==== 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 LYASE 05-APR-02 1LC7 . COMPND 2 MOLECULE: L-THREONINE-O-3-PHOSPHATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA ENTERICA; . AUTHOR C.-G.CHEONG,J.ESCALANTE-SEMERENA,I.RAYMENT . 359 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15214.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 246 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 6.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 25 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 30.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.5 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 2 1 2 1 1 1 1 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 1 1 1 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 1 1 2 1 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 . 1 0 1 0 0 1 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 4 A F 0 0 87 0, 0.0 2,-0.4 0, 0.0 10,-0.0 0.000 360.0 360.0 360.0 163.2 40.6 30.4 25.0 2 5 A N - 0 0 100 322,-0.0 2,-0.4 3,-0.0 3,-0.0 -0.888 360.0-179.5-132.0 98.0 38.2 32.8 23.2 3 6 A T - 0 0 29 -2,-0.4 321,-0.1 1,-0.1 318,-0.1 -0.807 28.5-144.0-101.5 140.1 36.7 31.2 20.1 4 7 A A S S+ 0 0 60 -2,-0.4 2,-0.3 1,-0.1 102,-0.2 0.778 87.3 26.0 -70.7 -27.9 34.3 33.1 17.8 5 8 A H S S- 0 0 46 1,-0.1 3,-0.3 100,-0.1 -1,-0.1 -0.966 80.0-115.9-137.4 156.2 32.3 29.9 17.3 6 9 A G S S+ 0 0 9 -2,-0.3 22,-0.2 21,-0.2 -1,-0.1 -0.016 85.9 66.9 -72.8-175.1 31.5 26.6 19.0 7 10 A G + 0 0 29 1,-0.1 2,-2.2 21,-0.1 3,-0.3 0.501 58.7 141.2 76.9 6.3 32.5 23.2 17.7 8 11 A N + 0 0 21 -3,-0.3 5,-0.2 1,-0.2 -1,-0.1 -0.330 10.2 147.0 -80.3 61.1 36.2 24.0 18.2 9 12 A I > + 0 0 62 -2,-2.2 4,-2.7 1,-0.2 5,-0.2 0.843 68.2 53.7 -67.9 -34.7 37.2 20.6 19.4 10 13 A R H > S+ 0 0 160 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.935 112.9 44.8 -65.2 -43.2 40.7 20.6 17.9 11 14 A E H > S+ 0 0 59 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.902 115.3 47.3 -66.4 -41.0 41.4 23.9 19.7 12 15 A P H > S+ 0 0 0 0, 0.0 4,-1.3 0, 0.0 -2,-0.2 0.923 111.6 49.5 -65.3 -46.7 39.9 22.7 23.0 13 16 A A H X>S+ 0 0 0 -4,-2.7 5,-2.2 1,-0.2 4,-1.4 0.903 108.9 54.0 -60.6 -41.0 41.8 19.4 22.9 14 17 A T H <5S+ 0 0 91 -4,-2.1 -1,-0.2 1,-0.2 -3,-0.1 0.850 102.5 57.9 -62.9 -33.5 45.0 21.3 22.2 15 18 A V H <5S+ 0 0 82 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.846 113.6 38.7 -62.6 -34.0 44.3 23.4 25.3 16 19 A L H <5S- 0 0 45 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.591 112.7-117.2 -93.1 -14.6 44.3 20.2 27.4 17 20 A G T <5S+ 0 0 68 -4,-1.4 2,-0.2 1,-0.3 -3,-0.2 0.755 76.8 110.1 83.4 25.8 47.1 18.5 25.6 18 21 A I S - 0 0 51 -2,-0.2 3,-2.2 1,-0.1 4,-0.1 -0.596 35.6-123.3 -81.2 143.0 43.4 14.3 21.0 20 23 A P G > S+ 0 0 47 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.783 108.0 68.5 -55.9 -29.3 40.1 15.9 19.8 21 24 A D G 3 S+ 0 0 126 1,-0.3 -11,-0.0 3,-0.0 -2,-0.0 0.581 88.9 66.3 -71.6 -4.0 38.4 12.4 19.8 22 25 A Q G < S+ 0 0 117 -3,-2.2 2,-0.3 2,-0.0 -1,-0.3 0.420 87.9 85.5 -92.0 -3.1 38.7 12.4 23.6 23 26 A L < - 0 0 21 -3,-1.9 2,-0.6 -4,-0.1 294,-0.2 -0.800 68.7-143.5-102.7 147.3 36.2 15.3 23.9 24 27 A L E -a 317 0A 12 292,-2.0 294,-2.5 -2,-0.3 2,-0.7 -0.943 28.6-143.6-104.2 115.1 32.4 15.1 24.1 25 28 A D E +a 318 0A 26 -2,-0.6 294,-0.2 292,-0.2 3,-0.1 -0.777 41.1 154.2 -95.6 115.5 31.2 18.2 22.2 26 29 A F + 0 0 0 292,-3.1 310,-1.5 -2,-0.7 294,-0.5 0.163 61.1 86.7-113.9 12.8 28.2 20.0 23.3 27 30 A S S S+ 0 0 0 291,-0.3 2,-0.3 292,-0.3 -21,-0.2 0.557 84.5 50.9 -93.8 -8.4 29.4 23.3 21.8 28 31 A A S S- 0 0 17 -22,-0.2 2,-0.9 -3,-0.1 308,-0.2 -0.947 80.9-131.8-124.9 148.5 28.0 22.9 18.3 29 32 A N + 0 0 0 331,-3.0 2,-0.4 -2,-0.3 266,-0.1 -0.583 41.7 154.9-109.1 73.4 24.4 21.9 17.6 30 33 A I - 0 0 45 -2,-0.9 184,-0.1 1,-0.1 183,-0.1 -0.808 54.9 -96.8-101.8 136.5 24.4 19.1 15.1 31 34 A N > - 0 0 5 182,-2.5 3,-0.9 -2,-0.4 307,-0.1 -0.263 31.6-146.7 -49.5 125.4 21.6 16.5 14.9 32 35 A P T 3 S+ 0 0 36 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.672 87.7 79.5 -71.9 -21.6 22.8 13.5 17.0 33 36 A L T 3 S- 0 0 71 1,-0.2 2,-0.1 305,-0.1 -2,-0.1 0.716 95.0-144.6 -60.6 -20.4 21.1 11.0 14.7 34 37 A G < - 0 0 26 -3,-0.9 -1,-0.2 2,-0.0 183,-0.1 -0.351 41.2 -11.7 87.9-170.0 24.0 11.4 12.4 35 38 A M S S- 0 0 99 -3,-0.1 181,-0.1 1,-0.1 5,-0.1 -0.462 77.1-104.4 -69.0 129.1 24.3 11.4 8.6 36 39 A P >> - 0 0 0 0, 0.0 4,-1.7 0, 0.0 3,-0.5 -0.295 28.1-125.5 -56.3 135.2 21.2 10.1 6.7 37 40 A V H 3> S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.891 108.7 51.3 -46.6 -52.8 21.9 6.6 5.4 38 41 A S H 3> S+ 0 0 48 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.855 106.1 56.5 -56.3 -38.5 21.0 7.4 1.8 39 42 A V H <> S+ 0 0 0 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.938 105.6 49.5 -60.9 -47.9 23.4 10.4 1.9 40 43 A K H X S+ 0 0 37 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.907 112.9 47.9 -59.5 -42.3 26.4 8.2 2.9 41 44 A R H X S+ 0 0 49 -4,-1.9 4,-3.0 1,-0.2 5,-0.2 0.938 110.7 50.6 -64.5 -45.8 25.6 5.8 0.1 42 45 A A H X S+ 0 0 15 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.898 110.5 49.8 -60.2 -41.4 25.2 8.6 -2.5 43 46 A L H < S+ 0 0 24 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.936 113.8 44.9 -63.8 -46.3 28.6 10.1 -1.5 44 47 A I H >< S+ 0 0 124 -4,-2.2 3,-0.8 1,-0.2 -2,-0.2 0.923 115.8 46.7 -65.1 -42.5 30.4 6.8 -1.7 45 48 A D H 3< S+ 0 0 126 -4,-3.0 3,-0.2 1,-0.2 -1,-0.2 0.825 121.3 36.0 -69.7 -30.8 28.8 5.8 -5.0 46 49 A N T >< S+ 0 0 77 -4,-2.2 3,-1.9 -5,-0.2 -1,-0.2 0.034 74.7 122.0-112.9 28.1 29.4 9.2 -6.7 47 50 A L G X + 0 0 91 -3,-0.8 3,-1.8 1,-0.3 -1,-0.2 0.834 65.6 68.5 -59.4 -32.6 32.7 10.2 -5.2 48 51 A D G > S+ 0 0 64 1,-0.3 3,-1.9 -3,-0.2 -1,-0.3 0.616 76.1 84.9 -64.0 -12.1 34.3 10.5 -8.7 49 52 A C G X S+ 0 0 28 -3,-1.9 3,-1.3 1,-0.3 -1,-0.3 0.680 73.9 73.2 -65.3 -12.9 32.1 13.5 -9.3 50 53 A I G < S+ 0 0 103 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.607 77.8 76.7 -77.1 -7.4 34.9 15.6 -7.6 51 54 A E G < S+ 0 0 168 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.3 0.567 97.7 50.7 -76.0 -9.8 37.0 15.1 -10.7 52 55 A R S < S- 0 0 167 -3,-1.3 195,-0.2 -4,-0.1 3,-0.1 -0.891 98.4 -97.8-124.6 159.3 34.9 17.7 -12.4 53 56 A Y - 0 0 165 -2,-0.3 -2,-0.1 1,-0.1 3,-0.1 -0.323 47.6-102.8 -66.7 156.0 33.9 21.2 -11.3 54 57 A P - 0 0 28 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 -0.316 50.1 -82.9 -72.2 168.6 30.4 21.5 -9.8 55 58 A D > - 0 0 76 1,-0.2 3,-2.1 -3,-0.1 188,-0.0 -0.656 38.1-142.6 -70.8 117.2 27.7 22.9 -12.1 56 59 A A T 3 S+ 0 0 40 -2,-0.6 187,-0.2 1,-0.3 188,-0.2 0.785 102.8 42.5 -55.2 -25.8 28.2 26.7 -11.7 57 60 A D T 3 S- 0 0 124 185,-0.1 -1,-0.3 186,-0.1 5,-0.1 0.442 98.8-141.0 -97.7 -3.9 24.4 27.1 -11.8 58 61 A Y <> + 0 0 8 -3,-2.1 4,-3.0 3,-0.1 5,-0.3 0.866 32.4 172.0 41.6 52.5 23.7 24.1 -9.5 59 62 A F H > S+ 0 0 130 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.951 72.1 43.6 -53.2 -58.6 20.7 23.2 -11.6 60 63 A H H > S+ 0 0 51 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.923 117.3 46.0 -56.5 -47.9 19.9 19.8 -9.9 61 64 A L H > S+ 0 0 1 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.938 114.1 47.4 -62.0 -47.0 20.4 21.2 -6.4 62 65 A H H X S+ 0 0 13 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.914 111.4 51.2 -63.7 -40.4 18.3 24.3 -7.0 63 66 A Q H X S+ 0 0 67 -4,-2.9 4,-2.5 -5,-0.3 -1,-0.2 0.918 110.7 49.8 -60.7 -41.6 15.6 22.2 -8.6 64 67 A A H X S+ 0 0 14 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.910 112.0 46.6 -63.2 -44.5 15.6 19.9 -5.5 65 68 A L H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.887 113.5 49.4 -64.7 -39.2 15.4 22.8 -3.1 66 69 A A H X>S+ 0 0 8 -4,-2.4 5,-1.7 -5,-0.2 4,-1.4 0.866 110.7 49.7 -68.5 -36.9 12.6 24.4 -5.2 67 70 A R H <5S+ 0 0 151 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.923 109.2 53.5 -66.8 -41.7 10.6 21.2 -5.3 68 71 A H H <5S+ 0 0 87 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.884 120.1 31.1 -60.7 -41.2 11.0 20.8 -1.5 69 72 A H H <5S- 0 0 35 -4,-1.8 -1,-0.2 2,-0.1 -2,-0.2 0.533 102.6-127.7 -97.3 -4.4 9.6 24.3 -0.8 70 73 A Q T <5 + 0 0 156 -4,-1.4 -3,-0.2 1,-0.2 -4,-0.1 0.953 67.3 124.5 55.7 52.1 7.2 24.4 -3.8 71 74 A V S - 0 0 63 0, 0.0 3,-1.6 0, 0.0 4,-0.1 -0.404 36.3-128.9 -62.1 141.4 10.1 28.9 -8.3 73 76 A A G > S+ 0 0 29 1,-0.3 3,-1.9 2,-0.2 -8,-0.0 0.786 106.0 70.3 -60.9 -28.1 13.8 27.8 -8.6 74 77 A S G 3 S+ 0 0 62 1,-0.3 -1,-0.3 3,-0.0 153,-0.0 0.689 88.3 63.8 -63.7 -17.4 14.6 31.4 -9.4 75 78 A W G < S+ 0 0 33 -3,-1.6 152,-1.9 151,-0.1 2,-0.4 0.513 94.3 79.2 -82.7 -4.2 13.8 32.3 -5.8 76 79 A I E < +B 226 0B 0 -3,-1.9 2,-0.4 150,-0.2 150,-0.2 -0.871 47.0 178.3-118.3 140.9 16.7 30.2 -4.5 77 80 A L E -B 225 0B 8 148,-2.3 148,-1.9 -2,-0.4 2,-0.1 -0.926 20.3-146.7-137.4 112.0 20.5 30.6 -4.2 78 81 A A E -B 224 0B 4 -2,-0.4 146,-0.3 146,-0.2 2,-0.3 -0.453 19.9-169.6 -76.8 148.8 22.6 27.9 -2.6 79 82 A G E -B 223 0B 2 144,-2.8 2,-2.3 -2,-0.1 144,-2.1 -0.878 39.1 -92.5-138.0 165.1 25.8 28.8 -0.6 80 83 A N S S- 0 0 63 -2,-0.3 4,-0.4 142,-0.2 142,-0.3 -0.506 105.3 -32.4 -78.8 67.1 28.8 27.3 1.0 81 84 A G S >> S- 0 0 0 -2,-2.3 4,-1.1 140,-0.3 3,-0.8 0.029 82.0 -84.2 94.4 156.7 27.0 27.0 4.3 82 85 A E H 3> S+ 0 0 12 140,-0.4 4,-1.9 1,-0.3 5,-0.2 0.710 126.4 72.1 -67.0 -18.7 24.4 29.5 5.5 83 86 A T H 3> S+ 0 0 44 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.930 97.6 48.4 -62.1 -41.3 27.3 31.6 6.7 84 87 A E H <> S+ 0 0 44 -3,-0.8 4,-2.8 -4,-0.4 -1,-0.2 0.920 106.7 56.4 -65.3 -37.0 28.1 32.4 3.0 85 88 A S H X S+ 0 0 3 -4,-1.1 4,-2.5 1,-0.2 -1,-0.2 0.857 104.6 53.4 -61.2 -34.8 24.4 33.2 2.5 86 89 A I H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.934 111.7 43.8 -65.1 -47.1 24.6 35.8 5.3 87 90 A F H X S+ 0 0 52 -4,-1.9 4,-2.9 1,-0.2 5,-0.3 0.885 112.9 54.2 -65.4 -36.7 27.6 37.5 3.6 88 91 A T H X S+ 0 0 26 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.927 111.3 43.2 -62.0 -45.5 25.8 37.2 0.2 89 92 A V H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.946 115.3 49.6 -68.5 -43.1 22.7 39.0 1.5 90 93 A A H X S+ 0 0 2 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.929 117.6 39.5 -61.2 -46.3 24.7 41.6 3.3 91 94 A S H < S+ 0 0 72 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.861 117.1 50.1 -73.3 -33.6 26.9 42.3 0.3 92 95 A G H < S+ 0 0 4 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.814 118.4 36.9 -74.5 -30.5 24.0 42.1 -2.2 93 96 A L H < S- 0 0 26 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.726 84.9-164.3 -91.8 -21.5 21.8 44.4 -0.3 94 97 A K < - 0 0 57 -4,-1.7 -3,-0.1 -5,-0.3 -4,-0.1 0.883 14.9-156.8 35.4 61.4 24.6 46.8 0.8 95 98 A P - 0 0 5 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.311 19.0-155.0 -63.8 146.3 22.4 48.5 3.5 96 99 A R S S+ 0 0 158 1,-0.4 22,-3.2 21,-0.2 2,-0.4 0.817 89.1 17.6 -85.0 -38.2 23.5 52.0 4.6 97 100 A R E S+c 118 0B 66 20,-0.2 48,-2.6 46,-0.2 49,-1.3 -1.000 77.6 172.6-134.4 131.0 21.8 51.4 8.0 98 101 A A E -cd 119 146B 0 20,-2.4 22,-3.1 -2,-0.4 2,-0.4 -0.989 20.8-141.6-141.6 151.8 20.8 48.1 9.4 99 102 A M E +cd 120 147B 10 47,-2.4 49,-2.6 -2,-0.3 2,-0.3 -0.925 16.5 179.8-116.0 137.5 19.5 46.7 12.6 100 103 A I E -cd 121 148B 11 20,-2.0 22,-3.3 -2,-0.4 2,-0.5 -0.831 26.1-123.5-124.5 164.4 20.5 43.4 14.3 101 104 A V E -c 122 0B 14 47,-0.5 22,-0.2 -2,-0.3 20,-0.1 -0.945 35.9-112.0-114.8 128.8 19.2 42.0 17.6 102 105 A T E S+c 123 0B 10 20,-2.2 22,-3.1 -2,-0.5 2,-0.1 -0.898 93.4 40.3-115.0 144.7 21.6 41.1 20.3 103 106 A P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 53,-0.2 0.552 93.2 123.6 -74.1 151.8 22.6 38.6 21.5 104 107 A G - 0 0 9 -2,-0.1 49,-0.1 49,-0.1 -2,-0.1 -0.961 67.9 -48.8-163.6 172.9 22.7 36.8 18.2 105 108 A F > - 0 0 21 -2,-0.3 3,-1.1 1,-0.1 4,-0.4 -0.257 52.6-133.5 -51.5 131.7 24.9 34.9 15.7 106 109 A A T 3> S+ 0 0 44 -102,-0.2 4,-1.6 1,-0.2 3,-0.4 0.749 92.1 74.6 -65.5 -25.1 28.1 36.9 15.3 107 110 A E H 3> S+ 0 0 12 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.745 82.9 65.8 -65.1 -23.5 28.4 36.7 11.6 108 111 A Y H <> S+ 0 0 10 -3,-1.1 4,-2.4 1,-0.2 -1,-0.2 0.958 107.1 42.7 -61.1 -48.9 25.6 39.3 10.9 109 112 A G H > S+ 0 0 18 -4,-0.4 4,-2.3 -3,-0.4 -1,-0.2 0.860 114.2 51.7 -63.8 -36.8 27.7 42.0 12.5 110 113 A R H X S+ 0 0 124 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.952 111.7 45.4 -65.6 -48.0 30.8 40.8 10.7 111 114 A A H X S+ 0 0 3 -4,-3.0 4,-1.1 1,-0.2 -2,-0.2 0.894 115.6 47.2 -61.9 -41.2 29.2 40.7 7.3 112 115 A L H <>S+ 0 0 0 -4,-2.4 5,-2.1 -5,-0.2 4,-0.2 0.871 109.3 52.8 -69.7 -38.6 27.6 44.2 7.8 113 116 A A H ><5S+ 0 0 64 -4,-2.3 3,-1.7 1,-0.2 -2,-0.2 0.940 109.9 48.5 -62.0 -47.3 30.8 45.8 9.1 114 117 A Q H 3<5S+ 0 0 125 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.781 107.3 56.3 -65.3 -25.7 32.8 44.6 6.1 115 118 A S T 3<5S- 0 0 40 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.442 116.1-114.6 -85.7 2.5 30.0 45.9 3.8 116 119 A G T < 5 + 0 0 67 -3,-1.7 2,-0.2 -4,-0.2 -3,-0.2 0.745 60.8 153.8 74.6 27.5 30.4 49.4 5.3 117 120 A C < - 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0 0 27 134,-0.2 -5,-2.5 -28,-0.1 -1,-0.2 -0.546 41.2-148.3 -81.2 140.5 13.6 31.3 21.7 159 162 A L - 0 0 28 -7,-0.2 -8,-0.1 -2,-0.2 3,-0.1 -0.924 17.1-126.8-109.8 116.4 11.2 31.7 18.7 160 163 A P - 0 0 18 0, 0.0 -27,-0.1 0, 0.0 -29,-0.0 -0.386 37.9-100.0 -62.0 141.5 9.3 34.9 18.2 161 164 A E > - 0 0 60 -29,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.200 26.8-117.0 -58.4 146.8 5.5 34.4 18.0 162 165 A R H > S+ 0 0 93 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.903 113.3 55.0 -56.0 -45.5 4.0 34.4 14.5 163 166 A P H > S+ 0 0 99 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.908 109.2 46.9 -56.3 -44.3 1.9 37.5 15.2 164 167 A L H > S+ 0 0 25 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.939 112.8 49.4 -65.4 -42.0 4.9 39.5 16.3 165 168 A L H X S+ 0 0 10 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.885 111.6 49.2 -66.3 -33.6 6.9 38.4 13.2 166 169 A Q H X S+ 0 0 58 -4,-2.7 4,-2.9 -5,-0.2 -1,-0.2 0.904 110.7 50.1 -68.3 -39.4 3.9 39.3 11.0 167 170 A A H X S+ 0 0 37 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.883 113.0 46.6 -65.9 -36.9 3.7 42.7 12.6 168 171 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.931 112.7 49.9 -69.2 -42.4 7.4 43.3 12.1 169 172 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.912 111.6 48.8 -61.7 -45.1 7.2 42.1 8.5 170 173 A D H X S+ 0 0 84 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.891 111.5 47.8 -64.6 -42.6 4.3 44.4 7.9 171 174 A R H X S+ 0 0 92 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.883 111.3 52.0 -67.3 -36.0 6.0 47.4 9.4 172 175 A C H <>S+ 0 0 0 -4,-2.6 5,-2.9 2,-0.2 4,-0.5 0.911 108.0 51.2 -64.0 -41.5 9.1 46.7 7.4 173 176 A K H ><5S+ 0 0 109 -4,-2.3 3,-0.8 1,-0.2 -2,-0.2 0.933 113.3 46.7 -59.8 -44.1 7.1 46.5 4.2 174 177 A S H 3<5S+ 0 0 96 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.797 116.1 42.2 -68.7 -31.2 5.6 49.9 5.1 175 178 A L T 3<5S- 0 0 24 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.246 113.2-112.3-100.6 11.5 8.9 51.5 6.0 176 179 A N T < 5 + 0 0 82 -3,-0.8 2,-0.4 -4,-0.5 -3,-0.2 0.932 66.3 148.2 57.5 50.2 10.8 50.0 3.0 177 180 A I < - 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0 0 41 -2,-0.1 4,-3.0 -307,-0.1 -1,-0.3 -0.337 61.8-107.1 -69.5 157.3 21.6 11.5 22.4 340 343 A A H > S+ 0 0 44 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.905 119.7 50.7 -49.8 -46.5 20.3 10.4 25.8 341 344 A A H > S+ 0 0 69 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.901 112.8 44.0 -60.9 -45.5 23.6 8.8 26.7 342 345 A Q H > S+ 0 0 51 1,-0.2 4,-2.0 2,-0.2 3,-0.4 0.927 112.5 53.0 -66.1 -42.9 25.7 11.8 25.8 343 346 A N H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.856 105.0 57.1 -60.0 -35.0 23.2 14.1 27.6 344 347 A E H X S+ 0 0 78 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.871 105.0 49.6 -66.4 -35.3 23.6 11.8 30.6 345 348 A R H X S+ 0 0 133 -4,-1.4 4,-1.8 -3,-0.4 -2,-0.2 0.890 110.9 50.0 -70.5 -38.1 27.3 12.4 30.7 346 349 A L H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.941 111.3 49.0 -63.9 -46.5 26.8 16.2 30.5 347 350 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.927 109.4 50.8 -59.9 -44.2 24.3 16.1 33.3 348 351 A A H X S+ 0 0 43 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.874 111.5 49.7 -63.1 -33.5 26.5 14.1 35.6 349 352 A A H X S+ 0 0 4 -4,-1.8 4,-1.1 2,-0.2 -1,-0.2 0.928 110.7 48.3 -70.5 -44.4 29.3 16.6 35.0 350 353 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 3,-0.3 0.886 108.3 55.9 -62.6 -38.4 27.1 19.6 35.8 351 354 A R H X S+ 0 0 99 -4,-2.5 4,-3.4 1,-0.2 -1,-0.2 0.914 102.5 54.1 -60.8 -43.8 25.9 17.9 38.9 352 355 A N H < S+ 0 0 123 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.806 115.9 41.2 -60.6 -29.4 29.5 17.4 40.3 353 356 A V H < S+ 0 0 19 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.836 128.5 26.7 -86.5 -36.1 30.0 21.2 39.8 354 357 A L H >< S+ 0 0 1 -4,-2.7 3,-0.6 -5,-0.1 -3,-0.2 0.670 97.4 92.7-105.0 -19.0 26.6 22.4 41.0 355 358 A T T 3< S+ 0 0 55 -4,-3.4 3,-0.1 -5,-0.3 -71,-0.0 -0.506 87.5 17.3 -81.7 144.7 25.3 19.8 43.6 356 359 A G T 3 S+ 0 0 90 1,-0.2 2,-0.4 -2,-0.2 -1,-0.2 0.792 88.9 132.7 69.3 30.6 25.9 20.0 47.3 357 360 A I < 0 0 41 -3,-0.6 -1,-0.2 0, 0.0 -71,-0.1 -0.951 360.0 360.0-117.3 129.8 26.9 23.7 47.3 358 361 A A 0 0 149 -2,-0.4 0, 0.0 -3,-0.1 0, 0.0 -0.314 360.0 360.0 -68.4 360.0 25.4 26.3 49.8 359 ! 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 0.0 360 990 A X 0 0 32 0, 0.0 -331,-3.0 0, 0.0 -355,-0.0 0.000 360.0 360.0 360.0 360.0 26.7 27.0 15.1