==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 29-APR-11 3RRF . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR I.A.SHUMILIN,M.CYMBOROWSKI,S.A.LESLEY,W.MINOR . 496 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21840.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 368 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 63 12.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 38 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 166 33.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 1 2 2 1 0 3 1 2 1 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 2 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 1 0 1 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 1 A M > 0 0 46 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -54.1 0.6 -48.7 -18.9 2 2 A K H > + 0 0 150 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.865 360.0 52.0 -60.2 -30.3 -1.5 -51.9 -18.1 3 3 A E H > S+ 0 0 137 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.839 106.8 51.5 -57.8 -40.2 1.9 -53.3 -19.3 4 4 A I H > S+ 0 0 7 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.867 110.1 47.0 -75.7 -35.7 3.5 -51.0 -16.8 5 5 A D H X S+ 0 0 57 -4,-3.0 4,-2.3 2,-0.2 5,-0.2 0.926 112.4 52.4 -60.8 -47.4 1.3 -52.3 -14.0 6 6 A E H X S+ 0 0 103 -4,-2.2 4,-3.0 -5,-0.2 5,-0.4 0.917 112.3 43.0 -58.1 -48.4 2.0 -55.9 -15.2 7 7 A L H X>S+ 0 0 54 -4,-2.5 4,-2.5 1,-0.2 5,-2.1 0.906 111.5 54.0 -65.1 -41.7 5.8 -55.4 -15.1 8 8 A T H <5S+ 0 0 0 -4,-1.9 6,-2.4 3,-0.2 -1,-0.2 0.869 118.0 37.2 -65.0 -35.5 5.8 -53.6 -11.8 9 9 A I H X5S+ 0 0 42 -4,-2.3 4,-0.9 4,-0.2 -2,-0.2 0.969 127.4 31.5 -76.6 -57.2 3.8 -56.5 -10.2 10 10 A K H <5S+ 0 0 138 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.848 132.3 26.0 -80.3 -34.2 5.4 -59.5 -11.9 11 11 A E T <5S+ 0 0 147 -4,-2.5 -3,-0.2 -5,-0.4 -1,-0.1 0.873 129.5 36.3 -96.4 -45.8 9.0 -58.4 -12.6 12 12 A Y T 4> - 0 0 64 -2,-0.5 4,-1.5 1,-0.1 3,-1.1 -0.352 15.5-130.4 -55.1 133.4 2.0 -56.4 -4.7 16 16 A S H 3> S+ 0 0 31 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.842 109.2 60.0 -58.2 -32.0 -1.0 -55.4 -6.9 17 17 A R H 3> S+ 0 0 106 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.829 100.9 53.2 -64.7 -32.9 -2.8 -54.5 -3.7 18 18 A I H <> S+ 0 0 93 -3,-1.1 4,-2.5 2,-0.2 -2,-0.2 0.897 109.1 48.7 -69.9 -41.2 -0.0 -51.9 -2.9 19 19 A L H X S+ 0 0 10 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.900 112.4 49.3 -60.1 -41.8 -0.5 -50.3 -6.3 20 20 A M H X S+ 0 0 7 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.924 110.9 49.0 -71.9 -39.6 -4.3 -50.2 -5.8 21 21 A E H X S+ 0 0 53 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.946 112.5 48.4 -60.4 -48.7 -3.9 -48.6 -2.3 22 22 A R H X S+ 0 0 61 -4,-2.5 4,-1.8 174,-0.2 -1,-0.2 0.880 110.6 51.8 -59.1 -40.5 -1.5 -46.0 -3.6 23 23 A A H X S+ 0 0 2 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.958 111.6 46.8 -59.5 -50.1 -4.0 -45.3 -6.5 24 24 A G H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 3,-0.2 0.904 110.7 49.1 -63.7 -44.5 -6.9 -44.8 -4.1 25 25 A I H X S+ 0 0 54 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.842 105.3 60.0 -65.7 -31.2 -5.1 -42.5 -1.7 26 26 A S H X S+ 0 0 0 -4,-1.8 4,-2.4 -5,-0.2 -1,-0.2 0.863 103.9 51.4 -57.5 -40.9 -3.9 -40.4 -4.6 27 27 A V H X S+ 0 0 0 -4,-1.5 4,-2.3 -3,-0.2 -2,-0.2 0.929 109.2 49.2 -63.7 -42.4 -7.5 -39.7 -5.4 28 28 A V H X S+ 0 0 25 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.946 113.9 45.3 -64.0 -48.5 -8.2 -38.7 -1.9 29 29 A L H X S+ 0 0 76 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.890 112.0 52.5 -60.5 -39.4 -5.2 -36.3 -1.8 30 30 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.910 109.3 49.3 -62.1 -42.3 -6.1 -34.9 -5.2 31 31 A M H X S+ 0 0 0 -4,-2.3 4,-3.9 1,-0.2 5,-0.4 0.896 109.5 51.2 -68.6 -38.7 -9.6 -34.2 -4.0 32 32 A E H X S+ 0 0 89 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.921 108.4 52.0 -63.2 -42.3 -8.4 -32.4 -0.9 33 33 A E H < S+ 0 0 118 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.866 119.7 36.4 -59.5 -38.4 -6.1 -30.2 -3.0 34 34 A E H < S+ 0 0 73 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.843 129.5 28.7 -86.1 -39.8 -9.1 -29.3 -5.3 35 35 A L H < S- 0 0 35 -4,-3.9 2,-0.2 1,-0.3 -3,-0.2 0.608 95.9-137.8 -97.9 -9.1 -12.0 -29.1 -2.7 36 36 A G S < S+ 0 0 35 -4,-2.1 -1,-0.3 -5,-0.4 -2,-0.1 -0.576 72.9 15.8 80.8-152.5 -10.1 -28.1 0.4 37 37 A N - 0 0 105 -2,-0.2 3,-0.5 1,-0.2 -4,-0.0 -0.282 64.7-159.5 -56.1 126.0 -11.1 -29.8 3.6 38 38 A L > + 0 0 11 1,-0.2 3,-1.9 2,-0.1 30,-0.5 0.513 68.4 94.5 -84.6 -5.3 -13.2 -32.9 2.8 39 39 A S T 3 S+ 0 0 52 1,-0.3 29,-0.4 28,-0.2 -1,-0.2 0.804 82.8 50.3 -70.6 -23.8 -14.8 -33.2 6.2 40 40 A D T 3 S+ 0 0 115 -3,-0.5 2,-0.3 27,-0.2 -1,-0.3 0.373 95.2 92.1 -88.3 5.7 -18.0 -31.3 5.2 41 41 A Y < - 0 0 70 -3,-1.9 27,-1.0 69,-0.0 28,-0.9 -0.732 64.7-140.5-106.7 149.4 -18.8 -33.2 2.0 42 42 A R E -a 69 0A 76 -2,-0.3 68,-2.6 26,-0.2 69,-2.1 -0.937 24.1-148.8-103.1 128.2 -20.9 -36.3 1.4 43 43 A F E -ab 70 111A 0 26,-3.2 28,-2.3 -2,-0.5 2,-0.6 -0.858 15.5-167.2-108.7 128.2 -19.4 -38.8 -1.2 44 44 A L E -ab 71 112A 0 67,-3.0 69,-3.0 -2,-0.5 2,-0.6 -0.940 14.9-165.5-105.9 114.3 -21.2 -41.1 -3.6 45 45 A V E -ab 72 113A 0 26,-2.8 28,-2.6 -2,-0.6 2,-0.6 -0.898 4.7-158.8-109.2 118.8 -18.7 -43.6 -5.0 46 46 A L E -ab 73 114A 1 67,-2.8 69,-2.5 -2,-0.6 2,-0.5 -0.893 16.0-170.0-101.3 117.6 -19.7 -45.6 -8.0 47 47 A C E -ab 74 115A 0 26,-2.5 28,-2.9 -2,-0.6 29,-0.8 -0.926 12.8-157.6-120.2 127.5 -17.7 -48.8 -8.4 48 48 A G - 0 0 1 67,-2.4 69,-0.1 -2,-0.5 8,-0.1 -0.283 38.6-102.2 -81.5 178.9 -17.5 -51.2 -11.2 49 49 A G S S+ 0 0 15 4,-0.1 31,-2.2 -2,-0.1 34,-0.2 0.401 94.0 73.3 -84.2 1.9 -16.4 -54.8 -10.7 50 50 A G S > S- 0 0 27 66,-0.4 4,-1.9 29,-0.2 5,-0.1 -0.120 104.6 -71.4-103.9-158.7 -12.8 -54.3 -12.1 51 51 A N H > S+ 0 0 83 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.806 128.8 57.8 -70.3 -27.1 -9.7 -52.6 -10.9 52 52 A N H > S+ 0 0 12 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.955 109.1 47.2 -63.9 -47.8 -11.0 -49.1 -11.4 53 53 A G H > S+ 0 0 0 63,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.872 107.9 55.4 -58.1 -39.4 -13.8 -50.1 -9.0 54 54 A G H X S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.910 105.1 52.4 -60.8 -42.6 -11.2 -51.6 -6.6 55 55 A D H X S+ 0 0 14 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.926 107.9 53.4 -57.2 -43.6 -9.5 -48.2 -6.7 56 56 A G H X S+ 0 0 0 -4,-2.0 4,-2.9 59,-0.2 -2,-0.2 0.897 104.3 53.3 -57.5 -42.6 -13.0 -46.7 -5.8 57 57 A F H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.888 107.7 52.2 -62.1 -36.1 -13.3 -49.0 -2.8 58 58 A V H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.915 110.4 48.3 -62.4 -46.1 -9.9 -47.8 -1.5 59 59 A V H X S+ 0 0 0 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.953 113.5 46.5 -56.6 -51.1 -11.2 -44.2 -1.9 60 60 A A H >X S+ 0 0 0 -4,-2.9 4,-0.9 1,-0.2 3,-0.8 0.940 112.8 49.2 -60.7 -46.8 -14.4 -45.0 -0.0 61 61 A R H >< S+ 0 0 21 -4,-2.9 3,-0.8 1,-0.3 -1,-0.2 0.899 108.9 51.7 -62.7 -44.2 -12.7 -46.8 2.7 62 62 A N H 3< S+ 0 0 58 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.709 108.5 53.2 -66.1 -19.9 -10.1 -44.0 3.3 63 63 A L H XX S+ 0 0 2 -4,-1.3 3,-2.0 -3,-0.8 4,-1.3 0.648 82.6 116.5 -84.0 -15.8 -13.0 -41.4 3.5 64 64 A L T << S+ 0 0 42 -4,-0.9 4,-0.1 -3,-0.8 31,-0.1 -0.266 85.9 3.7 -59.4 137.6 -14.8 -43.4 6.2 65 65 A G T 34 S+ 0 0 87 2,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.369 122.8 73.2 72.7 -3.0 -15.1 -41.6 9.6 66 66 A V T <4 S+ 0 0 95 -3,-2.0 2,-0.2 -28,-0.0 -2,-0.2 0.579 92.7 45.0-116.4 -17.7 -13.4 -38.5 8.2 67 67 A V S < S- 0 0 17 -4,-1.3 -2,-0.2 -27,-0.1 -28,-0.2 -0.743 92.4 -98.5-121.0 174.4 -16.1 -37.0 5.9 68 68 A K S S- 0 0 136 -27,-1.0 2,-0.3 -30,-0.5 -26,-0.2 0.841 95.8 -16.7 -64.1 -38.1 -19.9 -36.4 6.5 69 69 A D E -a 42 0A 73 -28,-0.9 -26,-3.2 2,-0.0 2,-0.4 -0.941 53.8-165.9-167.3 142.9 -21.1 -39.5 4.6 70 70 A V E +a 43 0A 10 -2,-0.3 26,-0.4 -28,-0.2 2,-0.3 -0.993 10.3 175.2-131.5 136.3 -19.8 -42.1 2.1 71 71 A L E -a 44 0A 8 -28,-2.3 -26,-2.8 -2,-0.4 2,-0.5 -0.993 15.7-151.8-135.9 135.7 -22.0 -44.5 0.2 72 72 A V E -ac 45 97A 0 24,-2.2 26,-2.4 -2,-0.3 2,-0.6 -0.939 0.2-159.0-102.7 129.6 -20.8 -47.0 -2.5 73 73 A V E -ac 46 98A 0 -28,-2.6 -26,-2.5 -2,-0.5 2,-0.7 -0.963 13.7-152.6 -99.6 113.9 -23.1 -48.1 -5.3 74 74 A F E +a 47 0A 2 24,-3.1 -26,-0.2 -2,-0.6 -28,-0.1 -0.823 19.7 174.4 -91.2 117.6 -21.6 -51.3 -6.6 75 75 A L + 0 0 14 -28,-2.9 -27,-0.2 -2,-0.7 -1,-0.1 0.544 45.3 87.8-105.6 -13.1 -22.7 -51.6 -10.3 76 76 A G - 0 0 13 -29,-0.8 3,-0.1 1,-0.1 -2,-0.0 -0.091 65.1-138.7 -77.5 179.3 -20.8 -54.6 -11.4 77 77 A K S S+ 0 0 194 1,-0.4 -1,-0.1 0, 0.0 2,-0.0 0.680 84.2 17.7 -97.8 -84.0 -21.6 -58.3 -11.4 78 78 A K S S- 0 0 187 1,-0.0 2,-0.4 0, 0.0 -1,-0.4 -0.278 74.8-133.9 -86.6 168.1 -18.4 -60.1 -10.4 79 79 A K - 0 0 39 -3,-0.1 -29,-0.2 -2,-0.0 -30,-0.1 -0.981 14.6-124.4-122.7 134.5 -15.4 -58.5 -8.7 80 80 A T > - 0 0 47 -31,-2.2 4,-3.4 -2,-0.4 5,-0.2 -0.296 41.6 -97.6 -66.2 164.7 -11.7 -59.0 -9.6 81 81 A P H > S+ 0 0 112 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.870 124.1 44.1 -58.9 -39.0 -9.5 -60.3 -6.8 82 82 A D H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.883 114.5 49.6 -73.8 -35.7 -8.2 -56.8 -5.8 83 83 A C H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.940 112.1 49.0 -62.9 -44.8 -11.6 -55.2 -6.1 84 84 A E H X S+ 0 0 94 -4,-3.4 4,-2.5 1,-0.2 -2,-0.2 0.903 110.7 50.5 -60.8 -43.9 -13.0 -58.0 -3.9 85 85 A Y H X S+ 0 0 99 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.923 113.8 44.3 -60.3 -46.0 -10.2 -57.5 -1.3 86 86 A N H X S+ 0 0 1 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.847 110.8 53.7 -72.8 -30.0 -10.9 -53.8 -1.2 87 87 A Y H X S+ 0 0 49 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.926 108.6 51.3 -60.9 -49.8 -14.7 -54.3 -1.0 88 88 A G H X S+ 0 0 27 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.909 110.9 47.3 -56.8 -42.6 -14.0 -56.6 1.9 89 89 A L H X S+ 0 0 41 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.933 108.9 54.4 -64.2 -44.4 -11.9 -53.9 3.6 90 90 A Y H <>S+ 0 0 0 -4,-2.6 5,-2.3 1,-0.2 -2,-0.2 0.949 113.8 41.9 -55.1 -47.7 -14.5 -51.2 3.0 91 91 A K H ><5S+ 0 0 90 -4,-2.4 3,-1.5 1,-0.2 -1,-0.2 0.873 111.6 53.1 -70.4 -40.3 -17.2 -53.4 4.7 92 92 A K H 3<5S+ 0 0 186 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.878 106.2 56.3 -60.7 -35.2 -14.9 -54.5 7.6 93 93 A F T 3<5S- 0 0 128 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.522 129.7-100.4 -74.9 -2.7 -14.2 -50.8 8.1 94 94 A G T < 5 + 0 0 64 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.631 68.7 157.4 95.9 20.8 -18.0 -50.3 8.5 95 95 A G < - 0 0 5 -5,-2.3 2,-0.4 -6,-0.2 -1,-0.2 -0.463 37.5-126.3 -85.4 151.3 -18.8 -48.9 5.0 96 96 A K - 0 0 128 -26,-0.4 -24,-2.2 -2,-0.1 2,-0.4 -0.808 25.3-178.4-101.8 131.6 -22.1 -49.1 3.3 97 97 A V E -c 72 0A 26 -2,-0.4 2,-0.3 -26,-0.2 -24,-0.2 -0.980 3.6-175.6-122.4 135.9 -22.6 -50.6 -0.2 98 98 A V E -c 73 0A 43 -26,-2.4 -24,-3.1 -2,-0.4 3,-0.0 -0.912 16.2-157.8-121.3 159.5 -25.8 -50.8 -2.2 99 99 A E S S+ 0 0 104 -2,-0.3 2,-0.4 -26,-0.2 -26,-0.1 0.394 73.4 75.0-111.3 -6.6 -26.3 -52.5 -5.6 100 100 A Q - 0 0 140 2,-0.0 2,-0.5 0, 0.0 -26,-0.1 -0.911 68.5-149.1-110.1 139.9 -29.3 -50.7 -6.8 101 101 A F - 0 0 25 -2,-0.4 3,-0.1 -28,-0.1 -2,-0.0 -0.898 8.7-162.1-106.6 129.3 -29.1 -47.1 -8.0 102 102 A E > - 0 0 119 -2,-0.5 3,-3.9 1,-0.1 4,-0.3 -0.972 23.8-129.3-118.0 125.1 -32.1 -44.9 -7.5 103 103 A P G > S+ 0 0 76 0, 0.0 3,-0.8 0, 0.0 4,-0.2 0.796 110.2 53.6 -38.8 -41.7 -32.4 -41.6 -9.6 104 104 A S G 3 S+ 0 0 58 1,-0.2 3,-0.5 2,-0.1 4,-0.3 0.417 83.6 90.6 -72.9 -0.9 -33.0 -39.6 -6.4 105 105 A I G X S+ 0 0 27 -3,-3.9 3,-1.2 1,-0.2 -1,-0.2 0.841 75.8 63.6 -68.5 -31.4 -29.8 -40.9 -4.8 106 106 A L G X S+ 0 0 10 -3,-0.8 3,-2.1 -4,-0.3 -1,-0.2 0.862 87.9 74.8 -58.0 -35.8 -27.7 -38.1 -6.2 107 107 A N G 3 S+ 0 0 116 -3,-0.5 -1,-0.2 1,-0.3 -2,-0.2 0.711 93.3 49.0 -48.0 -35.0 -29.8 -35.7 -4.0 108 108 A E G < S+ 0 0 83 -3,-1.2 2,-0.3 -4,-0.3 -1,-0.3 0.278 104.0 70.7 -93.8 10.4 -28.1 -36.6 -0.7 109 109 A F < - 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0 0 9 -5,-1.6 -1,-0.2 1,-0.1 -27,-0.2 -0.298 37.4-138.4 -65.7 143.6 15.4 -15.8 -37.3 261 261 A G S S+ 0 0 20 -29,-1.4 2,-0.4 -28,-0.8 -27,-0.2 0.891 77.5 8.2 -74.9 -43.0 18.1 -13.7 -38.8 262 262 A L E -j 234 0C 41 -29,-1.8 -27,-2.3 -30,-0.2 2,-0.4 -0.992 58.6-167.5-145.7 134.7 16.8 -13.0 -42.3 263 263 A V E -j 235 0C 2 -2,-0.4 20,-1.8 18,-0.3 2,-0.5 -0.995 4.4-174.5-127.8 125.8 13.5 -13.7 -44.1 264 264 A K E -jl 236 283C 52 -29,-2.6 -27,-2.5 -2,-0.4 2,-0.4 -0.970 8.1-158.7-115.1 130.4 12.9 -13.4 -47.8 265 265 A L E -jl 237 284C 0 18,-3.2 20,-3.2 -2,-0.5 2,-0.5 -0.862 6.2-156.2-102.9 143.9 9.5 -13.7 -49.3 266 266 A A E +jl 238 285C 0 -29,-3.0 -27,-2.0 -2,-0.4 18,-0.0 -0.989 31.6 157.0-117.4 116.6 8.9 -14.6 -53.0 267 267 A V E - l 0 286C 1 18,-2.0 20,-2.2 -2,-0.5 5,-0.3 -0.976 47.0 -91.4-142.3 140.9 5.4 -13.4 -53.9 268 268 A P E >> - l 0 287C 0 0, 0.0 3,-1.0 0, 0.0 4,-0.9 -0.368 64.0 -75.4 -57.8 134.7 3.8 -12.4 -57.3 269 269 A F T 34 S+ 0 0 102 18,-2.6 20,-0.3 1,-0.3 23,-0.1 -0.526 112.9 13.0 -69.2 139.4 4.1 -8.8 -58.3 270 270 A P T >4 S+ 0 0 66 0, 0.0 3,-1.8 0, 0.0 4,-0.4 -0.960 118.3 67.3 -94.9 10.7 2.5 -6.4 -57.1 271 271 A Q T X> S+ 0 0 39 -3,-1.0 3,-1.2 1,-0.3 4,-0.5 0.781 88.9 70.8 -64.6 -24.9 1.3 -8.5 -54.1 272 272 A N H >X S+ 0 0 6 -4,-0.9 3,-0.9 -5,-0.3 4,-0.7 0.810 87.8 65.4 -57.7 -29.5 4.8 -8.6 -52.8 273 273 A L H <> S+ 0 0 90 -3,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.763 86.4 70.9 -69.7 -21.5 4.6 -4.9 -52.0 274 274 A I H <> S+ 0 0 75 -3,-1.2 4,-0.9 -4,-0.4 -1,-0.2 0.871 94.2 54.9 -56.4 -42.2 1.9 -5.6 -49.4 275 275 A A H < - 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0 0 43 -2,-0.2 3,-1.6 48,-0.1 4,-0.1 -0.906 43.1 -73.9-156.0-174.9 -7.5 -21.7 -27.6 422 422 A T G > S+ 0 0 79 -2,-0.3 3,-1.4 1,-0.3 -18,-0.0 0.560 111.2 81.2 -72.1 -5.6 -10.3 -21.0 -30.1 423 423 A G G 3 S+ 0 0 1 1,-0.2 -1,-0.3 50,-0.0 6,-0.1 0.755 87.3 59.8 -69.0 -17.6 -8.9 -17.7 -31.1 424 424 A L G < S+ 0 0 33 -3,-1.6 2,-2.0 1,-0.2 -1,-0.2 0.547 78.9 92.1 -80.9 -10.4 -6.6 -19.7 -33.4 425 425 A S S < S+ 0 0 99 -3,-1.4 2,-0.3 -4,-0.1 -1,-0.2 -0.449 74.2 88.6 -80.4 64.0 -9.7 -21.1 -35.2 426 426 A K S > S- 0 0 80 -2,-2.0 3,-1.8 48,-0.0 4,-0.3 -0.968 90.1 -80.1-163.2 139.9 -9.4 -18.3 -37.7 427 427 A G T 3 S+ 0 0 77 -2,-0.3 47,-0.4 1,-0.2 -2,-0.0 -0.124 111.0 33.9 -46.1 134.2 -7.7 -17.7 -41.0 428 428 A G T 3> S+ 0 0 13 45,-0.1 4,-1.8 46,-0.1 -1,-0.2 -0.021 87.4 98.1 109.3 -24.3 -4.1 -16.7 -40.8 429 429 A S H <> S+ 0 0 11 -3,-1.8 4,-1.7 1,-0.2 -2,-0.1 0.880 85.2 47.7 -60.1 -47.9 -3.2 -18.8 -37.7 430 430 A G H > S+ 0 0 20 -4,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.842 105.7 58.4 -62.1 -39.8 -1.7 -21.6 -39.7 431 431 A D H > S+ 0 0 30 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.919 105.8 50.1 -61.5 -41.8 0.3 -19.2 -41.8 432 432 A V H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.926 107.8 52.2 -61.2 -46.2 2.1 -17.9 -38.7 433 433 A L H X S+ 0 0 3 -4,-1.7 4,-2.5 1,-0.2 5,-0.2 0.890 105.0 57.4 -60.8 -39.2 2.9 -21.4 -37.4 434 434 A T H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.925 108.0 45.7 -53.6 -46.9 4.5 -22.2 -40.8 435 435 A G H X S+ 0 0 0 -4,-1.5 4,-2.4 1,-0.2 -1,-0.2 0.896 110.9 54.4 -64.8 -44.9 6.9 -19.3 -40.5 436 436 A M H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.905 108.9 46.9 -52.9 -52.3 7.7 -20.2 -36.9 437 437 A I H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.958 113.8 47.7 -57.6 -48.3 8.7 -23.8 -37.8 438 438 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.906 110.4 54.4 -60.5 -41.1 10.8 -22.6 -40.7 439 439 A G H X S+ 0 0 0 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.909 108.3 46.5 -60.7 -44.4 12.5 -20.0 -38.5 440 440 A F H <>S+ 0 0 1 -4,-2.2 5,-2.3 2,-0.2 4,-0.4 0.872 110.3 53.0 -71.1 -34.5 13.5 -22.5 -35.9 441 441 A I H ><5S+ 0 0 17 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.942 107.4 52.3 -60.0 -45.3 14.8 -24.9 -38.5 442 442 A A H 3<5S+ 0 0 11 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.811 104.0 58.0 -59.4 -33.1 16.9 -22.1 -39.8 443 443 A Q T 3<5S- 0 0 24 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.511 130.1 -94.2 -76.0 -7.1 18.2 -21.5 -36.3 444 444 A G T < 5S+ 0 0 63 -3,-1.8 2,-0.2 -4,-0.4 -3,-0.2 0.445 79.3 134.4 111.5 4.0 19.5 -25.1 -36.2 445 445 A L < - 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