==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 04-MAY-10 3MVU . COMPND 2 MOLECULE: TENA FAMILY TRANSCRIPTIONAL REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: RUEGERIA SP. TM1040; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 225 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10186.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 81.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 3 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 1 0 2 1 0 1 0 0 0 1 1 0 0 0 0 0 1 0 1 1 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A X 0 0 181 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-149.9 38.7 4.0 29.2 2 2 A S + 0 0 92 1,-0.2 0, 0.0 2,-0.1 0, 0.0 0.920 360.0 24.9 -42.3 -56.4 38.0 2.0 32.4 3 3 A E S > S+ 0 0 90 1,-0.1 3,-1.0 2,-0.0 -1,-0.2 -0.730 75.4 169.5-124.5 78.2 38.4 5.0 34.6 4 4 A P T 3 + 0 0 28 0, 0.0 -1,-0.1 0, 0.0 176,-0.1 0.528 64.9 58.6 -79.8 -6.6 37.7 8.0 32.4 5 5 A Y T 3 S- 0 0 5 1,-0.4 4,-0.4 175,-0.1 3,-0.1 0.024 109.4 -88.6-116.8 26.5 37.5 10.9 34.9 6 6 A G <> - 0 0 23 -3,-1.0 4,-1.6 1,-0.1 -1,-0.4 -0.075 43.7 -71.7 94.1 170.4 40.9 10.7 36.6 7 7 A K H > S+ 0 0 125 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.927 121.7 51.4 -72.1 -46.6 42.6 9.0 39.5 8 8 A A H > S+ 0 0 0 172,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.889 110.2 48.8 -62.9 -42.6 41.0 10.8 42.4 9 9 A F H > S+ 0 0 0 -4,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.913 109.8 52.4 -62.0 -43.2 37.5 10.2 41.2 10 10 A S H X S+ 0 0 3 -4,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.897 112.6 45.5 -60.8 -40.8 38.1 6.5 40.6 11 11 A L H X S+ 0 0 53 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.917 114.6 47.0 -69.3 -42.7 39.5 6.2 44.2 12 12 A X H X S+ 0 0 1 -4,-2.7 4,-0.8 1,-0.2 -2,-0.2 0.908 109.7 54.1 -66.8 -38.2 36.6 8.2 45.7 13 13 A R H >< S+ 0 0 43 -4,-2.8 3,-0.8 1,-0.2 4,-0.3 0.908 107.2 51.3 -57.5 -47.2 34.0 6.2 43.7 14 14 A A H >< S+ 0 0 70 -4,-1.6 3,-0.7 1,-0.3 -1,-0.2 0.851 110.2 48.7 -65.0 -34.7 35.4 2.9 45.1 15 15 A E H 3< S+ 0 0 128 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.621 105.5 61.1 -78.1 -12.6 35.2 4.2 48.7 16 16 A A T XX S+ 0 0 0 -3,-0.8 4,-1.4 -4,-0.8 3,-0.8 0.384 84.5 151.7 -98.3 3.1 31.6 5.4 48.2 17 17 A E T <4 + 0 0 86 -3,-0.7 192,-0.0 1,-0.3 -3,-0.0 -0.503 54.2 24.1 -76.3 150.2 30.1 2.0 47.3 18 18 A P T 3> S+ 0 0 109 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 -0.989 123.0 55.7 -86.1 3.0 27.4 0.8 47.7 19 19 A A H <> S+ 0 0 11 -3,-0.8 4,-2.1 1,-0.2 -2,-0.2 0.882 102.6 59.9 -59.3 -40.1 25.8 4.3 47.7 20 20 A W H X S+ 0 0 2 -4,-1.4 4,-2.9 1,-0.2 5,-0.2 0.935 107.8 43.7 -55.8 -48.0 27.5 5.0 44.3 21 21 A R H > S+ 0 0 152 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.890 110.1 55.6 -62.8 -40.1 25.6 2.1 42.7 22 22 A A H < S+ 0 0 46 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.831 114.0 43.2 -61.5 -30.9 22.4 3.1 44.4 23 23 A Y H >< S+ 0 0 0 -4,-2.1 3,-1.3 -5,-0.2 -2,-0.2 0.957 119.4 37.8 -75.0 -59.6 22.9 6.6 42.8 24 24 A T H 3< S+ 0 0 4 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.636 125.7 38.6 -76.2 -15.3 24.0 5.6 39.3 25 25 A H T 3< S+ 0 0 70 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.1 -0.004 87.2 147.1-120.2 26.9 21.6 2.6 39.0 26 26 A H <> - 0 0 18 -3,-1.3 4,-2.4 1,-0.1 3,-0.3 -0.177 63.8-110.4 -58.7 152.0 18.7 4.3 40.8 27 27 A A H > S+ 0 0 66 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.874 120.1 56.7 -52.2 -38.4 15.1 3.5 39.8 28 28 A F H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.931 107.6 48.0 -60.3 -43.2 14.8 7.0 38.4 29 29 A V H > S+ 0 0 0 -3,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.907 108.9 52.9 -64.8 -40.4 17.7 6.4 36.1 30 30 A E H X S+ 0 0 58 -4,-2.4 4,-2.3 1,-0.2 6,-0.3 0.889 107.1 53.6 -63.9 -35.8 16.3 3.0 35.0 31 31 A G H X>S+ 0 0 5 -4,-2.2 6,-1.5 2,-0.2 5,-1.2 0.870 108.7 48.1 -61.5 -41.7 13.1 4.9 34.2 32 32 A L H ><5S+ 0 0 0 -4,-1.9 3,-0.5 3,-0.2 128,-0.4 0.928 112.6 50.6 -61.6 -44.3 15.0 7.3 32.0 33 33 A K H 3<5S+ 0 0 43 -4,-2.6 123,-2.1 1,-0.2 124,-1.1 0.896 119.6 33.1 -61.5 -47.8 16.8 4.3 30.4 34 34 A A H 3<5S- 0 0 37 -4,-2.3 -1,-0.2 121,-0.2 -2,-0.2 0.395 106.0-120.8 -89.1 -2.0 13.7 2.3 29.5 35 35 A G T <<5S+ 0 0 18 -4,-0.7 -3,-0.2 -3,-0.5 -4,-0.1 0.740 82.8 116.7 62.1 25.0 11.5 5.4 28.9 36 36 A T < + 0 0 104 -5,-1.2 -4,-0.2 -6,-0.3 -5,-0.1 0.523 33.4 113.6-100.5 -10.6 9.2 4.2 31.6 37 37 A L S S- 0 0 8 -6,-1.5 2,-0.1 -9,-0.1 -9,-0.0 -0.443 77.8-109.0 -57.9 130.1 9.6 7.1 34.1 38 38 A P >> - 0 0 82 0, 0.0 4,-2.3 0, 0.0 3,-0.6 -0.368 16.9-125.2 -68.2 145.2 6.3 9.0 34.3 39 39 A R H 3> S+ 0 0 192 1,-0.3 4,-3.0 2,-0.2 5,-0.3 0.877 110.3 56.9 -52.7 -44.5 6.1 12.4 32.6 40 40 A E H 3> S+ 0 0 77 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.879 107.9 46.9 -57.3 -41.1 4.9 14.0 35.8 41 41 A A H <> S+ 0 0 5 -3,-0.6 4,-2.5 2,-0.2 -1,-0.2 0.903 112.5 50.3 -67.5 -43.8 8.0 12.8 37.7 42 42 A F H X S+ 0 0 30 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.940 111.7 47.1 -61.4 -46.0 10.3 14.0 34.9 43 43 A L H X S+ 0 0 56 -4,-3.0 4,-2.0 2,-0.2 -1,-0.2 0.876 111.5 50.5 -64.9 -40.4 8.8 17.4 34.8 44 44 A H H X S+ 0 0 27 -4,-1.9 4,-2.3 -5,-0.3 5,-0.3 0.931 111.0 50.3 -59.0 -46.1 8.9 17.8 38.6 45 45 A Y H X S+ 0 0 0 -4,-2.5 4,-2.8 177,-0.3 -2,-0.2 0.913 108.4 52.7 -60.0 -41.4 12.6 16.7 38.4 46 46 A L H X S+ 0 0 11 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.905 109.8 47.4 -60.6 -46.3 13.2 19.3 35.7 47 47 A Q H X S+ 0 0 57 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.923 115.3 44.7 -62.2 -46.9 11.8 22.2 37.7 48 48 A Q H X S+ 0 0 10 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.895 109.8 56.3 -65.3 -37.5 13.7 21.2 40.9 49 49 A D H X S+ 0 0 7 -4,-2.8 4,-2.6 -5,-0.3 -1,-0.2 0.849 100.3 60.3 -66.1 -27.4 16.8 20.7 38.8 50 50 A Y H X S+ 0 0 29 -4,-1.6 4,-1.2 2,-0.2 -1,-0.2 0.929 109.9 40.8 -62.9 -44.6 16.4 24.4 37.6 51 51 A V H X S+ 0 0 18 -4,-1.3 4,-1.7 2,-0.2 3,-0.3 0.909 112.4 55.9 -67.1 -42.4 16.8 25.5 41.2 52 52 A F H X S+ 0 0 6 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.919 105.1 53.5 -56.9 -44.9 19.5 23.0 41.8 53 53 A L H X S+ 0 0 6 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.834 102.2 57.5 -62.3 -32.9 21.5 24.5 38.9 54 54 A I H X S+ 0 0 62 -4,-1.2 4,-1.8 -3,-0.3 -1,-0.2 0.968 114.9 36.5 -57.6 -54.3 21.3 28.0 40.3 55 55 A H H X S+ 0 0 27 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.844 115.0 54.1 -74.2 -33.0 23.0 26.9 43.5 56 56 A F H X S+ 0 0 10 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.892 107.8 52.3 -66.6 -38.6 25.3 24.4 41.8 57 57 A S H X S+ 0 0 9 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.904 108.1 51.2 -60.5 -43.9 26.5 27.3 39.6 58 58 A R H X S+ 0 0 109 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.896 107.6 53.3 -60.0 -38.9 27.1 29.4 42.7 59 59 A A H X S+ 0 0 1 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.900 108.0 49.4 -65.1 -39.4 29.2 26.5 44.1 60 60 A W H X S+ 0 0 0 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.887 108.8 52.8 -68.1 -32.9 31.3 26.4 41.0 61 61 A A H >X S+ 0 0 42 -4,-2.3 4,-1.7 1,-0.2 3,-0.5 0.925 105.6 55.6 -65.0 -39.4 31.8 30.2 41.3 62 62 A L H 3X S+ 0 0 14 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.879 99.6 60.4 -58.0 -35.2 33.0 29.5 44.9 63 63 A A H 3< S+ 0 0 0 -4,-1.5 4,-0.5 1,-0.2 -1,-0.2 0.865 102.1 52.1 -61.0 -38.1 35.5 27.1 43.4 64 64 A V H X< S+ 0 0 28 -4,-1.2 3,-1.3 -3,-0.5 -1,-0.2 0.950 109.4 49.1 -57.8 -49.4 37.0 30.1 41.5 65 65 A V H 3< S+ 0 0 112 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.866 113.2 47.4 -58.7 -37.5 37.2 32.0 44.8 66 66 A K T 3< S+ 0 0 55 -4,-2.3 64,-0.5 -5,-0.2 -1,-0.3 0.468 88.9 114.2 -88.7 0.4 38.9 29.0 46.5 67 67 A S < - 0 0 17 -3,-1.3 3,-0.0 -4,-0.5 -3,-0.0 -0.429 44.5-170.2 -72.5 146.6 41.4 28.5 43.7 68 68 A E + 0 0 113 -2,-0.1 2,-0.3 1,-0.0 -1,-0.1 0.671 67.8 48.2-105.4 -25.6 45.1 29.1 44.3 69 69 A T S > S- 0 0 36 1,-0.1 4,-2.2 0, 0.0 5,-0.2 -0.799 81.7-118.8-118.4 156.9 46.6 28.9 40.7 70 70 A H H > S+ 0 0 139 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.895 116.8 57.0 -60.8 -35.1 45.5 30.6 37.5 71 71 A S H > S+ 0 0 77 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.892 105.9 46.4 -61.7 -46.9 45.0 27.0 36.2 72 72 A E H > S+ 0 0 5 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.934 113.5 50.8 -58.6 -44.4 42.5 26.1 38.9 73 73 A X H X S+ 0 0 76 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.907 109.7 49.0 -64.9 -43.7 40.7 29.3 38.4 74 74 A L H X S+ 0 0 93 -4,-2.8 4,-2.9 2,-0.2 -1,-0.2 0.891 110.1 50.9 -64.2 -39.2 40.4 28.9 34.7 75 75 A A H X S+ 0 0 34 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.931 114.4 43.8 -63.8 -45.9 39.1 25.3 35.0 76 76 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.904 112.9 51.3 -64.6 -41.9 36.4 26.5 37.5 77 77 A V H X S+ 0 0 60 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.931 107.7 54.9 -60.7 -44.9 35.6 29.6 35.4 78 78 A G H X S+ 0 0 39 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.911 109.7 46.0 -50.3 -48.6 35.2 27.2 32.4 79 79 A T H X S+ 0 0 22 -4,-1.9 4,-0.8 2,-0.2 -2,-0.2 0.871 106.8 56.7 -67.2 -40.7 32.7 25.1 34.4 80 80 A V H >X S+ 0 0 26 -4,-2.5 4,-2.9 -20,-0.2 3,-0.6 0.918 112.3 44.0 -56.9 -40.9 30.7 28.1 35.6 81 81 A N H 3X S+ 0 0 85 -4,-2.3 4,-1.5 1,-0.2 6,-0.3 0.927 106.1 58.5 -67.7 -45.9 30.2 29.1 31.9 82 82 A A H 3<>S+ 0 0 44 -4,-2.5 5,-1.2 1,-0.2 -1,-0.2 0.690 121.4 30.7 -50.8 -20.1 29.4 25.5 31.0 83 83 A L H <<>S+ 0 0 10 -4,-0.8 5,-2.5 -3,-0.6 -2,-0.2 0.768 127.7 32.7-107.7 -39.2 26.6 26.0 33.6 84 84 A V H <5S+ 0 0 70 -4,-2.9 -3,-0.2 3,-0.2 -2,-0.1 0.689 126.2 35.2-106.0 -27.7 25.5 29.7 33.6 85 85 A A T <5S+ 0 0 63 -4,-1.5 -1,-0.2 -5,-0.3 -4,-0.1 -0.109 138.9 11.5-110.8 29.8 26.0 30.8 30.0 86 86 A E T >5S+ 0 0 37 -3,-0.2 4,-2.4 0, 0.0 5,-0.3 0.061 122.1 40.8-158.6 -78.4 24.9 27.4 28.6 87 87 A E H > S+ 0 0 120 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.877 116.2 46.7 -65.0 -36.4 19.7 28.8 29.7 90 90 A L H X S+ 0 0 133 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.907 109.6 55.0 -65.9 -44.7 19.2 25.5 27.7 91 91 A H H X S+ 0 0 16 -4,-2.3 4,-2.6 -5,-0.3 -2,-0.2 0.882 104.6 52.0 -56.1 -43.6 17.5 23.9 30.7 92 92 A I H X S+ 0 0 36 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.899 109.0 52.4 -59.3 -40.2 14.9 26.8 30.8 93 93 A G H X S+ 0 0 36 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.888 109.0 49.4 -62.6 -40.6 14.3 26.1 27.1 94 94 A I H X S+ 0 0 44 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.931 112.7 46.2 -65.1 -47.2 13.7 22.4 27.9 95 95 A C H <>S+ 0 0 3 -4,-2.6 5,-1.9 1,-0.2 -2,-0.2 0.918 114.1 50.0 -55.6 -46.9 11.2 23.3 30.7 96 96 A E H ><5S+ 0 0 121 -4,-2.7 3,-1.3 1,-0.2 -2,-0.2 0.884 108.6 50.2 -63.8 -42.4 9.6 25.8 28.4 97 97 A A H 3<5S+ 0 0 92 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.792 109.7 53.8 -64.6 -29.8 9.2 23.2 25.6 98 98 A S T 3<5S- 0 0 55 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.296 128.0 -98.0 -86.8 6.1 7.7 20.8 28.2 99 99 A G T < 5S+ 0 0 67 -3,-1.3 2,-0.5 1,-0.2 -3,-0.2 0.158 75.9 136.6 107.1 -17.9 5.0 23.4 29.2 100 100 A I < - 0 0 32 -5,-1.9 -1,-0.2 -6,-0.1 -2,-0.1 -0.539 49.4-130.3 -74.4 116.3 6.4 25.1 32.4 101 101 A S > - 0 0 65 -2,-0.5 4,-1.4 1,-0.1 5,-0.1 -0.044 12.6-123.0 -51.7 159.5 6.1 28.9 32.4 102 102 A Q H > S+ 0 0 43 2,-0.2 4,-1.6 3,-0.1 -1,-0.1 0.823 112.6 47.8 -78.5 -34.5 9.0 31.3 33.3 103 103 A E H > S+ 0 0 72 2,-0.2 4,-1.7 1,-0.2 -1,-0.1 0.915 112.8 48.0 -70.6 -44.9 7.2 32.9 36.2 104 104 A A H 4 S+ 0 0 50 2,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.867 110.9 52.6 -61.2 -39.8 6.1 29.5 37.6 105 105 A L H >< S+ 0 0 2 -4,-1.4 3,-1.5 1,-0.2 -1,-0.2 0.900 107.9 50.8 -59.8 -43.8 9.7 28.3 37.2 106 106 A F H 3< S+ 0 0 132 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.844 109.1 51.4 -68.6 -30.2 10.9 31.3 39.2 107 107 A A T 3< S+ 0 0 80 -4,-1.7 2,-0.4 -5,-0.1 -1,-0.3 0.085 80.1 146.1 -87.3 20.7 8.4 30.6 42.0 108 108 A T < - 0 0 21 -3,-1.5 2,-0.6 1,-0.1 -3,-0.1 -0.482 48.5-134.3 -67.1 121.0 9.7 26.9 42.2 109 109 A R - 0 0 188 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 -0.650 23.4-124.7 -73.7 119.5 9.4 25.8 45.8 110 110 A E - 0 0 37 -2,-0.6 2,-0.1 1,-0.1 -1,-0.1 -0.447 21.1-129.6 -71.1 122.3 12.7 24.0 46.6 111 111 A R >> - 0 0 46 -2,-0.3 4,-2.6 1,-0.1 3,-0.7 -0.393 18.9-117.0 -67.4 150.2 12.2 20.5 47.9 112 112 A A H 3> S+ 0 0 66 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.863 116.4 53.6 -54.9 -42.7 14.1 19.5 51.1 113 113 A E H 3> S+ 0 0 58 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.798 112.1 46.3 -63.5 -31.4 16.1 16.9 49.3 114 114 A N H <> S+ 0 0 0 -3,-0.7 4,-2.4 2,-0.2 5,-0.2 0.956 114.7 44.5 -71.9 -58.1 17.2 19.6 46.8 115 115 A L H X S+ 0 0 75 -4,-2.6 4,-2.7 1,-0.2 5,-0.4 0.908 110.2 58.1 -52.8 -45.6 18.0 22.2 49.4 116 116 A A H X S+ 0 0 40 -4,-3.0 4,-1.9 -5,-0.3 -1,-0.2 0.925 110.4 42.4 -55.2 -46.2 19.9 19.6 51.5 117 117 A Y H X S+ 0 0 0 -4,-1.1 4,-2.1 -5,-0.2 -1,-0.2 0.943 116.2 43.3 -69.2 -53.0 22.2 18.8 48.7 118 118 A T H X S+ 0 0 4 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.907 115.7 48.9 -65.4 -36.8 23.0 22.3 47.4 119 119 A R H X S+ 0 0 88 -4,-2.7 4,-2.5 -5,-0.2 5,-0.3 0.887 109.2 54.8 -70.1 -33.2 23.4 23.7 50.9 120 120 A F H X S+ 0 0 52 -4,-1.9 4,-2.1 -5,-0.4 -1,-0.2 0.933 111.6 43.0 -59.3 -47.4 25.7 20.8 51.8 121 121 A V H X S+ 0 0 2 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.944 115.5 47.9 -68.6 -46.1 28.0 21.5 48.9 122 122 A L H X S+ 0 0 10 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.924 113.4 47.4 -61.0 -46.3 28.1 25.3 49.3 123 123 A E H X S+ 0 0 109 -4,-2.5 4,-2.8 1,-0.2 5,-0.4 0.897 108.5 54.9 -66.5 -37.7 28.8 25.0 53.1 124 124 A A H X S+ 0 0 13 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.892 111.7 45.9 -57.0 -42.9 31.5 22.4 52.5 125 125 A G H < S+ 0 0 0 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.885 114.1 45.9 -67.6 -44.5 33.1 24.9 50.1 126 126 A Y H < S+ 0 0 145 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.941 121.3 37.7 -67.2 -43.6 32.8 27.9 52.4 127 127 A S H < S+ 0 0 87 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.821 123.9 33.4 -79.2 -34.9 34.0 26.1 55.5 128 128 A G S < S- 0 0 24 -4,-2.3 2,-0.1 -5,-0.4 -3,-0.0 -0.041 91.3 -91.0-101.0-151.4 36.7 23.9 53.9 129 129 A D > - 0 0 59 -2,-0.0 4,-1.9 0, 0.0 3,-0.3 -0.409 53.3 -73.1-112.0-170.1 39.1 24.5 51.0 130 130 A L H > S+ 0 0 2 -64,-0.5 4,-2.6 1,-0.2 5,-0.2 0.836 129.0 56.2 -55.6 -36.0 38.9 23.8 47.3 131 131 A L H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.893 106.2 49.6 -68.7 -39.8 39.4 20.1 47.8 132 132 A D H > S+ 0 0 13 -3,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.907 113.3 47.7 -58.7 -46.3 36.4 19.8 50.2 133 133 A L H X S+ 0 0 0 -4,-1.9 4,-1.9 -9,-0.2 -2,-0.2 0.920 112.6 46.8 -63.7 -44.6 34.3 21.7 47.6 134 134 A L H X S+ 0 0 3 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.882 109.2 55.4 -68.5 -35.3 35.4 19.5 44.7 135 135 A A H < S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.876 111.4 45.2 -59.7 -39.3 34.8 16.4 46.7 136 136 A A H < S+ 0 0 0 -4,-1.5 4,-0.4 1,-0.2 -2,-0.2 0.792 116.5 44.3 -73.7 -33.6 31.3 17.6 47.3 137 137 A L H X S+ 0 0 1 -4,-1.9 4,-2.0 1,-0.1 3,-0.3 0.689 95.4 78.7 -81.4 -24.8 30.7 18.6 43.6 138 138 A A H X>S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 5,-0.7 0.869 85.0 57.8 -61.5 -40.3 32.2 15.5 42.0 139 139 A P H >5S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 5,-0.3 0.925 110.2 44.7 -61.1 -40.1 29.3 13.1 42.5 140 140 A C H >5S+ 0 0 10 -4,-0.4 4,-1.9 -3,-0.3 5,-0.2 0.966 119.1 40.9 -59.8 -55.9 27.0 15.4 40.6 141 141 A V H X5S+ 0 0 9 -4,-2.0 4,-1.4 1,-0.2 -3,-0.2 0.977 125.5 32.9 -59.9 -58.1 29.4 16.0 37.7 142 142 A X H X5S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.809 114.6 57.8 -75.3 -33.0 30.9 12.5 37.3 143 143 A G H XX S+ 0 0 33 -4,-2.5 4,-2.7 1,-0.2 3,-0.5 0.937 112.5 49.2 -60.7 -47.3 25.8 4.1 30.2 151 151 A L H 3X S+ 0 0 1 -4,-2.8 4,-2.6 1,-0.3 -1,-0.2 0.805 103.3 61.4 -69.4 -25.7 22.4 5.1 28.9 152 152 A T H 3< S+ 0 0 79 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.887 115.3 34.7 -62.0 -39.8 23.9 6.1 25.5 153 153 A A H << S+ 0 0 90 -4,-1.2 -2,-0.2 -3,-0.5 -1,-0.2 0.845 131.1 31.1 -77.6 -36.3 24.9 2.4 25.3 154 154 A E H < S+ 0 0 87 -4,-2.7 -3,-0.2 -5,-0.1 -2,-0.2 0.487 76.8 124.5-111.7 -8.5 21.8 0.9 27.1 155 155 A A < - 0 0 37 -4,-2.6 -121,-0.2 -5,-0.2 -122,-0.1 -0.313 35.2-169.0 -60.3 138.3 18.6 3.0 26.5 156 156 A T S S+ 0 0 117 -123,-2.1 2,-0.3 1,-0.1 -122,-0.2 0.334 72.2 44.6-106.8 3.9 15.7 1.1 25.1 157 157 A S - 0 0 39 -124,-1.1 3,-0.2 -125,-0.2 -122,-0.2 -0.994 61.0-149.8-142.3 150.7 13.7 4.2 24.4 158 158 A T S > S+ 0 0 129 -2,-0.3 3,-2.4 1,-0.2 4,-0.3 0.350 73.5 104.7 -93.3 4.4 14.3 7.7 22.9 159 159 A L T 3 S+ 0 0 108 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 0.917 96.0 27.1 -50.6 -48.2 11.6 9.3 25.1 160 160 A Y T 3> S+ 0 0 15 -128,-0.4 4,-2.5 -3,-0.2 -1,-0.3 -0.051 87.8 124.9-102.7 30.6 14.3 10.8 27.4 161 161 A G H <> + 0 0 11 -3,-2.4 4,-3.0 1,-0.2 5,-0.2 0.811 68.5 56.6 -60.5 -34.9 16.9 10.9 24.5 162 162 A D H > S+ 0 0 141 -4,-0.3 4,-1.7 -3,-0.3 -1,-0.2 0.929 110.0 44.5 -64.7 -46.2 17.6 14.6 24.9 163 163 A W H > S+ 0 0 16 2,-0.2 4,-1.9 1,-0.2 5,-0.3 0.960 116.9 46.4 -60.0 -49.0 18.5 14.1 28.6 164 164 A I H X S+ 0 0 5 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.900 112.7 48.9 -62.2 -42.6 20.7 11.0 27.7 165 165 A D H X S+ 0 0 100 -4,-3.0 4,-0.6 2,-0.2 -1,-0.2 0.779 107.0 57.7 -73.7 -24.7 22.4 12.7 24.8 166 166 A T H < S+ 0 0 71 -4,-1.7 6,-0.4 -3,-0.3 3,-0.4 0.972 117.9 29.8 -61.1 -56.7 23.1 15.8 27.0 167 167 A Y H < S+ 0 0 13 -4,-1.9 -18,-0.3 1,-0.2 -2,-0.2 0.792 124.6 46.9 -84.1 -23.8 25.1 13.8 29.6 168 168 A G H < S+ 0 0 16 -4,-2.7 -1,-0.2 -20,-0.4 -3,-0.2 0.561 92.9 106.2 -86.2 -10.7 26.4 11.1 27.2 169 169 A G S X S- 0 0 23 -4,-0.6 4,-2.4 -3,-0.4 5,-0.2 -0.215 83.2-110.7 -77.5 162.0 27.5 13.6 24.6 170 170 A D H > S+ 0 0 141 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.850 113.7 56.4 -60.9 -38.4 31.1 14.6 23.9 171 171 A D H > S+ 0 0 148 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.948 112.1 41.3 -60.6 -48.6 30.8 18.1 25.3 172 172 A Y H > S+ 0 0 31 -6,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.913 114.7 51.6 -66.8 -41.6 29.6 16.9 28.7 173 173 A Q H X S+ 0 0 26 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.919 109.3 50.7 -60.8 -42.7 32.0 14.0 28.8 174 174 A A H X S+ 0 0 59 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.895 109.0 51.8 -60.4 -38.5 34.9 16.4 28.0 175 175 A A H X S+ 0 0 34 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.915 108.1 51.6 -68.1 -37.4 33.7 18.6 30.8 176 176 A C H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.893 109.5 49.8 -60.6 -44.9 33.7 15.6 33.2 177 177 A K H X S+ 0 0 88 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.885 108.8 53.0 -63.0 -38.3 37.3 14.8 32.2 178 178 A A H X S+ 0 0 54 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.901 108.7 48.7 -64.2 -41.5 38.3 18.4 32.8 179 179 A V H X S+ 0 0 6 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.899 109.4 53.8 -63.9 -37.1 36.8 18.4 36.3 180 180 A G H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -172,-0.3 0.880 108.8 48.6 -62.7 -39.0 38.7 15.1 36.9 181 181 A T H X S+ 0 0 78 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.908 111.2 50.3 -68.2 -43.6 42.0 16.7 35.8 182 182 A L H X S+ 0 0 9 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.918 111.3 48.5 -57.7 -46.0 41.3 19.7 38.1 183 183 A L H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.953 114.2 45.7 -64.3 -46.2 40.6 17.4 41.0 184 184 A D H X S+ 0 0 34 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.912 115.8 45.9 -62.0 -45.0 43.8 15.4 40.4 185 185 A D H X S+ 0 0 79 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.914 112.8 49.7 -66.0 -43.6 45.9 18.5 40.0 186 186 A A H X S+ 0 0 0 -4,-3.0 4,-1.9 -5,-0.2 5,-0.2 0.887 112.8 48.2 -60.5 -44.1 44.4 20.2 43.1 187 187 A L H X>S+ 0 0 0 -4,-2.5 4,-3.3 -5,-0.2 5,-0.7 0.925 113.4 45.8 -61.5 -48.3 45.0 17.1 45.2 188 188 A E H X5S+ 0 0 107 -4,-2.2 4,-1.4 -5,-0.2 -2,-0.2 0.905 111.6 52.6 -65.9 -40.5 48.6 16.7 44.1 189 189 A R H <5S+ 0 0 134 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.922 122.7 28.6 -57.3 -47.1 49.4 20.4 44.5 190 190 A R H <5S+ 0 0 51 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.868 135.7 23.1 -85.6 -41.9 48.1 20.5 48.1 191 191 A L H <5S- 0 0 47 -4,-3.3 -3,-0.2 1,-0.2 3,-0.2 0.545 104.4-117.3-109.7 -10.1 48.6 16.9 49.4 192 192 A G ><< - 0 0 30 -4,-1.4 3,-0.7 -5,-0.7 -1,-0.2 -0.203 42.0 -60.1 96.0 170.5 51.4 15.5 47.2 193 193 A A T 3 S+ 0 0 81 1,-0.3 2,-1.0 2,-0.1 3,-0.2 0.864 133.8 54.0 -58.6 -40.3 51.7 12.7 44.8 194 194 A E T > S+ 0 0 65 1,-0.2 3,-2.1 -3,-0.2 -1,-0.3 -0.357 70.0 152.5 -90.2 56.2 50.8 10.2 47.5 195 195 A F G X + 0 0 18 -2,-1.0 3,-1.4 -3,-0.7 6,-0.3 0.753 60.3 68.3 -64.3 -21.9 47.6 12.1 48.4 196 196 A T G 3 S+ 0 0 70 1,-0.3 -1,-0.3 -3,-0.2 6,-0.1 0.640 92.1 63.3 -71.6 -10.2 45.8 8.9 49.7 197 197 A S G < S+ 0 0 100 -3,-2.1 -1,-0.3 -6,-0.1 -2,-0.2 0.533 81.9 98.5 -90.4 -7.5 48.3 8.9 52.6 198 198 A S S X> S- 0 0 28 -3,-1.4 3,-1.5 -4,-0.2 4,-0.5 -0.585 79.7-129.4 -73.9 140.7 47.1 12.2 54.0 199 199 A P H >> S+ 0 0 117 0, 0.0 4,-0.8 0, 0.0 3,-0.5 0.793 108.5 67.6 -57.0 -24.3 44.7 12.2 56.9 200 200 A R H 3> S+ 0 0 62 1,-0.2 4,-2.6 2,-0.2 3,-0.2 0.785 83.1 73.9 -62.3 -30.4 42.6 14.6 54.7 201 201 A W H <> S+ 0 0 18 -3,-1.5 4,-2.7 -6,-0.3 5,-0.2 0.904 94.1 49.9 -56.0 -43.0 41.9 11.8 52.2 202 202 A S H < S+ 0 0 0 -4,-2.7 3,-1.5 1,-0.2 -1,-0.2 0.887 106.1 56.6 -57.2 -44.6 12.6 13.2 45.4 222 222 A G H 3< S+ 0 0 0 -4,-2.2 -177,-0.3 1,-0.3 -1,-0.2 0.856 104.8 50.8 -58.4 -35.8 12.2 13.0 41.7 223 223 A L T 3< S+ 0 0 56 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.519 106.5 59.9 -75.9 -6.2 10.1 9.9 41.9 224 224 A T < 0 0 60 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.1 -0.466 360.0 360.0-127.7 58.0 7.8 11.6 44.5 225 225 A P 0 0 107 0, 0.0 -184,-0.1 0, 0.0 -3,-0.1 -0.240 360.0 360.0 -58.2 360.0 6.3 14.7 42.9