==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 24-NOV-10 3PP8 . COMPND 2 MOLECULE: GLYOXYLATE/HYDROXYPYRUVATE REDUCTASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA ENTERICA SUBSP. ENTERICA SE . AUTHOR G.MINASOV,Z.WAWRZAK,T.SKARINA,Y.WANG,L.PAPAZISI,A.SAVCHENKO, . 310 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16072.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 53 17.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 29 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 25.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.6 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 2 0 0 0 0 3 1 2 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 6 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 1 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 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 -2 A S 0 0 158 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -67.1 -16.6 26.6 87.3 2 -1 A N + 0 0 148 1,-0.0 2,-0.1 0, 0.0 0, 0.0 -0.849 360.0 116.8-147.0 33.0 -17.3 29.3 86.3 3 0 A A - 0 0 36 1,-0.1 2,-0.5 26,-0.1 26,-0.1 -0.389 58.2-120.0 -68.3 133.2 -15.1 32.4 85.8 4 1 A X E -a 29 0A 17 24,-0.7 26,-3.0 -2,-0.1 2,-0.5 -0.641 28.3-153.2 -73.6 118.8 -14.8 33.7 82.2 5 2 A E E -a 30 0A 40 -2,-0.5 38,-3.8 24,-0.2 39,-1.6 -0.858 14.0-177.1-100.6 125.6 -11.1 33.6 81.1 6 3 A I E -ab 31 44A 1 24,-3.0 26,-1.7 -2,-0.5 2,-0.4 -0.955 6.8-162.1-120.4 137.3 -9.9 36.1 78.5 7 4 A I E -ab 32 45A 0 37,-2.3 39,-2.7 -2,-0.4 2,-0.4 -0.924 5.9-159.2-120.2 148.8 -6.4 36.2 77.0 8 5 A F E +ab 33 46A 1 24,-1.9 26,-3.5 -2,-0.4 2,-0.3 -0.985 12.6 173.1-133.8 136.2 -4.9 39.2 75.2 9 6 A Y E + b 0 47A 58 37,-2.7 39,-1.1 -2,-0.4 26,-0.1 -0.938 7.3 157.3-146.2 124.1 -1.9 39.5 72.7 10 7 A H - 0 0 25 -2,-0.3 5,-0.2 37,-0.2 39,-0.1 -0.995 35.5-138.3-143.1 134.9 -0.7 42.5 70.7 11 8 A P S S+ 0 0 47 0, 0.0 -1,-0.1 0, 0.0 38,-0.0 0.829 96.9 5.0 -64.4 -31.1 2.8 43.0 69.3 12 9 A T S S+ 0 0 120 2,-0.0 2,-0.1 3,-0.0 0, 0.0 0.506 99.4 102.2-133.8 -7.0 3.1 46.8 70.1 13 10 A F S S- 0 0 77 1,-0.1 2,-1.3 2,-0.0 -3,-0.2 -0.342 84.6 -94.1 -76.4 161.5 0.0 48.0 72.1 14 11 A N > - 0 0 104 1,-0.2 4,-1.9 2,-0.1 3,-0.4 -0.665 36.5-165.5 -78.3 98.7 0.2 48.6 75.8 15 12 A A H > S+ 0 0 15 -2,-1.3 4,-3.1 1,-0.2 5,-0.2 0.865 85.2 55.7 -51.4 -42.2 -1.0 45.2 77.2 16 13 A A H > S+ 0 0 66 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.910 106.7 48.7 -59.4 -46.7 -1.5 46.7 80.7 17 14 A W H > S+ 0 0 126 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.886 116.0 44.0 -61.1 -41.2 -3.8 49.5 79.4 18 15 A W H X S+ 0 0 11 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.887 110.4 53.0 -73.1 -42.3 -5.9 47.0 77.4 19 16 A V H X S+ 0 0 20 -4,-3.1 4,-2.1 -5,-0.2 -2,-0.2 0.938 112.6 48.2 -56.3 -45.0 -6.1 44.4 80.1 20 17 A N H X S+ 0 0 71 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 0.942 110.4 46.9 -60.6 -55.5 -7.3 47.1 82.5 21 18 A A H X S+ 0 0 19 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.860 113.6 52.2 -58.0 -35.6 -10.0 48.6 80.2 22 19 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.867 105.8 53.4 -66.9 -41.3 -11.1 45.0 79.5 23 20 A E H < S+ 0 0 82 -4,-2.1 6,-0.3 1,-0.2 -2,-0.2 0.883 112.6 43.9 -62.3 -38.8 -11.4 44.3 83.2 24 21 A K H < S+ 0 0 147 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.795 114.1 49.9 -77.0 -27.5 -13.6 47.3 83.8 25 22 A A H < S+ 0 0 43 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.865 127.3 24.7 -78.4 -40.0 -15.7 46.6 80.7 26 23 A L S >< S+ 0 0 1 -4,-2.6 3,-2.6 -5,-0.1 -1,-0.3 -0.684 74.5 172.1-122.6 74.6 -16.3 42.9 81.7 27 24 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.783 77.6 60.3 -54.3 -32.1 -15.8 43.1 85.5 28 25 A H T 3 S+ 0 0 114 -3,-0.1 -24,-0.7 -4,-0.1 2,-0.3 0.370 94.7 88.8 -78.4 1.5 -17.0 39.5 85.8 29 26 A A E < S-a 4 0A 13 -3,-2.6 2,-0.6 -6,-0.3 -24,-0.2 -0.734 70.0-138.2-104.3 152.1 -14.0 38.4 83.6 30 27 A R E -a 5 0A 152 -26,-3.0 -24,-3.0 -2,-0.3 2,-0.4 -0.961 30.6-173.9-102.5 116.8 -10.5 37.3 84.4 31 28 A V E +a 6 0A 13 -2,-0.6 2,-0.3 -26,-0.2 -24,-0.2 -0.895 7.2 171.9-114.6 142.4 -8.3 38.9 81.7 32 29 A R E -a 7 0A 53 -26,-1.7 -24,-1.9 -2,-0.4 2,-0.3 -0.996 35.8-112.5-151.2 147.7 -4.6 38.3 81.3 33 30 A E E -a 8 0A 80 -2,-0.3 2,-0.4 -26,-0.2 -24,-0.2 -0.637 40.3-122.6 -75.6 133.9 -1.9 39.2 78.8 34 31 A W - 0 0 5 -26,-3.5 2,-0.3 -2,-0.3 20,-0.1 -0.672 31.9-177.7 -81.9 134.1 -0.7 36.0 77.0 35 32 A K > - 0 0 133 -2,-0.4 3,-2.0 -26,-0.1 -26,-0.0 -0.946 41.9 -79.3-127.2 149.8 3.0 35.2 77.3 36 33 A V T 3 S+ 0 0 114 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 -0.139 119.0 30.7 -48.3 135.7 4.9 32.3 75.7 37 34 A G T 3 S+ 0 0 65 1,-0.2 2,-1.1 16,-0.1 -1,-0.3 0.340 82.5 129.9 93.7 -5.7 4.4 29.1 77.7 38 35 A D < + 0 0 27 -3,-2.0 -1,-0.2 1,-0.1 -2,-0.0 -0.707 15.0 152.5 -86.6 97.6 0.9 30.1 78.9 39 36 A N + 0 0 123 -2,-1.1 -1,-0.1 -3,-0.1 3,-0.1 -0.071 26.3 127.4-113.3 30.3 -1.3 27.0 78.1 40 37 A N S S- 0 0 108 1,-0.1 -2,-0.0 0, 0.0 -3,-0.0 -0.653 71.6 -84.9 -85.9 143.5 -3.9 27.6 80.8 41 38 A P - 0 0 112 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.032 47.1-179.6 -51.0 156.1 -7.5 27.6 79.6 42 39 A A - 0 0 6 17,-0.5 -36,-0.2 -3,-0.1 17,-0.1 -0.945 24.1-155.2-147.5 158.0 -9.2 30.7 78.1 43 40 A D S S+ 0 0 46 -38,-3.8 18,-3.6 1,-0.4 19,-1.1 0.731 83.0 24.9-104.1 -36.4 -12.7 31.2 76.7 44 41 A Y E -bc 6 62A 1 -39,-1.6 -37,-2.3 16,-0.2 2,-0.4 -0.985 65.5-155.3-135.0 142.0 -11.9 34.2 74.5 45 42 A A E -bc 7 63A 0 17,-1.9 19,-3.4 -2,-0.4 2,-0.6 -0.972 1.2-162.6-122.4 126.1 -8.7 35.4 72.8 46 43 A L E +bc 8 64A 0 -39,-2.7 -37,-2.7 -2,-0.4 2,-0.3 -0.949 32.2 165.7-106.3 117.9 -8.0 39.0 71.7 47 44 A V E -bc 9 65A 0 17,-2.8 19,-2.9 -2,-0.6 2,-0.3 -0.940 36.5-176.6-143.3 154.4 -5.2 39.0 69.2 48 45 A W S S- 0 0 59 -39,-1.1 -2,-0.0 -2,-0.3 17,-0.0 -0.965 88.9 -10.4-142.1 134.2 -3.1 40.7 66.5 49 46 A Q S S- 0 0 125 -2,-0.3 -39,-0.1 1,-0.1 16,-0.0 0.848 88.8-168.4 40.3 49.4 -0.3 38.9 64.7 50 47 A P - 0 0 3 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.302 19.0-120.9 -65.4 144.0 -0.7 36.0 67.1 51 48 A P >> - 0 0 33 0, 0.0 3,-1.3 0, 0.0 4,-0.8 -0.566 27.3-111.3 -78.6 156.3 2.0 33.3 67.1 52 49 A V H >> S+ 0 0 31 1,-0.2 4,-2.6 -2,-0.2 3,-1.0 0.902 112.7 59.9 -52.0 -50.7 0.8 29.8 66.4 53 50 A E H 34 S+ 0 0 105 1,-0.3 -1,-0.2 2,-0.2 -16,-0.1 0.642 95.9 64.1 -60.4 -16.0 1.4 28.4 69.9 54 51 A X H <4 S+ 0 0 0 -3,-1.3 -1,-0.3 1,-0.1 -2,-0.2 0.924 120.1 19.3 -71.6 -42.5 -0.9 31.0 71.4 55 52 A L H X< S+ 0 0 2 -3,-1.0 3,-1.7 -4,-0.8 30,-0.3 0.591 92.9 115.6-103.7 -15.6 -4.0 29.5 69.6 56 53 A A T 3< S- 0 0 40 -4,-2.6 27,-0.2 1,-0.3 28,-0.1 -0.338 92.4 -1.4 -62.4 128.9 -2.9 25.9 68.6 57 54 A G T 3 S+ 0 0 55 25,-0.6 -1,-0.3 1,-0.2 2,-0.2 0.491 96.9 142.1 73.2 1.4 -5.0 23.2 70.4 58 55 A R < - 0 0 28 -3,-1.7 2,-0.7 25,-0.3 27,-0.4 -0.524 47.6-144.1 -76.9 140.2 -7.1 25.8 72.3 59 56 A R + 0 0 212 -2,-0.2 -17,-0.5 -17,-0.1 2,-0.3 -0.958 37.3 167.7 -99.0 116.7 -10.8 25.3 72.9 60 57 A L - 0 0 16 -2,-0.7 -16,-0.2 1,-0.1 -17,-0.1 -0.941 45.6-143.5-132.7 150.3 -12.2 28.8 72.6 61 58 A K S S- 0 0 98 -18,-3.6 2,-0.3 -2,-0.3 -17,-0.2 0.762 85.9 -18.0 -82.2 -26.3 -15.6 30.3 72.4 62 59 A A E -c 44 0A 0 -19,-1.1 -17,-1.9 26,-0.1 2,-0.4 -0.942 51.6-137.7-173.5 152.0 -14.3 33.1 70.0 63 60 A V E -cd 45 90A 2 26,-2.2 28,-2.6 -2,-0.3 2,-0.5 -0.978 17.7-155.5-115.9 134.8 -11.2 34.9 68.8 64 61 A F E -cd 46 91A 0 -19,-3.4 -17,-2.8 -2,-0.4 2,-0.6 -0.956 9.3-144.0-112.4 120.5 -11.3 38.7 68.3 65 62 A V E -cd 47 92A 3 26,-3.2 2,-2.5 -2,-0.5 28,-0.7 -0.749 17.7-131.4 -84.9 123.7 -8.9 40.2 65.8 66 63 A L S S+ 0 0 9 -19,-2.9 2,-0.2 -2,-0.6 -1,-0.1 -0.376 78.1 11.9 -78.7 69.1 -7.6 43.6 67.1 67 64 A G S S- 0 0 12 -2,-2.5 26,-0.7 220,-0.1 2,-0.4 -0.789 89.1 -79.5 148.9 166.7 -8.2 45.6 64.0 68 65 A A S S+ 0 0 37 -2,-0.2 214,-0.1 24,-0.2 -2,-0.0 -0.780 91.2 80.8 -90.4 144.6 -9.9 45.6 60.6 69 66 A G + 0 0 21 -2,-0.4 4,-0.4 -4,-0.0 3,-0.2 0.595 42.0 174.3 115.2 79.7 -7.8 43.6 58.1 70 67 A V > + 0 0 10 1,-0.2 4,-2.6 2,-0.1 5,-0.2 0.395 59.4 92.9 -94.0 1.2 -8.3 39.9 58.5 71 68 A D H > S+ 0 0 76 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.910 84.1 49.4 -62.3 -44.7 -6.2 39.1 55.4 72 69 A A H > S+ 0 0 61 -3,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.968 116.5 40.1 -60.1 -54.5 -3.0 38.6 57.5 73 70 A I H > S+ 0 0 16 -4,-0.4 4,-3.0 1,-0.2 5,-0.3 0.914 111.2 56.3 -64.3 -45.1 -4.5 36.3 60.1 74 71 A L H X S+ 0 0 49 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.888 108.4 48.6 -55.3 -40.1 -6.7 34.3 57.6 75 72 A S H X S+ 0 0 71 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.843 110.8 49.5 -70.9 -34.5 -3.5 33.4 55.5 76 73 A K H X S+ 0 0 74 -4,-1.5 4,-0.6 2,-0.2 -2,-0.2 0.940 116.5 43.0 -68.1 -43.4 -1.6 32.3 58.7 77 74 A L H < S+ 0 0 9 -4,-3.0 6,-0.3 1,-0.2 -2,-0.2 0.886 116.2 47.7 -65.4 -40.0 -4.7 30.1 59.6 78 75 A N H < S+ 0 0 134 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.755 115.7 44.2 -74.3 -26.5 -5.1 28.9 56.0 79 76 A A H < S+ 0 0 72 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.490 124.7 38.0 -91.1 -9.8 -1.4 28.1 55.8 80 77 A H >< + 0 0 68 -4,-0.6 3,-2.9 -5,-0.1 4,-0.4 -0.558 67.6 175.1-137.3 68.6 -1.6 26.6 59.2 81 78 A P T 3 S+ 0 0 105 0, 0.0 3,-0.3 0, 0.0 5,-0.2 0.698 80.2 64.5 -50.4 -15.6 -5.0 24.8 59.3 82 79 A E T 3 S+ 0 0 106 1,-0.2 -25,-0.6 3,-0.1 3,-0.2 0.429 80.8 78.9 -88.9 1.0 -3.8 23.6 62.8 83 80 A X S < S+ 0 0 0 -3,-2.9 2,-0.4 -6,-0.3 -25,-0.3 0.855 104.0 18.0 -82.0 -35.4 -3.7 27.0 64.4 84 81 A L S S- 0 0 2 -4,-0.4 -1,-0.3 -3,-0.3 -28,-0.1 -0.947 83.8-114.4-141.1 120.4 -7.4 27.5 65.1 85 82 A D > - 0 0 99 -27,-0.4 3,-2.3 -2,-0.4 -25,-0.1 -0.319 32.3-129.2 -50.4 124.6 -10.1 24.8 65.2 86 83 A A T 3 S+ 0 0 84 1,-0.3 -1,-0.2 -5,-0.2 224,-0.1 0.499 102.4 67.5 -61.9 -6.4 -12.2 25.8 62.3 87 84 A S T 3 S+ 0 0 99 2,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.641 78.9 98.6 -85.8 -13.9 -15.4 25.6 64.4 88 85 A I S < S- 0 0 9 -3,-2.3 -26,-0.1 1,-0.1 -27,-0.1 -0.553 79.1-121.3 -77.8 125.6 -14.3 28.6 66.5 89 86 A P - 0 0 32 0, 0.0 -26,-2.2 0, 0.0 2,-0.4 -0.423 22.4-152.8 -71.5 145.7 -15.8 31.9 65.4 90 87 A L E -d 63 0A 1 218,-0.5 218,-2.9 -28,-0.2 2,-0.3 -0.941 13.0-168.4-117.4 134.7 -13.5 34.7 64.4 91 88 A F E -dE 64 307A 0 -28,-2.6 -26,-3.2 -2,-0.4 2,-0.3 -0.877 8.8-161.5-125.9 157.1 -14.4 38.4 64.7 92 89 A R E d 65 0A 77 214,-2.0 -24,-0.2 -2,-0.3 -26,-0.1 -0.954 360.0 360.0-134.7 155.6 -13.1 41.8 63.6 93 90 A L 0 0 33 -28,-0.7 194,-0.1 -26,-0.7 213,-0.1 -0.319 360.0 360.0 -66.7 360.0 -13.7 45.3 64.7 94 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 95 93 A T 0 0 53 0, 0.0 2,-1.8 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 127.1 -15.6 49.5 59.5 96 94 A G + 0 0 69 1,-0.2 3,-0.0 2,-0.1 -3,-0.0 -0.329 360.0 96.2 -82.5 56.9 -16.7 52.5 61.6 97 95 A X > + 0 0 18 -2,-1.8 4,-1.7 2,-0.1 -1,-0.2 -0.026 36.6 117.7-131.4 23.0 -13.6 54.6 60.8 98 96 A G H > S+ 0 0 4 -3,-0.3 4,-2.7 1,-0.2 5,-0.2 0.895 74.6 57.9 -60.0 -41.0 -15.0 56.7 58.0 99 97 A L H > S+ 0 0 115 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.926 104.5 50.4 -55.9 -49.9 -14.4 59.9 60.0 100 98 A Q H > S+ 0 0 19 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.886 112.6 46.2 -56.5 -42.5 -10.7 59.1 60.5 101 99 A X H X S+ 0 0 14 -4,-1.7 4,-3.0 2,-0.2 5,-0.3 0.902 110.2 54.2 -67.1 -42.6 -10.2 58.6 56.8 102 100 A Q H X S+ 0 0 37 -4,-2.7 4,-2.9 1,-0.2 5,-0.4 0.914 107.5 49.9 -58.0 -46.5 -12.2 61.7 56.0 103 101 A E H X S+ 0 0 105 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.939 114.3 45.2 -55.9 -47.9 -10.0 63.8 58.3 104 102 A Y H X S+ 0 0 28 -4,-1.9 4,-2.2 175,-0.2 5,-0.2 0.954 118.2 40.9 -63.4 -53.2 -6.8 62.5 56.6 105 103 A A H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 5,-0.4 0.899 114.9 49.8 -66.1 -44.7 -8.0 62.8 53.0 106 104 A V H X S+ 0 0 28 -4,-2.9 4,-2.1 -5,-0.3 5,-0.3 0.959 112.2 48.7 -63.3 -45.3 -9.7 66.1 53.4 107 105 A S H X S+ 0 0 76 -4,-2.3 4,-1.9 -5,-0.4 -2,-0.2 0.944 117.7 39.7 -57.4 -47.0 -6.6 67.6 55.1 108 106 A Q H X S+ 0 0 19 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.855 112.1 52.9 -75.6 -37.8 -4.1 66.3 52.4 109 107 A V H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.936 115.2 43.4 -65.2 -42.0 -6.2 66.9 49.3 110 108 A L H X S+ 0 0 38 -4,-2.1 4,-2.7 -5,-0.4 6,-0.2 0.888 110.2 57.0 -66.1 -38.9 -6.7 70.5 50.4 111 109 A H H <>S+ 0 0 57 -4,-1.9 5,-2.3 -5,-0.3 6,-0.5 0.943 113.7 39.4 -56.1 -48.3 -3.0 70.7 51.4 112 110 A W H ><5S+ 0 0 6 -4,-2.6 3,-1.6 3,-0.2 -2,-0.2 0.902 113.1 55.0 -68.9 -44.1 -2.1 69.7 47.8 113 111 A F H 3<5S+ 0 0 14 -4,-2.8 21,-0.5 1,-0.3 -2,-0.2 0.901 111.7 44.1 -58.3 -40.3 -4.8 71.9 46.3 114 112 A R T 3<5S- 0 0 149 -4,-2.7 -1,-0.3 -5,-0.1 -2,-0.2 0.319 112.7-121.9 -88.9 10.2 -3.5 75.0 48.1 115 113 A R T <>5 + 0 0 34 -3,-1.6 4,-3.0 -5,-0.1 5,-0.2 0.718 58.4 151.1 56.7 32.8 0.1 74.1 47.2 116 114 A F H > S+ 0 0 31 -6,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.955 109.3 43.7 -64.5 -48.3 3.9 71.4 49.6 118 116 A D H > S+ 0 0 30 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.933 113.4 51.8 -60.5 -44.6 5.2 73.9 47.1 119 117 A Y H X S+ 0 0 83 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.864 105.5 54.4 -64.8 -34.5 5.1 76.7 49.7 120 118 A Q H X S+ 0 0 123 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.908 109.6 47.8 -61.8 -40.2 7.1 74.6 52.2 121 119 A A H X S+ 0 0 49 -4,-1.7 4,-0.7 1,-0.2 -2,-0.2 0.875 111.7 50.4 -68.7 -37.0 9.8 74.1 49.5 122 120 A L H <>S+ 0 0 18 -4,-2.2 5,-2.5 1,-0.2 3,-0.4 0.860 109.2 52.1 -67.9 -36.4 9.8 77.8 48.8 123 121 A K H ><5S+ 0 0 156 -4,-2.2 3,-1.8 1,-0.2 -2,-0.2 0.896 104.2 55.2 -62.9 -44.5 10.1 78.5 52.6 124 122 A N H 3<5S+ 0 0 119 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.707 111.8 45.3 -64.2 -19.1 13.1 76.2 52.8 125 123 A Q T 3<5S- 0 0 134 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.259 109.6-125.3-103.4 7.5 14.7 78.4 50.1 126 124 A A T < 5 + 0 0 95 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.872 61.6 146.0 50.7 42.9 13.6 81.7 51.8 127 125 A L < - 0 0 81 -5,-2.5 2,-0.7 -6,-0.1 -1,-0.2 -0.948 44.7-147.9-119.5 118.5 11.9 82.7 48.6 128 126 A W + 0 0 231 -2,-0.5 -9,-0.0 -3,-0.1 -5,-0.0 -0.773 38.0 149.8 -84.4 113.4 8.7 84.7 48.7 129 127 A K - 0 0 107 -2,-0.7 2,-0.1 -10,-0.1 -7,-0.1 -0.673 38.1-149.6-153.6 92.0 6.7 83.6 45.6 130 128 A P - 0 0 102 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.416 29.5-144.6 -59.4 132.0 3.0 83.5 45.4 131 129 A L - 0 0 36 1,-0.1 -12,-0.0 -2,-0.1 -2,-0.0 -0.642 22.4 -86.1-101.3 158.7 2.2 80.7 43.0 132 130 A P - 0 0 95 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.286 50.3-117.1 -57.2 145.2 -0.5 80.3 40.4 133 131 A E - 0 0 143 -3,-0.1 2,-0.4 1,-0.0 -19,-0.1 -0.571 19.7-125.2 -87.0 146.4 -3.7 78.9 41.9 134 132 A Y - 0 0 25 -21,-0.5 2,-0.2 -2,-0.2 -1,-0.0 -0.746 21.8-128.1 -91.8 141.0 -5.2 75.6 40.8 135 133 A T - 0 0 55 -2,-0.4 4,-0.3 1,-0.1 3,-0.1 -0.513 14.4-126.2 -80.2 152.7 -8.8 75.5 39.6 136 134 A R S > S+ 0 0 99 1,-0.2 3,-1.2 2,-0.2 -1,-0.1 0.857 109.4 62.9 -63.1 -36.3 -11.2 73.0 41.2 137 135 A E T 3 S+ 0 0 143 1,-0.3 -1,-0.2 25,-0.1 3,-0.2 0.907 105.5 42.5 -57.0 -46.1 -12.0 71.8 37.7 138 136 A E T 3 S+ 0 0 77 1,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.469 101.5 76.6 -79.2 -2.5 -8.4 70.6 37.1 139 137 A F < + 0 0 0 -3,-1.2 -1,-0.2 -4,-0.3 2,-0.2 -0.460 66.8 168.1-110.4 61.4 -8.2 69.1 40.6 140 138 A S - 0 0 10 -2,-0.5 55,-2.8 -3,-0.2 54,-1.0 -0.482 25.7-142.0 -78.4 139.9 -10.2 66.0 40.1 141 139 A V E -fg 164 195B 0 22,-3.1 24,-2.1 53,-0.2 2,-0.5 -0.887 12.5-167.7-105.8 133.7 -10.2 63.3 42.8 142 140 A G E -fg 165 196B 0 53,-3.2 55,-3.2 -2,-0.4 2,-0.5 -0.983 4.1-163.5-124.2 116.5 -10.3 59.6 41.8 143 141 A I E -fg 166 197B 0 22,-2.6 24,-2.3 -2,-0.5 2,-0.6 -0.880 5.2-154.3-104.4 125.4 -11.0 57.0 44.5 144 142 A X E +fg 167 198B 0 53,-3.1 55,-2.9 -2,-0.5 24,-0.2 -0.875 59.1 45.9 -99.4 124.9 -10.2 53.4 43.9 145 143 A G - 0 0 2 22,-2.9 2,-0.2 -2,-0.6 55,-0.1 0.049 65.1-126.5 119.8 134.4 -12.2 51.0 45.9 146 144 A A + 0 0 20 55,-0.1 4,-0.3 4,-0.1 3,-0.2 -0.410 62.1 85.0 -94.0 179.4 -15.9 50.4 46.8 147 145 A G S > S- 0 0 35 1,-0.2 4,-2.0 -2,-0.2 5,-0.1 -0.325 93.0 -67.0 106.1 161.6 -17.0 50.1 50.4 148 146 A V H > S+ 0 0 78 2,-0.2 4,-3.7 1,-0.2 5,-0.2 0.848 125.2 57.7 -58.9 -41.8 -17.9 52.6 53.1 149 147 A L H > S+ 0 0 29 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.958 111.5 42.4 -57.8 -52.7 -14.4 54.2 53.5 150 148 A G H > S+ 0 0 1 -4,-0.3 4,-2.6 49,-0.3 -1,-0.2 0.897 115.7 50.9 -56.9 -41.5 -14.2 55.1 49.9 151 149 A A H X S+ 0 0 31 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.921 111.7 46.6 -66.4 -41.3 -17.8 56.3 50.0 152 150 A K H X S+ 0 0 90 -4,-3.7 4,-2.7 2,-0.2 5,-0.2 0.954 112.7 49.3 -63.9 -50.3 -17.2 58.4 53.1 153 151 A V H X S+ 0 0 0 -4,-3.0 4,-1.9 -5,-0.2 -2,-0.2 0.927 112.3 48.8 -57.5 -43.3 -14.0 60.0 51.6 154 152 A A H X S+ 0 0 2 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.953 110.2 51.8 -62.0 -47.0 -15.9 60.8 48.3 155 153 A E H X S+ 0 0 114 -4,-2.6 4,-1.1 1,-0.2 -2,-0.2 0.935 111.3 46.1 -54.9 -47.8 -18.7 62.3 50.2 156 154 A S H < S+ 0 0 19 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.809 114.6 47.3 -69.5 -28.3 -16.5 64.6 52.2 157 155 A L H ><>S+ 0 0 0 -4,-1.9 5,-1.3 -3,-0.3 3,-1.1 0.847 105.8 55.6 -83.2 -33.2 -14.4 65.7 49.2 158 156 A Q H ><5S+ 0 0 69 -4,-2.6 3,-1.6 1,-0.3 -2,-0.2 0.790 96.9 67.4 -67.8 -24.2 -17.4 66.5 46.8 159 157 A A T 3<5S+ 0 0 78 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.749 97.3 53.5 -64.6 -26.4 -18.6 68.8 49.6 160 158 A W T < 5S- 0 0 120 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.364 123.4-108.5 -87.3 1.7 -15.5 71.0 48.8 161 159 A G T < 5 + 0 0 41 -3,-1.6 -3,-0.2 1,-0.3 -2,-0.1 0.686 66.7 147.8 81.2 18.4 -16.5 71.0 45.1 162 160 A F < - 0 0 6 -5,-1.3 -1,-0.3 1,-0.1 2,-0.2 -0.649 56.8-108.2 -82.0 141.6 -13.9 68.8 43.6 163 161 A P - 0 0 40 0, 0.0 -22,-3.1 0, 0.0 2,-0.4 -0.536 44.6-153.1 -64.3 131.3 -14.9 66.7 40.6 164 162 A L E +f 141 0B 8 12,-0.4 14,-2.3 -2,-0.2 2,-0.3 -0.939 23.1 169.2-121.0 139.0 -15.1 63.1 41.9 165 163 A R E -fh 142 178B 30 -24,-2.1 -22,-2.6 -2,-0.4 2,-0.3 -0.962 12.1-160.2-135.4 151.1 -14.8 59.7 40.3 166 164 A C E -fh 143 179B 2 12,-2.3 14,-3.0 -2,-0.3 2,-0.4 -0.961 1.0-160.3-132.5 153.4 -14.5 56.2 41.7 167 165 A W E +fh 144 180B 6 -24,-2.3 -22,-2.9 -2,-0.3 2,-0.3 -0.999 23.4 145.0-134.2 131.2 -13.2 53.0 40.3 168 166 A S E - h 0 181B 6 12,-2.0 14,-2.3 -2,-0.4 4,-0.1 -0.907 56.2-111.2-150.3 171.1 -14.0 49.5 41.5 169 167 A R S S+ 0 0 119 -2,-0.3 2,-0.4 12,-0.2 -1,-0.1 0.812 104.4 61.1 -76.6 -28.8 -14.5 46.1 40.0 170 168 A S S S- 0 0 76 11,-0.1 2,-0.1 10,-0.1 10,-0.1 -0.794 96.4-108.0-101.0 141.4 -18.2 46.2 40.9 171 169 A R - 0 0 156 -2,-0.4 2,-0.2 10,-0.1 -2,-0.1 -0.413 44.7-179.5 -69.0 143.0 -20.6 48.9 39.5 172 170 A K - 0 0 73 -2,-0.1 7,-0.2 -6,-0.1 2,-0.1 -0.816 27.7-148.9-138.6 166.5 -21.6 51.5 42.1 173 171 A S + 0 0 110 -2,-0.2 5,-0.1 5,-0.1 -2,-0.0 -0.482 22.6 168.9-146.0 74.9 -23.7 54.6 42.5 174 172 A W > - 0 0 30 3,-0.2 3,-1.4 1,-0.1 -8,-0.1 -0.729 46.9 -98.6 -85.9 133.1 -22.5 57.1 45.0 175 173 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.197 103.9 5.3 -53.8 128.4 -24.2 60.5 44.9 176 174 A G T 3 S+ 0 0 63 1,-0.2 -12,-0.4 -3,-0.0 2,-0.4 0.766 107.0 110.1 69.6 30.3 -22.3 63.2 42.9 177 175 A V < - 0 0 22 -3,-1.4 2,-0.6 -14,-0.1 -12,-0.2 -0.995 67.5-129.9-139.8 128.6 -19.6 60.7 41.7 178 176 A E E -h 165 0B 108 -14,-2.3 -12,-2.3 -2,-0.4 2,-0.5 -0.688 31.4-142.6 -78.5 119.8 -18.9 59.3 38.2 179 177 A S E -h 166 0B 29 -2,-0.6 2,-0.4 -14,-0.2 -12,-0.2 -0.740 16.6-169.7 -92.9 124.9 -18.6 55.5 38.7 180 178 A Y E -h 167 0B 27 -14,-3.0 -12,-2.0 -2,-0.5 2,-0.4 -0.930 7.8-162.0-114.9 138.1 -16.0 53.5 36.7 181 179 A V E -h 168 0B 16 -2,-0.4 4,-0.4 -14,-0.2 -12,-0.2 -0.968 39.0 -7.1-133.4 129.4 -16.1 49.8 36.6 182 180 A G S >> S- 0 0 7 -14,-2.3 3,-2.0 -2,-0.4 4,-0.6 0.278 86.6 -70.4 79.2 160.9 -13.6 47.1 35.7 183 181 A R H 3> S+ 0 0 129 1,-0.3 4,-0.5 2,-0.2 3,-0.2 0.701 127.1 70.9 -57.6 -18.9 -10.1 47.0 34.1 184 182 A E H 34 S+ 0 0 157 1,-0.2 -1,-0.3 -3,-0.1 4,-0.3 0.816 107.5 31.5 -67.6 -32.2 -12.0 48.1 31.0 185 183 A E H <> S+ 0 0 60 -3,-2.0 4,-2.0 -4,-0.4 -1,-0.2 0.349 91.9 98.6-109.7 5.1 -12.7 51.6 32.3 186 184 A L H X S+ 0 0 16 -4,-0.6 4,-2.6 -3,-0.2 5,-0.2 0.925 82.2 50.1 -61.0 -45.7 -9.6 52.0 34.4 187 185 A R H X S+ 0 0 152 -4,-0.5 4,-3.2 1,-0.2 5,-0.2 0.959 109.3 50.2 -61.2 -50.3 -7.7 54.0 31.8 188 186 A A H > S+ 0 0 48 -4,-0.3 4,-1.1 1,-0.2 -1,-0.2 0.902 113.7 48.2 -50.7 -43.5 -10.6 56.5 31.3 189 187 A F H < S+ 0 0 0 -4,-2.0 3,-0.3 1,-0.2 -1,-0.2 0.917 114.3 44.1 -62.6 -47.8 -10.8 56.9 35.1 190 188 A L H >< S+ 0 0 3 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.895 105.7 61.6 -67.6 -42.2 -7.0 57.4 35.5 191 189 A N H 3< S+ 0 0 63 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.831 110.4 40.8 -54.7 -33.8 -6.7 59.8 32.5 192 190 A Q T 3< S+ 0 0 83 -4,-1.1 2,-0.6 -3,-0.3 -1,-0.3 0.350 94.3 100.0 -98.6 8.9 -9.1 62.3 34.2 193 191 A T < + 0 0 0 -3,-1.7 3,-0.2 -4,-0.2 -52,-0.2 -0.855 35.6 173.4-109.8 115.7 -7.8 62.0 37.8 194 192 A R S S+ 0 0 25 -54,-1.0 29,-2.1 -2,-0.6 2,-0.6 0.871 81.8 37.9 -79.5 -42.8 -5.4 64.6 39.3 195 193 A V E S-gi 141 223B 0 -55,-2.8 -53,-3.2 27,-0.2 2,-0.6 -0.937 74.9-161.4-116.3 111.5 -5.5 63.1 42.9 196 194 A L E -gi 142 224B 0 27,-3.1 29,-2.8 -2,-0.6 2,-0.5 -0.825 6.5-170.4 -96.1 119.9 -5.6 59.3 43.1 197 195 A I E -gi 143 225B 0 -55,-3.2 -53,-3.1 -2,-0.6 2,-0.7 -0.955 10.5-150.2-113.8 121.2 -6.7 58.0 46.4 198 196 A N E +gi 144 226B 0 27,-2.9 29,-1.8 -2,-0.5 30,-0.3 -0.814 35.1 148.4 -95.7 110.9 -6.4 54.3 47.0 199 197 A L + 0 0 10 -55,-2.9 -49,-0.3 -2,-0.7 -54,-0.1 0.032 24.6 146.5-124.1 26.4 -9.0 52.8 49.3 200 198 A L - 0 0 7 -56,-0.2 2,-0.1 -55,-0.1 -55,-0.1 -0.396 48.5-136.1 -62.9 121.5 -9.2 49.3 47.8 201 199 A P - 0 0 82 0, 0.0 -55,-0.1 0, 0.0 28,-0.1 -0.551 52.6 -90.2 -63.1 155.5 -9.9 46.4 50.2 202 200 A N + 0 0 43 -2,-0.1 2,-0.3 26,-0.1 3,-0.1 -0.168 51.4 170.1 -75.8 168.3 -7.3 43.9 48.9 203 201 A T > - 0 0 17 -3,-0.1 3,-1.6 1,-0.1 4,-0.4 -0.933 48.2-112.2-163.5 158.1 -7.7 41.3 46.2 204 202 A A G > S+ 0 0 95 -2,-0.3 3,-1.0 1,-0.3 -1,-0.1 0.878 119.5 60.8 -61.8 -32.8 -5.4 39.0 44.3 205 203 A Q G 3 S+ 0 0 112 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.304 102.9 47.8 -80.7 5.5 -6.4 41.2 41.3 206 204 A T G X S+ 0 0 2 -3,-1.6 3,-2.1 4,-0.0 4,-0.3 0.348 72.9 130.8-124.6 5.8 -5.0 44.4 42.8 207 205 A V T < S- 0 0 88 -3,-1.0 25,-0.2 -4,-0.4 27,-0.1 -0.405 90.7 -5.0 -62.7 127.7 -1.5 43.4 44.0 208 206 A G T 3 S+ 0 0 17 23,-2.9 -1,-0.3 -2,-0.1 26,-0.2 0.702 89.6 146.1 60.8 23.2 1.0 46.0 42.7 209 207 A I < + 0 0 7 -3,-2.1 2,-1.7 1,-0.2 5,-0.2 0.822 57.9 69.3 -62.3 -33.8 -1.8 47.7 40.8 210 208 A I B S+l 233 0C 0 22,-3.0 24,-3.1 -4,-0.3 2,-0.2 -0.700 77.6 124.0 -88.5 85.3 -0.2 51.0 41.4 211 209 A N S >> S- 0 0 47 -2,-1.7 4,-3.0 22,-0.2 3,-0.9 -0.678 81.0 -76.0-127.8-172.3 2.7 50.4 39.1 212 210 A S H 3> S+ 0 0 53 1,-0.3 4,-3.2 -2,-0.2 5,-0.2 0.871 126.5 60.6 -63.4 -35.2 4.1 52.3 36.1 213 211 A E H 34 S+ 0 0 147 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.870 114.7 36.2 -58.0 -37.5 1.4 51.0 33.8 214 212 A L H X> S+ 0 0 8 -3,-0.9 3,-1.6 -5,-0.2 4,-0.6 0.910 115.7 52.8 -79.8 -45.1 -1.2 52.7 36.0 215 213 A L H >< S+ 0 0 1 -4,-3.0 3,-1.3 1,-0.3 -2,-0.2 0.875 100.9 63.2 -61.6 -37.0 1.0 55.8 36.8 216 214 A D T 3< S+ 0 0 105 -4,-3.2 -1,-0.3 1,-0.2 -2,-0.2 0.746 99.3 54.6 -56.7 -26.0 1.5 56.3 33.1 217 215 A Q T <4 S+ 0 0 64 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.2 0.602 88.7 93.2 -87.4 -11.7 -2.3 56.9 32.6 218 216 A L S << S- 0 0 2 -3,-1.3 -27,-0.2 -4,-0.6 2,-0.1 -0.483 88.8-105.2 -73.8 151.3 -2.4 59.7 35.3 219 217 A P > - 0 0 47 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 -0.519 47.7 -90.0 -72.6 149.5 -2.0 63.3 34.0 220 218 A D T 3 S+ 0 0 117 1,-0.2 26,-0.2 -2,-0.1 27,-0.2 -0.208 113.9 37.6 -54.5 152.2 1.4 64.8 34.8 221 219 A G T 3 S+ 0 0 19 24,-1.5 -1,-0.2 25,-0.2 26,-0.2 0.717 89.1 145.9 75.4 22.8 1.5 66.6 38.1 222 220 A A E < - j 0 247B 0 24,-2.0 26,-2.5 -3,-0.6 27,-1.2 -0.283 38.0-137.1 -86.5 174.9 -0.7 64.1 39.8 223 221 A Y E -ij 195 249B 0 -29,-2.1 -27,-3.1 24,-0.2 2,-0.5 -0.963 3.1-149.3-133.7 150.8 -0.7 62.9 43.3 224 222 A V E -ij 196 250B 0 25,-1.5 27,-2.7 -2,-0.3 2,-0.6 -0.981 8.5-174.4-122.4 128.2 -1.1 59.5 45.0 225 223 A L E -ij 197 251B 0 -29,-2.8 -27,-2.9 -2,-0.5 2,-0.8 -0.975 11.2-161.7-119.8 111.6 -2.6 59.1 48.5 226 224 A N E +ij 198 252B 1 25,-2.4 27,-2.4 -2,-0.6 28,-0.6 -0.856 30.8 147.1-102.3 110.4 -2.3 55.5 49.7 227 225 A L + 0 0 6 -29,-1.8 -1,-0.1 -2,-0.8 -28,-0.1 0.330 63.2 57.7-118.8 6.3 -4.6 54.6 52.5 228 226 A A S S- 0 0 13 -30,-0.3 2,-0.4 1,-0.3 -29,-0.1 0.822 105.5 -18.2-106.7 -87.2 -5.3 51.0 51.7 229 227 A R > - 0 0 67 25,-0.1 3,-1.1 1,-0.1 4,-0.3 -0.972 41.7-137.3-132.7 145.0 -2.5 48.4 51.4 230 228 A G G > S+ 0 0 5 25,-0.6 3,-2.0 -2,-0.4 26,-0.7 0.882 103.8 61.4 -62.9 -38.5 1.2 48.6 50.9 231 229 A V G 3 S+ 0 0 65 24,-0.3 -23,-2.9 1,-0.3 -1,-0.2 0.599 88.7 72.7 -69.0 -9.8 1.3 45.8 48.4 232 230 A H G < S+ 0 0 0 -3,-1.1 -22,-3.0 -25,-0.2 2,-0.5 0.735 91.9 68.4 -72.9 -22.4 -1.0 47.8 46.2 233 231 A V B < S-l 210 0C 4 -3,-2.0 2,-1.1 -4,-0.3 -22,-0.2 -0.879 71.0-148.0-108.1 127.1 2.0 50.1 45.4 234 232 A Q > - 0 0 83 -24,-3.1 4,-1.9 -2,-0.5 3,-0.4 -0.782 21.4-159.6 -82.3 102.4 5.1 49.1 43.4 235 233 A E H > S+ 0 0 40 -2,-1.1 4,-2.4 1,-0.2 5,-0.2 0.852 84.9 54.1 -59.2 -39.9 7.5 51.4 45.4 236 234 A A H > S+ 0 0 63 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.906 110.7 47.1 -60.8 -42.0 10.2 51.6 42.7 237 235 A D H > S+ 0 0 41 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.861 109.9 53.1 -67.8 -35.7 7.6 52.7 40.1 238 236 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.963 110.7 46.5 -62.4 -53.2 6.2 55.3 42.4 239 237 A L H X S+ 0 0 24 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.880 111.1 52.4 -55.3 -44.5 9.6 56.8 43.1 240 238 A A H X S+ 0 0 58 -4,-2.2 4,-2.1 1,-0.2 6,-0.2 0.919 109.5 49.4 -59.7 -41.9 10.3 56.8 39.3 241 239 A A H X>S+ 0 0 8 -4,-2.3 6,-2.4 1,-0.2 5,-0.9 0.863 112.0 48.5 -67.5 -34.4 7.0 58.6 38.7 242 240 A L H <5S+ 0 0 0 -4,-2.2 3,-0.3 4,-0.2 -1,-0.2 0.894 112.0 49.8 -69.9 -37.9 7.9 61.2 41.3 243 241 A D H <5S+ 0 0 111 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.853 111.7 46.9 -72.9 -29.3 11.4 61.6 39.8 244 242 A S H <5S- 0 0 91 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.628 113.9-111.7 -83.6 -16.6 10.1 62.1 36.2 245 243 A G T <5S+ 0 0 37 -4,-0.9 -24,-1.5 2,-0.3 -23,-0.2 0.412 87.5 118.4 96.9 -1.9 7.4 64.7 37.2 246 244 A K S - 0 0 41 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.234 19.3-123.6 -53.1 142.4 12.7 49.4 56.7 262 260 A Q T 3 S+ 0 0 167 1,-0.3 5,-0.1 -3,-0.1 -2,-0.1 0.764 109.4 68.4 -55.9 -25.0 15.0 52.4 57.4 263 261 A E T 3 S+ 0 0 148 4,-0.1 -1,-0.3 3,-0.0 -3,-0.0 0.678 74.0 110.0 -68.5 -21.9 16.8 51.4 54.2 264 262 A S X - 0 0 14 -3,-2.0 3,-0.9 1,-0.1 4,-0.3 -0.349 67.7-140.4 -62.6 137.5 13.9 52.3 52.0 265 263 A P G >> S+ 0 0 56 0, 0.0 4,-1.2 0, 0.0 3,-1.1 0.660 93.3 80.9 -70.4 -15.3 14.4 55.4 49.8 266 264 A L G >4 S+ 0 0 2 1,-0.3 3,-0.8 2,-0.2 6,-0.2 0.920 86.5 57.3 -54.7 -43.2 10.8 56.5 50.5 267 265 A W G <4 S+ 0 0 135 -3,-0.9 -1,-0.3 1,-0.2 7,-0.1 0.812 111.5 45.0 -54.6 -27.5 12.0 57.9 53.9 268 266 A R G <4 S+ 0 0 167 -3,-1.1 -1,-0.2 -4,-0.3 -2,-0.2 0.627 83.3 105.6 -99.1 -18.5 14.4 60.0 51.8 269 267 A H X< - 0 0 22 -4,-1.2 3,-1.0 -3,-0.8 -30,-0.0 -0.480 60.1-147.1 -72.0 133.0 12.2 61.4 49.0 270 268 A P T 3 S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.651 95.7 48.4 -73.8 -16.3 11.3 65.1 49.5 271 269 A R T 3 S+ 0 0 94 -22,-0.1 -21,-2.0 2,-0.0 2,-0.5 0.108 92.1 87.8-114.6 20.6 7.9 64.8 47.8 272 270 A V E < -k 250 0B 18 -3,-1.0 2,-0.4 -23,-0.2 -21,-0.2 -0.966 59.0-162.5-111.4 127.6 6.7 61.7 49.6 273 271 A A E -k 251 0B 33 -23,-2.6 -21,-2.6 -2,-0.5 2,-0.4 -0.893 14.6-163.7-104.2 149.2 4.9 62.3 53.0 274 272 A X E -k 252 0B 46 -2,-0.4 -21,-0.2 -23,-0.2 -2,-0.0 -0.997 19.4-176.0-140.1 138.6 4.6 59.3 55.3 275 273 A T - 0 0 25 -23,-2.3 2,-2.7 -2,-0.4 4,-0.2 -0.996 38.3-114.4-129.7 138.0 2.6 58.2 58.3 276 274 A P S S- 0 0 107 0, 0.0 -22,-0.1 0, 0.0 -23,-0.1 -0.259 72.0 -70.2 -73.2 60.2 3.2 54.8 60.2 277 275 A H S S+ 0 0 93 -2,-2.7 -23,-0.1 -24,-1.1 -24,-0.1 0.948 99.2 125.2 53.1 58.4 -0.2 53.2 59.3 278 276 A I + 0 0 81 1,-0.1 3,-0.5 -3,-0.1 -1,-0.1 0.173 23.7 115.5-126.8 13.8 -2.3 55.4 61.5 279 277 A A S S+ 0 0 6 1,-0.3 2,-0.2 -26,-0.2 -175,-0.2 0.914 95.5 1.7 -55.2 -44.8 -4.8 56.7 59.0 280 278 A A S S+ 0 0 18 -53,-0.1 2,-0.4 -179,-0.1 -1,-0.3 -0.716 72.9 170.0-148.3 90.2 -7.7 55.1 60.8 281 279 A V - 0 0 59 -3,-0.5 2,-0.3 -2,-0.2 -181,-0.1 -0.813 40.4-112.7 -99.7 144.1 -7.1 53.1 64.0 282 280 A T - 0 0 26 -2,-0.4 -185,-0.1 1,-0.1 -2,-0.0 -0.620 36.7-112.6 -74.2 131.0 -10.1 51.9 66.1 283 281 A R >> - 0 0 123 -2,-0.3 4,-3.2 1,-0.1 3,-0.5 -0.436 21.4-126.7 -59.8 135.3 -10.2 53.8 69.4 284 282 A P H 3> S+ 0 0 45 0, 0.0 4,-3.4 0, 0.0 5,-0.3 0.875 110.7 56.7 -53.5 -36.4 -9.5 51.3 72.1 285 283 A A H 3> S+ 0 0 74 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.877 111.5 42.4 -61.5 -38.3 -12.7 52.4 73.9 286 284 A E H <> S+ 0 0 103 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.944 114.2 50.5 -73.9 -46.0 -14.6 51.6 70.8 287 285 A A H X S+ 0 0 2 -4,-3.2 4,-2.6 1,-0.2 -2,-0.2 0.919 112.8 47.5 -56.7 -47.6 -12.7 48.3 70.3 288 286 A I H X S+ 0 0 9 -4,-3.4 4,-2.4 1,-0.2 5,-0.3 0.846 109.6 52.4 -62.8 -40.7 -13.4 47.3 73.9 289 287 A D H X S+ 0 0 85 -4,-1.7 4,-1.9 -5,-0.3 -1,-0.2 0.912 111.9 47.2 -63.5 -40.1 -17.1 48.3 73.6 290 288 A Y H X S+ 0 0 24 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.968 114.0 45.8 -64.3 -50.9 -17.4 46.1 70.5 291 289 A I H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.935 115.1 45.6 -61.2 -47.7 -15.6 43.1 72.0 292 290 A S H X S+ 0 0 15 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.903 113.5 50.6 -64.4 -40.6 -17.5 43.2 75.4 293 291 A R H X S+ 0 0 101 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.913 112.2 46.6 -61.3 -42.6 -20.8 43.6 73.6 294 292 A T H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.868 110.0 52.5 -71.4 -37.2 -20.1 40.7 71.3 295 293 A I H X S+ 0 0 0 -4,-2.5 4,-3.2 -5,-0.2 5,-0.2 0.943 108.9 51.5 -61.4 -45.4 -19.0 38.4 74.1 296 294 A T H X S+ 0 0 55 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.917 108.7 50.2 -58.0 -44.3 -22.2 39.2 76.0 297 295 A Q H X>S+ 0 0 37 -4,-2.0 5,-2.9 2,-0.2 4,-0.6 0.902 112.1 48.2 -62.0 -39.9 -24.3 38.3 73.0 298 296 A L H ><5S+ 0 0 51 -4,-2.0 3,-1.2 2,-0.2 -2,-0.2 0.948 109.5 51.3 -66.7 -47.0 -22.4 35.0 72.6 299 297 A E H 3<5S+ 0 0 85 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.880 118.0 40.1 -57.2 -35.8 -22.8 34.1 76.3 300 298 A K H 3<5S- 0 0 145 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.451 111.5-117.8 -95.3 1.9 -26.5 34.8 75.9 301 299 A G T <<5 + 0 0 72 -3,-1.2 -3,-0.2 -4,-0.6 -4,-0.1 0.753 65.1 144.5 69.1 25.0 -27.0 33.2 72.5 302 300 A E < - 0 0 97 -5,-2.9 -1,-0.2 -6,-0.2 -2,-0.1 -0.507 59.3 -78.5 -91.6 163.0 -28.0 36.5 70.9 303 301 A P - 0 0 114 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.335 49.3-161.3 -62.7 139.6 -27.2 37.6 67.3 304 302 A V - 0 0 38 -7,-0.1 2,-0.3 -3,-0.1 3,-0.1 -0.708 4.7-149.3-115.4 168.8 -23.7 39.0 66.8 305 303 A T + 0 0 91 -2,-0.2 -11,-0.0 1,-0.1 0, 0.0 -0.950 67.4 46.8-135.6 154.9 -22.2 41.1 64.1 306 304 A G + 0 0 33 -2,-0.3 -214,-2.0 1,-0.3 2,-0.3 0.617 66.0 156.5 92.4 15.4 -18.6 41.4 62.7 307 305 A Q B -E 91 0A 114 -216,-0.2 2,-0.6 -3,-0.1 -1,-0.3 -0.553 36.3-137.7 -78.4 137.1 -18.0 37.7 62.2 308 306 A V - 0 0 19 -218,-2.9 -218,-0.5 -2,-0.3 2,-0.2 -0.840 12.1-133.2 -97.9 120.4 -15.5 36.8 59.6 309 307 A D - 0 0 130 -2,-0.6 2,-0.3 1,-0.1 -218,-0.0 -0.542 9.0-147.3 -70.0 135.2 -16.3 33.9 57.3 310 308 A R 0 0 68 -2,-0.2 -1,-0.1 -224,-0.1 -2,-0.0 -0.311 360.0 360.0-100.1 48.0 -13.3 31.6 57.0 311 309 A A 0 0 122 -2,-0.3 -1,-0.1 0, 0.0 -2,-0.1 0.406 360.0 360.0 -31.3 360.0 -14.0 30.6 53.4