==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 05-APR-10 2XB5 . COMPND 2 MOLECULE: TETRACYCLINE REPRESSOR PROTEIN CLASS D; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.KISKER,W.SAENGER,W.HINRICHS . 207 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13267.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 148 71.5 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 . 4 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 58.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 0 1 1 0 1 0 0 1 0 1 1 1 0 1 0 0 0 0 0 0 0 0 1 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 2 A A 0 0 91 0, 0.0 2,-0.4 0, 0.0 32,-0.1 0.000 360.0 360.0 360.0 148.5 11.9 21.4 6.4 2 3 A R - 0 0 162 1,-0.1 0, 0.0 5,-0.1 0, 0.0 -0.770 360.0-159.9 -87.2 134.9 9.4 22.7 8.9 3 4 A L + 0 0 25 -2,-0.4 2,-0.1 4,-0.1 -1,-0.1 -0.107 39.9 123.3-122.7 39.0 9.9 26.4 9.6 4 5 A N S > S- 0 0 44 1,-0.1 4,-2.1 4,-0.0 5,-0.2 -0.364 78.1 -94.7 -80.1 173.3 8.3 27.5 12.9 5 6 A R H > S+ 0 0 119 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.913 124.5 51.1 -54.5 -48.3 10.4 29.1 15.6 6 7 A E H > S+ 0 0 117 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.846 110.6 49.4 -63.6 -34.5 11.0 25.7 17.4 7 8 A S H > S+ 0 0 31 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.891 110.1 50.3 -71.2 -40.9 12.2 24.0 14.3 8 9 A V H X S+ 0 0 9 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.915 114.1 44.3 -62.8 -41.5 14.6 26.8 13.4 9 10 A I H X S+ 0 0 4 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.893 110.5 54.0 -75.4 -39.9 16.1 26.8 16.9 10 11 A D H X S+ 0 0 81 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.931 113.2 43.6 -52.4 -51.2 16.4 23.0 17.0 11 12 A A H X S+ 0 0 11 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.875 111.2 53.6 -65.0 -41.0 18.3 23.0 13.8 12 13 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.849 110.0 49.7 -61.3 -36.5 20.5 25.9 14.9 13 14 A L H X S+ 0 0 5 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.928 107.8 51.1 -69.2 -48.6 21.4 24.0 18.0 14 15 A E H X S+ 0 0 123 -4,-2.3 4,-1.2 1,-0.2 3,-0.4 0.953 112.9 48.8 -47.1 -49.8 22.3 20.8 16.1 15 16 A L H >X>S+ 0 0 5 -4,-2.3 4,-3.2 1,-0.2 3,-0.6 0.903 103.4 58.9 -62.7 -43.8 24.5 23.1 13.9 16 17 A L H 3X5S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.3 -1,-0.2 0.873 108.4 46.5 -53.3 -40.2 26.1 24.7 16.9 17 18 A N H 3<5S+ 0 0 73 -4,-1.7 -1,-0.3 -3,-0.4 -2,-0.2 0.708 116.9 43.7 -75.7 -26.9 27.4 21.2 18.1 18 19 A E H <<5S+ 0 0 104 -4,-1.2 -2,-0.2 -3,-0.6 -3,-0.2 0.945 133.4 13.7 -74.9 -55.9 28.6 20.2 14.6 19 20 A T H <5S- 0 0 36 -4,-3.2 4,-0.4 1,-0.2 -3,-0.2 0.533 94.9-125.7-105.0 -11.9 30.3 23.5 13.6 20 21 A G ><< - 0 0 1 -4,-1.9 3,-0.9 -5,-0.5 4,-0.3 -0.105 46.3 -65.1 77.6 169.4 30.8 25.8 16.7 21 22 A I G > S+ 0 0 18 1,-0.2 3,-0.6 2,-0.2 -1,-0.2 0.806 133.2 57.1 -66.0 -29.9 29.6 29.4 17.0 22 23 A D G 3 S+ 0 0 135 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.699 109.4 44.6 -75.0 -21.9 32.0 30.6 14.2 23 24 A G G < S+ 0 0 19 -3,-0.9 2,-1.6 -4,-0.4 -1,-0.2 0.297 82.4 109.7-101.8 4.0 30.5 28.1 11.7 24 25 A L < + 0 0 1 -3,-0.6 2,-0.3 -4,-0.3 -1,-0.0 -0.663 49.7 159.4 -79.4 86.8 27.0 29.0 12.7 25 26 A T > - 0 0 52 -2,-1.6 4,-2.3 1,-0.1 5,-0.1 -0.796 54.2-127.1-108.3 151.8 26.1 30.8 9.5 26 27 A T H > S+ 0 0 41 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.908 114.3 57.2 -61.8 -38.6 22.7 31.6 8.0 27 28 A R H > S+ 0 0 134 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.922 109.7 42.2 -56.4 -48.1 24.1 29.9 4.8 28 29 A K H > S+ 0 0 51 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.807 111.0 56.2 -70.7 -33.7 24.9 26.7 6.6 29 30 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.957 107.1 49.9 -62.3 -49.0 21.6 26.8 8.6 30 31 A A H X>S+ 0 0 2 -4,-2.7 5,-2.4 1,-0.2 4,-0.6 0.917 109.6 51.0 -54.2 -47.8 19.6 27.0 5.2 31 32 A Q H ><5S+ 0 0 129 -4,-1.9 3,-1.1 3,-0.2 -1,-0.2 0.926 109.2 52.6 -51.1 -46.8 21.6 24.0 3.9 32 33 A K H 3<5S+ 0 0 75 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.898 114.3 39.8 -60.6 -44.1 20.7 22.2 7.1 33 34 A L H 3<5S- 0 0 19 -4,-2.3 -1,-0.3 2,-0.1 -2,-0.2 0.435 111.6-122.8 -83.9 1.1 17.0 22.9 6.7 34 35 A G T <<5S+ 0 0 63 -3,-1.1 2,-0.3 -4,-0.6 -3,-0.2 0.914 70.3 123.0 55.0 46.0 17.3 22.2 2.9 35 36 A I < - 0 0 33 -5,-2.4 2,-0.3 -6,-0.1 -1,-0.2 -0.843 66.9-102.2-128.8 167.2 16.0 25.6 2.0 36 37 A E >> - 0 0 149 -2,-0.3 4,-1.5 -3,-0.1 3,-1.1 -0.668 38.4-110.2 -87.8 146.6 17.2 28.6 -0.0 37 38 A Q H 3> S+ 0 0 93 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.802 114.4 57.1 -49.1 -42.4 18.6 31.6 1.9 38 39 A P H 3> S+ 0 0 100 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.875 105.0 53.0 -62.2 -33.9 15.7 34.0 1.1 39 40 A T H <> S+ 0 0 61 -3,-1.1 4,-0.8 2,-0.2 3,-0.5 0.909 111.8 46.3 -58.1 -45.1 13.2 31.5 2.6 40 41 A L H >X S+ 0 0 3 -4,-1.5 4,-2.3 1,-0.2 3,-1.5 0.948 105.4 60.1 -62.3 -46.7 15.4 31.5 5.7 41 42 A Y H 3< S+ 0 0 146 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.717 96.7 61.3 -55.9 -24.9 15.6 35.3 5.7 42 43 A W H 3< S+ 0 0 189 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.880 117.5 29.2 -68.1 -35.8 11.9 35.5 6.0 43 44 A H H << S+ 0 0 75 -3,-1.5 2,-0.4 -4,-0.8 -2,-0.2 0.769 130.1 31.1 -95.5 -32.7 12.1 33.7 9.4 44 45 A V < - 0 0 19 -4,-2.3 -1,-0.3 1,-0.1 3,-0.1 -0.931 61.7-166.4-136.3 104.0 15.5 34.7 10.8 45 46 A K - 0 0 103 -2,-0.4 2,-0.3 -3,-0.2 -1,-0.1 0.749 64.4 -24.5 -72.7 -24.6 16.8 38.2 9.8 46 47 A N > - 0 0 80 1,-0.1 4,-2.0 -20,-0.0 -1,-0.1 -0.990 66.6 -84.5-174.2 176.9 20.5 37.7 10.9 47 48 A K H > S+ 0 0 75 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.866 119.3 52.3 -65.9 -38.4 23.1 35.9 13.1 48 49 A R H > S+ 0 0 117 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.911 107.5 51.2 -65.3 -44.9 22.7 38.2 16.1 49 50 A A H > S+ 0 0 46 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.959 114.5 46.7 -54.5 -48.1 18.9 37.6 16.2 50 51 A L H X S+ 0 0 7 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.900 109.6 50.5 -62.0 -47.5 19.7 33.9 16.1 51 52 A L H X S+ 0 0 15 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.884 110.7 51.7 -59.8 -38.4 22.4 34.0 18.8 52 53 A D H X S+ 0 0 70 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.895 110.7 46.2 -64.4 -42.2 20.0 35.9 21.1 53 54 A A H X S+ 0 0 26 -4,-1.9 4,-2.5 -5,-0.2 -2,-0.2 0.915 112.0 51.4 -69.0 -43.7 17.3 33.4 20.7 54 55 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.935 106.4 54.7 -56.7 -46.3 19.6 30.5 21.1 55 56 A A H X S+ 0 0 5 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.855 112.6 43.4 -55.7 -39.7 21.0 32.0 24.4 56 57 A V H X S+ 0 0 19 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.882 114.1 49.3 -75.1 -40.2 17.5 32.2 25.8 57 58 A E H X S+ 0 0 30 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.869 103.4 60.1 -69.6 -38.9 16.5 28.7 24.6 58 59 A I H X S+ 0 0 5 -4,-2.9 4,-2.1 1,-0.2 5,-0.2 0.940 113.0 38.2 -52.9 -47.1 19.5 27.1 26.0 59 60 A L H X S+ 0 0 19 -4,-1.1 4,-2.3 -5,-0.2 -2,-0.2 0.884 112.8 56.6 -74.6 -37.3 18.5 28.2 29.5 60 61 A A H < S+ 0 0 71 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.903 116.5 36.7 -59.7 -41.7 14.8 27.7 28.9 61 62 A R H < S+ 0 0 89 -4,-3.1 -2,-0.2 -5,-0.1 -1,-0.2 0.813 133.9 17.4 -80.0 -34.8 15.5 24.0 28.0 62 63 A H H < S+ 0 0 55 -4,-2.1 2,-1.0 -5,-0.3 -3,-0.2 0.496 96.0 89.4-124.8 -0.8 18.3 23.1 30.4 63 64 A H < + 0 0 27 -4,-2.3 3,-0.2 -5,-0.2 -1,-0.1 -0.803 44.7 160.6-101.1 92.1 18.5 25.6 33.2 64 65 A D + 0 0 142 -2,-1.0 2,-0.2 1,-0.2 3,-0.2 0.424 59.4 63.7 -97.7 -1.6 16.2 24.0 35.7 65 66 A Y + 0 0 64 16,-0.2 -1,-0.2 1,-0.1 19,-0.2 -0.507 59.5 124.4-117.6 66.2 17.2 25.7 39.0 66 67 A S + 0 0 30 -3,-0.2 -1,-0.1 -2,-0.2 49,-0.1 0.600 68.1 48.5 -98.3 -15.1 16.4 29.3 38.1 67 68 A L S S- 0 0 78 -3,-0.2 2,-0.1 47,-0.0 45,-0.0 -0.939 88.8-109.0-123.1 147.6 14.1 29.9 41.2 68 69 A P - 0 0 29 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.486 34.4-115.0 -68.8 145.6 14.7 29.1 44.8 69 70 A A > - 0 0 52 1,-0.2 3,-1.7 -2,-0.1 2,-0.2 -0.275 50.7 -73.6 -69.5 165.4 12.8 26.3 46.5 70 71 A A T 3 S+ 0 0 110 1,-0.3 -1,-0.2 -2,-0.0 0, 0.0 -0.454 119.7 1.2 -64.1 128.3 10.3 27.1 49.3 71 72 A G T 3 S+ 0 0 88 1,-0.2 -1,-0.3 -2,-0.2 2,-0.3 0.553 93.6 150.3 71.1 9.2 12.3 28.1 52.4 72 73 A E < - 0 0 23 -3,-1.7 -1,-0.2 1,-0.1 0, 0.0 -0.560 47.0-116.5 -79.6 138.5 15.6 27.6 50.7 73 74 A S > - 0 0 55 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.226 19.2-117.0 -66.5 155.4 18.5 29.8 52.0 74 75 A W H > S+ 0 0 11 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.942 116.1 56.0 -61.2 -42.2 20.2 32.3 49.8 75 76 A Q H > S+ 0 0 38 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.919 110.6 45.0 -55.4 -40.2 23.5 30.4 50.1 76 77 A S H > S+ 0 0 29 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.940 110.8 51.0 -72.7 -46.9 21.8 27.3 48.8 77 78 A F H X S+ 0 0 1 -4,-2.6 4,-3.4 1,-0.2 5,-0.2 0.932 109.7 51.6 -58.1 -43.6 19.9 28.9 46.0 78 79 A L H X S+ 0 0 2 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.875 112.6 45.3 -62.7 -38.4 23.1 30.5 44.7 79 80 A R H X S+ 0 0 71 -4,-1.5 4,-2.5 -5,-0.2 5,-0.2 0.974 117.5 43.2 -65.6 -56.1 25.0 27.2 44.7 80 81 A N H X S+ 0 0 42 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.917 115.5 49.7 -58.5 -44.7 22.2 25.3 43.1 81 82 A N H X S+ 0 0 16 -4,-3.4 4,-2.2 -5,-0.3 -1,-0.2 0.853 111.4 48.1 -60.9 -39.7 21.5 28.1 40.5 82 83 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.914 112.2 49.3 -70.9 -41.5 25.2 28.4 39.6 83 84 A M H X S+ 0 0 65 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.921 112.9 47.8 -57.5 -44.8 25.5 24.6 39.1 84 85 A S H X S+ 0 0 6 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.876 111.1 50.0 -66.4 -41.1 22.4 24.6 37.0 85 86 A F H X S+ 0 0 13 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.910 110.4 51.6 -62.0 -43.7 23.7 27.5 34.9 86 87 A R H X S+ 0 0 8 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.960 108.2 48.9 -61.0 -51.3 27.0 25.7 34.4 87 88 A R H X S+ 0 0 174 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.868 113.3 50.4 -54.9 -41.5 25.4 22.4 33.2 88 89 A A H >< S+ 0 0 0 -4,-1.7 3,-0.9 2,-0.2 4,-0.5 0.938 109.5 47.3 -61.6 -52.5 23.3 24.5 30.8 89 90 A L H >< S+ 0 0 2 -4,-2.5 3,-0.5 1,-0.2 6,-0.4 0.846 115.1 50.3 -55.9 -32.0 26.2 26.5 29.3 90 91 A L H 3< S+ 0 0 44 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.615 87.2 80.0 -89.8 -17.5 28.1 23.2 28.9 91 92 A R T << S+ 0 0 148 -4,-0.9 2,-0.4 -3,-0.9 -1,-0.2 0.759 97.7 44.8 -65.5 -24.9 25.3 21.2 27.1 92 93 A Y S X S- 0 0 18 -3,-0.5 3,-1.8 -4,-0.5 4,-0.3 -0.943 94.8-101.1-120.4 146.3 26.3 22.8 23.8 93 94 A R T 3 S+ 0 0 116 -2,-0.4 -75,-0.1 1,-0.3 -73,-0.1 -0.346 109.8 2.9 -53.2 136.5 29.6 23.6 22.1 94 95 A D T 3> S+ 0 0 11 1,-0.1 4,-1.5 -74,-0.1 -1,-0.3 0.760 90.0 142.0 47.8 29.0 30.6 27.3 22.5 95 96 A G H <> + 0 0 2 -3,-1.8 4,-1.5 -6,-0.4 -5,-0.2 0.866 68.6 50.4 -65.9 -40.3 27.4 27.6 24.6 96 97 A A H > S+ 0 0 0 -7,-0.3 4,-1.7 -4,-0.3 3,-0.3 0.934 109.7 51.9 -58.7 -46.1 29.2 30.0 27.1 97 98 A K H 4 S+ 0 0 72 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.797 106.8 53.6 -58.9 -34.1 30.3 32.0 24.1 98 99 A V H < S+ 0 0 1 -4,-1.5 -43,-0.2 1,-0.2 -1,-0.2 0.846 109.2 48.2 -71.7 -34.7 26.7 32.1 22.9 99 100 A H H >< S+ 0 0 37 -4,-1.5 3,-2.1 -3,-0.3 -2,-0.2 0.816 88.1 113.0 -70.4 -30.8 25.5 33.5 26.2 100 101 A L T 3< S+ 0 0 93 -4,-1.7 3,-0.1 1,-0.3 -45,-0.1 -0.073 83.6 8.2 -56.6 132.3 28.2 36.2 26.3 101 102 A G T 3 S+ 0 0 78 1,-0.3 -1,-0.3 0, 0.0 2,-0.1 0.406 96.2 128.3 78.8 -4.0 27.1 39.7 26.0 102 103 A T < - 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0 0 120 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.597 60.6-132.1 -72.3 -14.6 51.7 21.5 19.9 159 160 A A - 0 0 64 1,-0.1 -5,-0.0 2,-0.0 -4,-0.0 0.827 42.9 -45.7 68.2 119.4 50.4 20.7 23.4 160 161 A A - 0 0 72 1,-0.2 -1,-0.1 2,-0.0 5,-0.1 0.334 55.2-158.8 -11.4 85.8 52.5 21.2 26.6 161 162 A P - 0 0 96 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.383 21.6-162.6 -65.7 7.3 55.8 19.6 25.5 162 163 A D + 0 0 67 1,-0.2 2,-1.5 2,-0.1 8,-0.0 -0.101 58.9 91.9 51.6-134.6 56.7 19.1 29.2 163 164 A E S S+ 0 0 181 1,-0.3 -1,-0.2 2,-0.0 0, 0.0 -0.278 98.7 43.3 43.8 -83.0 60.5 18.4 29.9 164 165 A N S S+ 0 0 145 -2,-1.5 -1,-0.3 -3,-0.2 -2,-0.1 0.278 88.5 116.8 -74.3 13.6 61.1 22.1 30.4 165 166 A L S S- 0 0 31 -5,-0.1 -2,-0.0 -4,-0.1 0, 0.0 -0.685 70.9-122.3 -75.8 128.2 57.9 22.5 32.5 166 167 A P > - 0 0 69 0, 0.0 4,-2.8 0, 0.0 5,-0.2 -0.435 26.9-105.7 -75.0 158.0 58.9 23.5 36.0 167 168 A P H > S+ 0 0 80 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.804 110.8 41.9 -63.4 -43.7 57.7 21.2 38.8 168 169 A L H > S+ 0 0 144 2,-0.2 4,-3.6 1,-0.2 5,-0.1 0.957 117.8 45.6 -68.3 -52.7 54.8 22.9 40.5 169 170 A L H > S+ 0 0 87 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.938 112.2 54.8 -50.8 -48.7 53.2 24.2 37.3 170 171 A R H X S+ 0 0 94 -4,-2.8 4,-1.9 1,-0.3 -2,-0.2 0.937 113.7 39.3 -52.4 -53.9 53.7 20.6 35.8 171 172 A E H X S+ 0 0 117 -4,-2.4 4,-2.1 1,-0.2 -1,-0.3 0.876 111.9 60.3 -66.2 -35.8 51.9 19.1 38.8 172 173 A A H X S+ 0 0 46 -4,-3.6 4,-2.4 2,-0.2 -2,-0.2 0.921 106.7 45.1 -54.9 -46.3 49.4 22.0 38.7 173 174 A L H X S+ 0 0 69 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.897 107.5 56.1 -72.8 -40.7 48.3 21.2 35.1 174 175 A Q H < S+ 0 0 129 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.934 113.7 44.3 -47.4 -45.4 48.0 17.4 35.7 175 176 A I H >< S+ 0 0 95 -4,-2.1 3,-1.7 1,-0.2 4,-0.5 0.901 108.4 54.8 -71.0 -41.1 45.6 18.5 38.5 176 177 A M H 3< S+ 0 0 102 -4,-2.4 3,-0.4 1,-0.3 -1,-0.2 0.868 115.2 41.5 -62.2 -35.6 43.7 21.0 36.5 177 178 A D T 3< S+ 0 0 103 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.023 82.7 97.9 -99.4 20.7 43.0 18.3 33.8 178 179 A S S < S+ 0 0 79 -3,-1.7 2,-0.2 -5,-0.1 -1,-0.2 0.858 104.3 0.2 -69.7 -36.0 42.3 15.5 36.3 179 180 A D S S- 0 0 43 -4,-0.5 -1,-0.1 -3,-0.4 0, 0.0 -0.748 97.7 -77.9-137.5-173.5 38.6 16.4 35.6 180 181 A D S S- 0 0 80 -2,-0.2 -3,-0.1 1,-0.1 -4,-0.1 0.356 81.1 -87.1 -71.3 10.3 36.6 18.8 33.5 181 182 A G S > S+ 0 0 12 -5,-0.1 4,-2.1 -34,-0.0 5,-0.2 0.498 94.5 127.3 88.5 7.1 37.4 21.7 36.0 182 183 A E H > S+ 0 0 75 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.917 71.1 48.5 -62.0 -46.9 34.3 20.7 38.2 183 184 A Q H > S+ 0 0 126 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.959 112.9 48.6 -59.4 -51.8 36.3 20.5 41.5 184 185 A A H > S+ 0 0 47 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.887 114.2 46.6 -54.2 -43.3 38.0 23.8 40.8 185 186 A F H X S+ 0 0 4 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.951 113.2 47.6 -65.8 -46.0 34.7 25.4 40.0 186 187 A L H X S+ 0 0 60 -4,-3.0 4,-1.5 2,-0.2 -2,-0.2 0.867 112.9 48.6 -67.3 -37.4 32.9 23.9 43.0 187 188 A H H X S+ 0 0 143 -4,-2.7 4,-1.9 -5,-0.2 -1,-0.2 0.927 113.6 45.9 -67.7 -48.1 35.6 24.9 45.4 188 189 A G H X S+ 0 0 23 -4,-2.2 4,-2.5 -5,-0.3 -2,-0.2 0.902 107.4 59.8 -56.4 -42.4 35.8 28.5 44.1 189 190 A L H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.894 105.3 48.1 -57.5 -40.4 32.0 28.6 44.2 190 191 A E H X S+ 0 0 74 -4,-1.5 4,-2.7 2,-0.2 5,-0.3 0.920 108.3 53.8 -68.9 -42.0 32.1 28.0 48.0 191 192 A S H X S+ 0 0 72 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.968 109.6 48.1 -55.2 -51.8 34.7 30.6 48.5 192 193 A L H X S+ 0 0 44 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.889 113.7 46.4 -51.3 -49.8 32.5 33.2 46.7 193 194 A I H X S+ 0 0 5 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.909 113.4 47.7 -65.5 -43.2 29.3 32.3 48.7 194 195 A R H X S+ 0 0 149 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.930 110.0 53.9 -64.8 -45.9 31.1 32.3 52.1 195 196 A G H X S+ 0 0 39 -4,-2.7 4,-1.5 -5,-0.3 -2,-0.2 0.894 108.7 48.5 -55.0 -45.6 32.7 35.6 51.2 196 197 A F H X S+ 0 0 39 -4,-2.2 4,-2.9 -5,-0.2 -1,-0.2 0.926 108.5 56.0 -60.9 -40.2 29.3 37.1 50.5 197 198 A E H X S+ 0 0 52 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.914 105.7 48.7 -60.3 -44.3 28.1 35.7 53.8 198 199 A V H < S+ 0 0 71 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.844 113.4 49.5 -67.3 -26.4 30.8 37.5 55.8 199 200 A Q H >X S+ 0 0 89 -4,-1.5 3,-1.6 -5,-0.2 4,-0.9 0.975 111.0 47.7 -69.1 -57.0 29.9 40.7 54.0 200 201 A L H >< S+ 0 0 30 -4,-2.9 3,-1.6 1,-0.3 -2,-0.2 0.947 114.8 45.3 -42.2 -61.7 26.1 40.4 54.6 201 202 A T T 3< S+ 0 0 97 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.388 97.0 74.0 -79.9 5.0 26.5 39.6 58.3 202 203 A A T X4 S+ 0 0 3 -3,-1.6 3,-2.2 1,-0.2 2,-0.4 0.843 70.5 171.9 -74.6 -36.1 29.1 42.4 58.8 203 204 A L T << S- 0 0 141 -3,-1.6 -1,-0.2 -4,-0.9 -2,-0.1 -0.510 73.8 -22.7 61.2-116.5 26.2 44.9 58.6 204 205 A L T 3 S+ 0 0 176 -2,-0.4 -1,-0.3 -3,-0.1 2,-0.1 0.284 114.4 109.8-107.1 8.7 27.9 48.3 59.5 205 206 A Q S < S- 0 0 156 -3,-2.2 2,-0.5 1,-0.1 -3,-0.0 -0.440 79.4-102.3 -74.5 157.4 30.8 46.7 61.4 206 207 A I 0 0 169 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.1 -0.727 360.0 360.0 -84.2 122.6 34.3 46.7 60.1 207 208 A V 0 0 146 -2,-0.5 -1,-0.2 -8,-0.0 -8,-0.0 0.403 360.0 360.0-120.7 360.0 35.3 43.4 58.5