==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 10-DEC-10 3PXP . COMPND 2 MOLECULE: HELIX-TURN-HELIX DOMAIN PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CHLOROFLEXUS AURANTIACUS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 870 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40842.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 585 67.2 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 . 108 12.4 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 . 9 1.0 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 . 36 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 323 37.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.4 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 1 4 4 3 3 6 7 0 4 7 0 0 3 0 0 0 0 0 0 0 0 0 0 0 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 . 6 0 6 0 3 0 3 3 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 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 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 0 A G 0 0 24 0, 0.0 2,-0.3 0, 0.0 77,-0.2 0.000 360.0 360.0 360.0 179.4 32.7 -12.3 0.9 2 1 A X - 0 0 25 76,-1.4 81,-0.1 79,-0.3 2,-0.1 -0.975 360.0-102.7-137.8 154.5 34.0 -15.9 0.6 3 2 A E > - 0 0 132 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.384 42.7-110.3 -71.6 152.0 33.3 -19.0 -1.5 4 3 A R H > S+ 0 0 73 1,-0.2 4,-2.1 2,-0.2 44,-0.2 0.839 117.4 51.0 -54.6 -39.6 31.2 -21.6 0.3 5 4 A A H > S+ 0 0 61 43,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.907 111.9 46.6 -67.5 -41.4 34.1 -24.1 0.6 6 5 A A H > S+ 0 0 48 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.887 113.2 49.4 -66.3 -40.9 36.4 -21.4 2.1 7 6 A F H X S+ 0 0 2 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.872 109.2 53.5 -65.0 -38.2 33.6 -20.3 4.5 8 7 A G H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.892 107.8 49.3 -61.4 -41.5 33.2 -24.0 5.5 9 8 A K H X S+ 0 0 118 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.809 108.9 54.3 -69.0 -29.3 36.9 -24.3 6.3 10 9 A L H X S+ 0 0 2 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.940 107.8 48.4 -68.6 -47.6 36.6 -21.1 8.4 11 10 A V H X S+ 0 0 1 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.918 111.8 50.8 -58.9 -45.0 33.7 -22.6 10.5 12 11 A Q H X S+ 0 0 42 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.929 111.8 46.4 -58.1 -48.3 35.8 -25.8 11.0 13 12 A A H X S+ 0 0 10 -4,-2.1 4,-0.6 2,-0.2 -2,-0.2 0.903 113.4 49.1 -63.1 -43.0 38.8 -23.8 12.2 14 13 A L H >< S+ 0 0 2 -4,-2.7 3,-0.9 1,-0.2 4,-0.3 0.909 111.3 49.7 -63.2 -42.9 36.7 -21.6 14.6 15 14 A R H >< S+ 0 0 19 -4,-2.7 3,-1.7 1,-0.2 11,-0.6 0.911 107.6 54.0 -60.4 -45.0 35.0 -24.8 16.0 16 15 A R H 3< S+ 0 0 130 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.593 94.7 69.0 -71.7 -9.7 38.4 -26.4 16.6 17 16 A E T << S+ 0 0 41 -3,-0.9 -1,-0.3 -4,-0.6 2,-0.2 0.593 91.9 85.7 -78.9 -11.9 39.7 -23.3 18.6 18 17 A H < - 0 0 31 -3,-1.7 8,-1.5 -4,-0.3 2,-0.4 -0.644 57.8-165.0 -98.3 151.9 37.1 -24.4 21.3 19 18 A R B -A 25 0A 135 -2,-0.2 6,-0.2 6,-0.2 5,-0.1 -0.997 20.5-139.3-130.2 127.3 37.3 -26.8 24.2 20 19 A D > - 0 0 23 4,-2.6 3,-1.8 -2,-0.4 6,-0.0 0.036 41.9 -75.6 -73.4-171.8 34.0 -27.9 25.9 21 20 A E T 3 S+ 0 0 130 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.720 135.0 50.0 -57.6 -31.7 33.3 -28.4 29.6 22 21 A K T 3 S- 0 0 145 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.256 121.3-109.2 -91.9 7.8 35.3 -31.8 29.6 23 22 A G S < S+ 0 0 49 -3,-1.8 2,-0.2 1,-0.2 -2,-0.1 0.530 73.0 141.5 75.2 12.4 38.2 -30.0 27.9 24 23 A R - 0 0 173 1,-0.1 -4,-2.6 -5,-0.1 -1,-0.2 -0.618 61.0-102.8 -89.2 144.1 37.6 -31.8 24.5 25 24 A V B -A 19 0A 66 -2,-0.2 -6,-0.2 -6,-0.2 -9,-0.1 -0.381 51.1 -97.4 -58.9 135.7 38.0 -30.1 21.1 26 25 A W - 0 0 13 -8,-1.5 2,-0.2 -11,-0.6 -1,-0.1 -0.401 41.5-156.9 -62.8 129.0 34.5 -29.2 19.8 27 26 A T > - 0 0 60 -2,-0.1 4,-2.3 -3,-0.1 5,-0.2 -0.468 35.7 -99.6 -92.9 174.1 33.2 -31.8 17.3 28 27 A Q H > S+ 0 0 33 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.890 126.9 56.0 -61.0 -38.2 30.6 -31.2 14.7 29 28 A E H > S+ 0 0 110 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.875 107.8 47.3 -58.9 -45.1 28.1 -32.8 17.1 30 29 A V H > S+ 0 0 25 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.921 113.3 47.2 -65.9 -46.1 29.0 -30.3 19.9 31 30 A L H X S+ 0 0 0 -4,-2.3 4,-1.5 2,-0.2 6,-0.2 0.914 112.7 50.6 -62.6 -40.4 28.7 -27.3 17.5 32 31 A A H X>S+ 0 0 7 -4,-2.8 5,-2.0 1,-0.2 4,-0.9 0.932 112.0 47.5 -58.2 -47.8 25.3 -28.8 16.3 33 32 A E H ><5S+ 0 0 110 -4,-2.4 3,-0.6 1,-0.2 -2,-0.2 0.896 111.6 49.3 -60.1 -48.6 24.1 -29.1 19.9 34 33 A R H 3<5S+ 0 0 75 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.715 118.1 40.1 -66.5 -25.5 25.3 -25.5 20.8 35 34 A T H 3<5S- 0 0 1 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.462 104.3-127.4-100.5 -6.8 23.4 -24.0 17.8 36 35 A Q T <<5 + 0 0 134 -4,-0.9 -3,-0.2 -3,-0.6 -4,-0.1 0.776 69.6 130.5 61.2 29.9 20.3 -26.3 18.1 37 36 A L < - 0 0 26 -5,-2.0 -1,-0.2 -6,-0.2 -2,-0.2 -0.741 68.0 -93.8-107.7 155.1 21.0 -27.2 14.4 38 37 A P >> - 0 0 79 0, 0.0 4,-1.5 0, 0.0 3,-0.6 -0.433 29.1-123.6 -68.2 147.3 21.2 -30.8 12.9 39 38 A K H 3> S+ 0 0 67 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.868 113.2 60.0 -53.7 -38.9 24.7 -32.3 12.7 40 39 A R H 3> S+ 0 0 166 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.845 101.8 52.7 -60.5 -35.6 24.1 -32.7 8.9 41 40 A T H <> S+ 0 0 28 -3,-0.6 4,-2.3 2,-0.2 -1,-0.2 0.915 111.3 45.4 -65.9 -44.5 23.6 -28.9 8.5 42 41 A I H X S+ 0 0 1 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.899 113.2 51.9 -63.0 -42.1 27.0 -28.3 10.3 43 42 A E H X S+ 0 0 75 -4,-2.7 4,-1.7 2,-0.2 -2,-0.2 0.914 111.7 45.3 -59.6 -46.6 28.5 -31.0 8.1 44 43 A R H X>S+ 0 0 92 -4,-2.5 5,-2.3 2,-0.2 6,-0.7 0.841 113.2 50.4 -68.7 -37.1 27.2 -29.3 4.9 45 44 A I H ><5S+ 0 0 4 -4,-2.3 3,-0.9 3,-0.2 -2,-0.2 0.948 112.5 46.8 -65.0 -47.6 28.3 -25.8 6.1 46 45 A E H 3<5S+ 0 0 7 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.805 115.5 45.0 -67.5 -30.0 31.8 -27.2 6.8 47 46 A N H 3<5S- 0 0 108 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.465 110.4-121.9 -88.0 -8.5 32.0 -29.0 3.3 48 47 A G T <<5S+ 0 0 23 -3,-0.9 -43,-0.2 -4,-0.6 -3,-0.2 0.769 76.4 125.0 70.1 30.5 30.6 -25.9 1.5 49 48 A S < + 0 0 51 -5,-2.3 2,-0.7 -6,-0.1 -4,-0.2 0.234 43.4 92.4-103.9 12.2 27.7 -27.9 0.1 50 49 A L - 0 0 36 -6,-0.7 -1,-0.1 1,-0.1 -2,-0.0 -0.912 56.4-168.1-111.0 102.2 25.0 -25.5 1.5 51 50 A A S S+ 0 0 65 -2,-0.7 2,-0.5 1,-0.1 -1,-0.1 0.839 72.9 43.3 -56.6 -45.7 24.2 -22.9 -1.2 52 51 A H - 0 0 154 2,-0.0 2,-0.6 0, 0.0 -1,-0.1 -0.936 63.2-167.2-113.8 129.0 22.1 -20.5 1.0 53 52 A L - 0 0 17 -2,-0.5 -2,-0.0 26,-0.2 -3,-0.0 -0.923 20.3-151.5-113.1 98.3 23.2 -19.5 4.5 54 53 A D > - 0 0 77 -2,-0.6 4,-2.0 1,-0.1 5,-0.1 -0.266 24.8-107.9 -73.2 161.3 20.2 -17.8 6.3 55 54 A A H > S+ 0 0 48 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.847 116.1 56.1 -54.1 -45.9 20.5 -15.2 9.1 56 55 A D H > S+ 0 0 100 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.925 109.7 46.7 -55.9 -48.1 19.2 -17.6 11.9 57 56 A I H > S+ 0 0 15 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.928 114.6 46.5 -58.5 -50.6 22.0 -20.1 11.1 58 57 A L H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.905 114.2 46.7 -62.7 -43.3 24.7 -17.3 11.0 59 58 A L H X S+ 0 0 19 -4,-2.9 4,-2.5 2,-0.2 -1,-0.2 0.905 112.9 49.8 -64.8 -43.1 23.5 -15.7 14.2 60 59 A R H X S+ 0 0 101 -4,-2.7 4,-2.7 -5,-0.2 -2,-0.2 0.911 112.9 47.5 -60.4 -45.3 23.4 -19.1 16.0 61 60 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.923 113.9 46.4 -62.1 -47.1 26.9 -19.9 14.7 62 61 A A H <>S+ 0 0 0 -4,-2.6 5,-1.8 1,-0.2 4,-0.3 0.879 115.7 46.3 -64.5 -40.7 28.4 -16.5 15.8 63 62 A D H ><5S+ 0 0 99 -4,-2.5 3,-0.8 2,-0.2 -2,-0.2 0.919 115.9 44.1 -66.3 -48.6 26.6 -16.8 19.2 64 63 A A H 3<5S+ 0 0 15 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.863 111.8 53.0 -65.7 -38.7 27.8 -20.4 19.9 65 64 A L T 3<5S- 0 0 1 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.489 105.9-131.7 -78.5 -1.2 31.3 -19.7 18.6 66 65 A E T < 5 - 0 0 90 -3,-0.8 -3,-0.2 -4,-0.3 149,-0.2 0.899 36.6-174.9 52.9 48.5 31.5 -16.8 21.2 67 66 A L < - 0 0 12 -5,-1.8 -1,-0.2 1,-0.1 2,-0.1 -0.413 25.0-113.6 -71.1 148.5 32.9 -14.4 18.5 68 67 A T > - 0 0 8 -2,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.355 34.8-101.9 -72.4 165.6 34.0 -10.8 19.5 69 68 A I H > S+ 0 0 65 148,-0.3 4,-1.9 1,-0.2 5,-0.1 0.915 127.5 48.1 -55.7 -45.4 31.9 -7.9 18.1 70 69 A G H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.867 111.5 49.5 -62.2 -39.7 34.7 -7.3 15.6 71 70 A E H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.892 107.5 55.6 -66.8 -39.9 34.8 -11.1 14.7 72 71 A R H X S+ 0 0 28 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.930 107.3 48.6 -58.0 -51.5 30.9 -11.1 14.2 73 72 A R H X S+ 0 0 93 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.929 116.5 42.5 -52.1 -52.2 31.1 -8.3 11.7 74 73 A E H X S+ 0 0 56 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.870 115.1 50.8 -66.7 -38.0 33.9 -10.1 9.7 75 74 A F H X S+ 0 0 0 -4,-2.9 4,-1.3 2,-0.2 -2,-0.2 0.894 111.2 46.2 -67.3 -45.7 32.2 -13.5 10.0 76 75 A F H X S+ 0 0 8 -4,-2.9 4,-2.9 2,-0.2 5,-0.3 0.898 113.5 49.5 -66.2 -40.5 28.8 -12.3 8.7 77 76 A F H X S+ 0 0 69 -4,-2.0 4,-2.6 -5,-0.2 -2,-0.2 0.874 107.0 54.7 -67.8 -36.7 30.5 -10.5 5.8 78 77 A A H < S+ 0 0 0 -4,-2.1 -76,-1.4 -77,-0.2 -1,-0.2 0.836 117.0 39.3 -63.5 -30.8 32.5 -13.6 4.9 79 78 A A H < S+ 0 0 4 -4,-1.3 -2,-0.2 -78,-0.2 -1,-0.2 0.872 129.8 24.9 -85.4 -43.3 29.1 -15.5 4.7 80 79 A T H < S+ 0 0 24 -4,-2.9 -3,-0.2 -5,-0.1 -2,-0.2 0.584 84.8 122.1-103.7 -12.8 26.8 -12.8 3.1 81 80 A G < - 0 0 12 -4,-2.6 2,-0.4 -5,-0.3 -79,-0.3 -0.275 65.5-120.3 -54.9 128.7 29.2 -10.6 1.1 82 81 A I - 0 0 38 284,-0.1 2,-0.4 -81,-0.1 -1,-0.1 -0.637 21.1-144.8 -75.5 127.9 28.3 -10.5 -2.6 83 82 A I - 0 0 82 -2,-0.4 2,-0.1 -81,-0.1 4,-0.1 -0.808 19.4-126.6 -91.2 130.9 31.2 -11.7 -4.8 84 83 A E - 0 0 71 -2,-0.4 4,-0.1 2,-0.2 -1,-0.0 -0.381 11.6-123.6 -74.5 157.4 31.4 -9.8 -8.1 85 84 A Q S S+ 0 0 190 -2,-0.1 2,-0.3 2,-0.1 -1,-0.1 0.931 101.0 58.1 -66.2 -45.0 31.5 -11.6 -11.5 86 85 A K S S- 0 0 75 1,-0.1 -2,-0.2 3,-0.0 3,-0.1 -0.665 97.8-112.3 -86.1 137.8 34.8 -9.9 -12.4 87 86 A S - 0 0 113 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 -0.367 46.9 -82.4 -69.2 150.2 37.8 -10.4 -10.0 88 87 A A - 0 0 72 -4,-0.1 2,-0.4 1,-0.1 -1,-0.1 -0.188 42.6-145.8 -54.5 141.3 39.0 -7.4 -8.0 89 88 A T - 0 0 99 422,-0.2 2,-0.4 -3,-0.1 424,-0.3 -0.897 10.6-162.0-112.5 141.3 41.4 -4.9 -9.7 90 89 A Y - 0 0 91 -2,-0.4 422,-0.1 1,-0.1 159,-0.0 -0.987 23.0-141.1-128.9 138.3 44.2 -3.0 -7.9 91 90 A K S S+ 0 0 62 -2,-0.4 2,-0.3 422,-0.2 -1,-0.1 0.863 93.0 36.9 -58.7 -39.9 46.1 0.1 -9.0 92 91 A R S S- 0 0 104 -3,-0.1 -1,-0.0 1,-0.0 5,-0.0 -0.873 85.2-117.5-118.6 149.4 49.4 -1.4 -7.6 93 92 A S > - 0 0 44 -2,-0.3 4,-2.3 156,-0.1 5,-0.2 -0.280 42.9 -98.1 -70.2 165.1 50.7 -5.0 -7.4 94 93 A P H > S+ 0 0 12 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.927 127.7 47.5 -54.0 -44.0 51.3 -6.5 -3.9 95 94 A E H > S+ 0 0 97 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.890 113.3 46.9 -61.1 -45.6 55.0 -5.6 -4.1 96 95 A E H > S+ 0 0 111 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.789 110.3 55.0 -67.0 -31.7 54.3 -2.0 -5.2 97 96 A S H X S+ 0 0 6 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.885 111.2 42.7 -67.8 -44.4 51.6 -1.7 -2.5 98 97 A L H X S+ 0 0 6 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.899 113.5 51.9 -69.4 -42.2 54.1 -2.6 0.3 99 98 A Q H X S+ 0 0 79 -4,-2.2 4,-3.0 1,-0.2 -2,-0.2 0.862 107.6 53.6 -61.8 -37.0 56.8 -0.4 -1.2 100 99 A Y H X S+ 0 0 38 -4,-1.7 4,-1.2 2,-0.2 -1,-0.2 0.870 111.4 44.8 -64.3 -41.6 54.2 2.5 -1.3 101 100 A L H X S+ 0 0 6 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.892 114.0 49.8 -70.5 -39.4 53.6 2.0 2.5 102 101 A I H X S+ 0 0 1 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.934 109.4 51.5 -62.9 -47.4 57.4 1.7 3.2 103 102 A D H X S+ 0 0 65 -4,-3.0 4,-0.7 1,-0.2 -1,-0.2 0.807 113.3 46.5 -59.3 -32.9 58.0 5.0 1.2 104 103 A X H >< S+ 0 0 2 -4,-1.2 3,-0.7 2,-0.2 4,-0.4 0.937 112.3 45.8 -77.2 -48.7 55.4 6.7 3.3 105 104 A I H >< S+ 0 0 0 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.856 107.0 61.5 -66.7 -28.7 56.5 5.5 6.8 106 105 A R H 3< S+ 0 0 82 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.844 106.4 46.9 -59.4 -36.2 60.1 6.4 5.8 107 106 A N T << S+ 0 0 53 -4,-0.7 2,-0.3 -3,-0.7 -1,-0.2 0.450 92.6 99.5 -89.1 -1.7 59.0 10.0 5.4 108 107 A X < - 0 0 0 -3,-1.1 19,-0.2 -4,-0.4 447,-0.1 -0.621 59.6-154.3 -87.0 144.7 57.0 10.2 8.7 109 108 A N S S+ 0 0 40 445,-0.4 165,-0.3 -2,-0.3 164,-0.1 0.087 76.7 71.7-105.2 27.9 58.6 11.8 11.8 110 109 A V S S- 0 0 21 -5,-0.2 18,-0.2 163,-0.1 17,-0.2 -0.904 101.4 -78.0-130.9 158.7 56.3 9.7 14.1 111 110 A P + 0 0 0 0, 0.0 148,-1.9 0, 0.0 2,-0.3 -0.345 60.8 162.6 -59.0 132.8 56.4 6.0 15.0 112 111 A A E +B 258 0B 0 146,-0.2 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82.9 58.3 -6.6 28.6 162 161 A F H > S+ 0 0 10 -2,-1.4 4,-1.9 -8,-0.5 3,-0.4 0.849 71.7 63.8 -70.4 -35.0 55.5 -4.4 27.1 163 162 A R H > S+ 0 0 117 -8,-0.2 4,-1.9 -3,-0.2 7,-0.2 0.866 101.2 52.7 -56.4 -38.9 53.4 -4.7 30.3 164 163 A R H 4 S+ 0 0 129 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.842 107.7 51.0 -65.0 -40.0 56.2 -2.7 32.1 165 164 A V H < S+ 0 0 7 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.2 0.952 119.4 33.3 -64.0 -53.7 56.2 0.1 29.5 166 165 A V H >< S+ 0 0 3 -4,-1.9 3,-1.8 1,-0.2 -2,-0.2 0.703 89.0 173.3 -80.8 -21.0 52.4 0.8 29.6 167 166 A G G >< + 0 0 36 -4,-1.9 3,-2.0 -5,-0.3 -1,-0.2 -0.290 67.2 14.1 57.2-118.0 52.1 -0.1 33.3 168 167 A T G 3 S+ 0 0 154 1,-0.3 3,-0.3 -2,-0.1 -1,-0.3 0.643 124.0 64.4 -65.0 -15.7 48.6 0.6 34.8 169 168 A X G <> S+ 0 0 20 -3,-1.8 4,-2.4 1,-0.2 -1,-0.3 0.450 73.8 102.7 -83.8 -3.6 47.3 1.0 31.3 170 169 A W H <> S+ 0 0 26 -3,-2.0 4,-3.3 -7,-0.2 5,-0.3 0.870 75.3 50.9 -48.0 -56.5 48.1 -2.8 30.6 171 170 A D H > S+ 0 0 71 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.901 115.9 42.9 -49.9 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44.1 -9.3 16.4 182 181 A R H X S+ 0 0 13 -4,-2.4 4,-0.8 2,-0.2 -1,-0.2 0.873 115.9 44.2 -68.1 -39.0 40.9 -11.3 16.6 183 182 A A H < S+ 0 0 6 -4,-2.2 4,-0.3 2,-0.2 -2,-0.2 0.884 117.2 45.2 -73.5 -39.5 39.0 -9.1 14.1 184 183 A I H >< S+ 0 0 16 -4,-2.7 3,-0.5 1,-0.2 -2,-0.2 0.919 116.3 45.0 -68.4 -45.6 41.9 -8.8 11.6 185 184 A S H >< S+ 0 0 0 -4,-2.2 3,-1.8 -5,-0.3 4,-0.3 0.606 84.6 98.0 -74.7 -16.2 42.7 -12.5 11.7 186 185 A L G >< S+ 0 0 0 -4,-0.8 3,-1.2 1,-0.3 -1,-0.2 0.834 82.7 49.2 -43.4 -48.7 39.1 -13.7 11.4 187 186 A R G < S+ 0 0 88 -3,-0.5 -1,-0.3 -4,-0.3 3,-0.2 0.695 115.4 42.8 -67.9 -21.7 39.2 -14.2 7.6 188 187 A V G X S+ 0 0 15 -3,-1.8 3,-1.4 -71,-0.2 6,-0.3 0.134 74.6 114.7-113.0 19.3 42.5 -16.3 7.7 189 188 A R T < S+ 0 0 0 -3,-1.2 -1,-0.1 -4,-0.3 -2,-0.1 0.730 76.5 54.9 -63.9 -23.7 41.7 -18.5 10.8 190 189 A A T 3 S+ 0 0 42 -3,-0.2 -1,-0.3 -4,-0.2 2,-0.1 0.564 81.5 114.9 -85.3 -8.6 41.7 -21.7 8.6 191 190 A D S <> S- 0 0 58 -3,-1.4 4,-2.3 1,-0.1 3,-0.2 -0.405 71.0-133.6 -62.7 131.8 45.2 -21.0 7.2 192 191 A G H > S+ 0 0 61 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.881 108.4 53.2 -53.1 -41.9 47.8 -23.6 8.3 193 192 A Y H > S+ 0 0 25 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.897 107.5 50.4 -62.2 -42.2 50.2 -20.8 9.2 194 193 A F H > S+ 0 0 1 -6,-0.3 4,-3.3 2,-0.2 5,-0.2 0.924 108.4 52.3 -61.8 -44.1 47.5 -19.1 11.4 195 194 A V H X S+ 0 0 69 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.931 113.8 43.7 -57.0 -45.1 46.8 -22.4 13.2 196 195 A E H X S+ 0 0 94 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.901 114.1 51.0 -65.0 -43.9 50.6 -22.8 13.9 197 196 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 3,-0.3 0.927 110.2 48.6 -59.3 -49.1 50.8 -19.0 14.9 198 197 A L H X S+ 0 0 11 -4,-3.3 4,-2.7 1,-0.2 -2,-0.2 0.893 108.0 54.9 -61.5 -42.0 47.8 -19.4 17.4 199 198 A D H < S+ 0 0 90 -4,-2.0 -1,-0.2 -5,-0.2 4,-0.2 0.848 111.1 45.3 -59.7 -38.0 49.4 -22.5 19.0 200 199 A N H >< S+ 0 0 43 -4,-1.6 3,-1.1 -3,-0.3 -1,-0.2 0.882 113.1 49.2 -73.4 -39.0 52.6 -20.6 19.7 201 200 A L H >< S+ 0 0 0 -4,-2.2 3,-2.0 1,-0.2 7,-0.3 0.890 102.9 62.7 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-9.2 45.8 -9.5 -4.4 251 250 A X T 3 S- 0 0 54 1,-0.5 -1,-0.3 40,-0.0 39,-0.1 -0.000 127.9 -78.5-115.6 23.7 48.0 -11.2 -1.6 252 251 A G < - 0 0 19 -3,-1.5 -1,-0.5 -136,-0.1 -5,-0.0 -0.158 65.8 -44.5 99.7 163.8 45.9 -10.1 1.3 253 252 A L - 0 0 33 -5,-0.2 -136,-0.5 -3,-0.1 2,-0.4 -0.164 41.2-154.2 -63.6 158.4 45.5 -6.9 3.3 254 253 A L E -BF 116 247B 0 -7,-2.0 -7,-2.7 -138,-0.2 2,-0.4 -0.982 9.4-155.3-130.3 135.4 48.2 -4.5 4.6 255 254 A S E -BF 115 246B 0 -140,-3.0 -140,-2.1 -2,-0.4 2,-0.5 -0.961 3.4-152.9-115.8 136.9 47.7 -2.3 7.7 256 255 A X E -BF 114 245B 3 -11,-3.1 -11,-2.5 -2,-0.4 2,-0.5 -0.937 10.1-163.1-107.8 124.7 49.6 0.9 8.4 257 256 A H E +BF 113 244B 11 -144,-3.2 -144,-2.1 -2,-0.5 2,-0.3 -0.943 12.0 177.7-108.9 124.4 49.9 1.8 12.1 258 257 A T E -BF 112 243B 1 -15,-2.2 -15,-2.3 -2,-0.5 2,-0.5 -0.934 21.8-146.5-125.3 152.0 50.8 5.5 13.0 259 258 A Y E - F 0 242B 16 -148,-1.9 -17,-0.2 -2,-0.3 -2,-0.0 -0.961 14.2-163.2-122.4 105.8 51.2 7.2 16.4 260 259 A I E - F 0 241B 5 -19,-2.7 -19,-2.3 -2,-0.5 2,-0.1 -0.816 22.0-124.1 -90.0 124.4 50.2 10.9 16.3 261 260 A P E - F 0 240B 7 0, 0.0 141,-0.4 0, 0.0 -21,-0.3 -0.450 24.2-175.2 -72.7 142.3 51.5 13.0 19.4 262 261 A L + 0 0 4 -23,-3.2 -22,-0.2 -2,-0.1 139,-0.1 0.065 63.7 50.3-126.0 21.8 48.9 14.8 21.5 263 262 A S S > S- 0 0 27 -24,-0.4 4,-2.6 1,-0.1 3,-0.4 -0.972 83.2-115.6-153.6 148.8 51.0 16.8 24.0 264 263 A P H > S+ 0 0 100 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.848 117.2 52.3 -55.5 -36.1 54.0 19.1 23.6 265 264 A A H > S+ 0 0 58 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.860 111.6 45.6 -67.3 -37.6 56.3 16.6 25.5 266 265 A T H > S+ 0 0 0 -3,-0.4 4,-2.6 2,-0.2 5,-0.2 0.893 112.8 51.3 -71.0 -39.9 55.2 13.7 23.2 267 266 A T H X S+ 0 0 37 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.931 112.0 47.0 -59.2 -47.1 55.7 16.0 20.1 268 267 A D H X S+ 0 0 86 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.879 111.2 51.3 -64.7 -41.1 59.3 16.9 21.4 269 268 A L H X S+ 0 0 24 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.944 112.4 44.9 -61.1 -50.3 60.1 13.2 22.1 270 269 A F H X S+ 0 0 2 -4,-2.6 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T 3 S- 0 0 88 -39,-0.1 2,-1.9 -4,-0.0 -1,-0.3 -0.904 83.5-164.6-116.8 92.1 53.5 -17.5 1.1 291 290 A N < 0 0 99 -2,-0.6 -4,-0.0 -3,-0.5 -40,-0.0 -0.434 360.0 360.0 -81.3 63.6 53.9 -15.6 -2.2 292 291 A G 0 0 118 -2,-1.9 -41,-0.0 -41,-0.0 0, 0.0 -0.669 360.0 360.0 150.5 360.0 51.9 -18.2 -4.3 293 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 294 0 B G 0 0 20 0, 0.0 2,-0.3 0, 0.0 77,-0.2 0.000 360.0 360.0 360.0 143.2 22.5 -4.3 6.7 295 1 B X - 0 0 27 76,-1.6 81,-0.1 75,-0.2 2,-0.0 -0.960 360.0-106.4-132.7 152.9 19.0 -2.9 6.2 296 2 B E > - 0 0 133 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.348 43.5-106.7 -70.9 156.2 15.4 -4.0 6.7 297 3 B R H > S+ 0 0 76 1,-0.2 4,-2.1 2,-0.2 44,-0.2 0.853 119.5 49.4 -54.7 -41.1 13.6 -4.7 3.4 298 4 B A H > S+ 0 0 46 43,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.906 112.3 47.1 -66.9 -42.4 11.5 -1.5 3.5 299 5 B A H > S+ 0 0 45 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.879 112.6 50.0 -67.0 -38.7 14.5 0.7 4.2 300 6 B F H X S+ 0 0 2 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.875 108.6 52.9 -66.1 -40.7 16.4 -1.0 1.3 301 7 B G H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.859 107.6 50.9 -59.2 -39.4 13.4 -0.4 -1.0 302 8 B K H X S+ 0 0 117 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.834 108.9 52.7 -68.7 -29.9 13.5 3.3 -0.0 303 9 B L H X S+ 0 0 2 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.927 108.8 48.2 -69.1 -46.8 17.3 3.3 -0.9 304 10 B V H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.918 112.3 50.1 -58.8 -45.7 16.6 1.8 -4.4 305 11 B Q H X S+ 0 0 57 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.922 111.9 47.2 -58.5 -47.5 13.8 4.4 -5.0 306 12 B A H X S+ 0 0 6 -4,-2.1 4,-0.5 2,-0.2 -2,-0.2 0.891 112.9 48.9 -62.8 -42.7 16.2 7.3 -4.0 307 13 B L H >< S+ 0 0 1 -4,-2.6 3,-0.9 2,-0.2 4,-0.2 0.906 112.0 48.9 -64.6 -42.9 19.0 5.9 -6.2 308 14 B R H >< S+ 0 0 22 -4,-2.7 3,-1.7 1,-0.2 11,-0.6 0.907 108.1 54.6 -59.6 -44.8 16.6 5.6 -9.2 309 15 B R H 3< S+ 0 0 121 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.563 94.3 69.3 -71.2 -9.0 15.3 9.1 -8.6 310 16 B E T << S+ 0 0 38 -3,-0.9 -1,-0.3 -4,-0.5 2,-0.3 0.587 90.7 84.8 -80.8 -11.1 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4.3 76.6 9.7 622 38 C K H 3> S+ 0 0 83 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.872 113.8 60.4 -54.8 -39.3 7.8 75.1 10.0 623 39 C R H 3> S+ 0 0 125 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.832 102.6 51.4 -56.5 -38.2 8.1 77.1 13.4 624 40 C T H <> S+ 0 0 33 -3,-0.8 4,-2.2 2,-0.2 -1,-0.2 0.913 111.2 46.3 -67.2 -43.8 5.1 75.1 14.7 625 41 C I H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.898 112.6 52.3 -63.1 -42.0 6.7 71.7 13.7 626 42 C E H X S+ 0 0 66 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.906 111.3 45.3 -59.9 -46.5 9.9 73.0 15.3 627 43 C R H X>S+ 0 0 86 -4,-2.3 5,-2.4 2,-0.2 4,-0.7 0.846 112.9 50.6 -69.3 -37.2 8.1 73.9 18.7 628 44 C I H ><5S+ 0 0 4 -4,-2.2 3,-0.8 3,-0.2 -2,-0.2 0.949 113.0 46.0 -63.6 -47.9 6.2 70.5 18.7 629 45 C E H 3<5S+ 0 0 12 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.809 115.1 46.9 -67.3 -29.9 9.5 68.6 18.2 630 46 C N H 3<5S- 0 0 104 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.484 109.9-122.4 -84.8 -12.3 11.3 70.8 20.9 631 47 C G T <<5S+ 0 0 24 -3,-0.8 -43,-0.2 -4,-0.7 -3,-0.2 0.776 73.2 130.1 71.5 30.6 8.4 70.3 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46.9 34.7 833 249 C S T 3 S+ 0 0 73 -2,-0.3 3,-0.1 1,-0.3 -157,-0.1 0.560 121.9 51.9 -70.6 -9.4 9.0 49.7 35.6 834 250 C X T 3 S- 0 0 77 1,-0.5 38,-0.3 36,-0.0 -1,-0.3 -0.045 128.3 -78.6-115.7 26.5 11.2 48.4 32.7 835 251 C G < - 0 0 18 -3,-1.3 -1,-0.5 -136,-0.1 -5,-0.0 -0.116 66.1 -45.0 97.0 166.1 8.4 48.5 30.1 836 252 C L - 0 0 33 -5,-0.2 -136,-0.5 -3,-0.1 2,-0.4 -0.156 42.7-152.9 -64.3 158.9 5.4 46.3 29.2 837 253 C L E -PT 699 830H 0 -7,-2.1 -7,-2.7 -138,-0.2 2,-0.4 -0.982 8.6-156.1-130.8 137.0 5.5 42.5 29.0 838 254 C S E -PT 698 829H 0 -140,-2.9 -140,-2.1 -2,-0.4 2,-0.5 -0.972 4.4-151.3-117.9 135.5 3.1 40.5 26.7 839 255 C X E -PT 697 828H 21 -11,-3.0 -11,-2.5 -2,-0.4 2,-0.5 -0.929 11.5-162.7-105.2 125.5 2.0 36.9 27.1 840 256 C H E +PT 696 827H 10 -144,-3.3 -144,-2.1 -2,-0.5 2,-0.3 -0.934 12.8 175.4-109.2 125.6 1.0 35.1 23.9 841 257 C T E -PT 695 826H 16 -15,-2.1 -15,-2.4 -2,-0.5 2,-0.5 -0.927 22.8-142.8-127.4 153.5 -1.0 31.8 24.2 842 258 C Y E - T 0 825H 15 -148,-1.6 -17,-0.2 -2,-0.3 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