7 -66.1 -31.0 68.0 -36.9 -42.6 489 497 A H H <> S+ 0 0 27 -3,-1.2 4,-1.5 2,-0.2 -2,-0.2 0.880 110.5 54.4 -82.2 -40.0 71.5 -37.6 -41.4 490 498 A R H X S+ 0 0 13 -4,-1.8 4,-1.3 1,-0.2 3,-0.2 0.895 110.2 48.1 -61.4 -39.2 73.2 -35.2 -43.9 491 499 A M H X S+ 0 0 4 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.909 103.4 61.6 -66.3 -39.5 71.0 -32.4 -42.7 492 500 A T H X S+ 0 0 2 -4,-1.1 4,-1.9 1,-0.2 -1,-0.2 0.857 100.1 57.3 -53.0 -34.5 71.8 -33.4 -39.1 493 501 A T H X S+ 0 0 0 -4,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.946 106.9 44.6 -63.0 -50.0 75.3 -32.6 -40.0 494 502 A L H X S+ 0 0 0 -4,-1.3 4,-2.4 1,-0.2 -1,-0.2 0.830 110.0 57.4 -63.4 -31.7 74.5 -29.0 -41.1 495 503 A F H X S+ 0 0 38 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.881 107.6 47.4 -67.4 -37.6 72.4 -28.6 -37.9 496 504 A C H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.826 110.4 51.5 -72.0 -31.3 75.4 -29.5 -35.8 497 505 A I H X S+ 0 0 0 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.907 107.1 55.1 -71.8 -37.1 77.6 -27.0 -37.7 498 506 A N H < S+ 0 0 24 -4,-2.4 4,-0.4 1,-0.2 3,-0.3 0.922 113.9 39.1 -58.0 -48.4 74.9 -24.3 -37.1 499 507 A V H >< S+ 0 0 25 -4,-1.7 3,-1.0 1,-0.2 4,-0.4 0.908 113.8 53.9 -70.1 -43.2 74.9 -24.8 -33.3 500 508 A L H 3< S+ 0 0 0 -4,-2.2 4,-0.5 1,-0.2 3,-0.3 0.595 96.5 64.9 -70.0 -14.9 78.7 -25.3 -33.0 501 509 A S T 3X S+ 0 0 3 -4,-1.1 4,-0.5 -3,-0.3 -1,-0.2 0.731 91.9 67.3 -77.2 -23.2 79.7 -22.1 -34.8 502 510 A E T <4 S+ 0 0 93 -3,-1.0 -1,-0.2 -4,-0.4 -2,-0.2 0.788 120.1 15.8 -64.8 -28.6 78.0 -20.3 -31.9 503 511 A V T 4 S+ 0 0 33 -4,-0.4 -1,-0.2 -3,-0.3 -2,-0.2 0.195 109.0 75.8-134.3 18.9 80.7 -21.5 -29.6 504 512 A C T > S- 0 0 1 -4,-0.5 4,-0.5 -3,-0.2 -3,-0.1 0.579 90.2-125.1-107.9 -10.5 83.7 -22.7 -31.6 505 513 A G H X - 0 0 21 -4,-0.5 4,-1.8 1,-0.1 5,-0.2 0.185 28.8 -74.4 84.9 155.9 85.1 -19.4 -32.6 506 514 A Q H > S+ 0 0 94 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.839 125.0 53.2 -54.6 -40.8 86.0 -17.9 -36.0 507 515 A D H > S+ 0 0 91 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.995 111.1 41.4 -60.4 -69.8 89.1 -20.0 -36.5 508 516 A I H X S+ 0 0 5 -4,-0.5 4,-1.7 1,-0.2 5,-0.3 0.754 116.5 51.4 -49.3 -31.5 87.7 -23.5 -36.0 509 517 A T H X>S+ 0 0 0 -4,-1.8 5,-3.0 3,-0.2 4,-2.1 0.978 113.2 42.3 -72.3 -54.6 84.5 -22.6 -38.0 510 518 A T H <5S+ 0 0 28 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.932 124.7 36.1 -57.1 -49.1 86.3 -21.2 -41.1 511 519 A K H <5S+ 0 0 118 -4,-2.7 -3,-0.2 -5,-0.3 -1,-0.2 0.935 131.0 22.0 -73.1 -48.3 89.0 -24.0 -41.1 512 520 A H H <5S+ 0 0 64 -4,-1.7 -3,-0.2 -5,-0.3 -2,-0.2 0.533 130.8 24.6-106.3 -2.5 87.0 -27.1 -40.0 513 521 A M T X5S+ 0 0 2 -4,-2.1 4,-1.9 -5,-0.3 3,-0.3 0.693 106.4 64.7-123.8 -45.5 83.3 -26.6 -40.6 514 522 A L H > S+ 0 0 58 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.964 107.4 47.2 -58.5 -51.8 84.4 -26.3 -46.0 516 524 A T H > S+ 0 0 5 -3,-0.3 4,-0.8 1,-0.2 -2,-0.2 0.858 112.7 51.9 -57.6 -35.0 82.1 -29.2 -45.3 517 525 A V H >< S+ 0 0 0 -4,-1.9 3,-0.8 1,-0.2 -1,-0.2 0.955 111.9 43.1 -67.5 -50.4 79.1 -26.8 -45.5 518 526 A L H >< S+ 0 0 22 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.776 107.2 63.3 -65.3 -28.4 80.1 -25.3 -48.9 519 527 A R H >< S+ 0 0 158 -4,-2.1 3,-0.7 -5,-0.3 -1,-0.2 0.763 96.9 57.0 -68.6 -27.0 80.9 -28.8 -50.2 520 528 A M G X< S+ 0 0 10 -3,-0.8 3,-2.1 -4,-0.8 -1,-0.2 0.400 73.4 100.3 -87.2 5.1 77.3 -29.9 -49.8 521 529 A A G < S+ 0 0 3 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.655 86.5 48.8 -64.3 -10.5 76.0 -27.1 -52.0 522 530 A G G < S+ 0 0 64 -3,-0.7 -1,-0.3 -4,-0.1 -2,-0.1 0.012 79.1 146.6-115.9 26.9 75.8 -29.8 -54.6 523 531 A D < - 0 0 16 -3,-2.1 6,-0.2 1,-0.1 -3,-0.0 -0.340 55.9-124.8 -64.5 142.3 74.0 -32.4 -52.7 524 532 A P S S+ 0 0 109 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.780 92.5 72.3 -58.5 -28.6 71.6 -34.6 -54.8 525 533 A V S >> S- 0 0 17 1,-0.1 4,-1.9 -38,-0.0 3,-0.9 -0.802 75.1-143.0 -96.6 128.4 68.6 -33.8 -52.5 526 534 A A H 3> S+ 0 0 13 -2,-0.5 4,-2.7 1,-0.2 5,-0.3 0.834 97.7 62.8 -54.0 -38.1 67.0 -30.3 -52.5 527 535 A N H 3> S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.871 106.0 44.5 -58.4 -39.5 66.4 -30.3 -48.8 528 536 A V H <> S+ 0 0 0 -3,-0.9 4,-1.1 2,-0.2 -1,-0.2 0.921 111.7 55.6 -70.3 -43.4 70.1 -30.5 -48.0 529 537 A R H >X S+ 0 0 35 -4,-1.9 4,-1.5 1,-0.2 3,-1.1 0.946 110.9 40.1 -56.0 -54.0 70.8 -27.9 -50.6 530 538 A F H 3X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.3 -1,-0.2 0.885 111.8 57.6 -67.9 -30.9 68.5 -25.2 -49.3 531 539 A N H 3X S+ 0 0 4 -4,-1.6 4,-2.0 -5,-0.3 -1,-0.3 0.717 102.0 57.4 -68.7 -15.3 69.6 -26.0 -45.7 532 540 A V H X S+ 0 0 0 -4,-2.8 3,-2.1 1,-0.2 4,-0.9 0.602 95.3 95.2 -88.0 -10.2 77.4 -19.1 -39.6 540 548 A G G >< S+ 0 0 0 -4,-2.1 3,-0.7 -5,-0.3 -1,-0.2 0.835 78.8 58.3 -45.9 -43.8 78.1 -16.2 -42.1 541 549 A P G 34 S+ 0 0 99 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.623 101.9 54.8 -64.2 -16.9 78.5 -13.6 -39.3 542 550 A I G <4 S+ 0 0 47 -3,-2.1 -2,-0.2 -4,-0.1 2,-0.1 0.747 91.4 84.5 -90.0 -25.1 81.3 -15.5 -37.6 543 551 A L S << S- 0 0 9 -4,-0.9 -36,-0.1 -3,-0.7 -37,-0.0 -0.472 89.0-109.8 -74.7 145.8 83.5 -15.7 -40.7 544 552 A D >> - 0 0 62 -2,-0.1 4,-1.7 -38,-0.1 3,-0.6 -0.309 35.5-102.7 -70.9 165.8 85.7 -12.7 -41.3 545 553 A N H 3> S+ 0 0 113 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.835 115.7 60.0 -60.4 -39.3 84.8 -10.6 -44.3 546 554 A S H 3> S+ 0 0 88 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.850 108.6 47.0 -58.1 -36.5 87.4 -11.8 -46.8 547 555 A T H <>>S+ 0 0 11 -3,-0.6 4,-3.1 2,-0.2 5,-1.3 0.951 106.9 55.6 -69.0 -53.1 86.0 -15.3 -46.5 548 556 A L H <>S+ 0 0 14 -4,-1.7 5,-2.1 1,-0.2 -2,-0.2 0.748 116.6 38.6 -51.5 -29.1 82.4 -14.2 -46.9 549 557 A Q H <5S+ 0 0 75 -4,-1.5 -1,-0.2 3,-0.2 -2,-0.2 0.825 121.4 39.8 -93.2 -37.5 83.3 -12.6 -50.2 550 558 A S H <5S+ 0 0 69 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.858 133.6 13.5 -81.1 -38.8 85.8 -15.1 -51.6 551 559 A E T X5S+ 0 0 97 -4,-3.1 4,-0.8 -5,-0.2 -3,-0.2 0.748 127.4 40.2-112.7 -29.9 84.1 -18.4 -50.6 552 560 A V H > S+ 0 0 60 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.948 110.6 47.8 -57.9 -54.0 80.0 -17.5 -54.9 555 563 A I H X S+ 0 0 35 -4,-0.8 4,-2.5 2,-0.2 -2,-0.2 0.923 114.3 46.1 -55.2 -49.4 78.4 -20.6 -53.5 556 564 A L H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.965 110.0 54.1 -58.9 -52.1 75.1 -18.8 -52.6 557 565 A E H < S+ 0 0 88 -4,-2.7 4,-0.3 -5,-0.3 -1,-0.2 0.880 110.1 47.7 -49.3 -42.8 75.0 -17.0 -56.0 558 566 A K H >< S+ 0 0 101 -4,-2.3 3,-2.5 1,-0.2 4,-0.3 0.946 107.2 55.7 -64.8 -47.3 75.3 -20.4 -57.7 559 567 A L H >< S+ 0 0 1 -4,-2.5 3,-1.6 1,-0.3 -1,-0.2 0.791 95.9 66.4 -55.9 -28.7 72.5 -21.9 -55.5 560 568 A T T 3< S+ 0 0 19 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.652 98.0 54.4 -68.5 -11.9 70.2 -19.1 -56.6 561 569 A Q T < S+ 0 0 146 -3,-2.5 -1,-0.3 -4,-0.3 -2,-0.2 0.443 84.5 128.9 -97.9 -2.4 70.4 -20.7 -60.1 562 570 A D < - 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0 0 0 -32,-2.7 2,-0.4 -2,-0.5 -30,-0.2 -0.475 27.7-103.1 -95.9 173.1 46.2 -36.9 -51.4 692 115 C R - 0 0 0 39,-1.4 52,-0.5 -31,-0.2 2,-0.2 -0.825 34.4-165.7-100.1 135.1 42.4 -37.1 -51.1 693 116 C G > - 0 0 0 -2,-0.4 3,-1.1 51,-0.1 -32,-0.1 -0.543 41.5 -92.9-108.8 177.9 40.9 -39.5 -48.6 694 117 C N T 3 S+ 0 0 4 82,-0.4 6,-0.2 1,-0.2 72,-0.1 0.701 125.2 54.0 -67.7 -15.7 37.3 -40.7 -48.3 695 118 C H T 3 S+ 0 0 15 1,-0.2 2,-2.3 5,-0.1 -1,-0.2 0.554 79.2 88.6 -94.1 -12.0 36.6 -37.9 -45.9 696 119 C E S < S+ 0 0 0 -3,-1.1 2,-0.3 31,-0.1 -1,-0.2 -0.355 79.7 97.3 -81.7 60.4 37.8 -35.0 -48.1 697 120 C S S > S- 0 0 8 -2,-2.3 4,-1.0 68,-0.1 28,-0.1 -0.963 80.8-115.5-146.8 159.5 34.2 -34.9 -49.4 698 121 C R T 4 S+ 0 0 57 -2,-0.3 4,-0.4 26,-0.2 -1,-0.1 0.872 103.3 42.8 -70.5 -42.0 30.9 -33.1 -48.9 699 122 C Q T >4 S+ 0 0 124 1,-0.2 3,-1.2 2,-0.2 4,-0.2 0.953 113.5 47.7 -74.5 -45.3 28.5 -35.6 -47.5 700 123 C I G >> S+ 0 0 24 1,-0.2 4,-1.7 -6,-0.2 3,-1.3 0.815 104.6 61.2 -65.0 -28.2 30.6 -37.5 -45.0 701 124 C T G 3< S+ 0 0 0 -4,-1.0 6,-2.8 1,-0.3 7,-0.4 0.655 100.0 55.8 -74.6 -12.7 31.9 -34.2 -43.5 702 125 C Q G <4 S+ 0 0 98 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.400 111.5 43.8 -94.7 0.2 28.4 -33.3 -42.5 703 126 C V T <4 S+ 0 0 92 -3,-1.3 -2,-0.2 -4,-0.2 -3,-0.1 0.645 118.8 38.3-112.6 -27.2 28.0 -36.5 -40.6 704 127 C Y S < S- 0 0 94 -4,-1.7 -38,-2.2 -9,-0.1 2,-0.6 0.024 114.6 -80.4-122.5 32.9 31.3 -36.7 -38.8 705 128 C G S >> S+ 0 0 28 -40,-0.2 3,-1.7 -4,-0.2 4,-1.6 -0.763 97.9 89.7 122.7 -93.2 32.5 -33.3 -37.5 706 129 C F H 3> S+ 0 0 0 -2,-0.6 4,-2.1 1,-0.3 5,-0.2 0.601 92.6 51.7 -15.7 -53.2 34.2 -31.0 -40.0 707 130 C Y H 3> S+ 0 0 55 -6,-2.8 4,-1.2 1,-0.2 -1,-0.3 0.945 116.1 38.9 -58.2 -52.6 30.9 -29.3 -41.1 708 131 C D H <> S+ 0 0 84 -3,-1.7 4,-2.5 -7,-0.4 -2,-0.2 0.842 112.0 57.1 -67.8 -35.8 29.7 -28.5 -37.5 709 132 C E H X S+ 0 0 3 -4,-1.6 4,-1.2 1,-0.2 -1,-0.2 0.920 104.9 53.1 -62.9 -38.6 33.2 -27.6 -36.3 710 133 C C H X S+ 0 0 0 -4,-2.1 4,-1.2 -5,-0.3 6,-0.5 0.865 108.8 50.2 -62.9 -35.2 33.3 -25.0 -39.0 711 134 C L H >X S+ 0 0 61 -4,-1.2 4,-2.0 1,-0.2 3,-0.6 0.935 108.0 50.9 -67.4 -48.7 30.0 -23.6 -37.8 712 135 C R H 3< S+ 0 0 149 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.733 120.6 38.0 -61.7 -19.8 31.2 -23.4 -34.2 713 136 C K H 3< S+ 0 0 52 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.527 130.1 20.2-113.1 -4.7 34.3 -21.6 -35.4 714 137 C Y H << S- 0 0 32 -4,-1.2 -3,-0.2 -3,-0.6 -2,-0.2 0.383 89.1-126.5-140.4 -4.9 33.2 -19.2 -38.2 715 138 C G S < S+ 0 0 66 -4,-2.0 2,-0.3 -5,-0.3 -4,-0.2 0.463 84.1 51.7 70.0 0.9 29.5 -18.8 -37.6 716 139 C N S > S- 0 0 55 -6,-0.5 3,-0.7 -5,-0.0 4,-0.3 -0.977 88.3-106.1-163.1 156.0 28.7 -19.9 -41.2 717 140 C A T 3> S+ 0 0 32 -2,-0.3 4,-1.9 1,-0.2 3,-0.3 0.404 87.2 100.1 -68.2 2.3 29.3 -22.6 -43.8 718 141 C N H 3> S+ 0 0 60 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.922 79.6 50.7 -57.8 -48.2 31.7 -20.6 -46.0 719 142 C V H <> S+ 0 0 0 -3,-0.7 4,-1.5 1,-0.2 -1,-0.2 0.862 111.7 51.5 -58.7 -31.4 35.0 -22.0 -44.6 720 143 C W H > S+ 0 0 27 -3,-0.3 4,-2.8 -4,-0.3 -1,-0.2 0.863 109.6 47.4 -72.8 -36.0 33.5 -25.5 -45.2 721 144 C K H X S+ 0 0 92 -4,-1.9 4,-1.9 -3,-0.2 5,-0.3 0.882 108.9 55.2 -71.7 -37.6 32.5 -24.7 -48.8 722 145 C Y H X S+ 0 0 35 -4,-2.7 4,-1.2 -5,-0.2 -2,-0.2 0.903 115.9 38.3 -63.4 -37.5 36.0 -23.3 -49.5 723 146 C F H X S+ 0 0 0 -4,-1.5 4,-2.6 -5,-0.2 -2,-0.2 0.893 114.5 50.2 -81.1 -42.4 37.6 -26.5 -48.3 724 147 C T H < S+ 0 0 0 -4,-2.8 4,-0.3 2,-0.2 -2,-0.2 0.820 112.4 49.9 -67.1 -27.3 35.2 -29.0 -49.7 725 148 C D H >< S+ 0 0 35 -4,-1.9 3,-1.2 -5,-0.2 4,-0.3 0.903 110.5 50.6 -73.0 -40.6 35.5 -27.3 -53.1 726 149 C L H >< S+ 0 0 1 -4,-1.2 3,-2.7 -5,-0.3 4,-0.4 0.909 99.3 64.9 -61.7 -42.6 39.3 -27.5 -52.7 727 150 C F T 3< S+ 0 0 2 -4,-2.6 3,-0.5 1,-0.3 -1,-0.3 0.640 87.3 71.4 -56.5 -16.6 39.1 -31.2 -51.9 728 151 C D T < S+ 0 0 22 -3,-1.2 36,-0.5 -4,-0.3 -1,-0.3 0.771 97.5 50.5 -73.1 -20.8 37.8 -31.8 -55.4 729 152 C Y S < S+ 0 0 60 -3,-2.7 -1,-0.2 -4,-0.3 -2,-0.2 0.563 79.5 120.3 -91.7 -9.0 41.3 -31.0 -56.7 730 153 C L S S- 0 0 3 -3,-0.5 -39,-0.1 -4,-0.4 -38,-0.1 -0.376 72.1-112.7 -62.9 127.9 43.1 -33.3 -54.4 731 154 C P - 0 0 0 0, 0.0 -39,-1.4 0, 0.0 -110,-0.2 -0.343 18.4-141.1 -57.1 134.8 45.2 -35.9 -56.4 732 155 C L S S+ 0 0 0 -41,-0.2 12,-0.5 1,-0.1 2,-0.3 0.785 74.7 3.9 -73.5 -27.8 43.7 -39.4 -55.9 733 156 C T E -bC 622 743B 0 -112,-0.8 -110,-2.5 -113,-0.3 2,-0.4 -0.964 59.1-142.4-152.3 167.6 47.1 -41.2 -55.8 734 157 C A E -bC 623 742B 0 8,-2.7 8,-3.4 -2,-0.3 2,-0.6 -0.992 7.1-150.4-137.4 142.9 50.9 -40.7 -55.8 735 158 C L E -bC 624 741B 9 -112,-3.3 -110,-2.9 -2,-0.4 2,-0.7 -0.959 14.0-154.4-114.5 117.3 53.6 -42.8 -57.4 736 159 C V E >> S-bC 625 740B 0 4,-3.6 4,-2.4 -2,-0.6 3,-2.1 -0.834 75.8 -23.5 -99.8 116.2 56.9 -42.7 -55.6 737 160 C D T 34 S- 0 0 82 -112,-1.4 -1,-0.2 -2,-0.7 -111,-0.1 0.766 110.4 -78.1 59.6 26.7 60.0 -43.3 -57.7 738 161 C G T 34 S+ 0 0 37 -3,-0.2 -1,-0.3 -113,-0.2 3,-0.1 0.697 130.0 73.2 56.5 23.1 57.7 -45.2 -60.1 739 162 C Q T <4 S+ 0 0 84 -3,-2.1 73,-2.5 1,-0.2 74,-1.3 0.604 80.5 61.5-131.7 -35.6 57.7 -48.1 -57.7 740 163 C I E < -Cd 736 813B 5 -4,-2.4 -4,-3.6 71,-0.2 2,-0.5 -0.904 66.1-159.7-107.1 109.4 55.7 -47.3 -54.6 741 164 C F E -Cd 735 814B 0 72,-2.0 74,-3.3 -2,-0.7 2,-0.4 -0.775 11.9-169.7 -90.1 121.2 52.0 -46.6 -55.4 742 165 C C E +Cd 734 815B 0 -8,-3.4 -8,-2.7 -2,-0.5 2,-0.3 -0.927 17.9 144.2-117.8 139.5 50.2 -44.6 -52.6 743 166 C L E -C 733 0B 0 72,-1.8 74,-0.4 -2,-0.4 -10,-0.1 -0.962 50.0-111.9-162.0 161.7 46.5 -43.9 -52.2 744 167 C H S S+ 0 0 0 -12,-0.5 73,-2.0 -52,-0.5 32,-0.2 0.959 99.8 11.4 -66.8 -54.4 44.0 -43.5 -49.3 745 168 C G S S- 0 0 0 30,-1.8 2,-0.3 1,-0.2 31,-0.3 0.934 94.1-110.9 -91.1 -82.0 41.8 -46.6 -49.7 746 169 C G - 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