==== 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 OXIDOREDUCTASE 18-APR-01 1IGX . COMPND 2 MOLECULE: PROSTAGLANDIN ENDOPEROXIDE H SYNTHASE-1; . SOURCE 2 ORGANISM_SCIENTIFIC: OVIS ARIES; . AUTHOR M.G.MALKOWSKI,E.D.THURESSON,W.L.SMITH,R.M.GARAVITO . 553 1 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23133.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 349 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 1 0.2 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 . 25 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 179 32.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 3 2 2 3 4 2 1 1 0 0 2 1 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 11 2 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 32 A P 0 0 145 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 129.1 210.9 117.4 -38.2 2 33 A V - 0 0 75 1,-0.1 126,-0.1 2,-0.1 4,-0.0 -0.384 360.0-116.9 -61.9 125.2 214.5 116.9 -39.5 3 34 A N > - 0 0 16 124,-0.5 3,-2.1 -2,-0.2 4,-0.2 -0.489 25.9-147.2 -64.3 98.0 216.9 116.1 -36.6 4 35 A P G >> S+ 0 0 13 0, 0.0 3,-2.4 0, 0.0 4,-0.6 0.711 92.2 72.1 -40.8 -34.2 219.1 119.2 -37.0 5 36 A a G 34 S+ 0 0 23 1,-0.3 -2,-0.1 2,-0.2 11,-0.1 0.446 80.1 80.3 -68.3 8.2 222.2 117.3 -35.9 6 37 A b G <4 S+ 0 0 1 -3,-2.1 -1,-0.3 1,-0.2 124,-0.1 0.636 90.3 49.8 -84.8 -16.2 221.8 115.7 -39.3 7 38 A Y T <4 S- 0 0 123 -3,-2.4 -2,-0.2 -4,-0.2 -1,-0.2 0.684 105.4-130.9 -92.2 -22.0 223.5 118.7 -40.9 8 39 A Y < + 0 0 29 -4,-0.6 -3,-0.1 125,-0.1 -2,-0.1 0.982 38.3 171.8 68.6 59.6 226.4 118.7 -38.4 9 40 A P + 0 0 20 0, 0.0 -4,-0.1 0, 0.0 28,-0.1 0.965 49.1 89.6 -64.1 -51.9 226.1 122.4 -37.6 10 41 A c - 0 0 19 4,-0.1 2,-0.3 26,-0.1 3,-0.2 -0.187 63.1-166.5 -52.6 134.8 228.6 122.2 -34.8 11 42 A Q + 0 0 48 26,-2.0 22,-0.1 1,-0.2 3,-0.1 -0.824 57.6 29.9-122.0 158.8 232.2 122.8 -35.9 12 43 A H S S- 0 0 77 -2,-0.3 -1,-0.2 1,-0.2 21,-0.2 0.887 134.8 -49.9 60.1 42.2 235.6 122.3 -34.4 13 44 A Q S S+ 0 0 101 1,-0.2 2,-0.4 -3,-0.2 -1,-0.2 0.838 90.9 160.6 68.7 34.6 234.5 119.4 -32.2 14 45 A G - 0 0 11 23,-0.2 2,-0.5 24,-0.1 -1,-0.2 -0.762 42.8-115.9 -91.8 134.1 231.5 121.1 -30.8 15 46 A I E -A 27 0A 57 12,-1.2 12,-1.5 -2,-0.4 2,-0.3 -0.524 23.3-143.0 -72.1 117.9 228.8 118.8 -29.3 16 47 A a E -A 26 0A 39 -2,-0.5 2,-0.4 10,-0.2 10,-0.2 -0.633 23.9-175.6 -79.8 134.7 225.5 119.0 -31.1 17 48 A V E -A 25 0A 54 8,-1.0 8,-1.3 -2,-0.3 2,-0.1 -0.929 25.6-128.1-145.7 122.4 222.5 118.7 -28.8 18 49 A R E -A 24 0A 92 -2,-0.4 2,-0.4 6,-0.2 6,-0.3 -0.342 27.6-173.6 -60.8 128.4 218.7 118.5 -29.4 19 50 A F E > -A 23 0A 84 4,-1.3 4,-1.1 -2,-0.1 2,-0.2 -0.980 55.8 -25.0-131.4 119.9 216.8 121.1 -27.4 20 51 A G T 4 S- 0 0 55 -2,-0.4 -2,-0.0 1,-0.2 0, 0.0 -0.558 109.2 -48.1 79.4-146.2 213.1 121.1 -27.2 21 52 A L T 4 S+ 0 0 153 -2,-0.2 -1,-0.2 -3,-0.0 -3,-0.0 0.885 130.9 9.1 -92.5 -45.4 211.4 119.5 -30.2 22 53 A D T 4 S+ 0 0 104 -3,-0.2 -2,-0.1 -19,-0.1 2,-0.1 0.415 108.6 79.8-120.0 1.1 213.0 121.0 -33.3 23 54 A R E < -A 19 0A 141 -4,-1.1 -4,-1.3 -20,-0.1 2,-0.3 -0.292 50.3-163.6-101.1-173.2 216.1 123.0 -32.2 24 55 A Y E -A 18 0A 71 -6,-0.3 2,-0.3 -2,-0.1 -6,-0.2 -0.954 7.6-145.9-159.3 173.1 219.6 122.3 -31.1 25 56 A Q E -A 17 0A 103 -8,-1.3 -8,-1.0 -2,-0.3 2,-0.4 -0.972 13.2-136.1-152.1 134.0 222.6 123.8 -29.4 26 57 A c E -A 16 0A 23 10,-0.7 2,-1.0 -2,-0.3 -10,-0.2 -0.772 10.4-148.5 -93.5 136.1 226.3 123.5 -29.9 27 58 A D E +A 15 0A 91 -12,-1.5 -12,-1.2 -2,-0.4 -11,-0.1 -0.778 20.9 175.6-103.6 85.5 228.5 123.1 -26.7 28 59 A d > + 0 0 16 -2,-1.0 3,-2.3 -14,-0.2 5,-0.5 0.428 19.6 151.8 -74.0 1.1 231.6 124.8 -27.9 29 60 A T T 3 S- 0 0 74 1,-0.3 -14,-0.1 2,-0.1 -2,-0.1 0.061 75.2 -9.0 -35.4 140.6 233.3 124.4 -24.5 30 61 A R T 3 S+ 0 0 233 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.628 99.9 116.8 36.8 27.9 237.2 124.3 -24.8 31 62 A T S < S- 0 0 29 -3,-2.3 -1,-0.2 2,-0.4 -2,-0.1 0.692 87.0-114.6 -90.4 -19.6 236.9 124.0 -28.6 32 63 A G S S+ 0 0 14 1,-0.5 10,-2.7 -4,-0.4 13,-0.2 0.310 88.1 77.6 102.0 -6.7 238.7 127.2 -29.1 33 64 A Y - 0 0 29 -5,-0.5 -1,-0.5 8,-0.2 -2,-0.4 -0.712 58.3-157.4-126.3 179.7 235.7 128.8 -30.6 34 65 A S > + 0 0 53 -2,-0.2 5,-1.5 6,-0.2 6,-1.1 -0.923 40.3 76.3-149.1 167.8 232.4 130.4 -29.5 35 66 A G T > 5S- 0 0 29 -2,-0.3 3,-1.6 3,-0.2 -7,-0.2 -0.206 90.9 -55.5 109.5 160.2 229.1 131.0 -31.2 36 67 A P T 3 5S+ 0 0 108 0, 0.0 -10,-0.7 0, 0.0 -1,-0.2 0.800 140.5 17.5 -38.9 -44.7 225.9 129.1 -32.2 37 68 A N T 3 5S- 0 0 53 -3,-0.2 -26,-2.0 -27,-0.1 -23,-0.2 0.240 113.2-105.5-116.3 11.0 228.0 126.7 -34.3 38 69 A d T < 5S+ 0 0 0 -3,-1.6 -3,-0.2 -28,-0.2 -24,-0.1 0.998 79.1 126.2 59.9 75.3 231.5 127.3 -32.8 39 70 A T < + 0 0 77 -5,-1.5 -4,-0.1 1,-0.1 -1,-0.1 0.000 38.4 96.5-148.5 25.9 233.0 129.4 -35.7 40 71 A I S S- 0 0 93 -6,-1.1 -6,-0.2 -5,-0.1 3,-0.1 -0.725 72.0-141.1-124.6 80.0 234.2 132.4 -33.8 41 72 A P - 0 0 48 0, 0.0 -8,-0.2 0, 0.0 -9,-0.1 -0.088 15.9-122.8 -43.3 118.9 237.9 131.8 -33.2 42 73 A E > - 0 0 103 -10,-2.7 4,-2.5 1,-0.1 5,-0.2 -0.272 41.4 -90.8 -60.5 160.8 239.0 133.0 -29.8 43 74 A I H > S+ 0 0 106 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.855 126.6 40.8 -41.7 -52.7 241.8 135.4 -30.1 44 75 A W H > S+ 0 0 185 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.894 109.9 56.5 -68.3 -42.4 244.6 132.8 -29.8 45 76 A T H > S+ 0 0 28 -13,-0.2 4,-3.9 1,-0.2 5,-0.3 0.971 107.6 51.8 -50.7 -54.1 242.9 130.2 -32.0 46 77 A W H X S+ 0 0 138 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.919 110.5 47.2 -47.4 -54.0 242.8 132.8 -34.6 47 78 A L H >X S+ 0 0 61 -4,-1.9 4,-2.1 -5,-0.2 3,-0.9 0.988 114.5 45.9 -52.3 -64.5 246.5 133.5 -34.2 48 79 A R H 3X S+ 0 0 62 -4,-3.2 4,-2.0 1,-0.3 -2,-0.2 0.859 114.8 48.4 -46.5 -43.0 247.3 129.7 -34.3 49 80 A T H 3< S+ 0 0 79 -4,-3.9 -1,-0.3 -5,-0.3 -2,-0.2 0.835 112.7 48.1 -69.7 -31.3 245.0 129.3 -37.3 50 81 A T H << S+ 0 0 77 -4,-2.7 -2,-0.2 -3,-0.9 -1,-0.2 0.717 120.0 37.2 -81.0 -21.3 246.6 132.3 -39.1 51 82 A L H < S+ 0 0 143 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.650 94.0 96.9-102.5 -19.1 250.2 131.1 -38.4 52 83 A R < - 0 0 66 -4,-2.0 2,-0.0 -5,-0.3 -4,-0.0 -0.573 65.6-140.5 -77.9 131.2 249.8 127.4 -38.8 53 84 A P - 0 0 75 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.169 31.2 -77.9 -80.7 175.2 250.7 125.9 -42.3 54 85 A S >> - 0 0 57 1,-0.2 4,-1.9 -2,-0.0 3,-0.9 -0.495 30.2-132.2 -74.6 142.8 249.0 123.1 -44.3 55 86 A P H 3> S+ 0 0 41 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.783 112.7 65.5 -65.5 -20.4 249.7 119.6 -43.1 56 87 A S H 3> S+ 0 0 64 2,-0.2 4,-0.6 1,-0.2 -2,-0.0 0.867 102.3 47.2 -63.6 -37.8 250.4 119.2 -46.8 57 88 A F H X> S+ 0 0 98 -3,-0.9 4,-1.7 2,-0.2 3,-1.3 0.955 108.5 51.6 -68.7 -56.2 253.3 121.5 -46.3 58 89 A I H 3X S+ 0 0 71 -4,-1.9 4,-2.7 1,-0.3 5,-0.3 0.934 104.2 57.1 -47.8 -53.1 254.8 119.9 -43.2 59 90 A H H 3X S+ 0 0 28 -4,-2.3 4,-0.6 1,-0.2 -1,-0.3 0.846 105.5 56.2 -49.9 -30.8 254.8 116.6 -44.9 60 91 A F H X< S+ 0 0 99 -3,-1.3 3,-1.1 -4,-0.6 -2,-0.2 0.975 109.7 40.1 -64.7 -57.4 256.9 118.4 -47.5 61 92 A L H >X S+ 0 0 64 -4,-1.7 3,-2.4 1,-0.3 4,-1.2 0.972 111.9 56.8 -55.2 -55.9 259.5 119.6 -45.1 62 93 A L H 3< S+ 0 0 16 -4,-2.7 263,-2.2 1,-0.3 264,-0.5 0.662 114.4 41.6 -50.8 -17.0 259.6 116.3 -43.2 63 94 A T T << S+ 0 0 26 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.042 117.0 40.2-123.7 28.6 260.4 114.6 -46.5 64 95 A H T <4 S+ 0 0 99 -3,-2.4 2,-4.7 1,-0.1 3,-0.2 0.637 70.2 95.0-141.0 -43.8 262.9 116.9 -48.1 65 96 A G X + 0 0 23 -4,-1.2 4,-2.8 1,-0.2 5,-0.5 -0.095 45.5 177.9 -58.3 52.3 265.7 118.6 -46.1 66 97 A R H > S+ 0 0 49 -2,-4.7 4,-0.7 1,-0.2 -1,-0.2 0.732 84.3 24.3 -22.0 -48.3 268.1 115.8 -47.0 67 98 A W H > S+ 0 0 224 -3,-0.2 4,-1.9 2,-0.2 3,-0.4 0.920 115.1 59.9 -88.5 -55.1 270.7 117.8 -45.0 68 99 A L H > S+ 0 0 108 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.848 109.3 50.6 -41.9 -40.4 268.7 119.9 -42.6 69 100 A W H X S+ 0 0 20 -4,-2.8 4,-3.8 2,-0.2 -1,-0.2 0.886 102.3 54.7 -71.8 -42.0 267.4 116.6 -41.2 70 101 A D H X S+ 0 0 104 -4,-0.7 4,-0.6 -5,-0.5 -1,-0.2 0.869 114.7 44.5 -59.7 -33.6 270.7 114.8 -40.7 71 102 A F H < S+ 0 0 124 -4,-1.9 4,-0.4 2,-0.2 3,-0.4 0.892 115.2 45.6 -75.0 -44.3 271.8 117.8 -38.6 72 103 A V H >< S+ 0 0 11 -4,-2.2 3,-1.1 -5,-0.3 6,-0.4 0.895 111.7 55.1 -64.4 -38.4 268.5 118.0 -36.8 73 104 A N H 3< S+ 0 0 24 -4,-3.8 -1,-0.2 1,-0.2 -2,-0.2 0.720 105.6 52.8 -66.9 -22.1 268.8 114.2 -36.3 74 105 A A T 3< S+ 0 0 83 -4,-0.6 2,-0.3 -3,-0.4 -1,-0.2 0.445 108.9 50.0 -95.2 -0.1 272.2 114.6 -34.7 75 106 A T S X S- 0 0 34 -3,-1.1 3,-3.0 -4,-0.4 4,-0.3 -0.842 99.1 -90.6-132.8 171.0 271.2 117.1 -32.0 76 107 A F T 3> S+ 0 0 144 1,-0.3 4,-2.4 -2,-0.3 5,-0.2 0.705 111.0 87.3 -49.9 -24.3 268.6 117.7 -29.3 77 108 A I H 3> S+ 0 0 49 1,-0.2 4,-1.7 -6,-0.2 -1,-0.3 0.768 85.6 60.7 -50.4 -19.6 266.7 119.4 -32.1 78 109 A R H <> S+ 0 0 39 -3,-3.0 4,-2.9 -6,-0.4 3,-0.3 0.995 101.4 43.2 -69.8 -69.9 265.6 115.8 -32.6 79 110 A D H > S+ 0 0 47 -4,-0.3 4,-4.0 1,-0.2 5,-0.3 0.860 112.0 59.6 -45.1 -40.7 263.9 115.1 -29.2 80 111 A T H X S+ 0 0 71 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.962 108.6 40.3 -53.9 -57.9 262.3 118.5 -29.5 81 112 A L H X S+ 0 0 43 -4,-1.7 4,-3.7 -3,-0.3 5,-0.2 0.894 115.7 53.6 -59.9 -40.2 260.6 117.7 -32.8 82 113 A M H X S+ 0 0 4 -4,-2.9 4,-3.0 2,-0.2 -2,-0.2 0.983 109.8 46.0 -58.3 -57.7 259.8 114.2 -31.4 83 114 A R H X S+ 0 0 114 -4,-4.0 4,-1.3 2,-0.2 5,-0.2 0.897 117.5 46.3 -51.3 -42.8 258.2 115.7 -28.3 84 115 A L H X S+ 0 0 97 -4,-2.7 4,-1.4 -5,-0.3 5,-0.3 0.998 109.6 51.2 -61.3 -71.5 256.4 118.1 -30.6 85 116 A V H X S+ 0 0 26 -4,-3.7 4,-1.5 2,-0.2 5,-0.3 0.813 115.3 45.9 -29.8 -55.6 255.3 115.5 -33.1 86 117 A L H X S+ 0 0 6 -4,-3.0 4,-2.4 -5,-0.2 5,-0.3 0.969 110.4 46.5 -53.9 -88.2 253.8 113.4 -30.3 87 118 A T H X S+ 0 0 45 -4,-1.3 4,-2.8 1,-0.2 -2,-0.2 0.728 116.4 44.9 -19.0 -70.3 251.9 115.9 -28.1 88 119 A V H >< S+ 0 0 81 -4,-1.4 3,-0.9 -5,-0.2 -1,-0.2 0.955 115.5 44.8 -43.3 -75.8 250.1 117.6 -31.1 89 120 A R H >< S+ 0 0 34 -4,-1.5 3,-0.9 -5,-0.3 4,-0.3 0.871 117.9 45.4 -37.6 -53.7 249.2 114.4 -32.9 90 121 A S H >< S+ 0 0 4 -4,-2.4 3,-0.8 -5,-0.3 -1,-0.3 0.802 90.9 79.7 -66.7 -32.4 248.0 112.8 -29.7 91 122 A N T << S+ 0 0 144 -4,-2.8 -1,-0.2 -3,-0.9 -2,-0.2 0.391 87.2 67.6 -58.9 9.1 246.0 115.7 -28.3 92 123 A L T < S+ 0 0 42 -3,-0.9 -1,-0.2 -4,-0.2 -2,-0.1 0.888 73.3 79.8 -98.7 -46.3 243.2 114.7 -30.7 93 124 A I S < S- 0 0 13 -3,-0.8 -1,-0.1 -4,-0.3 27,-0.0 -0.520 87.2-120.2 -68.3 110.5 241.8 111.4 -29.6 94 125 A P - 0 0 38 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 -0.199 33.0-145.8 -52.9 137.9 239.4 112.2 -26.7 95 126 A S S S+ 0 0 33 2,-0.2 249,-0.0 249,-0.0 246,-0.0 -0.882 86.0 48.5-161.7 124.0 240.5 110.5 -23.5 96 127 A P S S- 0 0 73 0, 0.0 15,-0.1 0, 0.0 249,-0.0 0.465 118.3-102.3 -46.3 151.1 238.8 109.4 -21.3 97 128 A P - 0 0 13 0, 0.0 -2,-0.2 0, 0.0 3,-0.1 -0.185 36.0-156.6 -58.7 149.3 237.0 107.8 -24.3 98 129 A T + 0 0 22 21,-0.3 9,-0.4 -4,-0.3 2,-0.2 0.872 48.5 2.3 -96.3 -86.8 233.8 109.3 -25.5 99 130 A Y E -B 119 0B 23 20,-0.9 20,-2.6 7,-0.1 2,-0.3 -0.515 48.5-167.6-107.2 173.7 231.1 107.4 -27.4 100 131 A N E > -BC 118 103B 0 3,-1.3 3,-2.3 18,-0.3 18,-0.2 -0.915 50.3 -76.9-147.8 171.2 230.4 103.9 -28.8 101 132 A I T 3 S+ 0 0 43 16,-0.5 3,-0.1 87,-0.3 17,-0.1 0.718 131.3 45.1 -43.4 -26.8 228.1 102.1 -31.1 102 133 A A T 3 S+ 0 0 48 1,-0.2 2,-0.4 86,-0.1 -1,-0.3 0.585 114.4 43.8 -97.9 -12.6 225.4 102.3 -28.4 103 134 A H B < -C 100 0B 37 -3,-2.3 -3,-1.3 4,-0.0 2,-0.5 -0.911 44.0-172.6-143.7 117.2 225.8 105.9 -27.3 104 135 A D S S+ 0 0 69 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.1 -0.296 82.0 52.1 -95.6 49.6 226.2 109.2 -29.1 105 136 A Y S S- 0 0 136 -2,-0.5 5,-0.2 -7,-0.1 -5,-0.2 -0.901 101.6 -76.8-175.4 149.8 226.9 110.9 -25.8 106 137 A I + 0 0 119 -2,-0.3 2,-0.3 -7,-0.1 -7,-0.1 -0.287 56.5 166.1 -59.1 137.1 229.1 110.5 -22.7 107 138 A S > - 0 0 23 -9,-0.4 4,-2.1 -4,-0.1 5,-0.1 -0.991 49.9-125.2-152.7 150.6 227.9 107.8 -20.4 108 139 A W H > S+ 0 0 188 -2,-0.3 4,-1.9 2,-0.2 5,-0.2 0.784 116.0 56.9 -65.3 -25.5 229.3 105.8 -17.5 109 140 A E H > S+ 0 0 81 2,-0.2 4,-2.9 1,-0.2 3,-0.4 0.988 105.2 46.7 -66.9 -60.6 228.4 102.8 -19.6 110 141 A S H 4 S+ 0 0 5 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.851 112.0 55.2 -49.6 -38.6 230.6 103.9 -22.5 111 142 A F H < S+ 0 0 49 -4,-2.1 -1,-0.2 1,-0.1 -2,-0.2 0.918 121.4 21.2 -63.1 -48.3 233.3 104.6 -20.1 112 143 A S H < S+ 0 0 55 -4,-1.9 2,-2.8 -3,-0.4 -2,-0.2 0.741 92.4 92.3 -97.8 -29.1 233.6 101.2 -18.4 113 144 A N >< - 0 0 47 -4,-2.9 3,-1.6 -5,-0.2 -1,-0.1 -0.435 56.1-171.7 -69.7 77.8 232.0 98.6 -20.6 114 145 A V T 3 S+ 0 0 46 -2,-2.8 -1,-0.2 1,-0.3 81,-0.1 0.642 71.0 80.3 -45.6 -16.8 235.4 97.8 -22.2 115 146 A S T 3 S+ 0 0 33 74,-0.1 75,-1.6 -3,-0.1 -1,-0.3 0.934 73.4 83.3 -59.6 -49.6 233.5 95.6 -24.7 116 147 A Y B < S-E 189 0C 32 -3,-1.6 73,-0.3 73,-0.2 72,-0.0 -0.362 78.6-133.8 -60.2 124.0 232.4 98.5 -26.9 117 148 A Y - 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0 0 1 0, 0.0 -9,-0.2 0, 0.0 2,-0.2 -0.159 57.7-102.4 -54.9 150.7 254.9 76.9 -30.4 233 264 A P - 0 0 0 0, 0.0 22,-3.5 0, 0.0 4,-0.1 -0.497 33.4-118.1 -77.9 149.1 253.3 74.0 -28.6 234 265 A S B > -O 254 0M 16 20,-0.3 4,-1.9 2,-0.2 20,-0.3 -0.311 32.5-100.2 -77.3 164.9 250.5 72.0 -30.2 235 266 A V T 4 S+ 0 0 33 18,-2.1 2,-3.1 15,-0.4 19,-0.1 0.817 111.9 84.7 -58.2 -28.9 247.1 71.8 -28.7 236 267 A E T 4 S+ 0 0 80 14,-0.5 -1,-0.2 17,-0.3 -2,-0.2 -0.287 116.0 9.5 -72.2 57.4 248.1 68.3 -27.4 237 268 A E T 4 S+ 0 0 89 -2,-3.1 -1,-0.3 -4,-0.1 -2,-0.2 -0.179 128.8 63.1 160.1 -34.3 249.8 70.0 -24.4 238 269 A A S < S- 0 0 0 -4,-1.9 2,-4.6 2,-0.1 -2,-0.1 -0.697 74.5-168.0-111.5 73.7 248.3 73.5 -25.0 239 270 A P + 0 0 76 0, 0.0 2,-0.4 0, 0.0 -4,-0.1 -0.091 39.3 133.1 -57.9 47.4 244.7 72.5 -24.6 240 271 A V - 0 0 13 -2,-4.6 -2,-0.1 -28,-0.1 16,-0.1 -0.894 62.3-100.9-119.9 140.6 243.5 75.8 -26.1 241 272 A L + 0 0 122 -2,-0.4 2,-0.2 1,-0.1 -1,-0.1 0.034 48.5 158.9 -41.7 145.3 240.9 76.7 -28.7 242 273 A M - 0 0 13 2,-0.1 18,-0.1 13,-0.1 17,-0.1 -0.620 43.4-119.5-146.9-152.4 242.2 77.5 -32.2 243 274 A H + 0 0 110 16,-0.4 3,-0.1 -2,-0.2 17,-0.1 0.200 50.5 145.0-150.7 16.2 240.9 77.7 -35.7 244 275 A Y - 0 0 27 1,-0.1 -2,-0.1 15,-0.1 3,-0.1 -0.326 59.5 -93.9 -58.7 142.5 243.0 75.2 -37.6 245 276 A P > - 0 0 64 0, 0.0 2,-1.6 0, 0.0 3,-0.6 -0.253 46.9 -86.1 -64.6 146.7 240.9 73.4 -40.4 246 277 A R T 3 S+ 0 0 259 1,-0.2 -2,-0.0 2,-0.1 0, 0.0 -0.236 103.9 80.3 -50.8 80.1 239.2 70.0 -39.7 247 278 A G T 3 S+ 0 0 59 -2,-1.6 -1,-0.2 -3,-0.1 -3,-0.0 0.332 98.4 2.0-150.4 -76.0 242.2 67.9 -40.5 248 279 A I < + 0 0 116 -3,-0.6 5,-0.2 1,-0.1 -2,-0.1 -0.335 58.1 165.9-124.0 53.2 245.1 67.2 -38.2 249 280 A P S S+ 0 0 62 0, 0.0 -14,-0.3 0, 0.0 -13,-0.2 0.574 70.5 61.2 -43.2 -11.3 244.1 69.0 -35.0 250 281 A P S > S+ 0 0 78 0, 0.0 3,-0.9 0, 0.0 -14,-0.5 0.882 105.3 18.4 -81.5 -95.6 246.9 67.0 -33.2 251 282 A Q T 3 S+ 0 0 66 1,-0.2 3,-0.1 -17,-0.1 -3,-0.0 -0.417 128.1 25.3 -77.0 158.3 250.5 67.5 -34.5 252 283 A S T 3 S+ 0 0 48 1,-0.2 2,-1.0 -2,-0.1 -1,-0.2 0.418 93.6 115.3 68.9 -4.0 251.3 70.6 -36.5 253 284 A Q < - 0 0 18 -3,-0.9 -18,-2.1 -5,-0.2 -17,-0.3 -0.763 53.2-168.0-101.2 89.7 248.4 72.2 -34.8 254 285 A M B -O 234 0M 10 -2,-1.0 2,-0.4 -20,-0.3 -20,-0.3 -0.554 16.0-144.6 -87.2 139.2 250.1 75.0 -32.8 255 286 A A + 0 0 0 -22,-3.5 -13,-0.1 -2,-0.3 -14,-0.1 -0.821 29.4 156.1 -99.4 138.6 248.6 77.1 -30.0 256 287 A V - 0 0 9 -2,-0.4 -52,-0.2 -24,-0.1 -1,-0.1 0.723 57.5 -96.5-130.4 -51.6 249.7 80.7 -29.8 257 288 A G S S+ 0 0 0 -54,-0.2 2,-0.7 -57,-0.1 -52,-0.3 -0.055 104.3 77.8 148.1 -29.4 247.5 83.3 -28.1 258 289 A Q S > S- 0 0 4 -57,-0.5 3,-3.1 1,-0.2 -57,-0.1 -0.887 75.8-145.4-112.6 100.1 245.8 84.7 -31.1 259 290 A E T 3 S+ 0 0 25 -2,-0.7 -16,-0.4 1,-0.3 3,-0.3 0.747 93.7 44.3 -26.5 -58.1 243.2 82.2 -32.2 260 291 A V T > S+ 0 0 47 1,-0.2 3,-1.5 -18,-0.1 -1,-0.3 0.400 78.7 108.4 -81.0 4.6 243.5 82.7 -35.9 261 292 A F T < + 0 0 0 -3,-3.1 -1,-0.2 1,-0.2 7,-0.1 0.212 69.1 64.1 -70.1 19.6 247.3 82.7 -36.1 262 293 A G T 3 S+ 0 0 7 -3,-0.3 -1,-0.2 -2,-0.2 -2,-0.1 0.630 80.1 80.0-110.0 -21.8 247.5 79.3 -37.8 263 294 A L S < S+ 0 0 33 -3,-1.5 115,-2.4 1,-0.1 116,-0.3 0.458 100.5 33.0 -66.2 -2.2 245.7 80.3 -41.0 264 295 A L S > S- 0 0 32 113,-0.2 4,-1.9 114,-0.2 3,-0.3 -0.924 71.3-135.3-157.0 127.5 248.9 81.9 -42.4 265 296 A P H > S+ 0 0 6 0, 0.0 4,-3.3 0, 0.0 5,-0.1 0.865 104.1 63.1 -49.2 -37.3 252.6 81.0 -42.1 266 297 A G H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.941 105.7 39.1 -54.8 -57.2 253.2 84.7 -41.5 267 298 A L H > S+ 0 0 4 -3,-0.3 4,-3.1 1,-0.2 5,-0.2 0.971 118.5 48.1 -61.2 -51.3 251.3 85.2 -38.4 268 299 A M H X S+ 0 0 8 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.902 109.7 57.3 -53.8 -41.9 252.4 81.8 -37.0 269 300 A L H >X S+ 0 0 0 -4,-3.3 3,-2.4 -5,-0.3 4,-1.9 0.979 111.3 37.8 -50.1 -74.1 255.9 82.8 -37.9 270 301 A Y H 3X S+ 0 0 2 -4,-2.2 4,-2.9 1,-0.3 5,-0.3 0.894 110.5 62.7 -44.0 -48.8 256.0 86.0 -35.9 271 302 A A H 3X S+ 0 0 8 -4,-3.1 4,-1.5 -5,-0.3 -1,-0.3 0.782 108.3 44.8 -47.0 -32.6 254.0 84.2 -33.2 272 303 A T H X S+ 0 0 6 -4,-2.9 4,-2.9 2,-0.2 3,-1.6 0.985 114.2 44.8 -63.3 -58.4 258.1 86.4 -30.1 275 306 A L H 3X S+ 0 0 5 -4,-1.5 4,-2.1 1,-0.3 5,-0.4 0.925 111.6 53.3 -50.4 -49.8 257.6 83.2 -28.0 276 307 A R H 3X S+ 0 0 22 -4,-3.8 4,-0.8 1,-0.2 -1,-0.3 0.746 113.5 47.0 -58.5 -21.2 261.1 82.2 -28.8 277 308 A E H X S+ 0 0 0 -4,-3.2 4,-2.0 1,-0.2 3,-0.6 0.968 108.2 53.0 -52.6 -57.2 264.1 87.0 -22.1 282 313 A C H 3X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.3 5,-0.3 0.863 102.0 57.3 -44.2 -50.7 263.3 84.7 -19.2 283 314 A D H 3X S+ 0 0 93 -4,-2.4 4,-0.9 -5,-0.2 -1,-0.3 0.936 110.4 47.3 -49.7 -47.0 266.6 82.8 -19.5 284 315 A L H XX S+ 0 0 67 -4,-1.7 4,-1.0 -3,-0.6 3,-0.8 0.956 113.2 44.0 -59.9 -58.2 268.3 86.2 -19.1 285 316 A L H >X S+ 0 0 3 -4,-2.0 4,-2.3 1,-0.2 3,-1.8 0.952 105.3 60.4 -52.8 -58.9 266.3 87.5 -16.0 286 317 A K H 3< S+ 0 0 30 -4,-2.4 -1,-0.2 1,-0.3 6,-0.2 0.761 101.6 57.2 -41.3 -32.3 266.4 84.2 -14.0 287 318 A A H << S+ 0 0 81 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.919 111.2 41.3 -66.3 -43.5 270.2 84.6 -14.1 288 319 A E H << S+ 0 0 108 -3,-1.8 -2,-0.2 -4,-1.0 -1,-0.2 0.796 127.9 31.7 -74.1 -32.5 269.9 88.0 -12.5 289 320 A H >< + 0 0 39 -4,-2.3 3,-1.6 1,-0.1 -1,-0.2 -0.538 58.2 158.4-131.9 73.5 267.2 86.8 -10.1 290 321 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.913 76.8 66.4 -58.7 -40.9 267.5 83.2 -9.0 291 322 A T T 3 S+ 0 0 130 -3,-0.1 2,-0.3 -5,-0.0 -5,-0.0 0.349 85.3 117.4 -64.0 13.4 265.4 83.9 -5.9 292 323 A W < - 0 0 45 -3,-1.6 -74,-0.1 -6,-0.2 -3,-0.0 -0.631 57.9-139.8 -92.0 143.4 262.6 84.6 -8.3 293 324 A G > - 0 0 49 -2,-0.3 4,-0.5 1,-0.1 -1,-0.1 0.256 28.9-102.8 -74.4-156.8 259.3 82.8 -8.6 294 325 A D H > S+ 0 0 37 2,-0.1 4,-2.9 3,-0.1 5,-0.1 0.876 113.4 54.7 -95.4 -62.8 257.5 81.8 -11.8 295 326 A E H > S+ 0 0 89 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.853 112.1 47.9 -37.0 -51.5 254.7 84.4 -12.0 296 327 A Q H >>S+ 0 0 83 2,-0.2 4,-2.4 1,-0.2 5,-0.6 0.987 108.3 50.6 -56.4 -76.6 257.4 87.2 -11.7 297 328 A L H X5S+ 0 0 6 -4,-0.5 4,-1.5 1,-0.2 -1,-0.2 0.790 116.5 46.7 -28.4 -43.6 259.7 85.8 -14.4 298 329 A F H X5S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 3,-0.4 0.998 115.5 39.5 -66.8 -71.5 256.6 85.6 -16.5 299 330 A Q H X5S+ 0 0 72 -4,-3.0 4,-2.3 1,-0.3 -2,-0.2 0.858 116.4 51.2 -45.1 -48.4 255.1 89.1 -15.9 300 331 A T H X5S+ 0 0 11 -4,-2.4 4,-1.9 -5,-0.3 -1,-0.3 0.926 112.0 47.2 -58.5 -44.7 258.5 90.8 -16.0 301 332 A A H XX S+ 0 0 37 -4,-2.5 3,-2.2 1,-0.2 4,-1.7 0.978 104.9 47.5 -55.1 -59.6 255.9 90.1 -20.5 303 334 A L H 3X S+ 0 0 41 -4,-2.3 4,-3.2 1,-0.3 3,-0.4 0.898 103.7 61.6 -47.4 -50.0 256.5 93.8 -20.0 304 335 A I H 3X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.3 -1,-0.3 0.735 107.7 46.2 -51.9 -23.8 259.9 93.6 -21.7 305 336 A L H X S+ 0 0 0 -4,-3.2 4,-1.7 -5,-0.3 3,-0.6 0.943 112.1 44.0 -69.7 -83.5 258.5 97.4 -24.3 308 339 A E H 3X S+ 0 0 9 -4,-1.8 4,-2.8 1,-0.3 5,-0.3 0.760 115.6 53.1 -26.0 -49.3 260.5 96.0 -27.2 309 340 A T H 3X S+ 0 0 2 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.980 107.2 47.9 -56.5 -61.9 257.3 96.0 -29.2 310 341 A I H S+ 0 0 2 -4,-2.8 5,-2.3 1,-0.2 4,-1.1 0.863 110.0 56.5 -51.9 -42.1 260.3 98.6 -32.7 313 344 A V H <>S+ 0 0 2 -4,-3.1 5,-4.0 -5,-0.3 6,-0.4 0.961 118.8 32.8 -56.3 -49.1 256.8 99.7 -33.9 314 345 A I H <>S+ 0 0 4 -4,-1.2 5,-1.2 -5,-0.3 -2,-0.2 0.997 120.9 42.3 -71.6 -69.7 257.8 103.3 -33.5 315 346 A E H <5S+ 0 0 47 -4,-2.0 -1,-0.2 -5,-0.2 -3,-0.2 0.498 138.6 9.2 -60.6 -0.4 261.5 103.6 -34.4 316 347 A E T X5S+ 0 0 54 -4,-1.1 4,-1.8 -5,-0.4 5,-0.3 0.499 128.4 45.2-141.5 -51.9 261.1 101.2 -37.3 317 348 A Y H > - 0 0 29 -2,-0.6 3,-2.7 -252,-0.0 4,-0.2 -0.569 36.8-158.7-164.5 91.1 261.3 107.7 -25.1 332 363 A P G > S+ 0 0 0 0, 0.0 3,-2.1 0, 0.0 4,-0.4 0.740 87.0 76.4 -44.3 -30.0 258.4 108.0 -22.7 333 364 A E G > S+ 0 0 113 1,-0.3 3,-1.4 2,-0.2 4,-0.3 0.789 78.3 73.9 -56.7 -27.2 260.3 110.7 -20.9 334 365 A L G < S+ 0 0 9 -3,-2.7 -1,-0.3 1,-0.3 3,-0.1 0.617 101.6 40.3 -62.8 -15.3 259.4 113.2 -23.7 335 366 A L G X S+ 0 0 3 -3,-2.1 3,-2.2 -4,-0.2 -1,-0.3 0.373 84.6 101.0-112.7 1.6 255.8 113.4 -22.4 336 367 A F T < S+ 0 0 79 -3,-1.4 -2,-0.1 -4,-0.4 -1,-0.1 0.721 85.6 46.7 -58.7 -22.7 256.7 113.5 -18.8 337 368 A G T 3 S+ 0 0 81 -4,-0.3 -1,-0.3 -3,-0.1 2,-0.2 0.153 103.0 82.3-105.9 19.4 256.1 117.2 -18.7 338 369 A A S < S- 0 0 44 -3,-2.2 2,-0.8 2,-0.0 -3,-0.1 -0.475 88.7-103.6-111.1-178.3 252.9 117.1 -20.6 339 370 A Q + 0 0 203 -2,-0.2 2,-0.4 2,-0.0 -3,-0.1 -0.798 60.3 156.3-109.3 85.1 249.2 116.5 -19.7 340 371 A F - 0 0 33 -2,-0.8 2,-0.7 -5,-0.2 -249,-0.0 -0.886 39.2-139.5-116.5 144.1 248.9 113.0 -21.1 341 372 A Q - 0 0 103 -2,-0.4 2,-2.4 2,-0.1 -2,-0.0 -0.885 12.3-145.0-105.8 107.9 246.4 110.3 -20.1 342 373 A Y + 0 0 54 -2,-0.7 2,-0.2 165,-0.1 163,-0.1 -0.439 68.6 91.2 -71.2 77.3 248.1 106.9 -19.9 343 374 A R - 0 0 106 -2,-2.4 2,-0.2 158,-0.2 163,-0.1 -0.727 50.7-169.6-173.1 119.0 245.0 105.0 -21.2 344 375 A N - 0 0 32 -149,-0.2 2,-0.3 -2,-0.2 -150,-0.1 -0.683 7.0-169.7-111.6 166.7 243.8 104.0 -24.7 345 376 A R - 0 0 24 -2,-0.2 -149,-0.1 -249,-0.0 -152,-0.0 -0.828 33.7-114.4-156.8 109.4 240.6 102.6 -26.0 346 377 A I - 0 0 4 -2,-0.3 -228,-3.2 -168,-0.1 2,-0.3 -0.167 28.5-142.6 -52.4 133.3 240.5 101.3 -29.6 347 378 A A B > -d 118 0B 2 -230,-0.2 4,-2.1 1,-0.1 -228,-0.2 -0.770 12.7-134.6-101.0 144.1 238.3 103.2 -31.9 348 379 A M H > S+ 0 0 3 -230,-1.8 4,-2.7 -2,-0.3 5,-0.2 0.876 109.2 54.9 -63.1 -37.0 236.2 101.7 -34.7 349 380 A E H > S+ 0 0 1 -231,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.896 105.3 53.2 -62.9 -38.1 237.3 104.3 -37.1 350 381 A F H > S+ 0 0 13 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.956 109.5 49.5 -59.7 -48.6 240.9 103.4 -36.3 351 382 A N H >X S+ 0 0 11 -4,-2.1 3,-1.0 2,-0.2 4,-0.7 0.971 109.4 49.4 -53.0 -63.1 240.0 99.8 -37.1 352 383 A Q H >< S+ 0 0 0 -4,-2.7 3,-1.5 1,-0.3 -1,-0.2 0.902 111.2 52.3 -41.6 -52.5 238.4 100.6 -40.5 353 384 A L H 3< S+ 0 0 1 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.806 100.2 60.9 -54.7 -39.0 241.5 102.7 -41.4 354 385 A Y H << + 0 0 24 -4,-1.8 2,-2.9 -3,-1.0 -1,-0.3 0.578 67.5 115.7 -72.2 -8.6 244.0 99.9 -40.6 355 386 A H << + 0 0 33 -3,-1.5 2,-0.5 -4,-0.7 -1,-0.1 -0.314 31.8 159.7 -65.4 77.4 242.6 97.6 -43.2 356 387 A W > + 0 0 22 -2,-2.9 3,-2.2 1,-0.2 4,-0.3 -0.258 12.8 142.7 -94.5 46.9 245.7 97.6 -45.4 357 388 A H G > + 0 0 50 -2,-0.5 3,-2.2 1,-0.3 53,-0.2 0.828 59.2 73.4 -57.4 -32.8 244.9 94.4 -47.2 358 389 A P G 3 S+ 0 0 3 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.654 77.6 81.9 -58.2 -9.5 246.3 95.8 -50.4 359 390 A L G < S+ 0 0 8 -3,-2.2 42,-0.7 41,-0.1 -2,-0.2 0.897 73.6 95.2 -59.3 -39.6 249.6 95.2 -48.7 360 391 A M S < S- 0 0 23 -3,-2.2 50,-0.1 -4,-0.3 40,-0.0 -0.114 72.6-130.5 -55.6 148.3 249.4 91.6 -49.7 361 392 A P - 0 0 2 0, 0.0 49,-0.1 0, 0.0 3,-0.1 0.163 20.7-106.8 -81.7-161.5 251.1 90.4 -52.9 362 393 A D S S- 0 0 79 1,-0.3 11,-0.4 48,-0.1 2,-0.2 0.814 98.5 -6.3 -96.5 -49.8 249.9 88.3 -55.9 363 394 A S S S- 0 0 31 9,-0.1 2,-0.4 10,-0.1 -1,-0.3 -0.589 78.4-104.2-130.4-170.0 251.8 85.2 -54.9 364 395 A F - 0 0 6 7,-1.6 7,-0.5 6,-0.4 31,-0.0 -0.673 31.0-154.2-131.3 84.2 254.3 84.3 -52.2 365 396 A R + 0 0 38 -2,-0.4 2,-0.2 5,-0.3 5,-0.2 -0.224 18.6 170.5 -58.0 135.9 257.9 84.1 -53.5 366 397 A V B > -P 369 0N 9 3,-1.3 3,-1.8 31,-0.1 5,-0.1 -0.778 64.7 -59.6-150.1 98.0 260.4 81.9 -51.5 367 398 A G T 3 S- 0 0 81 1,-0.3 -2,-0.0 -2,-0.2 0, 0.0 -0.474 122.5 -20.5 63.8-100.2 263.8 81.2 -53.0 368 399 A P T 3 S+ 0 0 132 0, 0.0 -1,-0.3 0, 0.0 -3,-0.0 0.648 123.6 87.6-110.7 -23.6 262.6 79.4 -56.2 369 400 A Q B < -P 366 0N 27 -3,-1.8 -3,-1.3 1,-0.1 0, 0.0 -0.001 54.3-165.1 -65.6 177.8 259.1 78.4 -55.1 370 401 A D - 0 0 86 -5,-0.2 -6,-0.4 2,-0.0 -5,-0.3 0.015 12.7-156.9-162.0 41.7 256.1 80.8 -55.5 371 402 A Y - 0 0 48 -7,-0.5 -7,-1.6 -8,-0.2 2,-0.1 0.146 9.8-142.0 -29.8 122.6 253.2 79.5 -53.4 372 403 A S >> - 0 0 50 -9,-0.2 4,-1.7 1,-0.1 3,-1.1 -0.462 34.6 -93.5 -84.5 164.4 249.8 80.7 -54.5 373 404 A Y H >> S+ 0 0 6 -11,-0.4 4,-3.0 1,-0.3 3,-1.2 0.901 127.4 56.4 -42.3 -56.1 247.2 81.6 -52.0 374 405 A E H 34 S+ 0 0 85 1,-0.3 -1,-0.3 2,-0.2 -3,-0.1 0.841 112.8 41.6 -46.3 -41.6 245.7 78.1 -52.1 375 406 A Q H <4 S+ 0 0 96 -3,-1.1 -1,-0.3 1,-0.1 -2,-0.2 0.686 124.5 39.8 -79.1 -21.5 249.2 76.7 -51.2 376 407 A F H X< S+ 0 0 1 -4,-1.7 3,-3.1 -3,-1.2 -2,-0.2 0.920 92.8 84.1 -90.2 -65.7 249.6 79.5 -48.7 377 408 A L T 3< S- 0 0 56 -4,-3.0 -113,-0.2 1,-0.3 3,-0.1 -0.121 117.1 -7.7 -44.1 127.2 246.3 80.0 -47.0 378 409 A F T 3 S+ 0 0 100 -115,-2.4 -1,-0.3 1,-0.1 -114,-0.2 0.488 91.3 155.8 60.6 0.5 246.0 77.5 -44.2 379 410 A N < - 0 0 43 -3,-3.1 -1,-0.1 -116,-0.3 -3,-0.1 -0.234 24.0-167.4 -50.8 156.3 249.1 75.8 -45.3 380 411 A T + 0 0 73 -3,-0.1 -1,-0.1 -117,-0.0 -4,-0.1 0.192 69.9 38.3-140.5 23.2 250.4 74.0 -42.2 381 412 A S S >> S+ 0 0 70 2,-0.1 4,-3.7 3,-0.1 3,-0.5 0.442 83.7 93.3-140.5 -24.8 254.0 72.8 -42.8 382 413 A M H 3> S+ 0 0 4 1,-0.3 4,-2.6 2,-0.2 5,-0.5 0.860 87.7 53.8 -39.1 -49.4 255.5 75.7 -44.8 383 414 A L H 3> S+ 0 0 11 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.906 117.0 33.3 -56.2 -51.0 256.7 77.2 -41.5 384 415 A V H <4 S+ 0 0 30 -3,-0.5 -1,-0.2 2,-0.2 -2,-0.2 0.770 116.6 58.4 -78.7 -27.1 258.6 74.1 -40.2 385 416 A D H < S+ 0 0 73 -4,-3.7 -2,-0.2 1,-0.1 -3,-0.2 0.993 120.0 24.5 -65.2 -58.9 259.6 73.0 -43.7 386 417 A Y H < S- 0 0 74 -4,-2.6 4,-0.3 -5,-0.2 -2,-0.2 0.912 104.4-131.3 -74.3 -46.5 261.5 76.2 -44.6 387 418 A G X - 0 0 12 -4,-1.8 4,-3.3 -5,-0.5 5,-0.2 0.022 21.5 -90.4 103.7 145.9 262.4 77.5 -41.2 388 419 A V H > S+ 0 0 1 2,-0.2 4,-3.6 3,-0.2 5,-0.4 0.975 122.8 53.0 -52.7 -63.0 262.1 81.0 -39.6 389 420 A E H > S+ 0 0 23 1,-0.2 4,-2.8 2,-0.2 157,-0.3 0.894 117.1 37.4 -33.9 -73.5 265.6 82.2 -40.8 390 421 A A H > S+ 0 0 45 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.890 117.6 50.8 -49.1 -51.7 264.8 81.3 -44.4 391 422 A L H X S+ 0 0 0 -4,-3.3 4,-0.6 2,-0.2 -1,-0.2 0.920 111.2 47.0 -58.0 -48.1 261.2 82.3 -44.3 392 423 A V H >X S+ 0 0 0 -4,-3.6 3,-3.0 1,-0.2 4,-2.7 0.981 110.1 53.5 -55.8 -56.2 261.9 85.7 -42.9 393 424 A D H 3< S+ 0 0 44 -4,-2.8 4,-0.3 -5,-0.4 -1,-0.2 0.859 106.9 55.4 -46.0 -36.4 264.6 86.2 -45.4 394 425 A A H 3< S+ 0 0 11 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.624 112.3 39.6 -75.8 -13.1 262.0 85.4 -48.0 395 426 A F H X< S+ 0 0 1 -3,-3.0 -229,-1.2 -4,-0.6 3,-1.2 0.808 105.9 60.9-100.7 -42.3 259.6 88.1 -46.8 396 427 A S T 3< S+ 0 0 0 -4,-2.7 -2,-0.2 150,-0.3 -3,-0.1 0.580 110.3 48.5 -60.2 -7.1 262.1 90.8 -46.2 397 428 A R T 3 S+ 0 0 129 -5,-0.3 -1,-0.3 -4,-0.3 -2,-0.2 0.613 92.9 79.8-109.4 -17.3 262.8 90.4 -49.9 398 429 A Q S < S- 0 0 23 -3,-1.2 -233,-3.0 -4,-0.2 -232,-0.3 -0.825 80.4-124.5 -97.8 122.4 259.4 90.4 -51.5 399 430 A P B -K 164 0I 51 0, 0.0 -235,-0.3 0, 0.0 2,-0.1 -0.187 18.8-139.7 -59.8 154.7 257.9 93.9 -52.0 400 431 A A - 0 0 0 -237,-1.8 -241,-0.9 -241,-0.1 2,-0.4 -0.108 29.8 -92.3 -96.0-162.0 254.4 94.7 -50.5 401 432 A G B -I 158 0G 0 -42,-0.7 7,-0.1 -243,-0.3 -1,-0.0 -0.928 34.6 -93.9-125.7 148.1 251.8 96.7 -52.3 402 433 A R - 0 0 62 -245,-2.4 -245,-0.1 -2,-0.4 85,-0.1 -0.297 32.8-151.8 -50.5 130.3 250.8 100.4 -52.5 403 434 A I S S+ 0 0 2 83,-1.3 84,-0.2 -44,-0.1 2,-0.2 0.602 71.2 28.4 -84.4 -10.9 248.1 100.7 -49.9 404 435 A G S S+ 0 0 2 82,-1.3 73,-0.1 81,-0.1 74,-0.1 -0.539 71.8 81.4-132.1-161.5 246.4 103.6 -51.7 405 436 A G S S- 0 0 20 74,-1.0 -1,-0.1 71,-0.3 2,-0.1 -0.064 99.0 -99.9 87.6 -34.5 245.8 105.2 -55.0 406 437 A G S S+ 0 0 8 -4,-0.1 -255,-0.2 -255,-0.1 72,-0.1 -0.180 94.7 61.8 103.8 161.9 243.1 102.7 -55.4 407 438 A R + 0 0 72 -257,-2.7 -253,-0.8 -260,-0.2 -252,-0.3 0.915 69.5 109.4 51.7 56.8 242.6 99.4 -57.2 408 439 A N + 0 0 4 -257,-0.7 2,-0.4 -255,-0.2 -256,-0.2 0.307 37.0 110.5-142.1 11.1 245.3 97.4 -55.5 409 440 A I B S-h 152 0F 4 -258,-2.3 -256,-4.2 1,-0.1 5,-0.1 -0.735 70.1-117.1 -87.6 136.6 243.5 94.8 -53.3 410 441 A D > - 0 0 12 -2,-0.4 4,-0.8 -53,-0.2 -2,-0.1 -0.244 17.7-121.7 -67.9 163.0 243.9 91.2 -54.4 411 442 A H T 4 S+ 0 0 115 2,-0.2 4,-0.4 1,-0.2 -1,-0.1 0.849 106.9 60.8 -75.2 -36.1 240.7 89.3 -55.5 412 443 A H T 4 S+ 0 0 84 1,-0.2 3,-0.4 2,-0.1 -1,-0.2 0.927 120.9 25.8 -56.5 -46.8 241.1 86.5 -53.0 413 444 A I T >> S+ 0 0 23 1,-0.2 3,-2.3 2,-0.1 4,-0.6 0.501 89.7 104.9 -96.6 -6.6 240.8 88.9 -50.1 414 445 A L H 3X + 0 0 20 -4,-0.8 4,-1.3 1,-0.3 -1,-0.2 0.760 69.8 73.1 -46.5 -22.6 238.9 91.6 -51.9 415 446 A H H 3> S+ 0 0 110 -4,-0.4 4,-2.0 -3,-0.4 -1,-0.3 0.858 86.2 60.9 -62.6 -34.7 235.9 90.3 -49.9 416 447 A V H <> S+ 0 0 34 -3,-2.3 4,-2.3 1,-0.2 3,-0.5 0.968 101.8 51.9 -54.8 -57.1 237.2 91.9 -46.7 417 448 A A H X S+ 0 0 2 -4,-0.6 4,-2.1 1,-0.3 -1,-0.2 0.854 107.0 53.6 -47.0 -44.9 237.0 95.4 -48.1 418 449 A V H X S+ 0 0 32 -4,-1.3 4,-1.6 1,-0.2 -1,-0.3 0.916 109.5 48.1 -59.8 -43.7 233.4 94.8 -49.2 419 450 A D H X S+ 0 0 99 -4,-2.0 4,-5.0 -3,-0.5 5,-0.3 0.865 107.3 56.0 -65.2 -36.8 232.5 93.8 -45.6 420 451 A V H X S+ 0 0 3 -4,-2.3 4,-3.5 2,-0.2 -1,-0.2 0.926 110.1 45.1 -62.1 -42.1 234.3 96.9 -44.2 421 452 A I H X S+ 0 0 0 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.825 118.1 45.0 -69.9 -29.3 232.2 99.1 -46.4 422 453 A K H X S+ 0 0 40 -4,-1.6 4,-1.2 -5,-0.2 -2,-0.2 0.897 116.6 44.5 -79.4 -41.7 229.2 97.0 -45.3 423 454 A E H >X S+ 0 0 35 -4,-5.0 4,-2.6 2,-0.2 3,-0.8 0.944 106.3 59.3 -66.5 -48.7 230.2 97.0 -41.7 424 455 A S H 3X>S+ 0 0 2 -4,-3.5 4,-2.0 1,-0.3 5,-0.9 0.914 107.1 51.0 -42.1 -49.0 231.1 100.8 -41.7 425 456 A R H 3<5S+ 0 0 60 -4,-1.1 -1,-0.3 2,-0.2 -2,-0.2 0.815 104.5 52.7 -60.7 -38.2 227.4 101.2 -42.7 426 457 A V H <<5S+ 0 0 81 -4,-1.2 -1,-0.2 -3,-0.8 -2,-0.2 0.954 113.9 46.8 -62.5 -45.3 226.0 99.1 -39.9 427 458 A L H <5S- 0 0 5 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.806 105.6-135.7 -63.0 -35.9 228.1 101.3 -37.6 428 459 A R T <5 - 0 0 43 -4,-2.0 -304,-1.7 -5,-0.3 2,-0.2 0.949 26.5-170.4 75.6 52.9 226.9 104.5 -39.3 429 460 A L B < -F 123 0D 2 -5,-0.9 -1,-0.2 -306,-0.2 43,-0.2 -0.572 26.2-112.0 -75.9 137.3 230.3 106.4 -39.6 430 461 A Q - 0 0 7 -308,-0.5 42,-0.1 -2,-0.2 -1,-0.1 -0.120 51.5 -67.7 -62.4 165.6 229.9 110.0 -40.7 431 462 A P >> - 0 0 7 0, 0.0 4,-1.8 0, 0.0 3,-0.7 -0.169 43.2-110.0 -59.6 149.0 231.2 111.0 -44.2 432 463 A F T >4 S+ 0 0 1 38,-1.7 3,-1.3 1,-0.3 4,-0.4 0.911 120.4 52.2 -40.3 -57.9 234.8 111.0 -45.0 433 464 A N T >> S+ 0 0 2 34,-0.3 4,-2.1 1,-0.3 3,-1.5 0.862 105.4 52.8 -52.3 -41.4 234.7 114.8 -45.1 434 465 A E H <> S+ 0 0 28 -3,-0.7 4,-1.5 34,-0.3 -1,-0.3 0.825 111.2 49.8 -64.9 -25.7 233.2 115.0 -41.7 435 466 A Y H << S+ 0 0 0 -4,-1.8 -1,-0.3 -3,-1.3 -2,-0.2 0.409 105.3 56.3 -90.8 0.3 236.1 112.9 -40.7 436 467 A R H X4>S+ 0 0 13 -3,-1.5 5,-2.0 -4,-0.4 3,-0.5 0.850 107.8 47.4 -91.6 -50.4 238.6 115.1 -42.3 437 468 A K H ><5S+ 0 0 60 -4,-2.1 3,-2.5 1,-0.3 4,-0.3 0.977 107.9 54.4 -50.4 -66.1 237.5 118.2 -40.4 438 469 A R T 3<5S+ 0 0 24 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.1 0.788 109.7 51.1 -40.3 -33.4 237.5 116.3 -37.1 439 470 A F T < 5S- 0 0 4 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.2 -0.071 127.0 -94.9-100.9 36.8 241.1 115.4 -37.9 440 471 A G T < 5S+ 0 0 59 -3,-2.5 -3,-0.2 1,-0.2 2,-0.2 0.669 86.1 111.6 65.8 24.2 242.3 118.9 -38.7 441 472 A M < - 0 0 19 -5,-2.0 -1,-0.2 -4,-0.3 -5,-0.1 -0.670 68.2-101.3-120.0 176.9 241.9 119.1 -42.5 442 473 A K - 0 0 64 -2,-0.2 2,-0.1 1,-0.1 3,-0.1 -0.728 41.8-107.6 -96.1 145.3 239.8 120.8 -45.0 443 474 A P - 0 0 51 0, 0.0 25,-0.1 0, 0.0 -1,-0.1 -0.487 39.4-106.6 -70.5 142.6 236.9 119.0 -46.6 444 475 A Y - 0 0 7 1,-0.1 3,-0.1 -2,-0.1 -11,-0.1 -0.403 21.8-150.2 -66.2 151.2 237.5 118.0 -50.2 445 476 A T S S+ 0 0 99 1,-0.3 2,-0.3 22,-0.1 22,-0.2 0.584 71.9 2.1 -98.1 -13.4 235.5 120.2 -52.5 446 477 A S > - 0 0 43 21,-0.1 4,-2.6 1,-0.1 -1,-0.3 -0.951 67.0-110.9-171.0 151.0 235.2 117.6 -55.3 447 478 A F H > S+ 0 0 7 -2,-0.3 4,-2.0 1,-0.3 10,-0.1 0.811 119.9 60.1 -55.3 -29.8 236.0 114.0 -56.3 448 479 A Q H 4 S+ 0 0 58 1,-0.2 -1,-0.3 2,-0.2 9,-0.1 0.984 107.2 43.6 -61.3 -53.7 238.3 115.6 -58.8 449 480 A E H 4 S+ 0 0 87 1,-0.1 -2,-0.2 -3,-0.1 -1,-0.2 0.864 113.7 54.4 -58.9 -38.1 240.2 117.2 -55.9 450 481 A L H < S+ 0 0 1 -4,-2.6 30,-1.1 29,-0.1 -2,-0.2 0.984 108.6 44.8 -58.0 -79.2 240.1 114.0 -54.0 451 482 A T S < S- 0 0 6 -4,-2.0 28,-0.1 28,-0.2 27,-0.0 -0.388 82.5-130.1 -69.8 141.6 241.6 111.6 -56.6 452 483 A G S S+ 0 0 65 -2,-0.1 -1,-0.1 -47,-0.1 27,-0.1 0.826 92.3 42.5 -59.1 -31.7 244.7 112.8 -58.4 453 484 A E S S- 0 0 70 1,-0.0 27,-0.1 0, 0.0 -2,-0.0 0.276 78.2-128.6 -92.3-144.7 243.0 111.9 -61.7 454 485 A K S > S+ 0 0 66 3,-0.1 4,-2.5 -5,-0.0 5,-0.2 0.424 86.1 75.6-146.8 -23.9 239.5 112.3 -63.2 455 486 A E H > S+ 0 0 80 2,-0.2 4,-1.7 1,-0.1 5,-0.2 0.995 107.5 31.5 -58.9 -75.9 238.4 108.9 -64.5 456 487 A M H > S+ 0 0 27 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.936 117.4 62.0 -44.1 -55.6 237.5 107.3 -61.2 457 488 A A H > S+ 0 0 4 1,-0.2 4,-2.4 2,-0.2 3,-0.2 0.874 103.4 45.2 -34.6 -67.9 236.6 110.7 -59.9 458 489 A A H X S+ 0 0 61 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.919 113.3 50.9 -46.5 -55.0 233.7 111.3 -62.4 459 490 A E H X S+ 0 0 39 -4,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.888 109.5 50.5 -51.9 -45.3 232.3 107.8 -61.9 460 491 A L H X S+ 0 0 1 -4,-2.7 4,-3.1 -3,-0.2 5,-0.4 0.878 108.0 51.6 -64.7 -39.6 232.3 108.3 -58.1 461 492 A E H X S+ 0 0 114 -4,-2.4 4,-3.1 -5,-0.3 -1,-0.2 0.963 107.0 54.8 -60.3 -47.6 230.5 111.6 -58.3 462 493 A E H < S+ 0 0 128 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.845 116.2 39.3 -51.4 -37.0 227.9 109.8 -60.5 463 494 A L H < S+ 0 0 19 -4,-1.6 -2,-0.2 -5,-0.2 -326,-0.2 0.942 125.2 31.0 -81.2 -53.1 227.5 107.2 -57.7 464 495 A Y H < S- 0 0 3 -4,-3.1 2,-1.4 1,-0.1 -327,-0.2 0.626 86.7-151.3 -82.9 -15.2 227.7 109.3 -54.5 465 496 A G S < S+ 0 0 40 -4,-3.1 2,-0.3 -5,-0.4 -1,-0.1 -0.015 75.4 42.8 72.9 -36.3 226.1 112.4 -56.1 466 497 A D S >> S- 0 0 52 -2,-1.4 3,-1.5 -6,-0.1 4,-0.8 -0.992 77.9-131.6-145.3 133.4 227.9 114.7 -53.7 467 498 A I G >4 S+ 0 0 12 -2,-0.3 3,-1.1 1,-0.3 -34,-0.3 0.873 106.8 61.4 -49.0 -43.5 231.5 114.6 -52.5 468 499 A D G 34 S+ 0 0 50 1,-0.3 -34,-0.3 -23,-0.1 -1,-0.3 0.809 95.7 60.9 -56.5 -32.2 230.3 115.1 -48.9 469 500 A A G <4 S+ 0 0 0 -3,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.848 77.3 122.3 -65.6 -33.8 228.4 111.8 -49.1 470 501 A L << - 0 0 3 -3,-1.1 -38,-1.7 -4,-0.8 -37,-0.3 0.178 63.2-117.2 -29.8 141.2 231.6 109.9 -49.7 471 502 A E > - 0 0 2 -40,-0.2 4,-1.0 -39,-0.1 5,-0.1 -0.220 13.2-114.2 -84.1 174.6 232.3 107.2 -47.2 472 503 A F H > S+ 0 0 4 2,-0.2 4,-1.9 -43,-0.2 -1,-0.1 0.997 106.5 37.1 -71.1 -72.9 235.1 106.7 -44.7 473 504 A Y H > S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 5,-0.3 0.917 118.9 48.4 -47.9 -57.5 237.0 103.6 -45.8 474 505 A P H > S+ 0 0 2 0, 0.0 4,-1.9 0, 0.0 5,-0.3 0.936 107.5 57.7 -51.5 -48.4 236.6 104.2 -49.5 475 506 A G H >X S+ 0 0 0 -4,-1.0 4,-1.5 1,-0.2 3,-1.2 0.951 106.8 47.1 -45.2 -64.2 237.8 107.8 -49.1 476 507 A L H >< S+ 0 0 3 -4,-1.9 3,-0.6 1,-0.3 12,-0.4 0.894 117.0 41.1 -44.3 -55.8 241.1 106.8 -47.5 477 508 A L H 3< S+ 0 0 5 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.612 117.9 47.0 -74.2 -13.2 242.0 104.1 -50.1 478 509 A L H << S+ 0 0 3 -4,-1.9 -1,-0.2 -3,-1.2 -2,-0.2 0.500 86.7 112.1-104.0 -7.8 240.8 106.2 -53.0 479 510 A E S << S- 0 0 0 -4,-1.5 -74,-1.0 -3,-0.6 9,-0.4 -0.362 83.5 -97.6 -65.8 143.4 242.5 109.4 -51.9 480 511 A K - 0 0 85 -30,-1.1 9,-0.6 -31,-0.2 -1,-0.1 -0.453 45.2-127.9 -61.8 125.3 245.4 110.5 -54.1 481 512 A C B -Q 488 0O 30 7,-0.2 7,-0.3 -2,-0.2 8,-0.1 -0.195 26.4 -95.8 -68.6 169.4 248.6 109.3 -52.4 482 513 A H > - 0 0 28 5,-1.0 3,-2.2 6,-0.2 -1,-0.1 -0.450 63.9 -70.2 -78.8 161.2 251.5 111.6 -51.6 483 514 A P T 3 S- 0 0 111 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.331 119.5 -5.5 -56.7 124.9 254.3 111.6 -54.2 484 515 A N T 3 S+ 0 0 140 1,-0.2 2,-0.2 -2,-0.1 -2,-0.0 0.800 109.7 142.4 60.5 28.5 256.2 108.3 -54.1 485 516 A S < - 0 0 8 -3,-2.2 -1,-0.2 1,-0.1 -81,-0.1 -0.501 64.4-131.7-100.9 169.0 254.1 107.4 -51.1 486 517 A I S S- 0 0 0 1,-0.3 -82,-1.3 -165,-0.3 -83,-1.3 0.765 91.0 -5.7 -84.8 -31.0 252.5 104.2 -49.8 487 518 A F S S- 0 0 11 -84,-0.2 -5,-1.0 1,-0.2 -1,-0.3 -0.988 81.7 -82.3-160.1 164.0 249.3 106.0 -49.2 488 519 A G B > -Q 481 0O 0 -12,-0.4 4,-0.6 -9,-0.4 -7,-0.2 0.445 47.0 -93.1 -53.4-164.9 247.5 109.4 -49.3 489 520 A E H >> S+ 0 0 15 -9,-0.6 4,-1.6 2,-0.2 3,-1.3 0.975 113.4 59.0 -78.6 -67.8 247.4 112.2 -46.8 490 521 A S H 3> S+ 0 0 0 1,-0.3 4,-2.1 2,-0.2 5,-0.3 0.669 98.0 65.4 -37.5 -28.7 244.3 111.5 -44.8 491 522 A M H 3> S+ 0 0 4 -15,-0.2 4,-3.6 2,-0.2 -1,-0.3 0.973 108.2 35.7 -63.3 -54.8 245.7 108.2 -43.8 492 523 A I H S+ 0 0 19 -4,-1.9 4,-3.4 2,-0.2 5,-0.7 0.872 103.9 55.6 -42.9 -53.5 249.1 108.7 -36.3 497 528 A P H >5S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.964 117.5 35.3 -46.4 -61.2 246.9 110.3 -33.7 498 529 A F H X5S+ 0 0 6 -4,-1.0 4,-1.6 2,-0.2 -2,-0.2 0.951 121.8 52.2 -54.2 -51.6 245.2 107.0 -33.0 499 530 A S H >X5S+ 0 0 23 -4,-4.0 4,-1.7 1,-0.2 3,-1.1 0.970 116.4 32.3 -51.2 -71.6 248.5 105.3 -33.6 500 531 A L H 3X5S+ 0 0 13 -4,-3.4 4,-2.1 1,-0.3 5,-0.3 0.803 111.6 64.7 -63.2 -27.3 250.8 107.2 -31.3 501 532 A K H 3< S- 0 0 16 -3,-0.5 3,-3.2 -4,-0.3 4,-0.4 -0.430 76.2-124.7 -65.2 129.8 250.5 102.2 -22.6 507 538 A P G > S+ 0 0 62 0, 0.0 3,-1.7 0, 0.0 6,-0.5 0.762 110.0 64.0 -46.7 -30.9 250.9 102.1 -18.9 508 539 A I G 3 S+ 0 0 3 1,-0.3 -2,-0.1 5,-0.1 10,-0.1 0.787 96.3 61.1 -66.8 -21.8 254.5 101.1 -19.2 509 540 A C G < S+ 0 0 0 -3,-3.2 -1,-0.3 4,-0.1 -3,-0.1 0.563 86.3 100.2 -78.9 -9.5 255.1 104.4 -20.8 510 541 A S S <> S- 0 0 12 -3,-1.7 4,-3.1 -4,-0.4 3,-0.1 -0.328 84.7-118.7 -76.5 160.8 253.9 106.3 -17.7 511 542 A P T 4 S+ 0 0 62 0, 0.0 -1,-0.1 0, 0.0 -178,-0.0 0.956 114.5 61.0 -59.9 -48.4 256.4 107.8 -15.2 512 543 A E T 4 S+ 0 0 124 1,-0.2 3,-0.1 2,-0.1 -4,-0.1 0.842 119.3 23.8 -43.5 -48.5 254.9 105.4 -12.6 513 544 A Y T 4 S+ 0 0 114 -6,-0.5 2,-3.7 1,-0.1 5,-0.3 0.860 95.2 92.4 -90.6 -43.4 256.0 102.3 -14.6 514 545 A W < + 0 0 23 -4,-3.1 2,-0.3 -7,-0.3 -1,-0.1 -0.150 63.5 113.9 -56.1 56.1 258.9 103.5 -16.8 515 546 A K S > S- 0 0 95 -2,-3.7 4,-0.5 -3,-0.1 3,-0.3 -0.775 77.6-114.5-121.7 167.9 261.7 102.5 -14.3 516 547 A A T 4 S+ 0 0 25 -2,-0.3 9,-0.3 1,-0.2 8,-0.2 0.674 114.4 60.3 -78.6 -15.9 264.4 99.9 -14.4 517 548 A S T >4 S+ 0 0 91 3,-0.2 3,-1.9 1,-0.2 -1,-0.2 0.770 92.7 64.9 -81.1 -24.3 262.8 98.0 -11.5 518 549 A T T 34 S+ 0 0 32 -3,-0.3 -1,-0.2 -5,-0.3 -2,-0.2 0.819 113.6 34.0 -65.3 -27.4 259.6 97.5 -13.5 519 550 A F T 3< S- 0 0 0 -4,-0.5 5,-0.3 2,-0.2 -1,-0.3 -0.031 119.0-125.7-112.4 23.8 261.7 95.4 -15.9 520 551 A G S <> S+ 0 0 7 -3,-1.9 4,-0.5 4,-0.1 -3,-0.2 0.779 73.3 21.2 30.5 118.1 263.7 94.3 -12.9 521 552 A G H > S- 0 0 26 2,-0.1 4,-1.0 1,-0.1 -2,-0.2 0.006 91.5 -94.5 85.3 161.5 267.4 94.8 -13.4 522 553 A E H > S+ 0 0 109 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.746 120.7 70.4 -82.2 -24.7 269.1 97.3 -15.7 523 554 A V H > S+ 0 0 48 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.852 97.3 49.0 -59.0 -39.6 269.3 94.4 -18.2 524 555 A G H >X S+ 0 0 1 -4,-0.5 4,-1.7 -5,-0.3 3,-0.7 0.989 109.4 51.0 -63.7 -57.6 265.6 94.5 -18.7 525 556 A F H 3X S+ 0 0 13 -4,-1.0 4,-1.9 -9,-0.3 -2,-0.2 0.771 109.4 51.6 -49.8 -34.9 265.5 98.2 -19.3 526 557 A N H 3X S+ 0 0 72 -4,-1.9 4,-2.0 2,-0.2 -1,-0.3 0.875 102.4 58.3 -74.9 -34.6 268.2 98.0 -21.9 527 558 A L H << S+ 0 0 27 -4,-1.6 4,-0.4 -3,-0.7 -2,-0.2 0.936 112.0 42.6 -58.7 -42.8 266.5 95.3 -23.9 528 559 A V H >< S+ 0 0 0 -4,-1.7 3,-0.7 1,-0.2 -1,-0.2 0.908 114.2 50.1 -69.2 -42.0 263.5 97.6 -24.3 529 560 A K H 3< S+ 0 0 94 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.712 121.3 34.6 -69.5 -21.0 265.7 100.7 -25.0 530 561 A T T 3< S+ 0 0 70 -4,-2.0 -1,-0.2 -3,-0.1 -2,-0.2 0.223 81.8 138.2-120.4 16.6 267.7 98.8 -27.7 531 562 A A < + 0 0 4 -3,-0.7 2,-0.3 -4,-0.4 3,-0.1 -0.164 23.4 170.4 -59.6 157.3 265.2 96.4 -29.3 532 563 A T > - 0 0 40 1,-0.2 4,-2.4 -216,-0.0 5,-0.1 -0.967 45.2-119.2-160.7 162.6 265.2 96.0 -33.1 533 564 A L H > S+ 0 0 2 -2,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.977 117.6 53.6 -72.4 -54.6 263.7 93.9 -35.7 534 565 A K H > S+ 0 0 130 1,-0.3 4,-0.6 2,-0.2 -1,-0.2 0.757 115.0 42.4 -47.9 -29.0 267.1 92.6 -36.7 535 566 A K H > S+ 0 0 73 2,-0.1 4,-1.5 3,-0.1 5,-0.3 0.875 104.9 60.6 -87.9 -39.6 267.6 91.7 -33.1 536 567 A L H < S+ 0 0 4 -4,-2.4 4,-0.2 2,-0.1 -2,-0.2 0.867 118.7 33.3 -53.6 -36.1 264.2 90.2 -32.4 537 568 A V H >< S+ 0 0 1 -4,-2.2 3,-4.7 2,-0.1 -2,-0.1 0.900 116.8 44.3 -80.0 -91.8 265.0 87.7 -35.1 538 569 A e H 3< S+ 0 0 26 -4,-0.6 3,-0.5 1,-0.3 -3,-0.1 0.496 109.6 58.1 -32.4 -19.5 268.7 86.9 -35.2 539 570 A L T 3< S+ 0 0 79 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.1 0.706 111.7 42.9 -87.6 -21.6 269.0 86.5 -31.4 540 571 A N S < S+ 0 0 12 -3,-4.7 2,-0.3 -5,-0.3 -2,-0.2 -0.054 109.8 69.2-111.4 29.8 266.3 83.9 -31.6 541 572 A T S S- 0 0 23 -3,-0.5 3,-0.1 1,-0.1 -4,-0.0 -0.854 79.7-119.1-138.3 175.4 267.6 82.0 -34.6 542 573 A K S S+ 0 0 72 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.929 98.9 13.9 -78.9 -50.9 270.5 79.8 -35.7 543 574 A T S S- 0 0 96 -3,-0.1 -1,-0.3 0, 0.0 -3,-0.1 -0.891 78.1-113.7-128.8 157.9 271.6 82.2 -38.3 544 575 A e + 0 0 71 -2,-0.3 3,-0.1 -3,-0.1 -10,-0.0 -0.779 37.4 175.8 -95.0 102.5 271.0 85.8 -39.3 545 576 A P - 0 0 33 0, 0.0 2,-0.5 0, 0.0 -155,-0.1 0.476 49.0 -63.0 -75.5-140.1 269.2 86.0 -42.7 546 577 A Y + 0 0 56 -157,-0.3 2,-0.4 -156,-0.1 -150,-0.3 -0.980 59.8 173.6-118.8 121.9 268.0 89.4 -44.1 547 578 A V + 0 0 15 -2,-0.5 2,-0.3 -152,-0.1 -13,-0.2 -0.985 14.4 120.0-136.5 127.5 265.5 91.2 -42.1 548 579 A S - 0 0 14 -2,-0.4 -382,-0.2 -15,-0.1 -381,-0.1 -0.960 63.9-107.3-171.8 161.7 263.9 94.7 -42.5 549 580 A F S S+ 0 0 7 -2,-0.3 -385,-1.2 -383,-0.1 2,-0.3 0.351 103.2 45.3 -81.0 7.5 260.6 96.5 -43.0 550 581 A H B S-J 163 0H 81 -387,-0.3 -387,-0.3 -154,-0.1 -388,-0.1 -0.966 93.2 -93.0-146.2 162.6 261.7 97.2 -46.5 551 582 A V - 0 0 39 -389,-3.3 -154,-0.2 -2,-0.3 -2,-0.1 -0.370 42.8-115.4 -74.6 152.1 263.2 95.5 -49.5 552 583 A P 0 0 39 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 -0.330 360.0 360.0 -80.1 170.7 267.0 95.6 -50.0 553 584 A D 0 0 212 -2,-0.1 -2,-0.0 0, 0.0 0, 0.0 0.323 360.0 360.0 63.1 360.0 268.6 97.4 -53.0