==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 05-NOV-09 3A9S . COMPND 2 MOLECULE: D-ARABINOSE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS PALLIDUS; . AUTHOR K.TAKEDA,H.YOSHIDA,K.IZUMORI,S.KAMITORI . 1767 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 57394.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1243 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 152 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 151 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 134 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 177 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 540 30.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 1.5 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 5 3 1 9 8 2 4 0 1 8 3 0 0 0 0 3 0 0 6 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 3 4 5 9 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 PARALLEL BRIDGES PER LADDER . 6 5 7 12 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 6 3 3 3 0 0 3 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 A 0 0 21 0, 0.0 9,-2.9 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 143.5 -28.2 20.5 -11.1 2 3 A K B -A 9 0A 112 7,-0.3 7,-0.3 1,-0.1 5,-0.1 -0.497 360.0-115.7 -72.8 138.7 -27.2 17.6 -13.4 3 4 A D - 0 0 2 5,-2.1 -1,-0.1 3,-0.2 5,-0.1 -0.658 22.9-146.2 -74.3 124.8 -23.4 17.2 -13.8 4 5 A P S S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.662 90.2 22.3 -68.5 -16.0 -22.9 17.8 -17.6 5 6 A R S S+ 0 0 48 1,-0.1 2,-0.2 2,-0.1 292,-0.1 0.676 116.6 55.2-120.5 -30.6 -20.1 15.4 -18.0 6 7 A Y S S- 0 0 9 2,-0.1 -3,-0.2 1,-0.1 -1,-0.1 -0.700 88.7 -85.9-112.7 161.5 -20.3 12.8 -15.2 7 8 A V S S+ 0 0 116 -2,-0.2 -1,-0.1 171,-0.1 -2,-0.1 -0.294 90.9 7.8 -59.7 141.2 -22.9 10.4 -13.8 8 9 A G S S- 0 0 34 -5,-0.1 -5,-2.1 -4,-0.0 2,-0.2 -0.285 95.3 -50.8 86.6-169.7 -25.2 11.9 -11.3 9 10 A N B -A 2 0A 110 -7,-0.3 -7,-0.3 1,-0.1 3,-0.1 -0.698 56.7 -93.3-107.9 159.8 -25.9 15.5 -10.0 10 11 A L - 0 0 2 -9,-2.9 -1,-0.1 -2,-0.2 165,-0.0 -0.431 55.5 -92.1 -69.5 143.7 -23.5 18.1 -8.7 11 12 A P - 0 0 17 0, 0.0 47,-0.5 0, 0.0 2,-0.3 -0.252 41.2-149.1 -58.3 142.5 -23.1 18.2 -4.9 12 13 A K E -b 84 0B 35 71,-1.8 73,-3.1 67,-0.1 74,-1.1 -0.714 11.0-122.9-110.0 162.8 -25.4 20.4 -3.0 13 14 A I E -bc 86 59B 0 45,-2.3 47,-2.7 -2,-0.3 2,-0.4 -0.929 21.9-149.4-108.9 124.7 -24.8 22.3 0.3 14 15 A G E -bc 87 60B 0 72,-3.3 74,-2.7 -2,-0.5 2,-0.5 -0.799 3.8-153.9 -97.2 133.2 -27.2 21.5 3.2 15 16 A I E -bc 88 61B 0 45,-3.1 47,-1.9 -2,-0.4 74,-0.2 -0.923 4.3-161.1-109.6 123.2 -28.0 24.2 5.8 16 17 A R E -b 89 0B 5 72,-3.1 74,-2.6 -2,-0.5 2,-1.0 -0.864 2.4-160.0-107.2 103.1 -29.1 23.0 9.3 17 18 A P E -b 90 0B 0 0, 0.0 49,-3.3 0, 0.0 2,-0.3 -0.708 16.8-164.5 -84.4 103.3 -30.9 25.7 11.3 18 19 A T B +f 66 0C 0 72,-2.1 75,-0.3 -2,-1.0 2,-0.3 -0.625 10.5 177.2 -91.4 149.9 -30.5 24.6 14.9 19 20 A I - 0 0 0 47,-2.6 77,-0.5 -2,-0.3 2,-0.3 -0.933 39.5 -85.5-146.1 164.8 -32.6 25.9 17.7 20 21 A D - 0 0 0 -2,-0.3 75,-0.1 75,-0.2 10,-0.1 -0.586 36.5-143.9 -70.5 130.3 -33.4 25.7 21.5 21 22 A G + 0 0 22 46,-0.4 2,-0.2 -2,-0.3 -1,-0.1 0.669 64.5 111.7 -73.4 -16.0 -36.0 22.9 21.8 22 23 A R > - 0 0 2 1,-0.1 5,-3.0 2,-0.1 6,-0.2 -0.385 46.0-172.4 -63.6 125.3 -37.9 24.6 24.6 23 24 A R T > 5 + 0 0 129 3,-0.2 3,-1.2 -2,-0.2 4,-0.1 0.167 54.6 90.5 -92.1-144.5 -41.3 25.9 23.7 24 25 A K T 3 5S- 0 0 147 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.765 126.4 -37.2 61.1 22.3 -43.4 28.0 26.1 25 26 A G T 3>5S+ 0 0 25 -3,-0.1 4,-1.5 1597,-0.0 -1,-0.3 -0.156 126.2 80.4 127.1 -45.4 -41.8 31.0 24.5 26 27 A V H <>5S+ 0 0 0 -3,-1.2 4,-0.6 1596,-0.3 3,-0.5 0.991 100.7 34.2 -62.2 -66.8 -38.1 30.4 23.7 27 28 A R H >> S+ 0 0 146 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.951 114.4 44.0 -62.7 -51.3 -37.8 33.3 12.3 33 34 A T H > S+ 0 0 39 -4,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.876 114.2 51.3 -61.7 -39.0 -34.4 34.6 13.1 34 35 A T H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.917 111.7 45.1 -66.6 -44.7 -32.9 31.1 12.8 35 36 A M H X S+ 0 0 33 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.868 108.9 58.4 -66.4 -34.9 -34.4 30.4 9.4 36 37 A N H X S+ 0 0 61 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.852 104.1 51.7 -62.1 -35.4 -33.3 33.9 8.3 37 38 A M H X S+ 0 0 12 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.929 109.4 49.8 -65.5 -45.6 -29.7 32.9 9.2 38 39 A A H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.911 112.3 47.3 -59.1 -44.3 -30.0 29.8 7.0 39 40 A K H X S+ 0 0 110 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.864 109.0 54.3 -66.5 -37.3 -31.4 31.8 4.1 40 41 A A H X S+ 0 0 21 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.901 110.1 46.6 -64.3 -42.1 -28.7 34.4 4.5 41 42 A V H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.3 0.918 111.0 52.0 -66.5 -42.9 -26.0 31.8 4.2 42 43 A A H X S+ 0 0 8 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.935 111.4 47.7 -58.7 -45.4 -27.7 30.1 1.2 43 44 A K H X S+ 0 0 119 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.932 111.4 50.5 -61.1 -47.1 -27.8 33.5 -0.5 44 45 A L H X S+ 0 0 12 -4,-2.4 4,-0.7 1,-0.2 3,-0.3 0.922 113.6 44.3 -58.0 -47.0 -24.2 34.2 0.2 45 46 A L H >X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 3,-0.7 0.891 109.3 55.5 -67.9 -38.5 -23.0 30.9 -1.1 46 47 A E H 3< S+ 0 0 80 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.769 111.9 45.2 -65.4 -23.5 -25.2 31.0 -4.2 47 48 A E H 3< S+ 0 0 104 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.576 125.6 29.3 -95.5 -9.8 -23.6 34.4 -5.1 48 49 A N H << S+ 0 0 66 -4,-0.7 2,-0.5 -3,-0.7 -2,-0.2 0.590 108.0 63.9-125.0 -16.3 -20.0 33.3 -4.4 49 50 A V < - 0 0 2 -4,-3.0 8,-2.8 -5,-0.1 2,-0.3 -0.960 59.7-179.8-118.7 125.0 -19.6 29.6 -5.0 50 51 A F B -G 56 0D 72 -2,-0.5 5,-0.1 6,-0.3 -3,-0.0 -0.930 27.3-116.9-127.0 149.0 -20.1 28.1 -8.5 51 52 A Y > - 0 0 1 4,-3.2 3,-2.2 -2,-0.3 6,-0.1 -0.233 47.4 -93.4 -70.4 168.5 -19.9 24.6 -10.0 52 53 A Y T 3 S+ 0 0 12 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.696 126.2 56.1 -60.7 -18.0 -17.3 24.0 -12.7 53 54 A N T 3 S- 0 0 32 2,-0.1 -1,-0.3 366,-0.1 -2,-0.1 0.265 121.6-103.1 -97.1 10.6 -19.8 24.9 -15.4 54 55 A G S < S+ 0 0 21 -3,-2.2 -2,-0.1 1,-0.3 3,-0.1 0.322 78.1 134.5 88.6 -10.6 -20.5 28.3 -14.0 55 56 A Q - 0 0 82 1,-0.1 -4,-3.2 -5,-0.1 -1,-0.3 -0.512 64.1-106.1 -72.1 140.0 -23.9 27.4 -12.4 56 57 A P B -G 50 0D 62 0, 0.0 -6,-0.3 0, 0.0 -10,-0.1 -0.372 41.3 -96.9 -66.5 146.1 -24.3 28.7 -8.9 57 58 A V - 0 0 2 -8,-2.8 2,-0.4 -12,-0.4 -45,-0.1 -0.260 39.9-128.2 -59.2 149.0 -24.0 26.1 -6.1 58 59 A E - 0 0 66 -47,-0.5 -45,-2.3 -3,-0.1 2,-0.3 -0.879 20.8-157.9-106.8 135.9 -27.4 24.8 -4.9 59 60 A C E -c 13 0B 26 -2,-0.4 2,-0.4 -47,-0.2 -45,-0.2 -0.807 6.6-155.6-112.6 153.7 -28.3 24.8 -1.3 60 61 A V E -c 14 0B 10 -47,-2.7 -45,-3.1 -2,-0.3 2,-0.4 -0.996 9.9-158.0-127.7 124.2 -30.9 22.7 0.6 61 62 A I E -c 15 0B 38 -2,-0.4 -45,-0.2 -47,-0.2 -47,-0.0 -0.843 30.0-102.2-104.6 142.5 -32.3 24.0 3.9 62 63 A A - 0 0 6 -47,-1.9 13,-0.1 -2,-0.4 -1,-0.1 -0.222 28.3-121.1 -57.3 151.1 -33.9 21.7 6.5 63 64 A D S S+ 0 0 123 8,-0.1 2,-0.3 11,-0.1 -1,-0.1 0.726 92.5 16.0 -68.3 -23.1 -37.7 21.7 6.5 64 65 A T S S- 0 0 59 7,-0.2 2,-0.1 -47,-0.0 -2,-0.1 -0.911 93.7 -87.2-142.0 167.4 -37.8 22.8 10.1 65 66 A C - 0 0 4 -2,-0.3 2,-0.7 -49,-0.1 -47,-0.2 -0.456 47.6-120.3 -71.6 155.1 -35.5 24.2 12.7 66 67 A I B +f 18 0C 0 -49,-3.3 -47,-2.6 1,-0.1 -45,-0.1 -0.869 49.7 149.0-106.7 106.2 -33.5 21.5 14.5 67 68 A G + 0 0 4 -2,-0.7 -46,-0.4 -49,-0.2 2,-0.3 0.415 67.9 6.0-113.7 -0.6 -34.1 21.4 18.2 68 69 A G S > S- 0 0 12 31,-0.1 4,-1.7 -48,-0.1 5,-0.1 -0.939 88.5 -76.3-163.6-176.2 -33.7 17.7 18.9 69 70 A V H > S+ 0 0 104 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.828 119.0 58.0 -65.5 -35.4 -32.8 14.3 17.4 70 71 A K H > S+ 0 0 145 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.950 112.1 41.0 -61.0 -48.6 -36.0 13.8 15.6 71 72 A E H > S+ 0 0 43 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.815 112.6 55.6 -69.8 -29.6 -35.6 17.0 13.6 72 73 A A H X S+ 0 0 8 -4,-1.7 4,-2.4 27,-0.3 -2,-0.2 0.921 108.9 47.6 -67.8 -41.3 -31.9 16.2 13.1 73 74 A A H X S+ 0 0 58 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.896 109.5 53.7 -65.5 -38.8 -32.8 12.8 11.6 74 75 A E H X S+ 0 0 107 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.900 109.0 48.6 -62.4 -40.7 -35.4 14.5 9.4 75 76 A A H X S+ 0 0 3 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.933 110.1 51.3 -64.9 -45.4 -32.7 16.9 8.1 76 77 A A H X S+ 0 0 54 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.908 111.4 48.8 -57.2 -43.2 -30.3 14.0 7.5 77 78 A E H X S+ 0 0 96 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.922 112.5 46.3 -63.4 -46.5 -33.0 12.2 5.5 78 79 A K H X S+ 0 0 52 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.910 113.1 49.9 -63.9 -42.7 -33.9 15.3 3.4 79 80 A F H X>S+ 0 0 10 -4,-2.8 5,-2.7 1,-0.2 4,-0.7 0.881 109.2 51.6 -64.2 -38.7 -30.2 16.0 2.7 80 81 A A H ><5S+ 0 0 55 -4,-2.2 3,-0.5 -5,-0.2 -1,-0.2 0.905 113.6 44.1 -65.3 -40.6 -29.6 12.4 1.6 81 82 A R H 3<5S+ 0 0 175 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.770 113.4 51.0 -75.9 -24.8 -32.5 12.5 -0.8 82 83 A E H 3<5S- 0 0 85 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.479 115.6-110.8 -90.7 -4.0 -31.6 15.9 -2.2 83 84 A G T <<5 + 0 0 42 -4,-0.7 -71,-1.8 -3,-0.5 2,-0.3 0.883 49.7 176.2 78.0 39.9 -28.0 15.0 -2.9 84 85 A V E < +b 12 0B 22 -5,-2.7 -71,-0.2 -73,-0.2 -1,-0.2 -0.610 14.3 170.4 -79.3 134.0 -26.3 17.1 -0.2 85 86 A G E + 0 0 16 -73,-3.1 2,-0.3 -2,-0.3 -72,-0.2 0.360 65.5 40.9-124.5 2.3 -22.5 16.6 0.0 86 87 A V E -b 13 0B 0 -74,-1.1 -72,-3.3 21,-0.2 2,-0.4 -0.986 68.6-156.6-148.6 139.7 -21.5 19.5 2.4 87 88 A S E -bd 14 109B 0 21,-2.6 23,-1.9 -2,-0.3 2,-0.4 -0.963 9.5-173.9-129.7 144.2 -23.3 20.7 5.5 88 89 A I E -bd 15 110B 0 -74,-2.7 -72,-3.1 -2,-0.4 2,-0.4 -0.993 12.0-154.3-133.1 124.4 -23.4 23.9 7.5 89 90 A T E -bd 16 111B 0 21,-2.7 23,-3.3 -2,-0.4 2,-0.4 -0.813 14.9-173.6 -98.5 138.2 -25.1 24.4 10.8 90 91 A V E +bd 17 112B 0 -74,-2.6 -72,-2.1 -2,-0.4 23,-0.2 -0.987 10.7 156.2-133.3 143.3 -26.3 27.8 11.8 91 92 A T E - 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0 0 24 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 -0.575 43.9-169.8 -71.4 101.7 -16.0 11.5 -34.5 228 229 A K H > S+ 0 0 123 -2,-1.0 4,-2.1 1,-0.2 -1,-0.2 0.851 84.3 53.2 -63.4 -35.7 -14.7 11.8 -38.1 229 230 A E H > S+ 0 0 149 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.912 111.8 45.3 -66.7 -40.5 -16.8 15.0 -38.7 230 231 A E H > S+ 0 0 7 1,-0.2 4,-3.1 2,-0.2 -2,-0.2 0.909 108.9 58.0 -67.4 -40.3 -15.3 16.6 -35.6 231 232 A Y H X S+ 0 0 13 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.921 106.2 48.1 -54.1 -47.7 -11.9 15.4 -36.6 232 233 A E H X S+ 0 0 113 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.899 113.2 47.6 -61.5 -41.6 -12.1 17.3 -39.9 233 234 A R H X S+ 0 0 120 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.895 112.6 50.3 -66.0 -39.6 -13.3 20.4 -38.1 234 235 A A H X S+ 0 0 0 -4,-3.1 4,-2.6 2,-0.2 -2,-0.2 0.920 109.2 49.5 -64.6 -45.8 -10.5 20.1 -35.6 235 236 A L H X S+ 0 0 19 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.907 112.7 48.0 -61.2 -41.4 -7.8 19.6 -38.2 236 237 A K H X S+ 0 0 123 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.920 111.2 50.5 -64.6 -44.1 -9.0 22.7 -40.0 237 238 A W H X S+ 0 0 43 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.897 110.6 50.4 -60.3 -42.6 -9.2 24.7 -36.8 238 239 A V H X S+ 0 0 1 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.940 108.7 50.1 -62.2 -49.2 -5.6 23.7 -36.0 239 240 A K H < S+ 0 0 102 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.827 117.1 42.6 -60.2 -31.0 -4.3 24.7 -39.4 240 241 A E H < S+ 0 0 119 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.806 128.7 23.2 -86.5 -31.0 -6.0 28.1 -39.1 241 242 A N H < S+ 0 0 57 -4,-2.4 2,-0.9 -5,-0.2 -3,-0.2 0.655 102.5 78.0-112.4 -19.5 -5.1 28.9 -35.4 242 243 A C < - 0 0 10 -4,-2.9 2,-0.3 -5,-0.3 -1,-0.1 -0.809 68.4-151.4 -99.7 102.1 -2.1 26.9 -34.4 243 244 A K - 0 0 93 -2,-0.9 193,-3.2 191,-0.4 2,-0.5 -0.521 10.7-133.6 -73.9 131.0 1.1 28.6 -35.7 244 245 A V B -k 436 0F 82 -2,-0.3 193,-0.2 191,-0.2 3,-0.1 -0.743 22.7-155.0 -88.2 123.8 4.0 26.3 -36.4 245 246 A G - 0 0 8 191,-2.3 -1,-0.0 -2,-0.5 256,-0.0 -0.254 36.0 -57.7 -88.7-179.9 7.3 27.6 -35.1 246 247 A P - 0 0 77 0, 0.0 2,-0.7 0, 0.0 -1,-0.2 -0.181 50.3-119.0 -58.4 147.8 10.9 26.9 -36.2 247 248 A D - 0 0 28 1,-0.1 192,-0.1 190,-0.1 7,-0.1 -0.814 24.0-172.5 -91.9 116.8 12.2 23.3 -36.3 248 249 A N + 0 0 79 -2,-0.7 2,-0.2 190,-0.4 -1,-0.1 0.537 51.0 111.0 -86.8 -7.7 15.2 23.0 -33.9 249 250 A N S S- 0 0 15 189,-0.1 2,-0.6 4,-0.1 5,-0.1 -0.508 74.1-123.3 -67.5 130.9 16.0 19.5 -35.0 250 251 A R > - 0 0 202 -2,-0.2 3,-3.0 1,-0.1 4,-0.2 -0.706 37.3 -91.3 -85.4 119.5 19.3 19.5 -36.9 251 252 A D G > S+ 0 0 138 -2,-0.6 3,-1.3 1,-0.3 -1,-0.1 0.299 126.4 57.4 14.2 -65.4 19.0 18.1 -40.4 252 253 A G G 3 S+ 0 0 77 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.724 115.9 37.0 -56.3 -22.5 19.9 14.6 -39.3 253 254 A F G < S+ 0 0 85 -3,-3.0 -1,-0.3 2,-0.1 188,-0.2 0.398 89.9 118.2-110.1 -0.1 17.0 14.6 -36.9 254 255 A K < - 0 0 88 -3,-1.3 2,-0.2 -4,-0.2 186,-0.0 -0.485 57.6-135.9 -73.2 135.0 14.4 16.5 -38.9 255 256 A R - 0 0 48 -2,-0.2 -2,-0.1 1,-0.1 -1,-0.1 -0.577 28.6-103.5 -86.8 152.7 11.2 14.8 -39.9 256 257 A T > - 0 0 76 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.131 27.3-106.1 -71.3 169.5 9.9 15.1 -43.5 257 258 A E H > S+ 0 0 177 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.892 122.4 50.9 -62.3 -40.4 7.0 17.3 -44.6 258 259 A E H > S+ 0 0 163 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.918 110.5 48.1 -64.3 -44.4 4.8 14.2 -45.0 259 260 A Q H > S+ 0 0 74 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.930 108.8 54.1 -62.0 -45.4 5.7 13.0 -41.5 260 261 A K H X S+ 0 0 55 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.831 108.4 49.3 -59.2 -34.1 4.9 16.4 -40.0 261 262 A E H X S+ 0 0 64 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.909 112.3 47.2 -71.6 -41.3 1.5 16.5 -41.6 262 263 A K H X S+ 0 0 110 -4,-2.0 4,-2.8 1,-0.2 5,-0.3 0.869 105.6 60.8 -66.3 -35.2 0.7 13.0 -40.3 263 264 A D H X S+ 0 0 4 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.886 106.8 45.9 -58.1 -39.8 2.0 14.1 -36.9 264 265 A W H X S+ 0 0 11 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.922 111.8 50.3 -69.0 -45.7 -0.7 16.8 -36.8 265 266 A E H X S+ 0 0 54 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.924 115.6 41.8 -59.2 -47.1 -3.4 14.4 -37.9 266 267 A I H X S+ 0 0 9 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.880 111.1 56.6 -69.1 -38.0 -2.5 11.8 -35.3 267 268 A S H X S+ 0 0 0 -4,-2.0 4,-1.4 -5,-0.3 -2,-0.2 0.894 110.1 45.6 -60.2 -40.2 -2.0 14.5 -32.6 268 269 A V H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.922 111.6 50.9 -69.0 -44.6 -5.6 15.7 -33.2 269 270 A K H X S+ 0 0 28 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.877 106.4 56.5 -61.0 -36.5 -7.0 12.2 -33.2 270 271 A M H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.895 105.2 51.7 -61.8 -39.9 -5.2 11.5 -29.9 271 272 A A H X S+ 0 0 3 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.928 111.5 46.2 -62.4 -45.8 -7.0 14.5 -28.4 272 273 A L H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.927 114.0 48.2 -62.5 -46.3 -10.4 13.2 -29.5 273 274 A I H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.912 110.6 50.6 -62.2 -45.5 -9.7 9.7 -28.3 274 275 A A H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.935 113.5 45.0 -59.6 -47.3 -8.4 10.9 -24.9 275 276 A R H X S+ 0 0 22 -4,-2.1 4,-2.5 1,-0.2 5,-0.4 0.921 111.5 52.8 -63.3 -43.7 -11.5 13.0 -24.3 276 277 A D H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.856 108.6 51.5 -60.3 -35.5 -13.8 10.2 -25.5 277 278 A L H < S+ 0 0 3 -4,-2.2 19,-2.5 -5,-0.2 -1,-0.2 0.893 111.9 46.8 -68.1 -39.6 -12.2 7.9 -23.0 278 279 A M H < S+ 0 0 0 -4,-1.9 20,-2.5 17,-0.2 -2,-0.2 0.935 134.8 6.2 -69.6 -47.7 -12.7 10.3 -20.1 279 280 A V H < S- 0 0 33 -4,-2.5 -3,-0.2 1,-0.3 -2,-0.2 0.336 98.5-123.4-122.5 7.6 -16.3 11.3 -20.7 280 281 A G < - 0 0 10 -4,-1.8 -1,-0.3 -5,-0.4 2,-0.2 -0.103 16.9-117.6 76.6 179.8 -17.6 9.1 -23.5 281 282 A N >> - 0 0 31 12,-1.9 3,-1.6 11,-0.1 4,-0.7 -0.760 4.2-151.8-164.4 113.0 -19.2 10.2 -26.7 282 283 A K H >> S+ 0 0 121 1,-0.3 4,-1.6 -2,-0.2 3,-0.7 0.798 96.6 68.8 -55.4 -30.4 -22.8 9.5 -27.9 283 284 A K H 3> S+ 0 0 64 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.847 92.2 58.7 -58.8 -34.9 -21.4 9.7 -31.5 284 285 A L H <4>S+ 0 0 0 -3,-1.6 5,-2.8 1,-0.2 4,-0.3 0.850 102.0 53.7 -64.8 -33.9 -19.5 6.5 -31.0 285 286 A E H X<5S+ 0 0 102 -4,-0.7 3,-1.6 -3,-0.7 5,-0.3 0.928 106.3 51.7 -65.8 -43.0 -22.8 4.7 -30.2 286 287 A E H 3<5S+ 0 0 121 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.804 107.1 55.7 -62.4 -28.3 -24.3 5.9 -33.4 287 288 A M T 3<5S- 0 0 72 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.477 127.3 -97.2 -83.6 -4.4 -21.2 4.5 -35.2 288 289 A G T < 5S+ 0 0 62 -3,-1.6 2,-0.2 -4,-0.3 -3,-0.2 0.670 95.5 111.1 96.6 18.4 -21.6 1.0 -33.8 289 290 A Y >< + 0 0 60 -5,-2.8 4,-1.8 1,-0.1 -3,-0.1 -0.551 30.6 158.4-123.0 65.7 -19.2 1.3 -30.8 290 291 A G H > S+ 0 0 36 -5,-0.3 4,-0.6 -2,-0.2 -5,-0.2 0.813 71.4 50.0 -59.1 -38.6 -21.6 1.3 -27.9 291 292 A E H >> S+ 0 0 157 1,-0.2 3,-1.3 2,-0.2 4,-0.6 0.950 112.1 47.4 -67.6 -47.5 -19.1 0.2 -25.2 292 293 A E H >4 S+ 0 0 24 1,-0.3 3,-0.6 2,-0.2 -2,-0.2 0.818 102.3 66.5 -61.9 -30.6 -16.6 2.8 -26.2 293 294 A A H 3< S+ 0 0 13 -4,-1.8 -12,-1.9 1,-0.2 -1,-0.3 0.755 89.7 66.8 -63.3 -24.5 -19.4 5.4 -26.2 294 295 A L H << S- 0 0 138 -3,-1.3 3,-0.3 -4,-0.6 -1,-0.2 0.883 87.4-158.0 -66.9 -40.6 -19.8 5.0 -22.5 295 296 A G << - 0 0 22 -3,-0.6 -17,-0.2 -4,-0.6 -18,-0.2 -0.176 31.2 -86.4 83.7 176.1 -16.5 6.5 -21.4 296 297 A R - 0 0 72 -19,-2.5 -1,-0.2 -20,-0.1 -17,-0.1 0.176 48.7-120.7-110.1 16.3 -14.7 5.8 -18.1 297 298 A N + 0 0 40 -3,-0.3 -117,-2.3 1,-0.2 2,-0.6 0.873 53.0 169.3 45.8 48.1 -16.4 8.6 -16.1 298 299 A A E -i 180 0E 0 -20,-2.5 -1,-0.2 -21,-0.2 -117,-0.2 -0.801 33.9-175.4 -98.7 121.1 -13.0 10.2 -15.4 299 300 A I E S+ 0 0 8 -119,-1.4 38,-0.5 -2,-0.6 2,-0.3 0.543 84.8 17.7 -86.4 -7.9 -12.7 13.6 -13.8 300 301 A V E S+ij 181 337E 0 -120,-1.1 -118,-2.0 36,-0.1 2,-0.3 -0.973 71.1 169.3-158.9 148.1 -9.0 13.3 -14.3 301 302 A A E -ij 182 338E 0 36,-1.7 38,-3.2 -2,-0.3 2,-0.3 -0.937 15.8-144.8-152.8 173.7 -6.7 11.1 -16.4 302 303 A G E -ij 183 339E 0 -120,-2.0 -118,-2.0 -2,-0.3 2,-0.5 -0.979 6.1-144.9-146.4 157.0 -3.1 10.7 -17.5 303 304 A F E -ij 184 340E 0 36,-2.3 39,-1.2 -2,-0.3 38,-0.6 -0.984 6.9-153.7-127.3 119.9 -1.1 9.6 -20.6 304 305 A Q + 0 0 8 -120,-2.7 2,-1.0 -2,-0.5 37,-0.2 0.958 32.6 158.6 -56.2 -57.9 2.2 7.7 -20.2 305 306 A G >> + 0 0 4 -121,-0.2 4,-2.0 36,-0.1 5,-0.8 -0.570 33.9 93.0 72.7-103.0 3.6 8.7 -23.5 306 307 A Q T 45S+ 0 0 13 -2,-1.0 -117,-0.2 -3,-0.2 2,-0.1 -0.441 88.2 5.2 -69.1 142.2 7.4 8.3 -23.1 307 308 A R T >5S+ 0 0 41 -119,-0.2 4,-1.6 -2,-0.1 -1,-0.2 -0.905 130.4 32.4 -98.2 -29.9 9.0 6.0 -23.7 308 309 A Q T 45S+ 0 0 130 1,-0.2 4,-0.2 2,-0.2 -2,-0.2 0.868 124.4 36.6 -51.3 -51.5 6.8 3.4 -25.4 309 310 A W T >X5S+ 0 0 7 -4,-2.0 4,-3.3 1,-0.2 3,-1.5 0.944 118.1 48.6 -70.5 -48.6 4.4 5.6 -27.3 310 311 A T T 34 S+ 0 0 3 1,-0.2 4,-3.1 2,-0.1 5,-0.3 0.283 83.7 108.4 -87.7 12.8 1.2 13.7 -26.4 317 318 A D H > S+ 0 0 4 2,-0.2 4,-1.9 1,-0.2 83,-0.3 0.916 82.5 41.5 -55.9 -49.5 2.1 17.3 -26.3 318 319 A F H > S+ 0 0 2 -3,-0.4 4,-3.2 2,-0.2 5,-0.3 0.952 116.7 48.4 -65.1 -48.3 -0.8 18.7 -28.3 319 320 A M H > S+ 0 0 0 -4,-0.3 4,-2.4 1,-0.2 5,-0.3 0.933 115.3 44.7 -55.4 -49.1 -3.3 16.4 -26.7 320 321 A E H X S+ 0 0 8 -4,-3.1 4,-1.0 2,-0.2 -1,-0.2 0.812 115.1 50.0 -67.3 -29.6 -2.1 17.3 -23.2 321 322 A T H X S+ 0 0 1 -4,-1.9 4,-0.7 -5,-0.3 81,-0.5 0.968 115.1 39.9 -72.4 -53.7 -2.0 21.0 -24.2 322 323 A I H >< S+ 0 0 3 -4,-3.2 3,-0.8 1,-0.2 5,-0.3 0.885 111.4 54.9 -66.8 -41.3 -5.5 21.2 -25.7 323 324 A L H 3< S+ 0 0 4 -4,-2.4 13,-2.4 -5,-0.3 -1,-0.2 0.920 110.7 46.5 -60.1 -42.6 -7.4 19.0 -23.2 324 325 A N H 3< S+ 0 0 5 -4,-1.0 -1,-0.2 -5,-0.3 37,-0.2 0.605 97.6 94.6 -75.2 -12.2 -6.1 21.2 -20.3 325 326 A S S << S- 0 0 0 -3,-0.8 11,-0.2 -4,-0.7 76,-0.1 -0.330 82.0-123.6 -77.2 164.1 -7.0 24.4 -22.1 326 327 A S S S+ 0 0 0 9,-0.1 7,-2.2 6,-0.1 2,-0.3 0.161 89.1 28.0 -92.5 17.6 -10.3 26.3 -21.6 327 328 A F E +M 332 0G 2 -5,-0.3 2,-0.2 5,-0.3 5,-0.2 -0.984 55.2 157.6-169.1 160.1 -11.1 26.1 -25.3 328 329 A D E > -M 331 0G 9 3,-1.3 3,-2.4 -2,-0.3 -5,-0.0 -0.843 66.2 -46.4-162.9-161.3 -10.6 24.3 -28.6 329 330 A W T 3 S+ 0 0 22 1,-0.3 3,-0.1 -2,-0.2 -93,-0.0 0.629 132.3 54.9 -59.9 -14.8 -12.2 23.8 -32.0 330 331 A N T 3 S- 0 0 79 1,-0.4 -1,-0.3 -96,-0.0 2,-0.2 0.346 117.6-108.7 -99.9 4.9 -15.6 23.4 -30.4 331 332 A G E < -M 328 0G 31 -3,-2.4 -3,-1.3 2,-0.0 -1,-0.4 -0.526 63.2 -13.8 102.2-171.0 -15.3 26.7 -28.5 332 333 A K E S+M 327 0G 80 -5,-0.2 -5,-0.3 -2,-0.2 2,-0.3 -0.384 72.0 150.4 -68.6 145.9 -14.8 27.6 -24.9 333 334 A R - 0 0 27 -7,-2.2 86,-0.1 -2,-0.1 -2,-0.0 -0.981 50.2 -75.5-166.4 166.6 -15.3 24.8 -22.4 334 335 A A - 0 0 3 -2,-0.3 -9,-0.1 1,-0.1 25,-0.1 -0.405 58.6-105.9 -69.2 146.4 -14.2 23.5 -19.0 335 336 A P - 0 0 3 0, 0.0 2,-0.6 0, 0.0 -11,-0.2 -0.229 18.4-131.1 -68.1 165.9 -10.7 21.9 -19.1 336 337 A Y - 0 0 23 -13,-2.4 2,-0.5 -11,-0.2 -36,-0.1 -0.982 28.7-126.8-117.1 108.4 -10.2 18.1 -18.9 337 338 A I E +j 300 0E 2 -2,-0.6 -36,-1.7 -38,-0.5 2,-0.4 -0.455 40.8 173.8 -63.5 113.7 -7.6 17.7 -16.2 338 339 A F E -j 301 0E 0 -2,-0.5 2,-0.4 -38,-0.2 -36,-0.2 -0.973 22.2-140.8-134.0 121.3 -5.0 15.6 -18.0 339 340 A A E > -j 302 0E 0 -38,-3.2 -36,-2.3 -2,-0.4 3,-1.1 -0.648 11.2-134.4 -89.9 129.9 -1.6 14.5 -16.7 340 341 A T E > S+j 303 0E 5 -2,-0.4 3,-1.9 1,-0.2 6,-0.1 -0.428 93.7 15.0 -71.3 150.3 1.6 14.4 -18.7 341 342 A E T 3 S- 0 0 11 -38,-0.6 -153,-0.5 1,-0.3 -37,-0.3 0.723 122.5 -84.4 53.3 26.3 3.7 11.2 -18.2 342 343 A N T < S+ 0 0 0 -39,-1.2 2,-1.7 -3,-1.1 -1,-0.3 0.791 74.2 167.2 48.6 33.0 0.7 9.6 -16.5 343 344 A D X> - 0 0 0 -3,-1.9 4,-2.0 -40,-0.2 3,-0.6 -0.604 12.0-177.5 -77.3 88.2 1.8 11.4 -13.3 344 345 A N H 3> S+ 0 0 1 -2,-1.7 4,-2.2 -151,-1.0 -1,-0.2 0.805 77.5 57.6 -61.9 -29.2 -1.5 10.7 -11.4 345 346 A L H 3> S+ 0 0 2 -152,-1.2 4,-1.8 2,-0.2 121,-0.5 0.852 108.7 44.7 -71.6 -32.3 -0.2 12.6 -8.4 346 347 A N H <> S+ 0 0 0 -3,-0.6 4,-2.6 2,-0.2 -2,-0.2 0.846 110.1 57.7 -76.7 -30.5 0.4 15.8 -10.4 347 348 A G H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.917 109.3 43.4 -61.7 -42.8 -3.0 15.1 -12.0 348 349 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.867 110.2 55.8 -70.8 -35.3 -4.6 15.2 -8.5 349 350 A S H X S+ 0 0 0 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.922 111.9 44.4 -60.7 -42.4 -2.5 18.3 -7.6 350 351 A M H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.904 110.7 54.4 -67.2 -42.1 -4.0 19.9 -10.7 351 352 A L H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.888 104.6 53.8 -61.2 -41.0 -7.5 18.7 -9.9 352 353 A F H X S+ 0 0 2 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.953 113.2 43.0 -57.8 -50.6 -7.4 20.2 -6.4 353 354 A G H X S+ 0 0 0 -4,-1.6 4,-0.9 1,-0.2 6,-0.4 0.890 114.8 50.5 -63.4 -40.6 -6.6 23.6 -7.8 354 355 A Y H >X S+ 0 0 7 -4,-2.7 4,-3.9 1,-0.2 3,-0.9 0.943 108.9 49.3 -63.5 -49.6 -9.1 23.2 -10.6 355 356 A L H 3< S+ 0 0 15 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.720 112.9 49.2 -65.3 -19.0 -12.0 22.3 -8.4 356 357 A L H 3< S+ 0 0 8 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.625 129.6 18.0 -92.6 -14.3 -11.2 25.2 -6.1 357 358 A T H << S- 0 0 29 -3,-0.9 -2,-0.2 -4,-0.9 -3,-0.2 0.588 84.4-132.2-129.9 -21.1 -11.0 27.8 -8.9 358 359 A N < + 0 0 13 -4,-3.9 61,-0.6 1,-0.3 2,-0.3 0.620 69.1 124.7 69.5 15.0 -12.7 26.4 -12.1 359 360 A T S S- 0 0 6 -6,-0.4 -1,-0.3 -5,-0.3 -2,-0.2 -0.786 71.3 -94.4-109.2 150.8 -9.6 27.6 -13.9 360 361 A A - 0 0 1 57,-0.4 176,-0.4 -2,-0.3 2,-0.4 -0.280 41.2-139.5 -58.9 142.5 -7.2 25.6 -16.2 361 362 A Q - 0 0 2 -37,-0.2 2,-0.6 174,-0.1 40,-0.4 -0.855 6.8-129.0-110.7 142.4 -4.1 24.3 -14.3 362 363 A I E -N 534 0H 7 172,-2.8 172,-2.5 -2,-0.4 2,-0.4 -0.802 11.2-150.7 -98.0 119.5 -0.5 24.3 -15.6 363 364 A F E +N 533 0H 4 -2,-0.6 33,-0.5 170,-0.2 2,-0.3 -0.683 31.8 169.4 -81.0 132.5 1.5 21.0 -15.5 364 365 A A E -N 532 0H 2 168,-2.1 168,-2.0 -2,-0.4 2,-0.4 -0.994 38.3-126.8-150.2 156.2 5.2 21.8 -15.2 365 366 A D E -N 531 0H 6 -2,-0.3 30,-2.1 166,-0.2 2,-1.6 -0.783 28.1-129.8 -93.6 142.2 8.7 20.5 -14.5 366 367 A V E +O 394 0H 9 164,-2.5 28,-0.2 -2,-0.4 350,-0.1 -0.772 48.6 165.6 -91.6 87.8 10.6 22.2 -11.7 367 368 A R E + 0 0 3 26,-1.7 345,-0.4 -2,-1.6 2,-0.3 0.922 43.1 1.8 -77.2 -52.2 13.5 22.6 -14.1 368 369 A T E -O 393 0H 0 25,-1.0 25,-3.2 -3,-0.2 2,-0.6 -0.997 46.1-144.9-148.4 140.4 16.1 25.1 -12.8 369 370 A Y E -O 392 0H 17 -2,-0.3 2,-0.7 23,-0.2 23,-0.2 -0.926 24.2-159.7-100.0 121.3 16.8 27.4 -9.9 370 371 A W E -O 391 0H 0 21,-3.1 21,-2.1 -2,-0.6 366,-0.1 -0.896 5.2-158.3-106.8 107.2 18.5 30.5 -11.3 371 372 A S > - 0 0 4 -2,-0.7 4,-2.5 364,-0.4 5,-0.2 -0.360 30.8-112.1 -78.1 160.5 20.4 32.4 -8.6 372 373 A P H > S+ 0 0 48 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.919 120.9 53.8 -58.5 -39.5 21.2 36.1 -9.0 373 374 A E H > S+ 0 0 92 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.908 109.4 46.8 -59.7 -45.1 24.9 35.0 -9.3 374 375 A A H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.911 112.1 48.7 -66.3 -43.5 24.1 32.5 -12.1 375 376 A V H X>S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.7 0.911 112.1 50.3 -64.0 -39.7 22.0 35.0 -14.1 376 377 A K H X5S+ 0 0 95 -4,-2.5 4,-1.6 -5,-0.2 -2,-0.2 0.917 112.5 46.5 -64.5 -43.3 24.7 37.6 -13.8 377 378 A R H <5S+ 0 0 105 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.951 119.3 39.4 -62.9 -49.8 27.4 35.2 -15.0 378 379 A V H <5S+ 0 0 29 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.801 136.9 12.5 -73.1 -31.4 25.4 33.9 -17.9 379 380 A T H <5S- 0 0 35 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.610 87.1-124.7-122.5 -19.4 23.8 37.2 -19.0 380 381 A G S < - 0 0 122 5,-0.0 3,-1.7 3,-0.0 4,-0.3 -0.735 39.0 -7.4-121.6 170.3 15.5 43.2 -10.2 385 386 A G G > S- 0 0 62 1,-0.3 3,-1.9 -2,-0.2 4,-0.2 -0.136 129.4 -1.0 49.9-133.7 12.3 43.6 -8.2 386 387 A R G 3 S+ 0 0 131 1,-0.3 3,-0.5 2,-0.1 -1,-0.3 0.780 138.0 53.8 -57.8 -27.4 10.5 40.4 -7.2 387 388 A A G X S+ 0 0 7 -3,-1.7 3,-2.5 1,-0.2 -1,-0.3 0.520 76.5 104.0 -86.2 -5.2 13.1 38.5 -9.1 388 389 A A T < S+ 0 0 38 -3,-1.9 -1,-0.2 1,-0.3 -5,-0.1 0.700 82.2 45.6 -50.1 -27.3 16.0 40.1 -7.2 389 390 A N T 3 S- 0 0 103 -3,-0.5 131,-0.4 1,-0.4 -1,-0.3 0.235 126.8 -74.6-104.0 14.0 16.6 37.0 -5.0 390 391 A G < - 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0 0 100 -3,-1.2 2,-0.2 -4,-0.4 186,-0.0 -0.557 62.9-132.9 -78.7 138.1 -43.7 35.2 37.3 1435 256 C R - 0 0 53 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.1 -0.526 29.7 -98.2 -86.3 156.7 -44.2 32.5 39.9 1436 257 C T > - 0 0 77 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.180 28.8-108.5 -71.4 165.8 -46.5 33.1 42.9 1437 258 C E H > S+ 0 0 177 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.879 123.0 50.4 -60.5 -38.1 -45.4 34.1 46.4 1438 259 C E H > S+ 0 0 168 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.909 110.6 48.3 -67.3 -42.7 -46.3 30.6 47.5 1439 260 C Q H > S+ 0 0 73 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.901 108.7 54.3 -64.0 -41.6 -44.3 29.0 44.7 1440 261 C K H X S+ 0 0 53 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.840 107.6 50.4 -62.7 -33.7 -41.3 31.2 45.5 1441 262 C E H X S+ 0 0 66 -4,-1.5 4,-2.0 2,-0.2 3,-0.3 0.931 111.7 46.6 -70.1 -44.5 -41.3 30.1 49.1 1442 263 C K H X S+ 0 0 126 -4,-2.0 4,-2.8 1,-0.2 5,-0.3 0.838 105.5 61.7 -65.8 -31.9 -41.5 26.4 48.1 1443 264 C D H X S+ 0 0 4 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.886 106.9 45.0 -60.3 -39.3 -38.7 27.1 45.6 1444 265 C W H X S+ 0 0 10 -4,-1.3 4,-2.3 -3,-0.3 -2,-0.2 0.918 111.9 51.2 -69.9 -45.2 -36.4 28.1 48.5 1445 266 C E H X S+ 0 0 53 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.932 115.5 41.7 -58.1 -47.9 -37.4 25.2 50.6 1446 267 C I H X S+ 0 0 13 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.898 111.0 56.5 -67.6 -41.2 -36.7 22.7 47.8 1447 268 C S H X S+ 0 0 0 -4,-2.1 4,-1.5 -5,-0.3 -1,-0.2 0.893 110.4 45.4 -58.0 -40.3 -33.5 24.5 46.8 1448 269 C V H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.911 111.5 50.9 -70.1 -42.9 -32.2 24.1 50.3 1449 270 C K H X S+ 0 0 28 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.874 107.4 55.8 -61.7 -36.3 -33.2 20.4 50.5 1450 271 C M H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.899 105.7 50.8 -62.3 -41.8 -31.5 19.9 47.2 1451 272 C A H X S+ 0 0 2 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.926 112.0 47.0 -62.3 -45.2 -28.2 21.2 48.7 1452 273 C L H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.929 113.5 47.7 -62.2 -46.9 -28.5 18.9 51.7 1453 274 C I H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.904 110.8 51.0 -61.9 -44.2 -29.3 15.9 49.6 1454 275 C A H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.934 113.4 44.7 -60.2 -47.0 -26.4 16.6 47.1 1455 276 C R H X S+ 0 0 23 -4,-2.2 4,-2.4 1,-0.2 5,-0.4 0.923 112.0 52.5 -63.5 -44.6 -23.9 16.9 50.0 1456 277 C D H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.856 108.8 51.1 -59.8 -36.2 -25.3 13.8 51.7 1457 278 C L H < S+ 0 0 4 -4,-2.2 19,-2.6 -5,-0.2 -1,-0.2 0.895 111.9 47.7 -68.4 -38.9 -24.9 11.9 48.5 1458 279 C M H < S+ 0 0 0 -4,-1.9 20,-2.5 17,-0.2 -2,-0.2 0.916 134.6 5.3 -69.9 -45.8 -21.2 13.0 48.1 1459 280 C V H < S- 0 0 25 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.353 99.0-122.9-125.0 6.3 -19.9 12.3 51.6 1460 281 C G < - 0 0 4 -4,-1.8 2,-0.2 -5,-0.4 -1,-0.2 -0.100 16.7-116.7 77.9 178.2 -22.7 10.6 53.5 1461 282 C N >> - 0 0 16 12,-1.8 3,-1.3 11,-0.1 4,-0.7 -0.796 5.1-153.8-162.6 113.6 -24.4 11.7 56.8 1462 283 C K H >> S+ 0 0 145 1,-0.3 4,-1.5 -2,-0.2 3,-0.9 0.806 96.1 68.3 -57.1 -31.9 -24.4 9.9 60.1 1463 284 C K H 3> S+ 0 0 59 1,-0.3 4,-1.1 2,-0.2 -1,-0.3 0.856 92.7 59.4 -57.2 -36.4 -27.7 11.6 61.0 1464 285 C L H <4>S+ 0 0 0 -3,-1.3 5,-2.8 1,-0.2 4,-0.3 0.834 101.4 53.8 -63.5 -32.2 -29.3 9.6 58.2 1465 286 C E H X<5S+ 0 0 132 -3,-0.9 3,-1.6 -4,-0.7 5,-0.3 0.923 105.9 51.6 -68.0 -43.0 -28.3 6.3 60.0 1466 287 C E H 3<5S+ 0 0 140 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.756 107.3 56.3 -64.3 -23.2 -29.9 7.5 63.2 1467 288 C M T 3<5S- 0 0 66 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.518 127.1 -98.7 -86.4 -7.1 -33.1 8.2 61.2 1468 289 C G T < 5S+ 0 0 63 -3,-1.6 2,-0.3 -4,-0.3 -3,-0.2 0.658 94.3 112.5 98.1 17.4 -33.2 4.6 59.9 1469 290 C Y >< + 0 0 59 -5,-2.8 4,-1.8 1,-0.1 -3,-0.1 -0.565 30.3 158.3-121.1 66.5 -31.6 5.2 56.5 1470 291 C G H > S+ 0 0 36 -2,-0.3 4,-0.6 -5,-0.3 -1,-0.1 0.816 71.3 49.1 -59.6 -38.8 -28.3 3.3 57.0 1471 292 C E H >> S+ 0 0 154 1,-0.2 3,-1.3 2,-0.2 4,-0.6 0.951 112.7 47.6 -68.4 -47.9 -27.5 2.8 53.3 1472 293 C E H >4 S+ 0 0 22 1,-0.3 3,-0.6 2,-0.2 -2,-0.2 0.827 102.0 66.1 -60.9 -32.2 -28.1 6.4 52.4 1473 294 C A H 3< S+ 0 0 14 -4,-1.8 -12,-1.8 1,-0.2 -1,-0.3 0.764 90.6 66.4 -62.7 -24.6 -25.9 7.5 55.4 1474 295 C L H << S- 0 0 136 -3,-1.3 3,-0.3 -4,-0.6 -1,-0.2 0.895 87.1-159.4 -66.5 -42.3 -22.9 5.9 53.8 1475 296 C G << - 0 0 21 -4,-0.6 -17,-0.2 -3,-0.6 -18,-0.2 -0.157 32.0 -85.7 83.3 174.6 -22.6 8.3 50.9 1476 297 C R - 0 0 73 -19,-2.6 -1,-0.2 -20,-0.1 -17,-0.1 0.185 49.0-120.8-107.8 15.3 -20.7 7.7 47.6 1477 298 C N + 0 0 38 -3,-0.3 -117,-2.3 1,-0.2 2,-0.5 0.877 53.1 169.3 47.2 47.3 -17.3 8.8 48.7 1478 299 C A E -a 1360 0Y 0 -20,-2.5 -1,-0.2 -21,-0.2 -117,-0.2 -0.799 33.8-175.9 -98.9 123.0 -17.2 11.5 46.0 1479 300 C I E S+ 0 0 8 -119,-1.5 38,-0.5 -2,-0.5 2,-0.3 0.515 84.6 19.8 -88.4 -7.1 -14.6 14.2 45.9 1480 301 C V E S+a 1361 0Y 0 -120,-1.0 -118,-2.0 36,-0.1 2,-0.3 -0.973 71.2 169.2-158.4 146.2 -16.4 15.7 42.9 1481 302 C A E -ab13621518Y 0 36,-1.7 38,-3.2 -2,-0.3 2,-0.3 -0.932 15.8-146.1-151.4 173.9 -20.0 15.4 41.5 1482 303 C G E -ab13631519Y 0 -120,-2.0 -118,-2.0 -2,-0.3 2,-0.5 -0.981 6.4-145.1-146.7 155.7 -22.4 16.9 39.0 1483 304 C F E -ab13641520Y 0 36,-2.4 39,-1.3 -2,-0.3 38,-0.6 -0.982 7.3-153.0-126.4 119.5 -26.1 17.5 38.7 1484 305 C Q + 0 0 7 -120,-2.8 2,-1.0 -2,-0.5 -1,-0.2 0.955 33.0 158.8 -54.9 -56.9 -27.7 17.3 35.3 1485 306 C G >> + 0 0 4 -121,-0.2 4,-1.9 36,-0.1 5,-0.9 -0.564 34.0 92.9 72.5-102.6 -30.6 19.7 36.0 1486 307 C Q T 45S+ 0 0 14 -2,-1.0 -117,-0.2 -3,-0.2 2,-0.1 -0.440 88.5 4.7 -68.5 141.6 -31.7 20.8 32.6 1487 308 C R T >5S+ 0 0 42 -119,-0.2 4,-1.5 136,-0.1 -1,-0.2 -0.920 130.0 32.8 -98.8 -27.1 -33.9 19.7 31.0 1488 309 C Q T 45S+ 0 0 126 2,-0.2 4,-0.2 1,-0.2 5,-0.2 0.881 124.0 36.2 -55.5 -51.2 -35.6 17.0 32.9 1489 310 C W T >X5S+ 0 0 7 -4,-1.9 4,-3.3 1,-0.2 3,-1.7 0.963 118.7 48.3 -69.8 -50.6 -35.4 18.3 36.5 1490 311 C T T 34 S+ 0 0 3 1,-0.2 4,-3.1 2,-0.1 5,-0.3 0.280 82.9 108.9 -88.3 12.7 -29.9 23.6 40.9 1497 318 C D H > S+ 0 0 4 1,-0.2 4,-2.2 2,-0.2 83,-0.3 0.927 83.0 41.1 -53.9 -52.3 -28.6 27.1 40.9 1498 319 C F H > S+ 0 0 1 -3,-0.4 4,-3.2 2,-0.2 5,-0.3 0.938 116.6 49.1 -63.7 -45.9 -28.6 27.6 44.7 1499 320 C M H > S+ 0 0 1 -4,-0.3 4,-2.3 1,-0.2 5,-0.2 0.924 115.2 44.0 -57.0 -48.5 -27.4 24.0 45.4 1500 321 C E H X S+ 0 0 6 -4,-3.1 4,-1.0 2,-0.2 -1,-0.2 0.824 115.3 50.1 -68.4 -31.7 -24.5 24.5 42.9 1501 322 C T H X S+ 0 0 1 -4,-2.2 4,-0.6 -5,-0.3 81,-0.5 0.962 115.4 39.3 -71.4 -52.3 -23.8 27.9 44.2 1502 323 C I H >< S+ 0 0 2 -4,-3.2 3,-0.8 1,-0.2 5,-0.3 0.893 111.6 54.9 -69.0 -41.2 -23.6 27.0 47.9 1503 324 C L H 3< S+ 0 0 4 -4,-2.3 13,-2.6 -5,-0.3 -1,-0.2 0.907 110.5 46.9 -60.1 -40.8 -21.8 23.7 47.7 1504 325 C N H 3< S+ 0 0 5 -4,-1.0 -1,-0.2 -5,-0.2 37,-0.2 0.600 97.7 94.7 -76.2 -12.1 -18.9 25.2 45.7 1505 326 C S S << S- 0 0 0 -3,-0.8 11,-0.2 -4,-0.6 76,-0.1 -0.321 82.2-123.5 -77.0 164.0 -18.7 28.1 48.2 1506 327 C S S S+ 0 0 1 9,-0.1 7,-2.0 6,-0.1 2,-0.3 0.132 89.2 27.8 -93.5 19.4 -16.3 28.2 51.2 1507 328 C F E +E 1512 0a 2 -5,-0.3 2,-0.2 5,-0.3 5,-0.2 -0.977 55.3 156.7-170.6 159.5 -19.2 28.7 53.7 1508 329 C D E > -E 1511 0a 7 3,-1.2 3,-2.4 -2,-0.3 -5,-0.0 -0.843 66.9 -45.7-163.4-160.5 -22.8 28.1 54.4 1509 330 C W T 3 S+ 0 0 23 1,-0.3 3,-0.1 -2,-0.2 -94,-0.0 0.696 132.7 55.1 -58.5 -19.9 -25.3 27.9 57.4 1510 331 C N T 3 S- 0 0 81 1,-0.4 -1,-0.3 -96,-0.0 2,-0.2 0.378 117.8-109.3 -94.6 4.2 -22.8 25.6 59.2 1511 332 C G E < -E 1508 0a 33 -3,-2.4 -3,-1.2 2,-0.0 -1,-0.4 -0.499 63.5 -14.3 101.1-172.7 -20.0 28.2 58.9 1512 333 C K E S+E 1507 0a 110 -5,-0.2 -5,-0.3 -2,-0.2 2,-0.3 -0.378 72.6 151.7 -67.3 143.6 -16.8 28.2 56.8 1513 334 C R - 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