==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 11-DEC-06 2O7T . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM GLUTAMICUM; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 188 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10800.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 140 74.5 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 115 61.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 1 2 0 0 1 0 0 1 0 1 0 0 0 1 0 0 1 0 0 1 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 . 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 0 152 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 133.3 28.3 7.3 34.4 2 2 A R >> - 0 0 128 1,-0.1 4,-2.3 2,-0.0 3,-0.9 -0.316 360.0-119.9 -60.3 140.2 26.0 8.2 31.4 3 3 A A H 3> S+ 0 0 75 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.845 113.9 50.2 -48.7 -42.7 25.6 12.0 31.0 4 4 A D H 3> S+ 0 0 78 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.779 109.2 50.4 -71.2 -28.5 21.8 11.7 31.5 5 5 A A H <> S+ 0 0 14 -3,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.864 111.2 49.6 -74.7 -37.2 22.2 9.6 34.7 6 6 A L H X S+ 0 0 87 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.868 111.1 48.3 -69.2 -38.7 24.5 12.2 36.1 7 7 A K H X S+ 0 0 81 -4,-1.8 4,-2.2 -5,-0.2 -1,-0.2 0.876 111.0 51.5 -66.6 -39.9 22.2 15.1 35.2 8 8 A R H X S+ 0 0 95 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.931 109.3 50.0 -64.0 -43.7 19.3 13.2 36.8 9 9 A R H X S+ 0 0 80 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.898 111.0 49.5 -59.6 -42.6 21.3 12.7 40.0 10 10 A E H X S+ 0 0 61 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.859 109.1 52.3 -67.6 -37.6 22.2 16.4 40.1 11 11 A H H X S+ 0 0 91 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.839 106.4 52.7 -66.8 -34.8 18.6 17.4 39.6 12 12 A I H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.914 111.5 47.8 -66.2 -41.7 17.4 15.1 42.5 13 13 A I H X S+ 0 0 13 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.926 113.2 46.0 -63.0 -49.4 20.0 16.9 44.8 14 14 A T H X S+ 0 0 54 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.881 112.9 51.4 -59.7 -42.6 19.0 20.4 43.7 15 15 A T H X S+ 0 0 15 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.913 109.8 49.1 -61.6 -44.4 15.3 19.5 44.1 16 16 A T H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.945 109.9 50.9 -64.0 -46.3 16.0 18.2 47.6 17 17 A C H X S+ 0 0 2 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.925 112.5 47.6 -57.2 -45.0 18.0 21.4 48.6 18 18 A N H >X S+ 0 0 76 -4,-2.4 4,-1.2 1,-0.2 3,-0.6 0.894 109.0 53.3 -61.7 -43.7 15.1 23.5 47.4 19 19 A L H >X S+ 0 0 5 -4,-2.5 4,-3.5 1,-0.2 3,-0.7 0.917 103.8 56.9 -60.5 -39.9 12.5 21.4 49.2 20 20 A Y H 3< S+ 0 0 4 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.803 108.8 47.9 -61.8 -24.9 14.5 21.9 52.5 21 21 A R H << S+ 0 0 88 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.692 124.2 28.5 -85.9 -21.1 14.1 25.6 52.0 22 22 A T H << S+ 0 0 104 -4,-1.2 2,-0.3 -3,-0.7 -2,-0.2 0.677 113.5 58.7-112.6 -22.6 10.4 25.6 51.3 23 23 A H S < S- 0 0 78 -4,-3.5 2,-0.1 -5,-0.2 5,-0.1 -0.791 90.1 -91.3-116.2 155.1 9.0 22.5 53.1 24 24 A H > - 0 0 131 -2,-0.3 3,-1.3 1,-0.1 4,-0.5 -0.414 38.0-136.1 -58.5 126.5 8.8 21.3 56.7 25 25 A H G > S+ 0 0 68 1,-0.3 3,-0.8 2,-0.2 -1,-0.1 0.862 102.2 48.5 -60.1 -37.8 12.0 19.1 57.1 26 26 A D G 3 S+ 0 0 154 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.573 101.0 67.1 -77.5 -12.9 10.2 16.3 58.9 27 27 A S G < S+ 0 0 48 -3,-1.3 2,-0.4 2,-0.0 -1,-0.2 0.583 80.4 99.1 -82.8 -12.8 7.4 16.2 56.3 28 28 A L < - 0 0 10 -3,-0.8 2,-0.2 -4,-0.5 3,-0.0 -0.640 47.3-179.3 -88.7 130.2 9.6 14.9 53.5 29 29 A T > - 0 0 57 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.743 42.9-110.0-115.8 164.7 9.8 11.3 52.4 30 30 A X H > S+ 0 0 9 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.948 123.6 52.7 -60.3 -41.5 11.9 9.6 49.8 31 31 A E H > S+ 0 0 102 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.871 108.3 49.6 -59.0 -42.8 8.7 9.1 47.9 32 32 A N H > S+ 0 0 71 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.849 111.9 48.7 -63.6 -42.3 7.9 12.9 48.2 33 33 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.912 110.0 50.3 -66.4 -44.6 11.3 13.8 46.9 34 34 A A H X>S+ 0 0 2 -4,-2.6 5,-1.9 2,-0.2 4,-0.6 0.951 112.3 49.1 -60.0 -46.6 11.1 11.4 44.0 35 35 A E H ><5S+ 0 0 90 -4,-2.4 3,-1.3 1,-0.2 -2,-0.2 0.936 112.3 46.1 -59.0 -48.5 7.7 12.9 43.1 36 36 A Q H 3<5S+ 0 0 115 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.832 112.3 51.6 -66.0 -33.2 9.0 16.6 43.3 37 37 A A H 3<5S- 0 0 6 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.500 110.4-123.8 -77.0 -8.9 12.1 15.7 41.3 38 38 A G T <<5S+ 0 0 69 -3,-1.3 2,-0.2 -4,-0.6 -3,-0.2 0.709 73.0 116.7 71.3 19.0 9.9 14.1 38.5 39 39 A V < - 0 0 27 -5,-1.9 -1,-0.3 -6,-0.2 2,-0.1 -0.731 69.6-100.0-112.2 164.8 11.8 10.8 38.8 40 40 A G > - 0 0 42 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.473 30.3-115.8 -79.7 158.2 10.7 7.3 39.9 41 41 A V H > S+ 0 0 65 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.922 116.5 53.5 -57.7 -46.5 11.3 6.0 43.4 42 42 A A H > S+ 0 0 64 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.863 108.5 49.2 -59.9 -38.3 13.6 3.2 41.9 43 43 A T H > S+ 0 0 45 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.936 112.1 49.0 -65.1 -47.8 15.7 5.8 40.0 44 44 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 3,-0.3 0.961 113.3 47.1 -53.6 -51.9 16.0 7.9 43.2 45 45 A Y H < S+ 0 0 83 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.759 104.5 58.2 -69.4 -25.9 17.0 4.8 45.3 46 46 A R H < S+ 0 0 194 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.908 114.9 39.5 -69.1 -36.0 19.6 3.5 42.8 47 47 A N H < S+ 0 0 25 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.886 132.4 23.9 -72.8 -42.0 21.4 6.9 43.1 48 48 A F < - 0 0 0 -4,-2.5 -1,-0.3 -5,-0.2 6,-0.1 -0.928 68.7-162.2-132.1 101.2 20.8 7.2 46.9 49 49 A P S S+ 0 0 85 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 0.674 74.4 0.1 -61.0 -20.3 20.3 3.9 48.7 50 50 A D S > S- 0 0 75 1,-0.1 4,-2.1 -20,-0.0 5,-0.2 -0.953 81.8 -91.6-158.9 174.0 18.8 5.6 51.8 51 51 A R H > S+ 0 0 67 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.883 120.9 54.3 -60.9 -43.8 17.8 9.0 53.2 52 52 A F H > S+ 0 0 95 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.917 108.6 50.3 -58.4 -42.8 21.1 9.5 55.0 53 53 A T H > S+ 0 0 51 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.907 111.6 46.6 -64.6 -43.8 23.0 8.9 51.7 54 54 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.953 114.0 48.1 -61.6 -49.6 20.8 11.4 49.9 55 55 A D H X S+ 0 0 21 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.913 112.8 48.4 -59.4 -42.0 21.2 14.0 52.7 56 56 A X H X S+ 0 0 12 -4,-3.0 4,-2.8 2,-0.2 -1,-0.2 0.855 108.3 53.9 -67.0 -33.6 25.0 13.4 52.7 57 57 A A H X S+ 0 0 13 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.867 109.6 49.6 -65.8 -33.3 25.1 13.8 48.9 58 58 A C H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.916 110.6 48.9 -68.3 -46.0 23.3 17.1 49.4 59 59 A A H X S+ 0 0 8 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.912 111.0 50.5 -54.4 -49.9 25.8 18.2 52.1 60 60 A Q H X S+ 0 0 75 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.950 111.7 47.2 -57.4 -50.0 28.7 17.2 49.9 61 61 A Y H X S+ 0 0 102 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.926 113.7 48.2 -56.3 -47.8 27.2 19.2 47.0 62 62 A L H X S+ 0 0 30 -4,-2.7 4,-3.0 2,-0.2 -1,-0.2 0.882 109.5 51.5 -64.7 -40.1 26.6 22.3 49.2 63 63 A F H X S+ 0 0 47 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.913 109.1 52.0 -62.5 -41.8 30.1 22.2 50.7 64 64 A N H X S+ 0 0 75 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.916 112.0 46.1 -58.3 -42.6 31.5 22.1 47.2 65 65 A V H X S+ 0 0 55 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.944 111.9 50.2 -65.9 -48.1 29.4 25.2 46.3 66 66 A V H X S+ 0 0 29 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.904 108.5 54.2 -56.4 -43.1 30.4 27.0 49.5 67 67 A I H X S+ 0 0 20 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.904 107.5 49.3 -59.7 -41.5 34.1 26.3 48.8 68 68 A S H X S+ 0 0 80 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.901 111.3 49.3 -66.1 -37.6 33.8 27.9 45.3 69 69 A L H X S+ 0 0 40 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.924 112.3 49.2 -64.6 -42.7 32.1 31.0 46.8 70 70 A Q H X S+ 0 0 2 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.910 111.9 47.8 -60.1 -45.1 34.9 31.1 49.4 71 71 A L H X S+ 0 0 90 -4,-2.6 4,-2.1 2,-0.2 5,-0.2 0.893 112.2 49.0 -67.2 -38.0 37.6 30.8 46.7 72 72 A Q H X S+ 0 0 137 -4,-2.4 4,-2.3 -5,-0.2 5,-0.2 0.967 115.7 44.7 -62.9 -45.4 35.9 33.5 44.6 73 73 A A H X S+ 0 0 5 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.908 112.0 50.9 -64.8 -44.4 35.7 35.8 47.6 74 74 A I H < S+ 0 0 36 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.962 115.4 42.4 -60.0 -49.7 39.3 35.1 48.8 75 75 A S H < S+ 0 0 90 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.856 121.5 40.2 -66.8 -34.4 40.8 35.8 45.4 76 76 A T H >< S+ 0 0 51 -4,-2.3 3,-1.4 -5,-0.2 4,-0.3 0.727 94.2 87.5 -85.6 -23.6 38.6 38.9 44.7 77 77 A F G >< S+ 0 0 0 -4,-2.3 3,-2.2 1,-0.3 7,-0.2 0.836 76.2 61.8 -46.9 -53.0 38.7 40.3 48.3 78 78 A P G 3 S+ 0 0 75 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.699 109.9 40.6 -54.1 -27.6 41.9 42.5 48.0 79 79 A T G < S+ 0 0 125 -3,-1.4 -2,-0.2 1,-0.2 -3,-0.1 0.241 132.2 19.7-108.9 13.2 40.5 44.7 45.3 80 80 A D <> + 0 0 84 -3,-2.2 4,-3.3 -4,-0.3 5,-0.3 -0.066 69.6 165.5-168.2 61.2 36.9 45.1 46.6 81 81 A P H > S+ 0 0 32 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.883 78.3 38.2 -52.6 -56.6 36.9 44.3 50.4 82 82 A E H > S+ 0 0 116 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.890 119.2 48.8 -63.8 -41.1 33.5 45.7 51.4 83 83 A G H > S+ 0 0 26 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.945 116.2 41.5 -64.5 -49.9 31.8 44.6 48.1 84 84 A V H X S+ 0 0 9 -4,-3.3 4,-2.3 -7,-0.2 5,-0.2 0.914 115.3 50.8 -64.7 -45.2 33.1 41.1 48.3 85 85 A W H X S+ 0 0 7 -4,-2.8 4,-1.7 -5,-0.3 -2,-0.2 0.926 115.1 43.0 -58.1 -47.5 32.5 40.7 52.0 86 86 A T H X S+ 0 0 59 -4,-2.3 4,-3.1 -5,-0.2 5,-0.2 0.945 115.4 46.5 -65.4 -52.4 28.9 41.9 51.7 87 87 A S H X S+ 0 0 65 -4,-2.4 4,-2.0 -5,-0.2 -2,-0.2 0.847 110.3 54.7 -62.9 -34.9 28.0 39.9 48.6 88 88 A F H X S+ 0 0 12 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.932 114.3 39.6 -62.2 -47.3 29.6 36.8 50.0 89 89 A N H X S+ 0 0 0 -4,-1.7 4,-2.6 -5,-0.2 5,-0.2 0.918 113.5 54.2 -71.3 -42.0 27.4 37.0 53.2 90 90 A Q H X S+ 0 0 57 -4,-3.1 4,-3.2 1,-0.2 5,-0.2 0.914 108.3 52.1 -54.5 -44.0 24.3 38.1 51.3 91 91 A L H X S+ 0 0 66 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.916 111.2 43.2 -64.6 -45.0 24.7 35.1 49.1 92 92 A L H <>S+ 0 0 18 -4,-1.7 5,-2.4 2,-0.2 6,-0.3 0.926 117.6 48.2 -65.8 -40.9 24.9 32.5 51.9 93 93 A F H ><5S+ 0 0 14 -4,-2.6 3,-1.4 1,-0.2 5,-0.3 0.960 114.9 43.0 -61.0 -52.6 22.1 34.2 53.7 94 94 A D H 3<5S+ 0 0 101 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.750 110.2 57.7 -70.6 -24.5 19.8 34.4 50.7 95 95 A R T 3<5S- 0 0 161 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.185 120.7-101.6 -94.1 14.0 20.5 30.9 49.5 96 96 A G T X>5 + 0 0 10 -3,-1.4 4,-2.9 3,-0.1 3,-1.9 0.721 61.9 155.9 81.9 24.7 19.4 29.4 52.8 97 97 A L H 3> S+ 0 0 14 -3,-1.9 4,-1.4 59,-0.1 -1,-0.2 0.730 116.8 51.6 -95.9 -39.8 17.6 26.2 56.5 100 100 A L H X S+ 0 0 12 -4,-2.9 4,-2.0 2,-0.2 5,-0.2 0.870 103.5 55.6 -70.5 -38.7 20.1 23.8 55.0 101 101 A V H X S+ 0 0 53 -4,-2.1 4,-2.7 -5,-0.3 3,-0.3 0.975 113.5 39.2 -61.9 -55.0 22.4 23.4 58.0 102 102 A P H 4 S+ 0 0 47 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.838 114.6 55.8 -64.1 -29.0 19.7 22.2 60.4 103 103 A A H < S+ 0 0 17 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.2 0.862 122.7 25.1 -65.0 -37.1 18.0 20.2 57.7 104 104 A L H < S+ 0 0 15 -4,-2.0 -3,-0.2 -3,-0.3 -1,-0.2 0.600 91.4 105.9-108.2 -15.7 21.2 18.3 57.0 105 105 A A < - 0 0 50 -4,-2.7 4,-0.1 -5,-0.2 2,-0.1 -0.481 59.6-138.1 -73.7 136.2 23.4 18.2 60.1 106 106 A P - 0 0 29 0, 0.0 6,-0.1 0, 0.0 -2,-0.1 -0.374 37.3 -94.1 -77.7 170.8 23.6 15.0 62.1 107 107 A E S S+ 0 0 118 1,-0.1 2,-0.4 -2,-0.1 -2,-0.1 0.847 116.0 28.5 -55.5 -34.8 23.6 15.2 65.9 108 108 A S S > S- 0 0 43 1,-0.1 3,-1.8 0, 0.0 4,-0.1 -0.977 74.1-136.5-126.2 142.9 27.4 15.3 65.8 109 109 A L G > S+ 0 0 79 -2,-0.4 3,-1.2 1,-0.3 -1,-0.1 0.673 104.0 74.2 -67.4 -13.9 29.6 16.5 63.1 110 110 A D G 3 S+ 0 0 141 1,-0.2 -1,-0.3 -4,-0.0 7,-0.1 0.670 84.3 65.8 -69.0 -19.7 31.6 13.3 63.7 111 111 A D G < S+ 0 0 87 -3,-1.8 -1,-0.2 2,-0.0 -2,-0.2 0.495 74.8 110.1 -81.5 -6.5 28.8 11.4 62.0 112 112 A L S < S- 0 0 13 -3,-1.2 -7,-0.0 -4,-0.1 5,-0.0 -0.488 81.3-108.8 -65.5 137.6 29.6 13.1 58.6 113 113 A P >> - 0 0 46 0, 0.0 4,-2.6 0, 0.0 3,-0.5 -0.347 36.0-101.1 -61.6 156.7 31.1 10.5 56.2 114 114 A D H 3> S+ 0 0 145 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.776 120.7 52.1 -52.1 -38.7 34.9 11.1 55.6 115 115 A E H 3> S+ 0 0 65 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.893 114.3 44.1 -68.8 -35.0 34.5 12.8 52.2 116 116 A V H <> S+ 0 0 0 -3,-0.5 4,-2.4 2,-0.2 -2,-0.2 0.920 110.8 53.9 -73.9 -39.5 32.1 15.3 53.7 117 117 A S H X S+ 0 0 20 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.869 106.2 53.2 -61.9 -37.7 34.2 15.8 56.9 118 118 A A H X S+ 0 0 35 -4,-1.8 4,-2.0 -5,-0.2 -1,-0.2 0.936 108.1 50.6 -62.6 -44.6 37.1 16.7 54.7 119 119 A L H X S+ 0 0 29 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.909 107.7 53.6 -61.6 -38.5 35.0 19.3 52.9 120 120 A R H X S+ 0 0 60 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.906 107.4 51.1 -61.4 -42.8 33.9 20.7 56.3 121 121 A R H X S+ 0 0 138 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.901 109.7 48.8 -61.4 -43.8 37.6 21.1 57.3 122 122 A T H X S+ 0 0 63 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.894 110.7 52.8 -62.2 -37.7 38.4 23.0 54.0 123 123 A T H X S+ 0 0 17 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.906 109.5 47.5 -66.4 -40.4 35.4 25.2 54.6 124 124 A E H X S+ 0 0 79 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.888 112.4 49.9 -68.2 -39.5 36.6 26.1 58.2 125 125 A K H X S+ 0 0 74 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.922 110.8 48.3 -64.2 -47.1 40.1 26.8 56.9 126 126 A N H X S+ 0 0 21 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.833 107.1 57.8 -62.6 -33.4 38.8 29.1 54.1 127 127 A T H X S+ 0 0 12 -4,-1.8 4,-3.3 2,-0.2 -1,-0.2 0.877 105.2 49.7 -63.4 -40.6 36.6 30.9 56.6 128 128 A T H X S+ 0 0 57 -4,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.905 110.2 51.0 -61.8 -44.7 39.6 31.8 58.8 129 129 A T H X S+ 0 0 56 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.960 114.0 44.8 -59.8 -46.8 41.3 33.1 55.6 130 130 A L H X S+ 0 0 2 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.917 112.8 49.2 -63.9 -47.1 38.3 35.2 54.8 131 131 A I H X S+ 0 0 0 -4,-3.3 4,-2.7 1,-0.2 -1,-0.2 0.899 109.1 53.1 -58.2 -42.2 37.8 36.5 58.3 132 132 A N H X S+ 0 0 87 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.863 110.1 48.8 -62.7 -35.0 41.5 37.4 58.5 133 133 A L H X S+ 0 0 27 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.929 111.2 49.8 -67.1 -41.4 41.0 39.4 55.2 134 134 A A H <>S+ 0 0 0 -4,-2.4 5,-3.2 1,-0.2 6,-0.7 0.890 111.0 48.6 -64.6 -42.4 38.0 41.1 56.7 135 135 A K H ><5S+ 0 0 27 -4,-2.7 3,-1.3 4,-0.2 -1,-0.2 0.869 108.2 55.7 -62.8 -40.5 39.8 42.0 59.8 136 136 A Q H 3<5S+ 0 0 134 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.887 110.8 44.2 -59.1 -39.6 42.7 43.4 57.7 137 137 A H T 3<5S- 0 0 73 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.200 118.1-109.0 -94.5 13.2 40.3 45.7 55.9 138 138 A G T < 5S+ 0 0 47 -3,-1.3 -3,-0.2 2,-0.2 -2,-0.1 0.687 87.0 117.0 70.0 23.6 38.5 46.9 59.0 139 139 A L S - 0 0 73 42,-3.7 3,-1.4 -2,-0.4 -6,-0.1 -0.254 28.1-123.2 -58.7 141.2 36.4 43.6 64.7 142 142 A H T 3 S+ 0 0 131 1,-0.2 -1,-0.1 -7,-0.1 -7,-0.1 0.689 105.3 61.8 -62.0 -21.5 39.8 41.9 65.6 143 143 A D T 3 S+ 0 0 140 2,-0.1 2,-0.4 44,-0.0 -1,-0.2 0.703 80.0 100.8 -79.6 -17.2 38.4 40.2 68.8 144 144 A I < - 0 0 20 -3,-1.4 -4,-0.0 39,-0.2 39,-0.0 -0.529 68.8-137.2 -75.7 122.2 35.8 38.2 66.9 145 145 A A > - 0 0 45 -2,-0.4 4,-2.0 1,-0.1 3,-0.2 -0.398 16.9-120.4 -75.3 149.3 36.7 34.5 66.4 146 146 A P H > S+ 0 0 31 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.880 113.7 52.5 -53.9 -38.4 36.1 32.8 63.1 147 147 A G H > S+ 0 0 40 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.836 106.3 52.8 -68.9 -32.9 33.8 30.1 64.8 148 148 A T H > S+ 0 0 90 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.931 109.0 50.3 -67.4 -41.6 31.7 32.8 66.4 149 149 A Y H X S+ 0 0 8 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.912 112.0 47.4 -59.7 -45.6 31.2 34.4 63.0 150 150 A I H X S+ 0 0 43 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.938 113.4 45.7 -62.5 -51.2 30.1 31.1 61.5 151 151 A V H X S+ 0 0 92 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.895 114.2 50.9 -61.2 -38.3 27.7 30.1 64.2 152 152 A G H X S+ 0 0 16 -4,-2.3 4,-3.1 -5,-0.2 5,-0.2 0.924 109.8 48.5 -65.4 -46.6 26.3 33.7 64.1 153 153 A L H X S+ 0 0 5 -4,-2.5 4,-1.3 2,-0.2 -1,-0.2 0.898 113.4 47.0 -60.2 -42.8 25.8 33.6 60.4 154 154 A I H < S+ 0 0 46 -4,-2.4 4,-0.5 -5,-0.2 -2,-0.2 0.931 115.0 48.4 -64.7 -41.1 24.1 30.2 60.6 155 155 A T H >< S+ 0 0 95 -4,-2.5 3,-1.2 1,-0.2 -2,-0.2 0.939 111.7 45.4 -67.5 -51.4 21.9 31.5 63.5 156 156 A I H 3< S+ 0 0 34 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.748 111.0 56.4 -66.8 -21.2 20.8 34.8 61.9 157 157 A S T 3< S+ 0 0 3 -4,-1.3 -59,-0.3 -5,-0.2 -1,-0.2 0.507 77.4 107.5 -84.2 -12.4 20.0 33.0 58.6 158 158 A R S < S- 0 0 162 -3,-1.2 -59,-0.1 -4,-0.5 -61,-0.0 -0.594 78.4-120.9 -70.4 119.8 17.6 30.5 60.2 159 159 A P - 0 0 61 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.229 31.8 -98.4 -62.1 156.0 14.2 31.7 59.0 160 160 A P - 0 0 54 0, 0.0 5,-0.1 0, 0.0 12,-0.0 -0.238 45.0 -86.8 -69.3 160.6 11.7 32.6 61.8 161 161 A I >> - 0 0 121 1,-0.1 3,-1.9 3,-0.1 4,-0.6 -0.301 50.0-100.3 -60.5 155.8 9.0 30.2 63.0 162 162 A T G >4 S+ 0 0 112 1,-0.3 3,-2.4 2,-0.2 -1,-0.1 0.880 120.3 60.4 -44.8 -54.5 5.9 30.5 60.8 163 163 A A G 34 S+ 0 0 91 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.715 111.5 40.5 -48.1 -30.2 4.0 32.7 63.3 164 164 A L G <4 S+ 0 0 122 -3,-1.9 -1,-0.3 2,-0.1 2,-0.2 0.377 90.9 111.9-102.9 0.8 6.7 35.4 62.9 165 165 A A << - 0 0 58 -3,-2.4 2,-0.3 -4,-0.6 3,-0.1 -0.518 48.8-159.9 -78.2 140.5 7.2 35.1 59.1 166 166 A T - 0 0 63 -2,-0.2 6,-0.1 1,-0.1 -2,-0.1 -0.865 28.2-119.3-117.0 156.2 6.2 37.9 56.8 167 167 A I S S+ 0 0 157 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.919 117.7 39.9 -59.1 -45.7 5.6 37.9 53.1 168 168 A S S S- 0 0 74 1,-0.1 -1,-0.2 -3,-0.1 5,-0.1 0.838 92.0-148.3 -70.7 -34.1 8.4 40.4 52.5 169 169 A E > + 0 0 56 3,-0.1 4,-3.4 4,-0.0 5,-0.3 0.680 48.5 143.4 70.2 19.1 10.7 38.9 55.1 170 170 A N H > + 0 0 106 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.888 65.9 52.6 -58.6 -45.1 12.1 42.4 55.6 171 171 A S H > S+ 0 0 91 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.962 116.0 42.6 -53.8 -49.9 12.5 42.0 59.4 172 172 A H H >> S+ 0 0 28 1,-0.2 3,-0.8 2,-0.2 4,-0.5 0.907 114.0 49.1 -62.1 -48.0 14.5 38.8 58.6 173 173 A K H >X S+ 0 0 49 -4,-3.4 3,-0.9 1,-0.3 4,-0.9 0.836 105.8 58.2 -64.6 -33.7 16.5 40.3 55.6 174 174 A A H 3X S+ 0 0 52 -4,-2.5 4,-2.0 -5,-0.3 -1,-0.3 0.800 91.9 72.0 -64.1 -27.0 17.4 43.3 57.7 175 175 A L H