==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 08-JAN-01 1HV6 . COMPND 2 MOLECULE: ALGINATE LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SPHINGOMONAS SP.; . AUTHOR H.-J.YOON,W.HASHIMOTO,O.MIYAKE,K.MURATA,B.MIKAMI . 351 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15193.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 239 68.1 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 . 6 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 16 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 15.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 152 43.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.0 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 0 1 1 0 0 0 2 0 0 1 0 1 2 0 2 0 1 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 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 4 A G 0 0 107 0, 0.0 211,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -39.4 3.2 6.7 38.4 2 5 A S + 0 0 108 1,-0.2 0, 0.0 4,-0.0 0, 0.0 0.929 360.0 116.4 85.3 83.7 6.3 4.6 39.3 3 6 A H S > S- 0 0 33 215,-0.0 3,-2.1 216,-0.0 -1,-0.2 -0.948 79.7 -82.9-163.3 163.9 9.2 5.1 37.0 4 7 A P T 3 S+ 0 0 84 0, 0.0 3,-0.2 0, 0.0 211,-0.0 0.687 127.2 44.0 -51.2 -19.4 12.8 6.4 37.3 5 8 A F T > S+ 0 0 40 1,-0.1 3,-1.5 206,-0.1 209,-0.1 0.063 71.7 117.9-115.7 27.1 11.6 10.0 37.0 6 9 A D T < S+ 0 0 57 -3,-2.1 -1,-0.1 1,-0.3 205,-0.1 0.455 80.3 48.1 -73.4 2.1 8.5 10.0 39.3 7 10 A Q T 3 S+ 0 0 140 -3,-0.2 -1,-0.3 -4,-0.1 -2,-0.1 0.223 80.2 131.6-122.8 12.3 10.1 12.6 41.6 8 11 A A < - 0 0 16 -3,-1.5 2,-0.3 199,-0.1 203,-0.2 -0.294 41.2-152.9 -64.7 149.4 11.2 15.1 38.9 9 12 A V - 0 0 78 252,-0.2 2,-0.8 201,-0.1 -2,-0.1 -0.912 22.2-108.8-127.5 153.7 10.4 18.7 39.5 10 13 A V - 0 0 6 -2,-0.3 197,-0.1 1,-0.2 251,-0.0 -0.723 35.6-179.5 -81.2 110.9 9.8 21.7 37.3 11 14 A K + 0 0 149 -2,-0.8 -1,-0.2 1,-0.3 250,-0.1 0.884 68.4 12.9 -79.4 -41.9 12.8 23.9 37.8 12 15 A D > - 0 0 59 1,-0.1 3,-1.6 4,-0.1 -1,-0.3 -0.888 55.5-163.0-144.7 108.1 12.1 26.9 35.6 13 16 A P T 3 S+ 0 0 33 0, 0.0 3,-0.2 0, 0.0 138,-0.1 0.565 93.1 54.0 -66.2 -8.7 8.6 27.5 34.0 14 17 A T T 3 S+ 0 0 56 1,-0.1 138,-0.2 137,-0.1 137,-0.1 0.347 77.1 96.2-108.0 5.7 10.1 29.9 31.4 15 18 A A < - 0 0 4 -3,-1.6 3,-0.4 1,-0.1 5,-0.2 0.751 63.8-175.5 -67.7 -26.3 12.8 27.6 30.0 16 19 A S - 0 0 0 -4,-0.2 244,-0.2 1,-0.2 -1,-0.1 -0.119 48.0 -65.4 61.8-159.9 10.6 26.6 27.1 17 20 A Y S S+ 0 0 2 128,-0.2 2,-0.3 242,-0.1 -1,-0.2 0.371 118.8 26.1-107.3 2.5 11.8 23.9 24.6 18 21 A V S S- 0 0 15 -3,-0.4 2,-1.3 242,-0.1 3,-0.1 -0.931 94.2 -92.9-151.9 166.5 14.7 25.9 23.2 19 22 A D > - 0 0 70 -2,-0.3 4,-2.5 328,-0.2 5,-0.3 -0.740 42.4-172.9 -89.4 93.4 17.0 28.7 24.5 20 23 A V H > S+ 0 0 18 -2,-1.3 4,-2.6 -5,-0.2 5,-0.2 0.906 77.5 47.1 -53.0 -53.5 15.0 31.7 23.1 21 24 A K H > S+ 0 0 153 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.961 116.4 43.4 -54.7 -57.1 17.4 34.5 24.0 22 25 A A H > S+ 0 0 54 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.853 115.7 47.9 -59.6 -39.4 20.5 32.6 22.6 23 26 A R H X S+ 0 0 27 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.875 110.4 51.6 -71.6 -38.1 18.7 31.5 19.5 24 27 A R H X S+ 0 0 31 -4,-2.6 4,-1.5 -5,-0.3 -2,-0.2 0.911 109.2 51.7 -63.1 -42.8 17.3 34.9 18.8 25 28 A T H X>S+ 0 0 84 -4,-2.3 4,-2.2 -5,-0.2 5,-0.6 0.923 109.5 48.6 -59.9 -47.4 20.8 36.4 19.1 26 29 A F H X5S+ 0 0 64 -4,-1.9 4,-0.6 1,-0.2 -1,-0.2 0.907 111.5 50.4 -60.4 -42.0 22.2 33.9 16.6 27 30 A L H <5S+ 0 0 14 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.765 115.5 42.6 -68.9 -25.4 19.4 34.6 14.2 28 31 A Q H <5S+ 0 0 123 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.754 129.0 19.8 -93.7 -27.1 19.9 38.4 14.4 29 32 A S H <5S+ 0 0 91 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.1 0.829 103.1 82.5-107.0 -55.0 23.7 38.7 14.3 30 33 A G S < - 0 0 48 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.235 39.4 -88.6 -78.4 178.1 23.3 30.1 5.1 34 37 A D H > S+ 0 0 134 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.834 126.4 54.7 -58.1 -35.8 20.6 29.9 2.4 35 38 A R H > S+ 0 0 25 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.957 110.7 43.4 -64.1 -51.0 18.7 27.1 4.2 36 39 A L H >> S+ 0 0 0 1,-0.2 4,-0.6 2,-0.2 3,-0.5 0.869 111.5 55.9 -63.0 -36.9 18.3 29.1 7.4 37 40 A K H >< S+ 0 0 104 -4,-2.2 3,-1.3 1,-0.3 -1,-0.2 0.915 104.2 52.5 -61.9 -43.6 17.4 32.3 5.4 38 41 A A H 3< S+ 0 0 72 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.723 105.0 59.1 -65.2 -19.8 14.6 30.4 3.7 39 42 A A H << S+ 0 0 12 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.2 0.616 75.7 114.2 -85.5 -13.6 13.3 29.4 7.2 40 43 A L S << S- 0 0 74 -3,-1.3 2,-0.1 -4,-0.6 57,-0.1 -0.372 70.5-120.1 -61.5 129.7 12.9 33.0 8.5 41 44 A P - 0 0 35 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.411 22.6-116.0 -71.3 147.0 9.2 33.8 9.1 42 45 A K - 0 0 176 -2,-0.1 2,-0.1 1,-0.0 55,-0.1 -0.725 30.4-127.5 -85.0 127.4 7.6 36.7 7.2 43 46 A E + 0 0 82 -2,-0.5 2,-0.3 54,-0.0 -1,-0.0 -0.452 35.1 169.6 -73.6 146.2 6.5 39.4 9.5 44 47 A Y - 0 0 73 -2,-0.1 2,-1.3 0, 0.0 3,-0.1 -0.958 45.1 -93.7-150.0 164.1 2.9 40.7 9.3 45 48 A D > + 0 0 85 -2,-0.3 3,-0.8 1,-0.2 4,-0.1 -0.686 43.3 170.5 -86.4 92.8 0.5 42.9 11.2 46 49 A a G > + 0 0 9 -2,-1.3 3,-1.3 1,-0.2 -1,-0.2 0.685 61.9 79.8 -76.3 -18.2 -1.3 40.4 13.4 47 50 A T G 3 S+ 0 0 85 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.749 98.2 40.7 -63.5 -24.4 -3.0 43.1 15.5 48 51 A T G < S+ 0 0 110 -3,-0.8 2,-0.5 2,-0.1 -1,-0.3 0.301 97.3 91.3-108.3 11.4 -5.7 43.7 12.9 49 52 A E < - 0 0 126 -3,-1.3 2,-0.2 -4,-0.1 0, 0.0 -0.904 67.2-136.2-111.5 133.2 -6.4 40.1 11.9 50 53 A A - 0 0 103 -2,-0.5 3,-0.1 1,-0.0 -2,-0.1 -0.515 19.2-149.2 -81.6 151.6 -9.0 37.9 13.4 51 54 A T - 0 0 31 -2,-0.2 36,-0.1 1,-0.1 -1,-0.0 -0.676 35.8 -63.3-115.5 170.7 -8.2 34.3 14.2 52 55 A P - 0 0 19 0, 0.0 -1,-0.1 0, 0.0 31,-0.0 -0.197 49.7-135.0 -55.6 141.6 -10.3 31.1 14.4 53 56 A N - 0 0 107 1,-0.1 2,-0.1 -3,-0.1 34,-0.1 -0.724 24.1-106.2 -97.0 149.1 -13.1 31.0 17.0 54 57 A P - 0 0 15 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.407 36.8-100.2 -74.3 149.0 -13.7 28.0 19.2 55 58 A Q - 0 0 58 -2,-0.1 2,-0.4 1,-0.1 4,-0.1 -0.437 43.0-122.4 -64.0 142.0 -16.7 25.6 18.6 56 59 A Q S S- 0 0 146 -2,-0.1 2,-0.3 -3,-0.1 -1,-0.1 -0.758 70.5 -6.4 -94.5 134.2 -19.4 26.5 21.1 57 60 A G S S+ 0 0 52 -2,-0.4 68,-0.3 63,-0.3 2,-0.2 -0.713 120.3 14.7 92.0-139.7 -20.7 23.8 23.4 58 61 A E S S- 0 0 119 -2,-0.3 2,-0.5 1,-0.1 68,-0.2 -0.494 78.1-120.4 -75.4 138.0 -19.5 20.2 23.0 59 62 A M + 0 0 8 66,-3.8 68,-0.5 -2,-0.2 2,-0.4 -0.681 38.2 174.7 -81.1 120.9 -16.5 19.6 20.9 60 63 A V - 0 0 75 -2,-0.5 66,-0.0 66,-0.1 -2,-0.0 -0.967 22.3-162.7-133.9 120.1 -17.3 17.2 18.0 61 64 A I - 0 0 15 -2,-0.4 70,-0.3 20,-0.0 71,-0.2 -0.897 32.3-128.3 -98.0 114.1 -15.0 16.2 15.1 62 65 A P - 0 0 23 0, 0.0 2,-0.2 0, 0.0 12,-0.0 -0.091 27.8 -93.6 -57.0 158.0 -17.4 14.8 12.4 63 66 A R - 0 0 190 1,-0.1 14,-0.3 2,-0.1 13,-0.2 -0.515 28.4-132.7 -72.7 146.4 -16.7 11.4 10.9 64 67 A R S S+ 0 0 145 -2,-0.2 10,-2.4 9,-0.1 2,-0.4 0.824 89.7 43.0 -70.4 -32.1 -14.7 11.6 7.7 65 68 A Y B S-A 73 0A 53 3,-0.3 8,-0.2 8,-0.3 3,-0.2 -0.895 82.6-125.0-117.8 146.0 -17.0 9.2 5.8 66 69 A L S S+ 0 0 113 6,-1.9 2,-0.3 -2,-0.4 7,-0.1 0.777 99.7 2.8 -56.9 -26.1 -20.8 9.2 5.8 67 70 A S S > S- 0 0 94 5,-0.5 3,-0.6 3,-0.3 -1,-0.2 -0.915 116.6 -13.9-163.9 132.2 -20.6 5.6 6.8 68 71 A G T 3 S- 0 0 45 -2,-0.3 -3,-0.3 1,-0.2 -4,-0.1 -0.328 98.8 -50.0 78.0-157.7 -17.7 3.2 7.6 69 72 A N T 3 S+ 0 0 129 -5,-0.1 2,-0.3 -2,-0.1 -1,-0.2 0.385 115.7 11.8 -99.2 0.1 -14.0 3.6 6.9 70 73 A H S < S+ 0 0 120 -3,-0.6 -3,-0.3 2,-0.0 -5,-0.0 -0.910 84.6 59.2-159.6-175.7 -14.3 4.6 3.2 71 74 A G S S+ 0 0 42 -2,-0.3 -3,-0.0 -6,-0.1 -5,-0.0 -0.591 86.9 33.0 89.6-146.8 -16.6 5.7 0.4 72 75 A P S S- 0 0 96 0, 0.0 -6,-1.9 0, 0.0 -5,-0.5 -0.184 82.4-125.0 -49.2 134.4 -18.9 8.8 0.2 73 76 A V B -A 65 0A 100 -8,-0.2 -8,-0.3 -7,-0.1 -9,-0.1 -0.570 10.0-121.9 -88.4 149.0 -17.3 11.7 2.2 74 77 A N >> - 0 0 23 -10,-2.4 3,-1.4 -2,-0.2 4,-0.5 -0.791 15.6-152.0 -88.9 115.9 -18.9 13.6 5.0 75 78 A P T 34 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -11,-0.1 0.666 90.8 65.1 -62.3 -16.7 -19.0 17.3 4.0 76 79 A D T 3> S+ 0 0 99 -13,-0.2 4,-1.2 1,-0.2 -12,-0.1 0.740 89.2 70.5 -77.6 -22.5 -19.0 18.4 7.6 77 80 A Y H <> S+ 0 0 42 -3,-1.4 4,-2.3 -14,-0.3 3,-0.3 0.947 91.6 51.5 -60.9 -55.4 -15.5 17.0 8.1 78 81 A E H X S+ 0 0 125 -4,-0.5 4,-1.9 1,-0.2 5,-0.2 0.917 109.4 47.9 -51.8 -54.9 -13.3 19.4 6.1 79 82 A P H > S+ 0 0 82 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.844 113.9 47.9 -59.4 -33.1 -14.6 22.7 7.6 80 83 A V H X S+ 0 0 27 -4,-1.2 4,-1.3 -3,-0.3 -2,-0.2 0.936 112.4 44.8 -76.0 -45.4 -14.2 21.4 11.2 81 84 A V H X S+ 0 0 5 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.830 109.5 57.9 -68.1 -28.7 -10.7 20.0 11.0 82 85 A T H X S+ 0 0 62 -4,-1.9 4,-2.5 -5,-0.3 5,-0.3 0.886 99.2 59.4 -66.5 -37.8 -9.5 23.1 9.1 83 86 A L H X S+ 0 0 42 -4,-1.1 4,-1.9 -5,-0.2 -1,-0.2 0.940 111.3 40.9 -54.1 -48.4 -10.6 25.2 12.0 84 87 A Y H X S+ 0 0 4 -4,-1.3 4,-2.4 1,-0.2 -2,-0.2 0.894 113.4 51.4 -69.9 -41.1 -8.2 23.3 14.3 85 88 A R H X S+ 0 0 124 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.812 110.8 49.5 -67.8 -27.9 -5.4 23.1 11.8 86 89 A D H X S+ 0 0 64 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.909 108.9 52.8 -74.4 -42.0 -5.6 26.9 11.3 87 90 A F H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.3 -2,-0.2 0.933 113.5 44.1 -55.0 -47.7 -5.6 27.4 15.0 88 91 A E H X S+ 0 0 5 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.896 113.4 49.6 -66.8 -42.3 -2.4 25.3 15.2 89 92 A K H X S+ 0 0 104 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.920 113.7 45.4 -63.8 -45.0 -0.7 27.0 12.2 90 93 A I H X S+ 0 0 39 -4,-2.9 4,-2.3 2,-0.2 5,-0.2 0.904 112.0 51.9 -66.5 -41.1 -1.3 30.5 13.5 91 94 A S H X S+ 0 0 0 -4,-2.1 4,-1.9 -5,-0.3 -2,-0.2 0.943 113.3 43.8 -59.5 -49.3 -0.2 29.6 17.1 92 95 A A H X S+ 0 0 4 -4,-2.2 4,-2.7 1,-0.2 251,-0.2 0.880 112.1 52.9 -65.0 -40.7 3.1 28.1 15.9 93 96 A T H X S+ 0 0 36 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.929 110.2 46.8 -61.9 -45.5 3.7 31.0 13.5 94 97 A L H X S+ 0 0 2 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.880 112.2 51.5 -64.8 -38.0 3.3 33.6 16.1 95 98 A G H X S+ 0 0 1 -4,-1.9 4,-1.5 -5,-0.2 -2,-0.2 0.942 111.9 46.3 -63.0 -47.2 5.5 31.6 18.5 96 99 A N H X S+ 0 0 3 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.871 111.3 51.9 -62.8 -39.2 8.2 31.4 15.8 97 100 A L H X>S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.6 0.927 107.6 52.3 -64.8 -43.1 7.9 35.2 15.0 98 101 A Y H X5S+ 0 0 12 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.860 111.5 47.4 -61.2 -34.4 8.3 36.1 18.6 99 102 A V H <5S+ 0 0 0 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.938 116.4 42.7 -70.5 -47.6 11.5 34.0 18.8 100 103 A A H <5S+ 0 0 13 -4,-2.3 -2,-0.2 1,-0.1 -3,-0.2 0.880 130.0 22.4 -67.6 -42.9 13.0 35.4 15.6 101 104 A T H <5S- 0 0 30 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.788 83.2-142.3 -98.0 -33.5 12.2 39.1 16.1 102 105 A G << + 0 0 19 -4,-1.2 -4,-0.1 -5,-0.6 -3,-0.1 0.497 46.9 150.0 82.0 2.6 11.7 39.5 19.8 103 106 A K >> - 0 0 97 -6,-0.3 3,-1.6 1,-0.1 4,-0.6 -0.580 45.8-145.1 -75.3 120.4 8.9 42.0 19.2 104 107 A P H >> S+ 0 0 44 0, 0.0 4,-2.0 0, 0.0 3,-0.7 0.733 89.7 79.3 -54.9 -24.8 6.2 41.8 22.1 105 108 A V H 3> S+ 0 0 51 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.850 89.4 53.0 -55.2 -35.9 3.5 42.5 19.5 106 109 A Y H <> S+ 0 0 7 -3,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.838 106.9 52.2 -70.2 -30.7 3.5 38.9 18.4 107 110 A A H S+ 0 0 0 -4,-1.3 5,-2.3 2,-0.2 -2,-0.2 0.863 113.1 50.9 -73.6 -37.0 -10.5 30.0 23.6 118 121 A A H ><5S+ 0 0 8 -4,-2.7 3,-2.2 1,-0.2 -2,-0.2 0.941 106.7 53.5 -66.3 -47.1 -10.0 29.9 27.3 119 122 A K H 3<5S+ 0 0 131 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.829 109.6 49.8 -57.0 -32.2 -13.0 32.1 28.0 120 123 A A T 3<5S- 0 0 24 -4,-1.0 -63,-0.3 -5,-0.2 -1,-0.3 0.378 111.0-123.3 -87.6 3.9 -15.1 29.7 26.0 121 124 A D T X 5 - 0 0 74 -3,-2.2 3,-0.7 1,-0.1 4,-0.4 0.868 46.0-177.8 54.5 42.1 -13.8 26.7 27.8 122 125 A A T 3 < + 0 0 10 -5,-2.3 -1,-0.1 1,-0.2 -66,-0.1 -0.232 56.1 26.0 -69.5 159.0 -12.6 25.1 24.6 123 126 A L T 3 S+ 0 0 5 2,-0.1 -1,-0.2 1,-0.1 52,-0.1 0.692 105.1 86.0 61.4 23.9 -10.9 21.7 24.4 124 127 A L S < S+ 0 0 12 -3,-0.7 2,-0.7 1,-0.2 -2,-0.1 0.689 70.1 62.9-122.2 -31.6 -12.7 20.6 27.6 125 128 A N S S+ 0 0 94 -4,-0.4 -66,-3.8 -68,-0.3 2,-0.3 -0.861 72.7 105.1-106.3 106.1 -16.2 19.2 26.7 126 129 A Y S S- 0 0 19 -2,-0.7 -66,-0.1 -68,-0.2 -68,-0.0 -0.982 72.9 -84.1-165.8 170.4 -16.2 16.1 24.5 127 130 A D > - 0 0 79 -68,-0.5 3,-2.1 -2,-0.3 6,-0.5 -0.777 31.8-151.0 -86.4 115.5 -16.7 12.4 24.3 128 131 A P T 3 S+ 0 0 32 0, 0.0 -1,-0.1 0, 0.0 50,-0.0 0.632 94.8 62.5 -63.0 -12.4 -13.3 10.8 25.3 129 132 A K T 3 S+ 0 0 184 4,-0.1 2,-0.2 51,-0.0 -2,-0.0 0.364 96.9 78.5 -92.5 3.2 -14.2 7.8 23.1 130 133 A S S X> S- 0 0 38 -3,-2.1 3,-1.4 1,-0.0 4,-0.5 -0.508 97.2 -96.9-108.7 177.6 -14.2 10.0 20.0 131 134 A Q H >> S+ 0 0 83 -70,-0.3 4,-2.0 1,-0.3 3,-0.7 0.753 113.7 76.1 -62.1 -26.3 -11.7 11.7 17.6 132 135 A S H 3> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.849 86.2 62.0 -54.0 -36.0 -12.1 14.9 19.6 133 136 A W H <> S+ 0 0 7 -3,-1.4 4,-1.2 -6,-0.5 -1,-0.2 0.899 107.6 42.1 -58.9 -41.5 -9.9 13.2 22.3 134 137 A Y H < S+ 0 0 2 -4,-1.7 3,-1.0 -5,-0.2 4,-0.2 0.934 114.6 46.3 -59.8 -48.6 4.2 28.8 21.3 147 150 A L H >< S+ 0 0 0 -4,-2.4 3,-2.3 1,-0.2 -1,-0.2 0.844 99.2 68.9 -63.5 -36.7 3.3 30.3 24.7 148 151 A S H >< S+ 0 0 0 -4,-2.3 3,-0.6 1,-0.3 -1,-0.2 0.714 92.8 60.5 -57.6 -21.6 6.3 28.7 26.5 149 152 A T T << S+ 0 0 8 -3,-1.0 -1,-0.3 -4,-0.6 3,-0.2 0.609 108.1 43.5 -81.0 -13.5 8.6 31.0 24.5 150 153 A M T X S+ 0 0 3 -3,-2.3 3,-0.9 -4,-0.2 -1,-0.2 0.062 74.1 109.5-120.9 26.0 7.0 34.1 26.0 151 154 A M T < S+ 0 0 30 -3,-0.6 -1,-0.1 1,-0.2 -2,-0.1 0.625 85.6 46.1 -75.6 -13.8 6.6 33.2 29.7 152 155 A A T 3 S+ 0 0 69 -138,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.286 81.5 122.2-109.1 7.4 9.3 35.7 30.6 153 156 A E < - 0 0 14 -3,-0.9 3,-0.2 1,-0.2 -3,-0.1 -0.621 40.4-171.5 -76.5 115.9 7.9 38.6 28.4 154 157 A P S S+ 0 0 96 0, 0.0 2,-1.6 0, 0.0 4,-0.2 0.805 72.4 71.3 -76.3 -33.7 7.3 41.6 30.6 155 158 A N S S+ 0 0 117 2,-0.1 2,-0.3 3,-0.0 -47,-0.1 -0.381 84.7 86.2 -85.0 60.1 5.4 43.8 28.0 156 159 A V S S- 0 0 18 -2,-1.6 2,-0.8 -3,-0.2 3,-0.1 -0.986 94.4 -84.2-153.4 151.9 2.2 41.7 28.0 157 160 A D > - 0 0 92 -2,-0.3 4,-2.0 1,-0.2 3,-0.3 -0.449 41.6-166.9 -62.3 104.3 -1.0 41.6 30.0 158 161 A T H > S+ 0 0 75 -2,-0.8 4,-1.9 1,-0.2 -1,-0.2 0.812 83.7 54.4 -64.9 -32.8 0.1 39.3 32.8 159 162 A A H > S+ 0 0 52 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.836 108.7 50.6 -70.2 -31.9 -3.4 38.6 34.1 160 163 A Q H > S+ 0 0 19 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.933 108.1 51.1 -70.3 -46.7 -4.3 37.5 30.7 161 164 A R H X S+ 0 0 36 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.883 109.2 52.4 -57.7 -39.3 -1.3 35.1 30.5 162 165 A E H X S+ 0 0 124 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.899 107.8 50.5 -63.9 -41.8 -2.3 33.6 33.9 163 166 A R H X S+ 0 0 93 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.906 112.4 46.9 -62.3 -44.0 -5.8 33.0 32.7 164 167 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.925 110.9 51.4 -65.4 -45.4 -4.6 31.2 29.6 165 168 A V H X S+ 0 0 17 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.894 109.4 50.0 -60.3 -41.3 -2.0 29.1 31.5 166 169 A K H X S+ 0 0 148 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.886 110.3 52.2 -64.0 -38.2 -4.7 27.9 34.0 167 170 A W H X S+ 0 0 10 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.949 109.4 46.8 -62.0 -51.2 -6.9 27.0 31.1 168 171 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.886 110.4 54.3 -59.7 -38.6 -4.2 24.9 29.4 169 172 A N H X S+ 0 0 30 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.914 110.5 45.9 -61.7 -43.2 -3.4 23.2 32.7 170 173 A R H X S+ 0 0 143 -4,-2.1 4,-2.2 2,-0.2 5,-0.2 0.925 111.5 52.9 -64.7 -44.0 -7.1 22.3 33.0 171 174 A V H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.945 112.8 43.0 -57.1 -50.0 -7.2 21.1 29.4 172 175 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.899 111.2 53.0 -66.4 -41.7 -4.2 18.8 29.9 173 176 A R H < S+ 0 0 89 -4,-2.3 4,-0.4 -5,-0.2 -1,-0.2 0.916 114.5 44.0 -61.9 -39.1 -5.2 17.3 33.2 174 177 A H H >< S+ 0 0 64 -4,-2.2 3,-0.8 -5,-0.2 4,-0.5 0.937 113.6 48.7 -70.0 -46.4 -8.6 16.4 31.8 175 178 A Q H >< S+ 0 0 0 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.904 114.6 44.4 -61.9 -42.6 -7.3 15.0 28.5 176 179 A T T 3< S+ 0 0 14 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.488 92.8 81.2 -82.7 -3.1 -4.7 12.8 30.1 177 180 A S T < S+ 0 0 73 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.2 0.757 78.2 82.3 -73.1 -22.5 -7.0 11.5 32.8 178 181 A F S < S- 0 0 53 -3,-0.8 -4,-0.0 -4,-0.5 0, 0.0 -0.673 70.9-151.0 -85.4 134.6 -8.4 9.0 30.4 179 182 A P - 0 0 103 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 0.809 27.1-143.0 -73.5 -35.3 -6.4 5.8 29.9 180 183 A G - 0 0 33 5,-0.1 -51,-0.0 6,-0.0 5,-0.0 -0.150 25.1 -73.0 89.1 169.8 -7.2 4.8 26.3 181 184 A G > - 0 0 44 -2,-0.0 4,-1.0 1,-0.0 5,-0.1 0.211 67.1 -61.0 -84.3-153.9 -7.7 1.3 25.0 182 185 A D T 4 S+ 0 0 157 2,-0.1 4,-0.1 1,-0.1 -1,-0.0 0.732 135.3 21.7 -65.2 -25.3 -5.4 -1.6 24.2 183 186 A T T >> S+ 0 0 82 2,-0.1 4,-2.0 3,-0.1 3,-1.8 0.806 120.3 53.4-108.1 -51.4 -3.4 0.4 21.7 184 187 A S T 34 S+ 0 0 9 1,-0.3 -2,-0.1 2,-0.2 -1,-0.0 0.644 101.5 66.2 -61.6 -14.1 -4.0 4.1 22.4 185 188 A C T 3< S+ 0 0 27 -4,-1.0 -1,-0.3 1,-0.1 -3,-0.1 0.828 123.4 9.9 -71.2 -32.3 -2.9 3.4 26.0 186 189 A C T <4 S+ 0 0 28 -3,-1.8 -2,-0.2 -5,-0.1 46,-0.2 0.407 106.5 84.2-135.7 2.7 0.5 2.7 24.8 187 190 A N S >X S- 0 0 7 -4,-2.0 3,-1.2 45,-0.1 4,-1.1 -0.016 102.6 -58.3 -93.4-156.6 1.2 3.6 21.1 188 191 A N H 3> S+ 0 0 1 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.802 132.0 64.5 -58.3 -27.8 2.2 6.9 19.6 189 192 A H H 3> S+ 0 0 26 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.889 97.4 55.5 -62.1 -36.8 -0.9 8.5 21.0 190 193 A S H <> S+ 0 0 0 -3,-1.2 4,-1.4 -7,-0.2 -1,-0.2 0.903 109.1 47.8 -61.3 -37.8 0.4 7.8 24.5 191 194 A Y H X S+ 0 0 1 -4,-1.1 4,-2.3 2,-0.2 -2,-0.2 0.860 108.3 52.7 -72.8 -35.4 3.5 9.8 23.5 192 195 A W H X S+ 0 0 2 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.918 110.2 48.5 -64.8 -41.4 1.6 12.7 22.1 193 196 A R H X S+ 0 0 1 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.860 109.1 58.1 -63.6 -31.2 -0.3 12.9 25.4 194 197 A G H X S+ 0 0 0 -4,-1.4 4,-2.2 -5,-0.2 -2,-0.2 0.934 106.1 43.6 -63.6 -48.2 3.2 12.7 26.9 195 198 A Q H X S+ 0 0 1 -4,-2.3 4,-2.3 1,-0.2 5,-0.3 0.845 112.5 55.7 -67.4 -32.1 4.5 15.8 25.1 196 199 A E H X S+ 0 0 0 -4,-1.9 4,-1.7 -5,-0.2 5,-0.2 0.942 111.5 41.5 -63.1 -49.3 1.2 17.6 25.9 197 200 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.879 114.7 53.6 -66.3 -39.2 1.5 17.0 29.7 198 201 A T H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.944 112.3 39.1 -64.0 -53.3 5.3 17.8 29.7 199 202 A I H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.876 121.8 44.1 -69.5 -34.2 5.2 21.2 28.0 200 203 A I H X S+ 0 0 0 -4,-1.7 4,-2.3 -5,-0.3 6,-0.3 0.868 108.9 57.0 -77.0 -34.3 2.1 22.3 29.9 201 204 A G H <>S+ 0 0 0 -4,-2.4 5,-2.6 -5,-0.2 9,-0.2 0.887 109.5 48.5 -60.2 -36.7 3.4 20.8 33.2 202 205 A V H ><5S+ 0 0 0 -4,-1.7 3,-0.7 3,-0.2 -2,-0.2 0.922 113.6 42.3 -69.7 -48.6 6.4 23.1 32.7 203 206 A I H 3<5S+ 0 0 5 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.798 120.4 42.7 -72.9 -27.2 4.5 26.4 31.9 204 207 A S T 3<5S- 0 0 27 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.364 107.1-129.1 -96.2 4.3 1.9 25.8 34.6 205 208 A K T < 5 + 0 0 115 -3,-0.7 2,-0.8 1,-0.2 -3,-0.2 0.889 53.9 153.7 48.2 46.4 4.6 24.7 37.0 206 209 A D >< - 0 0 28 -5,-2.6 4,-2.4 -6,-0.3 3,-0.3 -0.865 26.7-171.4-106.8 97.0 2.6 21.5 37.8 207 210 A D H > S+ 0 0 55 -2,-0.8 4,-2.6 1,-0.2 5,-0.2 0.832 82.7 57.4 -58.0 -36.2 5.1 18.8 38.8 208 211 A E H > S+ 0 0 126 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.920 110.9 41.9 -62.7 -43.5 2.5 16.1 38.9 209 212 A L H > S+ 0 0 6 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.925 113.1 54.1 -68.6 -44.8 1.6 16.7 35.2 210 213 A F H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.916 110.4 47.4 -54.0 -46.9 5.3 17.1 34.3 211 214 A R H X S+ 0 0 59 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.880 108.6 52.8 -63.4 -42.7 6.1 13.7 35.8 212 215 A W H X S+ 0 0 73 -4,-1.9 4,-0.7 1,-0.2 -1,-0.2 0.917 109.7 51.9 -60.2 -41.3 3.2 11.9 34.1 213 216 A G H >X S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 4,-0.8 0.928 107.1 49.0 -61.1 -50.1 4.5 13.3 30.9 214 217 A L H >X S+ 0 0 0 -4,-2.2 4,-1.5 1,-0.3 3,-0.7 0.847 103.2 65.8 -59.1 -32.8 8.1 12.1 31.4 215 218 A G H 3X S+ 0 0 10 -4,-1.9 4,-2.1 1,-0.2 -1,-0.3 0.742 92.8 58.6 -61.8 -26.0 6.6 8.7 32.2 216 219 A R H < S+ 0 0 51 -4,-2.1 3,-0.6 1,-0.2 -1,-0.2 0.899 107.3 52.2 -55.5 -43.3 6.9 3.6 28.6 220 223 A A H >< S+ 0 0 0 -4,-1.9 3,-2.2 1,-0.2 -1,-0.2 0.894 100.7 59.5 -62.5 -43.1 8.0 4.0 25.0 221 224 A M H >< S+ 0 0 2 -4,-1.8 3,-0.7 1,-0.3 -1,-0.2 0.784 104.1 52.8 -58.6 -26.7 11.6 2.9 25.6 222 225 A G T << S+ 0 0 39 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.448 101.9 60.5 -88.5 0.6 10.3 -0.4 26.9 223 226 A L T < S+ 0 0 38 -3,-2.2 8,-2.8 -4,-0.2 2,-0.5 -0.021 78.5 111.9-115.1 27.0 8.2 -1.0 23.8 224 227 A I B < -B 230 0B 5 -3,-0.7 6,-0.2 6,-0.2 5,-0.1 -0.882 61.7-133.2-103.8 132.6 11.1 -1.0 21.4 225 228 A N > - 0 0 42 4,-3.8 3,-1.8 -2,-0.5 -2,-0.1 -0.173 35.2 -90.9 -73.5 174.0 12.0 -4.2 19.6 226 229 A E T 3 S+ 0 0 169 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.722 127.8 47.5 -58.1 -26.3 15.6 -5.6 19.2 227 230 A D T 3 S- 0 0 47 2,-0.1 -1,-0.3 46,-0.0 46,-0.0 0.377 124.5 -97.7 -99.3 3.2 16.0 -3.7 16.0 228 231 A G S < S+ 0 0 0 -3,-1.8 2,-0.2 1,-0.3 53,-0.2 0.451 79.2 135.6 96.1 0.5 14.7 -0.3 17.2 229 232 A S - 0 0 0 52,-0.1 -4,-3.8 1,-0.1 2,-0.5 -0.553 59.2-114.0 -81.9 148.3 11.2 -0.7 15.8 230 233 A F B > -B 224 0B 0 -6,-0.2 4,-1.8 -2,-0.2 3,-0.5 -0.724 18.3-137.4 -84.7 125.4 8.2 0.3 18.0 231 234 A V T 4 S+ 0 0 54 -8,-2.8 3,-0.3 -2,-0.5 -1,-0.1 0.901 100.2 41.6 -43.8 -58.4 6.1 -2.7 19.0 232 235 A H T >4 S+ 0 0 44 -9,-0.3 3,-0.7 1,-0.2 -1,-0.2 0.759 111.8 53.4 -67.9 -27.2 2.7 -1.0 18.4 233 236 A E G >4 S+ 0 0 0 -3,-0.5 3,-1.4 1,-0.2 10,-0.2 0.777 95.7 68.0 -79.9 -25.6 3.6 0.9 15.2 234 237 A M G 3< S+ 0 0 8 -4,-1.8 -1,-0.2 -3,-0.3 3,-0.2 0.339 90.2 66.8 -74.8 9.8 4.8 -2.3 13.4 235 238 A T G < S+ 0 0 86 -3,-0.7 -1,-0.3 1,-0.1 -2,-0.1 0.171 74.2 90.5-112.1 16.1 1.1 -3.5 13.4 236 239 A R S X S- 0 0 87 -3,-1.4 3,-2.3 1,-0.3 -1,-0.1 0.134 75.6-149.8-101.3 20.7 -0.1 -0.8 11.1 237 240 A H G > S+ 0 0 101 1,-0.3 3,-1.8 2,-0.2 4,-0.3 -0.231 78.8 8.3 54.5-122.6 0.4 -2.7 7.8 238 241 A E G 3 S+ 0 0 92 1,-0.3 63,-2.5 2,-0.1 -1,-0.3 0.576 135.3 53.1 -68.4 -6.2 1.2 -0.4 4.9 239 242 A Q G <> S+ 0 0 38 -3,-2.3 4,-2.4 61,-0.2 -1,-0.3 0.234 76.7 104.4-110.2 11.0 1.5 2.5 7.4 240 243 A S H <> S+ 0 0 0 -3,-1.8 4,-1.7 2,-0.2 5,-0.1 0.920 82.4 44.0 -60.6 -47.1 4.0 0.9 9.7 241 244 A L H > S+ 0 0 0 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.883 112.9 54.6 -66.8 -35.4 7.1 2.9 8.6 242 245 A H H > S+ 0 0 8 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.920 111.6 42.8 -61.7 -47.7 5.0 6.1 8.6 243 246 A Y H X S+ 0 0 47 -4,-2.4 4,-2.0 -10,-0.2 -1,-0.2 0.760 107.5 59.7 -73.1 -24.9 3.9 5.5 12.3 244 247 A Q H X S+ 0 0 0 -4,-1.7 4,-0.6 -5,-0.2 -1,-0.2 0.938 113.2 39.5 -65.6 -45.1 7.4 4.4 13.3 245 248 A N H >X S+ 0 0 0 -4,-1.9 3,-1.0 1,-0.2 4,-0.6 0.902 112.0 58.0 -68.5 -41.6 8.6 7.9 12.2 246 249 A Y H >< S+ 0 0 31 -4,-2.4 3,-1.2 1,-0.3 -2,-0.2 0.872 100.1 56.3 -57.5 -41.2 5.5 9.6 13.6 247 250 A A H 3X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.3 -1,-0.3 0.763 96.5 66.5 -64.2 -25.0 6.2 8.3 17.1 248 251 A M H S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.893 116.5 57.0 -69.7 -35.0 6.5 13.6 20.4 251 254 A L H X S+ 0 0 0 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.903 107.0 50.4 -59.1 -40.3 9.3 11.5 22.0 252 255 A T H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.898 110.1 49.6 -64.8 -40.9 11.8 14.0 20.7 253 256 A M H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.852 107.7 52.6 -70.2 -33.9 9.9 17.0 22.1 254 257 A I H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.949 113.4 45.7 -64.4 -43.8 9.5 15.4 25.6 255 258 A A H X S+ 0 0 1 -4,-1.9 4,-2.1 2,-0.2 10,-0.3 0.893 113.5 47.8 -64.5 -43.1 13.3 14.9 25.6 256 259 A E H X S+ 0 0 14 -4,-2.5 4,-1.1 2,-0.2 -1,-0.2 0.904 114.7 47.1 -65.3 -40.5 14.1 18.4 24.4 257 260 A T H < S+ 0 0 2 -4,-2.4 3,-0.4 1,-0.2 4,-0.2 0.912 112.1 49.2 -67.3 -41.4 11.7 19.9 26.9 258 261 A A H ><>S+ 0 0 0 -4,-2.7 5,-2.2 1,-0.2 3,-1.6 0.866 104.1 60.9 -65.9 -36.1 13.1 17.8 29.8 259 262 A S H ><5S+ 0 0 35 -4,-2.1 3,-1.6 1,-0.3 -1,-0.2 0.842 98.2 56.4 -60.0 -35.5 16.7 18.8 28.8 260 263 A R T 3<5S+ 0 0 83 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.545 104.2 55.7 -74.9 -6.2 15.9 22.5 29.4 261 264 A Q T < 5S- 0 0 8 -3,-1.6 -1,-0.3 -4,-0.2 -2,-0.2 0.184 127.2-100.0-106.8 12.2 14.8 21.4 33.0 262 265 A G T < 5S+ 0 0 65 -3,-1.6 2,-0.4 1,-0.3 -3,-0.2 0.550 84.0 127.3 82.8 8.7 18.2 19.8 33.6 263 266 A I < - 0 0 29 -5,-2.2 2,-1.1 -6,-0.1 -1,-0.3 -0.850 51.9-147.7-103.9 133.2 17.0 16.2 32.9 264 267 A D + 0 0 105 -2,-0.4 3,-0.5 1,-0.2 4,-0.2 -0.659 31.7 158.1 -99.5 78.3 18.8 14.0 30.4 265 268 A L > + 0 0 1 -2,-1.1 3,-2.2 -10,-0.3 -1,-0.2 0.855 67.1 67.8 -67.5 -36.8 16.0 11.8 29.0 266 269 A Y T 3 S+ 0 0 5 1,-0.3 9,-0.4 -3,-0.2 10,-0.3 0.848 95.1 57.4 -52.4 -36.0 17.9 11.0 25.9 267 270 A A T 3 S+ 0 0 63 -3,-0.5 2,-0.4 7,-0.1 -1,-0.3 0.565 80.3 113.6 -74.5 -7.6 20.4 8.9 28.0 268 271 A Y < - 0 0 48 -3,-2.2 7,-0.4 -4,-0.2 2,-0.3 -0.523 46.1-177.0 -73.2 124.9 17.6 6.7 29.3 269 272 A K - 0 0 126 -2,-0.4 2,-0.3 5,-0.1 5,-0.2 -0.824 19.2-164.9-120.6 159.0 17.9 3.1 28.2 270 273 A E S S- 0 0 56 3,-2.3 3,-0.4 -2,-0.3 -46,-0.1 -0.926 76.6 -21.6-146.0 115.3 15.9 -0.2 28.6 271 274 A N S S- 0 0 130 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.879 127.1 -47.9 52.5 46.0 17.3 -3.6 27.7 272 275 A G S S+ 0 0 64 1,-0.2 2,-0.3 5,-0.0 -1,-0.2 0.815 118.8 104.5 68.4 31.1 20.0 -2.2 25.4 273 276 A R + 0 0 69 -3,-0.4 -3,-2.3 -52,-0.0 2,-0.2 -0.996 35.3 155.7-145.3 137.6 17.6 0.1 23.5 274 277 A D >> - 0 0 18 -2,-0.3 4,-1.1 -5,-0.2 3,-0.8 -0.735 61.8 -72.3-142.9-169.3 17.0 3.8 23.6 275 278 A I H 3> S+ 0 0 0 -7,-0.4 4,-2.1 -9,-0.4 5,-0.1 0.789 126.4 62.6 -65.1 -25.9 15.7 6.5 21.3 276 279 A H H 3> S+ 0 0 36 -10,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.851 97.9 56.6 -66.8 -33.1 18.8 6.3 19.2 277 280 A S H <> S+ 0 0 17 -3,-0.8 4,-1.6 1,-0.2 -1,-0.2 0.898 107.8 48.5 -63.0 -40.1 17.9 2.7 18.3 278 281 A A H X S+ 0 0 0 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.905 110.2 50.7 -67.3 -42.4 14.6 3.9 17.0 279 282 A R H X S+ 0 0 29 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.939 109.1 51.5 -60.7 -46.5 16.3 6.7 14.9 280 283 A K H X S+ 0 0 121 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.844 107.7 52.5 -60.9 -34.1 18.7 4.1 13.4 281 284 A F H X S+ 0 0 7 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.906 107.0 51.8 -68.8 -41.4 15.8 1.8 12.4 282 285 A V H X S+ 0 0 1 -4,-1.9 4,-1.9 1,-0.2 5,-0.2 0.958 112.9 45.2 -58.2 -50.6 13.9 4.7 10.6 283 286 A F H X S+ 0 0 3 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.889 115.8 46.4 -61.4 -39.9 17.0 5.5 8.6 284 287 A A H X S+ 0 0 38 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.852 111.1 51.3 -72.1 -35.7 17.8 1.9 7.8 285 288 A A H < S+ 0 0 0 -4,-2.6 7,-0.2 2,-0.2 -1,-0.2 0.824 107.8 52.3 -71.8 -33.0 14.2 1.0 6.8 286 289 A V H < S+ 0 0 35 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.869 114.6 42.9 -70.0 -35.8 13.9 4.0 4.4 287 290 A K H < S+ 0 0 116 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.887 131.7 23.7 -75.0 -39.1 17.2 2.9 2.7 288 291 A N >< - 0 0 71 -4,-2.3 3,-2.1 -5,-0.1 -1,-0.3 -0.764 65.2-177.3-131.4 85.7 16.1 -0.8 2.7 289 292 A P G > S+ 0 0 69 0, 0.0 3,-1.1 0, 0.0 4,-0.4 0.591 73.9 83.1 -57.7 -12.0 12.3 -1.2 2.9 290 293 A D G > S+ 0 0 111 1,-0.2 3,-1.3 2,-0.2 4,-0.3 0.788 76.1 70.6 -65.6 -25.0 12.9 -5.0 3.0 291 294 A L G X S+ 0 0 46 -3,-2.1 3,-1.0 1,-0.3 -1,-0.2 0.817 91.5 58.7 -60.4 -30.1 13.5 -4.7 6.8 292 295 A I G X> S+ 0 0 1 -3,-1.1 4,-2.4 -4,-0.2 3,-2.2 0.716 84.0 83.1 -72.6 -19.8 9.8 -3.9 7.2 293 296 A K G <4 S+ 0 0 119 -3,-1.3 -1,-0.2 -4,-0.4 -2,-0.2 0.675 78.6 66.4 -58.1 -19.9 8.9 -7.3 5.7 294 297 A K G <4 S+ 0 0 132 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.1 0.720 116.5 26.1 -74.4 -18.2 9.4 -9.0 9.0 295 298 A Y T <4 S+ 0 0 70 -3,-2.2 2,-0.3 1,-0.3 -2,-0.2 0.716 131.5 17.0-113.7 -32.5 6.4 -7.1 10.3 296 299 A A < - 0 0 10 -4,-2.4 -1,-0.3 1,-0.1 4,-0.1 -0.988 47.7-158.3-149.2 136.3 4.2 -6.3 7.3 297 300 A S + 0 0 86 -2,-0.3 -4,-0.1 -3,-0.1 -1,-0.1 0.645 65.5 100.8 -86.8 -17.0 4.0 -7.7 3.8 298 301 A E S S- 0 0 57 1,-0.1 2,-0.1 -5,-0.0 -2,-0.1 -0.347 86.0 -97.5 -71.1 148.4 2.2 -4.6 2.3 299 302 A P - 0 0 115 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.430 48.9-113.1 -63.8 137.8 4.1 -2.0 0.3 300 303 A Q - 0 0 33 -2,-0.1 2,-0.7 -4,-0.1 -61,-0.2 -0.551 13.3-129.7 -82.8 136.7 5.0 0.9 2.6 301 304 A D + 0 0 57 -63,-2.5 3,-0.2 -2,-0.3 -59,-0.2 -0.727 27.2 178.6 -81.3 116.0 3.5 4.4 2.2 302 305 A T > + 0 0 73 -2,-0.7 3,-1.3 1,-0.2 -1,-0.1 -0.043 37.0 123.9-111.8 32.0 6.5 6.8 2.2 303 306 A R T 3 S+ 0 0 78 1,-0.3 3,-0.4 2,-0.1 -1,-0.2 0.832 71.4 59.8 -59.4 -33.0 4.7 10.1 1.7 304 307 A A T 3 S+ 0 0 1 -3,-0.2 2,-0.6 1,-0.2 -1,-0.3 0.665 90.1 73.1 -71.5 -16.9 6.3 11.5 4.9 305 308 A F < + 0 0 20 -3,-1.3 -1,-0.2 3,-0.1 -2,-0.1 -0.330 68.7 108.6 -99.3 53.0 9.8 11.0 3.7 306 309 A K S > S- 0 0 104 -2,-0.6 3,-2.1 -3,-0.4 6,-0.2 -0.962 82.0 -90.8-122.5 142.1 10.1 13.8 1.2 307 310 A P T 3 S+ 0 0 70 0, 0.0 24,-0.1 0, 0.0 3,-0.1 -0.211 113.7 26.3 -50.9 136.1 12.2 17.0 1.8 308 311 A G T 3 S+ 0 0 32 22,-0.4 28,-0.4 25,-0.4 2,-0.2 0.330 83.1 139.4 93.0 -10.7 10.1 19.6 3.5 309 312 A R X - 0 0 74 -3,-2.1 3,-1.9 -5,-0.1 -1,-0.3 -0.510 55.5-136.0 -71.3 135.2 7.5 17.3 5.1 310 313 A G G > S+ 0 0 18 1,-0.3 3,-1.9 -2,-0.2 4,-0.2 0.755 99.0 76.9 -59.9 -24.7 6.6 18.4 8.7 311 314 A D G 3 S+ 0 0 17 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.646 88.9 58.1 -59.5 -18.2 7.0 14.7 9.7 312 315 A L G X> S+ 0 0 0 -3,-1.9 3,-1.4 1,-0.2 4,-0.7 0.332 70.6 107.1 -96.3 6.5 10.8 15.2 9.6 313 316 A N H X> + 0 0 0 -3,-1.9 4,-1.0 1,-0.3 3,-0.9 0.823 69.3 64.7 -54.2 -36.6 10.9 18.0 12.2 314 317 A W H 3> S+ 0 0 1 -3,-0.3 4,-2.3 1,-0.2 -1,-0.3 0.794 92.2 63.4 -60.5 -28.2 12.3 15.8 14.9 315 318 A I H <> S+ 0 0 2 -3,-1.4 4,-2.8 1,-0.2 5,-0.3 0.858 96.7 57.4 -65.9 -35.2 15.5 15.3 12.9 316 319 A E H + 0 0 34 1,-0.2 3,-1.1 -2,-0.1 -1,-0.1 -0.610 42.1 175.5 -86.0 76.7 22.0 13.4 7.3 327 330 A E T 3 S+ 0 0 110 -2,-1.8 -1,-0.2 1,-0.2 -2,-0.0 0.797 73.0 42.0 -52.8 -39.4 22.3 9.9 5.7 328 331 A L T 3 S- 0 0 42 -3,-0.2 -1,-0.2 0, 0.0 -2,-0.1 0.479 105.5-120.7 -92.6 -3.4 19.2 10.2 3.5 329 332 A G < + 0 0 37 -3,-1.1 3,-0.2 2,-0.1 -2,-0.1 0.838 67.0 138.1 67.6 33.9 19.6 13.8 2.4 330 333 A F + 0 0 14 1,-0.2 2,-2.1 2,-0.1 -22,-0.4 0.805 48.2 79.3 -79.3 -32.8 16.3 14.9 3.9 331 334 A M + 0 0 13 1,-0.2 -1,-0.2 -24,-0.1 -2,-0.1 -0.300 61.7 104.2 -79.2 59.5 17.6 18.2 5.4 332 335 A T S S+ 0 0 77 -2,-2.1 -1,-0.2 -3,-0.2 -2,-0.1 0.852 76.7 33.2 -98.7 -70.9 17.5 20.3 2.2 333 336 A V S S- 0 0 68 -3,-0.4 -25,-0.4 1,-0.1 -1,-0.2 -0.444 100.2 -85.2 -84.8 162.4 14.5 22.6 2.4 334 337 A P - 0 0 41 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.251 39.2-140.1 -64.8 153.5 13.2 24.0 5.7 335 338 A I - 0 0 0 -22,-0.1 10,-1.0 -3,-0.1 2,-0.4 -0.930 17.8-177.5-118.7 141.7 10.8 22.1 7.8 336 339 A F + 0 0 77 -28,-0.4 7,-0.3 -2,-0.4 -26,-0.1 -0.981 8.6 165.4-141.5 123.9 7.8 23.4 9.7 337 340 A D B > > -C 342 0C 22 5,-2.5 5,-2.3 -2,-0.4 3,-1.6 -0.876 22.1-159.8-142.0 107.3 5.4 21.5 12.0 338 341 A P G > 5S+ 0 0 21 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.876 92.3 59.2 -50.4 -43.3 3.0 23.3 14.3 339 342 A R G 3 5S+ 0 0 30 1,-0.3 -194,-0.0 2,-0.2 -250,-0.0 0.620 108.8 43.3 -65.1 -17.8 2.6 20.2 16.6 340 343 A T G < 5S- 0 0 0 -3,-1.6 -1,-0.3 2,-0.2 -3,-0.1 -0.233 136.6 -72.6-121.8 42.9 6.4 20.0 17.3 341 344 A G T < 5S- 0 0 2 -3,-1.3 2,-0.4 -5,-0.1 -2,-0.2 0.632 73.3 -90.0 82.8 17.5 7.0 23.7 18.0 342 345 A G B - 0 0 7 -2,-0.4 4,-2.1 -7,-0.3 -7,-0.2 -0.678 52.1-175.9 -85.3 108.4 10.0 25.4 12.4 344 347 A A H >>S+ 0 0 0 -2,-0.8 4,-2.0 -9,-0.3 5,-1.2 0.792 87.3 59.2 -69.7 -26.1 12.8 23.1 13.7 345 348 A T H >5S+ 0 0 0 -10,-1.0 4,-0.6 3,-0.2 -1,-0.2 0.940 109.3 42.8 -65.7 -45.0 15.1 24.5 11.0 346 349 A L H 45S+ 0 0 0 -11,-0.4 -2,-0.2 1,-0.2 -1,-0.2 0.889 122.3 38.8 -66.1 -41.9 14.6 28.1 12.4 347 350 A L H <5S+ 0 0 6 -4,-2.1 -328,-0.2 1,-0.1 -2,-0.2 0.624 134.2 8.7 -89.0 -16.0 14.9 27.0 16.0 348 351 A A H <5S+ 0 0 15 -4,-2.0 -3,-0.2 -5,-0.1 2,-0.1 0.608 85.9 112.3-137.7 -27.8 17.6 24.4 16.0 349 352 A Y << - 0 0 33 -5,-1.2 -32,-0.1 -4,-0.6 -33,-0.1 -0.344 40.3-174.4 -58.6 124.2 19.5 24.1 12.7 350 353 A K 0 0 132 -2,-0.1 -1,-0.1 -318,-0.0 -318,-0.0 -0.946 360.0 360.0-124.9 109.4 23.1 25.2 13.0 351 354 A P 0 0 107 0, 0.0 -2,-0.1 0, 0.0 -316,-0.0 -0.253 360.0 360.0 -71.9 360.0 25.1 25.4 9.8