==== 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 04-DEC-08 2W53 . COMPND 2 MOLECULE: REPRESSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: STENOTROPHOMONAS MALTOPHILIA; . AUTHOR M.J.MATE,A.ROMERO,A.HERNANDEZ,J.L.MARTINEZ . 375 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18405.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 280 74.7 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 . 4 1.1 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 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 229 61.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.9 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 2 1 0 1 0 1 1 0 0 0 1 2 0 2 0 1 2 1 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 . 2 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 7 A E > 0 0 151 0, 0.0 3,-2.7 0, 0.0 4,-0.4 0.000 360.0 360.0 360.0 94.2 39.2 13.2 52.0 2 8 A D G > + 0 0 43 1,-0.3 3,-1.5 2,-0.2 42,-0.1 0.762 360.0 56.5 -48.9 -44.0 37.1 11.3 49.4 3 9 A T G 3 S+ 0 0 56 1,-0.3 -1,-0.3 41,-0.0 38,-0.0 0.571 99.1 63.1 -69.9 -8.1 34.7 9.6 51.8 4 10 A Q G < S+ 0 0 129 -3,-2.7 -1,-0.3 2,-0.1 -2,-0.2 0.546 76.1 112.2 -89.2 -9.6 33.6 13.0 53.2 5 11 A A < - 0 0 5 -3,-1.5 2,-0.2 -4,-0.4 31,-0.0 -0.404 64.4-133.6 -65.4 140.4 32.2 14.2 49.9 6 12 A T > - 0 0 90 1,-0.1 4,-2.2 -2,-0.1 5,-0.2 -0.576 13.3-122.0 -94.4 159.6 28.4 14.6 49.9 7 13 A R H > S+ 0 0 116 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.915 113.8 50.4 -66.4 -43.5 26.1 13.3 47.2 8 14 A E H > S+ 0 0 105 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.888 109.9 50.7 -61.8 -41.2 24.7 16.8 46.5 9 15 A G H > S+ 0 0 27 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.900 111.0 47.9 -63.0 -41.7 28.2 18.3 46.2 10 16 A I H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.947 114.9 46.8 -64.0 -45.5 29.3 15.6 43.8 11 17 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.911 111.3 50.2 -62.6 -44.2 26.1 16.3 41.8 12 18 A D H X S+ 0 0 83 -4,-3.1 4,-1.7 2,-0.2 -1,-0.2 0.920 114.2 45.5 -59.9 -45.2 26.5 20.1 41.9 13 19 A A H X S+ 0 0 9 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.914 113.3 50.6 -62.1 -44.5 30.1 19.7 40.6 14 20 A A H X S+ 0 0 0 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.900 107.5 51.9 -61.7 -43.9 29.0 17.2 38.0 15 21 A E H X S+ 0 0 8 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.915 109.6 50.2 -58.1 -43.4 26.3 19.4 36.6 16 22 A A H X S+ 0 0 19 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.902 113.1 46.3 -63.5 -42.1 28.8 22.4 36.3 17 23 A C H X>S+ 0 0 1 -4,-1.9 4,-3.0 2,-0.2 5,-0.6 0.919 112.9 48.5 -64.5 -48.8 31.3 20.1 34.4 18 24 A F H X5S+ 0 0 1 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.890 111.8 50.9 -60.0 -41.2 28.6 18.7 32.1 19 25 A H H <5S+ 0 0 28 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.878 118.9 36.5 -63.4 -37.0 27.3 22.2 31.4 20 26 A E H <5S+ 0 0 111 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.844 133.7 18.7 -89.6 -32.6 30.8 23.5 30.5 21 27 A H H <5S- 0 0 93 -4,-3.0 4,-0.4 1,-0.2 -3,-0.2 0.591 102.8-116.2-114.2 -18.8 32.4 20.5 28.7 22 28 A G X< - 0 0 27 -4,-1.5 4,-0.8 -5,-0.6 -1,-0.2 -0.236 35.9 -78.9 95.5 166.6 29.5 18.3 27.6 23 29 A V T >4 S+ 0 0 45 1,-0.2 3,-0.6 2,-0.2 -1,-0.1 0.936 124.8 53.2 -72.0 -45.5 28.8 14.8 28.8 24 30 A A T 34 S+ 0 0 87 1,-0.2 -1,-0.2 -6,-0.1 -2,-0.1 0.869 112.9 41.4 -54.8 -44.4 31.4 13.0 26.6 25 31 A R T 34 S+ 0 0 196 -4,-0.4 2,-0.3 -7,-0.1 -1,-0.2 0.577 92.5 97.4 -89.4 -10.7 34.4 15.2 27.6 26 32 A T << - 0 0 0 -4,-0.8 2,-0.3 -3,-0.6 23,-0.0 -0.592 59.5-163.1 -77.4 135.3 33.6 15.3 31.3 27 33 A T > - 0 0 60 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.778 32.6-115.5-116.1 166.8 35.6 12.7 33.3 28 34 A L H > S+ 0 0 20 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.880 118.6 53.8 -64.7 -37.8 35.1 11.3 36.8 29 35 A E H > S+ 0 0 95 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.902 108.3 50.0 -59.3 -41.8 38.5 12.9 37.7 30 36 A M H > S+ 0 0 51 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.931 110.7 47.8 -66.0 -46.8 37.2 16.2 36.5 31 37 A I H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 6,-0.2 0.943 113.6 48.7 -57.3 -46.8 34.0 16.0 38.5 32 38 A G H X>S+ 0 0 0 -4,-2.6 5,-3.0 1,-0.2 4,-0.7 0.945 113.3 46.6 -58.4 -49.2 36.0 14.9 41.6 33 39 A A H ><5S+ 0 0 67 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.901 108.9 54.9 -60.6 -43.8 38.4 17.8 41.2 34 40 A R H 3<5S+ 0 0 127 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.887 108.5 49.2 -55.9 -41.5 35.6 20.3 40.6 35 41 A A H 3<5S- 0 0 30 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.557 125.6-102.8 -77.7 -10.2 34.0 19.2 44.0 36 42 A G T <<5S+ 0 0 62 -3,-1.1 -3,-0.2 -4,-0.7 -2,-0.1 0.597 95.2 70.9 99.2 16.8 37.4 19.6 45.8 37 43 A Y S > - 0 0 79 -2,-0.1 3,-1.6 -6,-0.1 4,-0.7 -0.738 48.7 -80.2-129.7-178.0 39.3 13.1 43.5 39 45 A R H >> S+ 0 0 108 1,-0.3 4,-2.1 -2,-0.2 3,-1.0 0.836 123.0 67.4 -52.6 -34.4 37.6 10.4 41.4 40 46 A G H 3> S+ 0 0 25 1,-0.3 4,-1.4 2,-0.2 -1,-0.3 0.844 92.8 59.0 -60.4 -31.4 37.2 8.3 44.5 41 47 A A H <4 S+ 0 0 0 -3,-1.6 4,-0.3 2,-0.2 -1,-0.3 0.832 106.7 47.7 -66.8 -29.6 34.7 10.8 45.9 42 48 A V H XX S+ 0 0 0 -3,-1.0 4,-2.7 -4,-0.7 3,-1.7 0.934 109.4 51.8 -76.4 -41.6 32.6 10.2 42.9 43 49 A Y H 3< S+ 0 0 125 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.762 94.7 72.3 -62.6 -27.9 32.8 6.5 43.2 44 50 A W T 3< S+ 0 0 157 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.764 118.8 16.8 -60.7 -22.0 31.7 6.8 46.8 45 51 A H T <4 S+ 0 0 56 -3,-1.7 2,-0.4 -4,-0.3 -2,-0.2 0.638 126.6 45.5-120.7 -26.9 28.2 7.6 45.5 46 52 A F < - 0 0 6 -4,-2.7 -1,-0.2 1,-0.1 3,-0.1 -0.964 58.3-146.6-132.1 140.9 28.1 6.5 41.8 47 53 A K S S- 0 0 154 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.863 82.1 -24.8 -70.0 -34.6 29.2 3.4 40.0 48 54 A N S > S- 0 0 64 -6,-0.1 4,-1.4 1,-0.1 3,-0.4 -0.924 77.8 -76.1-165.3-178.7 30.1 5.3 36.9 49 55 A K H > S+ 0 0 58 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.868 122.1 60.2 -66.4 -35.3 29.5 8.5 34.9 50 56 A S H > S+ 0 0 90 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.894 105.0 49.5 -55.4 -42.8 26.1 7.2 33.5 51 57 A E H > S+ 0 0 85 -3,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.849 110.6 50.6 -66.2 -35.9 24.8 7.0 37.1 52 58 A V H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 3,-0.3 0.961 111.3 46.7 -65.1 -49.0 26.0 10.5 37.8 53 59 A L H X S+ 0 0 36 -4,-2.8 4,-2.4 1,-0.3 -2,-0.2 0.917 111.8 52.1 -60.0 -41.0 24.3 11.9 34.7 54 60 A A H X S+ 0 0 32 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.3 0.820 108.6 49.6 -64.8 -36.4 21.1 10.0 35.6 55 61 A A H X S+ 0 0 6 -4,-1.6 4,-1.6 -3,-0.3 -1,-0.2 0.859 110.4 51.4 -69.6 -37.6 21.1 11.4 39.1 56 62 A I H X S+ 0 0 0 -4,-2.3 4,-0.9 1,-0.2 -2,-0.2 0.913 113.8 44.5 -62.0 -42.8 21.6 15.0 37.7 57 63 A V H X S+ 0 0 5 -4,-2.4 4,-2.7 -5,-0.2 3,-0.4 0.895 110.8 52.6 -70.5 -40.9 18.6 14.4 35.4 58 64 A E H X S+ 0 0 109 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.851 103.4 59.6 -63.1 -33.7 16.4 12.8 38.0 59 65 A R H < S+ 0 0 46 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.817 117.1 29.9 -66.6 -34.1 17.0 15.8 40.3 60 66 A V H X S+ 0 0 6 -4,-0.9 4,-0.9 -3,-0.4 -2,-0.2 0.843 122.4 49.1 -92.4 -43.5 15.5 18.3 37.8 61 67 A H H X S+ 0 0 36 -4,-2.7 4,-1.6 1,-0.2 -3,-0.2 0.886 102.0 60.9 -69.6 -39.5 13.1 16.1 36.1 62 68 A L H X S+ 0 0 70 -4,-2.4 4,-2.2 -5,-0.3 -1,-0.2 0.792 98.2 53.5 -68.1 -34.8 11.3 14.5 39.1 63 69 A P H > S+ 0 0 61 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.929 109.3 51.9 -61.1 -41.7 9.9 17.7 40.7 64 70 A F H X S+ 0 0 36 -4,-0.9 4,-2.3 1,-0.2 -2,-0.2 0.900 109.2 50.8 -59.2 -38.3 8.3 18.5 37.3 65 71 A M H X S+ 0 0 13 -4,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.912 106.9 52.1 -68.9 -41.9 6.8 15.0 37.3 66 72 A Q H X S+ 0 0 118 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.858 111.0 49.2 -58.7 -40.1 5.3 15.3 40.8 67 73 A E H X S+ 0 0 65 -4,-2.0 4,-0.8 2,-0.2 3,-0.4 0.937 110.0 48.8 -65.2 -50.3 3.7 18.6 39.7 68 74 A L H >< S+ 0 0 10 -4,-2.3 3,-0.7 1,-0.2 4,-0.3 0.854 106.8 59.0 -56.5 -37.6 2.2 17.1 36.6 69 75 A E H >< S+ 0 0 72 -4,-2.1 3,-1.3 1,-0.2 -1,-0.2 0.894 99.3 57.1 -57.8 -41.6 0.9 14.2 38.7 70 76 A R H >< S+ 0 0 94 -4,-1.3 3,-1.6 -3,-0.4 -1,-0.2 0.726 89.9 74.2 -61.8 -28.0 -1.1 16.6 40.9 71 77 A T T << S+ 0 0 2 -4,-0.8 -1,-0.2 -3,-0.7 12,-0.2 0.679 94.5 50.7 -63.7 -20.4 -3.0 18.0 37.9 72 78 A S T < S+ 0 0 18 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.282 82.3 140.4-100.7 9.8 -5.2 14.8 37.6 73 79 A T X - 0 0 51 -3,-1.6 3,-0.8 1,-0.1 -3,-0.0 -0.205 55.0-138.0 -61.2 146.4 -6.2 14.7 41.3 74 80 A D T 3 S+ 0 0 124 1,-0.2 -1,-0.1 3,-0.1 -2,-0.0 0.435 97.4 70.4 -71.4 -9.6 -9.8 13.8 42.4 75 81 A Q T 3 S+ 0 0 165 2,-0.0 2,-0.3 1,-0.0 -1,-0.2 0.418 97.5 48.4 -98.5 1.7 -9.8 16.6 44.9 76 82 A R < - 0 0 103 -3,-0.8 -1,-0.0 -5,-0.0 6,-0.0 -0.977 62.9-150.7-140.1 152.7 -9.9 19.4 42.5 77 83 A D S S+ 0 0 98 -2,-0.3 3,-0.1 1,-0.2 -3,-0.1 0.135 77.8 76.7-115.5 22.3 -12.1 20.1 39.5 78 84 A T > + 0 0 47 1,-0.1 4,-2.4 2,-0.1 5,-0.2 -0.471 43.6 153.5-129.0 62.7 -10.0 22.2 37.3 79 85 A P H > S+ 0 0 4 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.820 75.9 50.6 -63.3 -36.5 -7.5 19.8 35.6 80 86 A V H > S+ 0 0 1 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.930 113.1 44.1 -66.4 -45.6 -7.0 21.9 32.5 81 87 A H H > S+ 0 0 79 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.882 113.9 51.9 -63.9 -37.3 -6.3 25.1 34.5 82 88 A D H X S+ 0 0 6 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.909 108.8 49.9 -67.4 -42.6 -4.0 23.1 36.8 83 89 A L H X S+ 0 0 0 -4,-2.2 4,-2.8 -12,-0.2 5,-0.2 0.904 112.2 47.9 -59.9 -44.1 -2.1 21.6 33.8 84 90 A R H X S+ 0 0 4 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.920 110.6 52.4 -63.1 -40.3 -1.6 25.1 32.4 85 91 A A H X S+ 0 0 4 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.923 113.0 43.4 -62.8 -46.2 -0.5 26.4 35.8 86 92 A V H X S+ 0 0 6 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.946 118.2 44.0 -63.0 -49.9 2.1 23.6 36.1 87 93 A M H X S+ 0 0 14 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.921 114.2 47.7 -66.1 -47.1 3.3 24.0 32.5 88 94 A I H X S+ 0 0 5 -4,-3.0 4,-2.2 -5,-0.2 -1,-0.2 0.928 112.3 48.2 -62.4 -47.4 3.5 27.8 32.3 89 95 A H H X S+ 0 0 55 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.2 0.796 110.8 53.9 -65.1 -26.7 5.3 28.1 35.6 90 96 A S H X S+ 0 0 16 -4,-1.5 4,-2.6 2,-0.2 5,-0.2 0.914 107.2 49.7 -66.4 -49.1 7.8 25.4 34.3 91 97 A F H X S+ 0 0 7 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.894 112.8 48.6 -53.7 -43.5 8.5 27.4 31.1 92 98 A I H X S+ 0 0 52 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.929 110.6 48.8 -64.9 -47.4 9.1 30.5 33.3 93 99 A E H X S+ 0 0 91 -4,-2.0 4,-2.4 2,-0.2 8,-0.2 0.923 113.2 47.9 -57.9 -43.0 11.4 28.6 35.7 94 100 A L H < S+ 0 0 12 -4,-2.6 7,-0.2 1,-0.2 -1,-0.2 0.885 112.8 49.1 -67.0 -39.7 13.4 27.2 32.7 95 101 A S H < S+ 0 0 28 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.895 121.1 34.3 -61.2 -40.4 13.6 30.6 31.1 96 102 A E H < S+ 0 0 106 -4,-2.5 2,-0.7 1,-0.2 -2,-0.2 0.660 105.7 69.8 -99.5 -16.1 14.8 32.3 34.2 97 103 A D X - 0 0 45 -4,-2.4 4,-2.6 -5,-0.2 5,-0.2 -0.881 58.2-169.9-108.4 106.4 17.0 29.6 35.9 98 104 A E H > S+ 0 0 128 -2,-0.7 4,-2.7 2,-0.2 5,-0.2 0.872 86.6 50.6 -62.4 -42.3 20.2 29.1 33.9 99 105 A R H > S+ 0 0 92 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.949 112.2 47.5 -58.6 -52.0 21.2 26.0 35.9 100 106 A L H > S+ 0 0 13 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.902 112.8 50.2 -57.2 -45.6 17.8 24.4 35.4 101 107 A R H X S+ 0 0 85 -4,-2.6 4,-2.3 -7,-0.2 -1,-0.2 0.907 107.8 50.6 -63.9 -45.1 17.9 25.3 31.7 102 108 A K H X S+ 0 0 52 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.883 110.7 49.8 -65.9 -32.1 21.3 23.8 31.0 103 109 A T H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.901 109.2 51.7 -71.0 -37.3 20.4 20.6 32.6 104 110 A M H X S+ 0 0 30 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.910 109.3 53.3 -57.3 -40.0 17.2 20.5 30.6 105 111 A E H X S+ 0 0 39 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.913 106.4 49.0 -66.2 -43.5 19.5 21.0 27.6 106 112 A I H < S+ 0 0 10 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.935 112.9 50.1 -60.9 -38.9 21.8 18.1 28.4 107 113 A M H < S+ 0 0 18 -4,-2.1 3,-0.5 1,-0.2 -2,-0.2 0.905 117.6 36.9 -68.7 -38.7 18.7 15.9 28.8 108 114 A L H < S+ 0 0 15 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.844 116.7 45.6 -82.7 -37.9 17.0 16.9 25.5 109 115 A R < 0 0 64 -4,-2.3 176,-1.1 -5,-0.2 -1,-0.2 0.000 360.0 360.0-101.2 30.6 19.8 17.2 23.0 110 116 A S 0 0 63 -3,-0.5 175,-0.3 174,-0.1 -3,-0.1 0.606 360.0 360.0 -79.7 360.0 21.4 14.0 24.2 111 ! 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 0.0 112 126 A T > 0 0 87 0, 0.0 4,-2.0 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0-103.8 18.7 7.6 25.1 113 127 A E H > + 0 0 151 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.722 360.0 61.3 -64.9 -26.6 16.7 5.4 27.6 114 128 A M H > S+ 0 0 69 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.897 106.4 45.7 -69.5 -40.3 16.5 8.3 30.0 115 129 A Q H > S+ 0 0 9 -3,-0.3 4,-3.2 2,-0.2 5,-0.3 0.944 111.1 52.3 -67.9 -45.3 14.6 10.4 27.5 116 130 A Q H X S+ 0 0 58 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.955 112.7 44.7 -54.7 -52.6 12.3 7.5 26.6 117 131 A A H X S+ 0 0 52 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.930 114.7 49.1 -57.8 -44.4 11.4 6.9 30.2 118 132 A G H X S+ 0 0 8 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.898 110.5 49.4 -63.2 -44.2 11.0 10.6 30.9 119 133 A F H X S+ 0 0 16 -4,-3.2 4,-2.7 2,-0.2 5,-0.2 0.931 111.7 49.8 -57.5 -48.0 8.7 11.1 27.8 120 134 A R H X S+ 0 0 113 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.949 110.5 50.1 -59.6 -48.8 6.6 8.1 28.9 121 135 A D H X S+ 0 0 61 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.940 113.8 44.9 -51.0 -52.6 6.3 9.5 32.4 122 136 A A H X S+ 0 0 14 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.903 112.6 50.4 -63.1 -42.8 5.2 13.0 31.2 123 137 A L H X S+ 0 0 24 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.909 108.7 53.0 -61.9 -43.3 2.7 11.6 28.6 124 138 A D H X S+ 0 0 71 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.930 112.3 43.5 -56.1 -49.7 1.1 9.4 31.2 125 139 A R H X S+ 0 0 54 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.898 114.2 48.8 -68.3 -41.2 0.5 12.3 33.6 126 140 A M H X S+ 0 0 8 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.934 112.1 50.6 -61.5 -45.0 -0.7 14.7 30.9 127 141 A E H X S+ 0 0 43 -4,-2.8 4,-2.0 -5,-0.2 -2,-0.2 0.883 108.8 51.8 -59.6 -38.7 -3.0 11.9 29.6 128 142 A R H X S+ 0 0 65 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.899 109.4 48.8 -67.8 -35.4 -4.4 11.4 33.1 129 143 A A H X S+ 0 0 2 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.897 112.9 47.5 -67.9 -44.1 -5.1 15.1 33.6 130 144 A L H X S+ 0 0 3 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.781 108.4 56.1 -68.1 -28.2 -6.9 15.2 30.2 131 145 A R H X S+ 0 0 108 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.866 108.8 46.5 -71.3 -35.9 -8.8 12.0 31.2 132 146 A R H X S+ 0 0 36 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.901 110.5 53.6 -66.9 -44.8 -10.1 13.8 34.3 133 147 A A H <>S+ 0 0 0 -4,-2.3 5,-3.4 1,-0.2 6,-0.5 0.900 110.3 47.3 -51.9 -45.3 -10.9 16.8 32.1 134 148 A R H ><5S+ 0 0 100 -4,-2.1 3,-1.3 4,-0.2 -1,-0.2 0.869 109.8 52.1 -65.2 -39.3 -13.0 14.5 29.9 135 149 A D H 3<5S+ 0 0 117 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.836 110.9 49.4 -64.9 -32.6 -14.7 13.0 33.0 136 150 A L T 3<5S- 0 0 62 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.301 118.7-112.7 -89.9 7.9 -15.6 16.5 34.0 137 151 A G T < 5S+ 0 0 41 -3,-1.3 -3,-0.2 -5,-0.1 -2,-0.1 0.703 81.8 122.5 69.9 22.9 -17.0 17.4 30.5 138 152 A Q < + 0 0 35 -5,-3.4 51,-2.6 -6,-0.2 2,-0.2 0.584 50.5 83.0 -93.6 -8.5 -14.2 19.9 29.7 139 153 A L B S-A 188 0A 10 -6,-0.5 49,-0.3 49,-0.3 3,-0.1 -0.620 87.4-106.3 -92.7 150.7 -12.9 18.2 26.5 140 154 A R > - 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0 0 29 0, 0.0 3,-0.1 0, 0.0 -117,-0.0 -0.243 23.7 -93.7 -76.5 164.4 -2.3 31.6 36.1 200 214 A E - 0 0 170 1,-0.1 -111,-0.1 -111,-0.0 -115,-0.0 -0.470 55.2 -94.9 -67.8 146.3 -1.5 31.5 39.8 201 215 A P - 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -115,-0.1 -0.332 54.2 -85.3 -62.1 154.8 1.1 28.8 40.6 202 216 A L 0 0 23 -120,-0.1 -131,-0.0 -117,-0.1 -120,-0.0 -0.307 360.0 360.0 -64.6 138.1 -0.5 25.5 41.7 203 217 A P 0 0 105 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.935 360.0 360.0 -39.8 360.0 -1.3 25.4 45.4 204 !* 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 0.0 205 13 B R > 0 0 96 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -71.5 33.4 14.6 -2.7 206 14 B E H > + 0 0 52 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.841 360.0 57.6 -66.4 -34.8 30.0 13.0 -2.6 207 15 B G H > S+ 0 0 24 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.935 107.3 47.3 -60.0 -46.3 31.8 9.7 -2.1 208 16 B I H > S+ 0 0 76 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.964 113.4 46.7 -59.5 -52.3 33.4 11.2 1.0 209 17 B L H < S+ 0 0 37 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.871 112.8 51.0 -59.1 -37.2 30.1 12.5 2.3 210 18 B D H < S+ 0 0 108 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.882 111.5 46.5 -65.4 -43.3 28.4 9.1 1.6 211 19 B A H < 0 0 36 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.906 360.0 360.0 -62.9 -46.3 31.2 7.3 3.5 212 20 B A < 0 0 57 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.950 360.0 360.0 -68.5 360.0 30.9 9.8 6.3 213 ! 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 0.0 214 35 B E 0 0 208 0, 0.0 3,-0.4 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 54.8 39.2 8.6 11.1 215 36 B M > + 0 0 68 1,-0.2 4,-2.5 2,-0.1 5,-0.2 0.082 360.0 104.7 -95.5 19.9 38.4 5.8 8.6 216 37 B I H > S+ 0 0 25 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.947 85.0 44.6 -63.8 -48.7 36.0 8.0 6.6 217 38 B G H >>S+ 0 0 28 -3,-0.4 5,-2.6 1,-0.2 4,-1.3 0.909 115.1 49.1 -58.0 -43.7 38.7 8.2 3.9 218 39 B A H 45S+ 0 0 79 -4,-0.3 -2,-0.2 2,-0.2 -1,-0.2 0.821 111.3 47.5 -68.8 -33.8 39.3 4.5 4.2 219 40 B R H <5S+ 0 0 74 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.912 115.4 47.2 -68.6 -42.1 35.5 3.7 4.0 220 41 B A H <5S- 0 0 23 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.707 112.3-127.6 -66.8 -26.0 35.4 6.1 1.0 221 42 B G T <5 + 0 0 63 -4,-1.3 -3,-0.2 1,-0.3 2,-0.2 0.643 62.7 132.3 84.8 18.7 38.5 4.3 -0.4 222 43 B Y < 0 0 127 -5,-2.6 -1,-0.3 -6,-0.2 -2,-0.1 -0.650 360.0 360.0-105.9 162.4 40.5 7.6 -0.9 223 44 B T 0 0 153 -2,-0.2 -5,-0.1 -5,-0.0 -1,-0.1 0.685 360.0 360.0 -60.9 360.0 44.0 8.7 0.0 224 ! 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 0.0 225 56 B S > 0 0 76 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -48.4 32.5 18.6 12.3 226 57 B E H > + 0 0 159 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.853 360.0 50.9 -63.3 -33.4 33.0 20.0 8.8 227 58 B V H > S+ 0 0 47 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.937 110.6 45.5 -67.1 -49.0 31.9 16.5 7.6 228 59 B L H > S+ 0 0 73 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.846 115.0 49.9 -64.5 -36.6 28.8 16.4 9.8 229 60 B A H X S+ 0 0 3 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.943 108.6 50.4 -66.2 -50.1 28.0 20.0 8.7 230 61 B A H X S+ 0 0 33 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.799 111.6 52.0 -56.2 -30.6 28.5 19.1 5.0 231 62 B I H X S+ 0 0 13 -4,-1.6 4,-1.2 2,-0.2 -1,-0.2 0.929 109.6 45.6 -73.5 -46.6 26.1 16.2 5.6 232 63 B V H X S+ 0 0 2 -4,-2.2 4,-2.6 1,-0.2 3,-0.2 0.899 112.2 54.4 -65.6 -36.8 23.4 18.3 7.2 233 64 B E H X S+ 0 0 88 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.916 104.2 52.4 -59.0 -46.9 23.8 20.9 4.4 234 65 B R H < S+ 0 0 99 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.769 116.5 40.1 -64.1 -29.0 23.3 18.3 1.5 235 66 B V H X S+ 0 0 18 -4,-1.2 4,-1.1 -3,-0.2 -1,-0.2 0.843 112.1 55.0 -87.1 -41.3 20.0 17.1 3.1 236 67 B H H X S+ 0 0 35 -4,-2.6 4,-2.5 -5,-0.2 3,-0.5 0.947 97.7 66.5 -51.7 -55.5 18.7 20.5 4.1 237 68 B L H X S+ 0 0 74 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.802 98.4 47.3 -39.1 -61.0 19.0 22.0 0.6 238 69 B P H > S+ 0 0 69 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.916 115.7 46.2 -50.1 -49.2 16.3 19.9 -1.1 239 70 B F H X S+ 0 0 29 -4,-1.1 4,-2.6 -3,-0.5 -2,-0.2 0.896 111.6 52.8 -63.8 -39.6 13.8 20.5 1.7 240 71 B M H X S+ 0 0 16 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.902 108.6 48.2 -62.2 -46.0 14.6 24.2 1.7 241 72 B Q H X S+ 0 0 108 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.900 111.6 51.7 -61.9 -38.6 14.0 24.6 -2.0 242 73 B E H X S+ 0 0 78 -4,-2.0 4,-0.8 -5,-0.2 -2,-0.2 0.935 111.7 46.2 -61.5 -47.5 10.7 22.8 -1.6 243 74 B L H >< S+ 0 0 8 -4,-2.6 3,-0.7 1,-0.2 4,-0.3 0.889 109.3 55.3 -62.2 -39.3 9.7 25.1 1.2 244 75 B E H >< S+ 0 0 84 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.892 102.2 57.2 -60.4 -40.6 10.7 28.1 -0.8 245 76 B R H >< S+ 0 0 113 -4,-2.0 3,-1.8 1,-0.2 -1,-0.2 0.756 90.1 73.8 -61.7 -25.2 8.5 27.1 -3.7 246 77 B T T << S+ 0 0 2 -4,-0.8 -1,-0.2 -3,-0.7 12,-0.2 0.689 95.2 50.8 -66.2 -19.7 5.4 27.1 -1.4 247 78 B S T < S+ 0 0 27 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.246 78.9 142.6 -99.7 11.8 5.3 30.9 -1.3 248 79 B T X - 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