==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOSYNTHETIC PROTEIN 22-OCT-08 3EZF . COMPND 2 MOLECULE: PARA; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA ENTERICA SUBSP. ENTERICA SE . AUTHOR M.A.SCHUMACHER . 342 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18684.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 237 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 2.0 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 . 1 0.3 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 . 21 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 119 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.6 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 3 2 1 1 0 3 1 0 2 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 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 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 3 A R > 0 0 270 0, 0.0 3,-3.3 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 -86.8 55.8 45.2 8.0 2 4 A D T 3 + 0 0 108 1,-0.3 4,-0.4 2,-0.3 5,-0.1 0.456 360.0 81.8 -60.3 0.4 53.2 43.6 10.3 3 5 A Y T 3 S+ 0 0 213 1,-0.3 3,-0.4 2,-0.2 4,-0.4 0.864 103.6 35.1 -69.7 -33.5 50.9 43.9 7.4 4 6 A G S < S+ 0 0 65 -3,-3.3 -2,-0.3 1,-0.2 -1,-0.3 0.322 117.2 59.3 -95.0 4.3 52.7 40.7 6.5 5 7 A G S > S+ 0 0 18 -4,-0.2 4,-0.8 2,-0.1 -2,-0.2 0.335 93.2 61.9-111.9 1.8 52.8 40.1 10.3 6 8 A V H > S+ 0 0 90 -4,-0.4 4,-2.5 -3,-0.4 -2,-0.1 0.661 94.7 62.2 -96.6 -26.0 49.0 40.1 10.8 7 9 A G H > S+ 0 0 38 -4,-0.4 4,-3.0 2,-0.2 5,-0.2 0.838 101.3 54.5 -67.8 -32.1 48.6 37.1 8.6 8 10 A T H > S+ 0 0 78 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.983 109.1 44.3 -63.6 -59.0 50.7 35.2 11.1 9 11 A I H X S+ 0 0 113 -4,-0.8 4,-2.9 1,-0.2 -2,-0.2 0.916 112.6 57.2 -50.6 -43.2 48.4 36.1 14.0 10 12 A A H X S+ 0 0 51 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.976 109.4 41.4 -51.3 -63.7 45.6 35.2 11.6 11 13 A L H X S+ 0 0 123 -4,-3.0 4,-2.8 1,-0.2 5,-0.3 0.891 112.6 53.6 -52.5 -48.0 46.9 31.7 11.0 12 14 A R H X S+ 0 0 202 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.935 113.7 45.3 -55.1 -43.7 47.8 31.1 14.7 13 15 A A H X S+ 0 0 52 -4,-2.9 4,-2.5 -5,-0.3 -2,-0.2 0.986 112.0 48.1 -62.2 -61.8 44.2 32.1 15.5 14 16 A S H X S+ 0 0 55 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.902 112.9 50.0 -44.4 -52.5 42.5 30.1 12.8 15 17 A A H X S+ 0 0 59 -4,-2.8 4,-1.3 1,-0.3 3,-0.4 0.959 110.9 48.0 -51.7 -57.8 44.5 27.0 13.8 16 18 A L H < S+ 0 0 108 -4,-2.4 4,-0.5 -5,-0.3 -1,-0.3 0.816 107.0 60.0 -55.0 -31.8 43.7 27.5 17.4 17 19 A L H >X S+ 0 0 114 -4,-2.5 3,-1.6 2,-0.2 4,-1.0 0.942 99.1 56.3 -62.1 -49.0 40.0 27.9 16.4 18 20 A K H >< S+ 0 0 171 -4,-2.1 3,-1.6 -3,-0.4 -2,-0.2 0.937 105.4 48.7 -47.4 -59.2 39.9 24.4 14.8 19 21 A A T 3< S+ 0 0 95 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.631 103.6 66.6 -59.2 -11.9 41.0 22.6 18.0 20 22 A M T <4 0 0 126 -3,-1.6 -1,-0.3 -4,-0.5 -2,-0.2 0.837 360.0 360.0 -77.0 -34.8 38.3 24.7 19.7 21 23 A S << 0 0 125 -3,-1.6 -2,-0.2 -4,-1.0 -1,-0.2 0.649 360.0 360.0 -83.4 360.0 35.5 22.9 17.8 22 ! 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 23 38 A Y 0 0 138 0, 0.0 2,-0.1 0, 0.0 148,-0.0 0.000 360.0 360.0 360.0 116.5 15.3 26.4 35.1 24 39 A Y + 0 0 147 2,-0.0 2,-0.5 47,-0.0 147,-0.0 -0.402 360.0 164.5-177.2 94.3 12.6 25.2 37.5 25 40 A Q + 0 0 75 -2,-0.1 47,-0.6 44,-0.0 2,-0.3 -0.957 11.3 177.8-114.6 128.9 9.6 27.0 38.7 26 41 A T E -A 71 0A 34 -2,-0.5 2,-0.3 45,-0.2 45,-0.2 -0.895 15.5-142.8-126.1 157.0 6.8 25.2 40.4 27 42 A F E -A 70 0A 16 43,-2.5 43,-1.3 -2,-0.3 2,-0.3 -0.837 13.2-125.3-118.7 158.2 3.5 26.5 41.8 28 43 A T >> - 0 0 68 -2,-0.3 4,-2.4 41,-0.2 3,-0.8 -0.672 34.7-108.3 -93.7 157.0 1.6 25.5 44.9 29 44 A R H 3> S+ 0 0 101 39,-0.4 4,-2.5 1,-0.3 5,-0.2 0.943 122.9 52.7 -49.2 -52.5 -2.1 24.5 44.4 30 45 A N H 3> S+ 0 0 70 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.809 108.3 52.9 -54.1 -31.7 -3.2 27.7 46.0 31 46 A A H <4 S+ 0 0 32 -3,-0.8 3,-0.4 2,-0.2 4,-0.3 0.957 108.6 46.7 -69.7 -50.2 -0.9 29.5 43.6 32 47 A V H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.841 109.1 57.7 -59.8 -32.0 -2.5 27.9 40.6 33 48 A A H 3< S+ 0 0 9 -4,-2.5 5,-0.3 1,-0.3 -1,-0.2 0.879 98.9 58.0 -66.3 -37.4 -5.9 28.7 42.0 34 49 A K T 3< S+ 0 0 184 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.540 90.3 102.4 -70.6 -4.1 -4.9 32.4 42.1 35 50 A L S X S- 0 0 9 -3,-1.2 3,-1.4 -4,-0.3 82,-0.1 -0.461 88.0 -75.8 -81.0 154.2 -4.4 32.2 38.4 36 51 A P T 3 S+ 0 0 37 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.029 113.5 7.5 -46.7 144.8 -6.9 33.5 35.8 37 52 A K T 3 S+ 0 0 140 1,-0.2 2,-0.3 -3,-0.1 -3,-0.1 0.683 114.9 97.8 54.0 22.3 -10.0 31.5 35.1 38 53 A L < + 0 0 19 -3,-1.4 2,-0.3 -5,-0.3 -1,-0.2 -0.922 44.3 176.4-137.8 163.2 -9.1 29.1 38.0 39 54 A S > - 0 0 45 -2,-0.3 4,-2.6 -3,-0.1 5,-0.3 -0.957 51.0 -91.6-156.6 165.3 -10.0 28.6 41.7 40 55 A R H > S+ 0 0 166 -2,-0.3 4,-1.3 1,-0.2 5,-0.1 0.742 128.1 51.0 -56.7 -21.9 -9.1 26.1 44.4 41 56 A R H > S+ 0 0 146 2,-0.2 4,-1.4 3,-0.1 -1,-0.2 0.894 110.2 47.5 -81.7 -41.9 -12.2 24.2 43.3 42 57 A I H > S+ 0 0 17 2,-0.2 4,-3.3 -3,-0.2 -2,-0.2 0.961 115.9 44.2 -61.3 -55.3 -11.2 24.1 39.7 43 58 A V H X S+ 0 0 2 -4,-2.6 4,-3.4 2,-0.2 5,-0.3 0.950 112.5 49.1 -54.2 -59.2 -7.7 23.0 40.4 44 59 A D H X S+ 0 0 73 -4,-1.3 4,-1.5 -5,-0.3 -1,-0.2 0.800 118.0 43.4 -53.6 -30.8 -8.5 20.3 43.0 45 60 A Q H X S+ 0 0 59 -4,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.851 112.4 51.4 -83.7 -39.1 -11.1 19.0 40.5 46 61 A A H X S+ 0 0 0 -4,-3.3 4,-3.1 2,-0.2 -2,-0.2 0.952 113.7 44.6 -61.9 -49.9 -8.8 19.3 37.5 47 62 A I H X S+ 0 0 7 -4,-3.4 4,-2.5 2,-0.2 5,-0.3 0.941 114.2 48.8 -60.4 -49.5 -6.0 17.4 39.3 48 63 A K H X S+ 0 0 101 -4,-1.5 4,-1.9 -5,-0.3 3,-0.3 0.973 115.9 43.3 -53.5 -59.2 -8.4 14.7 40.6 49 64 A E H X S+ 0 0 75 -4,-2.7 4,-0.5 1,-0.2 -2,-0.2 0.921 114.6 50.3 -53.2 -49.7 -10.0 14.2 37.2 50 65 A M H >< S+ 0 0 13 -4,-3.1 3,-0.6 1,-0.2 -1,-0.2 0.812 112.4 45.0 -61.4 -36.1 -6.6 14.2 35.4 51 66 A E H >< S+ 0 0 81 -4,-2.5 3,-1.5 -3,-0.3 -1,-0.2 0.755 95.3 77.8 -78.9 -24.7 -5.0 11.7 37.7 52 67 A E H 3< S+ 0 0 150 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.784 110.7 26.4 -55.2 -22.7 -8.1 9.6 37.5 53 68 A D T << S- 0 0 130 -3,-0.6 -1,-0.3 -4,-0.5 2,-0.2 -0.279 127.6 -74.4-139.1 54.6 -6.7 8.6 34.1 54 69 A G S < S+ 0 0 43 -3,-1.5 -1,-0.4 1,-0.2 0, 0.0 -0.564 73.4 122.2 94.1-157.4 -2.9 8.9 34.2 55 70 A Y - 0 0 79 -2,-0.2 2,-0.5 1,-0.1 -1,-0.2 0.665 47.8-135.9 63.2 129.8 -0.8 12.1 34.2 56 71 A Q - 0 0 158 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.964 8.9-148.2-121.7 120.1 1.6 12.8 37.0 57 72 A F - 0 0 3 -2,-0.5 2,-0.2 1,-0.1 13,-0.1 -0.505 30.1-102.0 -85.3 154.7 1.9 16.1 38.7 58 73 A N - 0 0 49 -2,-0.2 11,-2.0 11,-0.1 2,-0.4 -0.469 40.6-167.4 -72.8 142.0 5.3 17.2 40.1 59 74 A K - 0 0 82 9,-0.3 2,-0.2 -2,-0.2 7,-0.0 -0.998 11.7-135.4-139.4 138.2 5.7 16.9 43.9 60 75 A K - 0 0 100 -2,-0.4 7,-1.5 1,-0.0 2,-0.8 -0.486 10.1-138.1 -88.1 158.3 8.2 18.3 46.4 61 76 A Q B +B 66 0B 151 5,-0.2 2,-0.3 -2,-0.2 5,-0.1 -0.860 52.2 140.4-113.5 84.6 9.9 16.4 49.3 62 77 A V + 0 0 56 -2,-0.8 2,-2.4 3,-0.5 3,-0.3 -0.892 64.8 6.4-123.8 160.8 9.7 19.2 51.8 63 78 A G S S- 0 0 82 -2,-0.3 3,-0.1 1,-0.2 -2,-0.1 -0.455 117.7 -77.2 68.0 -82.9 8.9 18.8 55.5 64 79 A N S S+ 0 0 140 -2,-2.4 -1,-0.2 1,-0.2 2,-0.0 0.159 111.7 78.3-177.0 -33.9 8.9 14.9 55.3 65 80 A V S S- 0 0 83 -3,-0.3 -3,-0.5 1,-0.1 2,-0.3 0.118 92.7 -82.6 -77.2-174.1 5.5 14.3 53.6 66 81 A E B -B 61 0B 111 -5,-0.1 -5,-0.2 1,-0.1 -1,-0.1 -0.788 45.2-173.4-104.3 150.2 4.6 14.7 49.8 67 82 A Q - 0 0 80 -7,-1.5 -1,-0.1 -2,-0.3 2,-0.1 0.473 23.5-117.9-107.0-118.7 3.7 18.2 48.4 68 83 A Y + 0 0 35 2,-0.0 2,-0.5 -41,-0.0 -39,-0.4 -0.230 30.7 170.0 163.0 95.3 2.4 19.3 45.0 69 84 A A - 0 0 3 -11,-2.0 -41,-0.2 -41,-0.1 -11,-0.1 -0.811 19.4-160.1-124.5 87.6 4.6 21.6 42.9 70 85 A L E -A 27 0A 0 -43,-1.3 -43,-2.5 -2,-0.5 2,-0.1 -0.387 11.6-133.8 -69.8 144.9 3.1 21.8 39.4 71 86 A T E > -A 26 0A 16 -45,-0.2 4,-2.6 -2,-0.1 5,-0.3 -0.450 32.3 -93.0 -93.8 169.7 5.3 23.0 36.6 72 87 A I H > S+ 0 0 2 -47,-0.6 4,-1.7 1,-0.3 5,-0.1 0.824 131.1 48.2 -50.3 -32.5 4.6 25.5 33.9 73 88 A Q H > S+ 0 0 80 2,-0.2 4,-2.8 3,-0.2 -1,-0.3 0.881 106.7 53.6 -77.5 -40.3 3.5 22.5 31.8 74 89 A N H > S+ 0 0 14 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.948 111.8 46.5 -56.2 -50.4 1.3 21.0 34.5 75 90 A V H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.898 113.0 49.1 -58.0 -46.0 -0.5 24.4 34.8 76 91 A I H X S+ 0 0 3 -4,-1.7 4,-1.4 -5,-0.3 -1,-0.2 0.875 110.7 51.2 -63.3 -37.4 -0.8 24.6 31.0 77 92 A D H X S+ 0 0 44 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.799 107.6 52.0 -71.1 -27.5 -2.2 21.1 30.9 78 93 A I H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.887 110.1 49.0 -73.0 -38.8 -4.8 21.9 33.6 79 94 A Y H <>S+ 0 0 3 -4,-2.1 5,-2.7 1,-0.2 -2,-0.2 0.806 112.7 49.6 -67.4 -29.9 -5.9 24.9 31.4 80 95 A A H ><5S+ 0 0 34 -4,-1.4 3,-1.6 3,-0.2 -2,-0.2 0.890 109.2 49.3 -76.2 -40.1 -6.0 22.4 28.5 81 96 A H H 3<5S+ 0 0 67 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.905 106.2 57.3 -64.2 -38.4 -8.0 19.9 30.5 82 97 A R T 3<5S- 0 0 69 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.300 116.3-122.8 -73.8 11.5 -10.3 22.8 31.4 83 98 A K T < 5 + 0 0 188 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.820 54.0 160.4 46.7 42.8 -10.7 23.2 27.7 84 99 A I < - 0 0 25 -5,-2.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.836 45.6-110.1 -95.0 115.0 -9.5 26.9 27.7 85 100 A P - 0 0 67 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.040 28.8-134.4 -46.0 137.1 -8.3 27.9 24.2 86 101 A K > - 0 0 40 1,-0.1 3,-2.4 36,-0.1 4,-0.5 -0.462 28.9-101.3 -87.8 165.7 -4.6 28.4 23.7 87 102 A Y G >> S+ 0 0 3 34,-1.7 4,-1.8 1,-0.3 3,-1.1 0.831 122.9 61.0 -57.6 -31.9 -3.1 31.4 21.9 88 103 A R G 34 S+ 0 0 90 33,-0.5 -1,-0.3 1,-0.2 5,-0.1 0.427 97.9 60.2 -76.1 2.6 -2.6 29.2 18.8 89 104 A D G <4 S+ 0 0 107 -3,-2.4 -1,-0.2 3,-0.1 -2,-0.2 0.555 109.7 38.3-104.2 -11.4 -6.4 28.6 18.7 90 105 A I T <4 S+ 0 0 104 -3,-1.1 2,-0.4 -4,-0.5 -2,-0.2 0.812 111.9 53.4-103.8 -44.1 -7.3 32.3 18.3 91 106 A H S < S- 0 0 31 -4,-1.8 -1,-0.2 1,-0.1 4,-0.1 -0.768 77.6-122.6-104.1 140.3 -4.6 33.6 15.9 92 107 A K - 0 0 196 -2,-0.4 -2,-0.1 1,-0.1 -1,-0.1 -0.225 59.1 -73.9 -63.5 171.1 -3.4 32.4 12.6 93 108 A S S S+ 0 0 44 1,-0.1 127,-0.1 -5,-0.1 -1,-0.1 -0.557 93.2 27.1-102.2 145.9 0.3 31.7 12.7 94 109 A P - 0 0 6 0, 0.0 2,-0.9 0, 0.0 127,-0.2 0.906 45.1-171.9 87.2 84.1 3.5 33.9 12.9 95 110 A Y E -c 221 0C 15 125,-1.5 127,-2.1 124,-0.2 2,-0.6 -0.877 22.3-152.3 -93.5 107.5 3.1 37.4 14.4 96 111 A V E -c 222 0C 0 -2,-0.9 146,-1.9 125,-0.2 147,-1.6 -0.750 10.0-164.6 -92.9 121.0 6.6 38.8 13.6 97 112 A I E -cd 223 243C 2 125,-2.6 127,-2.2 -2,-0.6 2,-0.8 -0.878 7.6-155.0-107.7 111.4 7.9 41.5 15.9 98 113 A F E -cd 224 244C 1 145,-2.6 147,-2.8 -2,-0.6 2,-0.6 -0.750 16.0-149.6 -86.0 109.4 10.9 43.6 14.7 99 114 A V E -cd 225 245C 10 125,-2.0 2,-1.4 -2,-0.8 127,-0.6 -0.726 5.0-142.0 -86.2 119.8 12.6 44.8 17.9 100 115 A V + 0 0 4 145,-2.9 2,-0.8 -2,-0.6 125,-0.1 -0.606 27.4 175.2 -81.8 84.9 14.3 48.2 17.5 101 116 A N 0 0 67 -2,-1.4 125,-0.1 125,-0.5 147,-0.1 -0.827 360.0 360.0 -99.5 110.1 17.5 47.9 19.5 102 117 A L 0 0 92 -2,-0.8 -1,-0.2 145,-0.3 146,-0.0 0.735 360.0 360.0 -97.7 360.0 19.8 50.9 19.2 103 ! 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 0.0 104 126 A S >> 0 0 93 0, 0.0 3,-1.7 0, 0.0 4,-1.6 0.000 360.0 360.0 360.0 -86.1 17.0 41.7 26.5 105 127 A T H 3> + 0 0 6 1,-0.3 4,-2.2 2,-0.2 3,-0.4 0.878 360.0 49.4 -44.6 -44.5 14.8 40.5 23.6 106 128 A V H 3> S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 -1,-0.3 0.817 103.9 61.8 -66.8 -26.0 15.0 37.0 24.9 107 129 A T H <> S+ 0 0 79 -3,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.881 105.0 45.6 -67.0 -36.8 14.1 38.4 28.3 108 130 A L H X S+ 0 0 24 -4,-1.6 4,-3.0 -3,-0.4 5,-0.3 0.940 112.6 51.0 -70.3 -44.9 10.8 39.6 27.0 109 131 A A H X S+ 0 0 0 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.927 112.2 47.3 -56.0 -45.0 10.2 36.3 25.3 110 132 A H H X S+ 0 0 20 -4,-3.1 4,-2.0 2,-0.2 -1,-0.2 0.903 113.9 47.6 -62.9 -42.8 11.0 34.5 28.6 111 133 A A H X S+ 0 0 27 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.978 109.7 50.5 -61.2 -61.3 8.6 36.8 30.5 112 134 A L H < S+ 0 0 4 -4,-3.0 3,-0.2 1,-0.2 11,-0.2 0.861 112.2 52.9 -45.2 -39.4 5.7 36.5 28.1 113 135 A R H < S+ 0 0 18 -4,-1.7 10,-0.2 -5,-0.3 -1,-0.2 0.954 117.5 29.5 -65.3 -56.2 6.2 32.8 28.3 114 136 A V H < S+ 0 0 42 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.366 87.8 140.8 -90.5 6.0 6.1 32.1 32.1 115 137 A H >X - 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0 0 80 -122,-0.1 0, 0.0 1,-0.0 0, 0.0 -0.954 360.0-129.2-123.1 141.1 29.6 25.7 20.4 144 171 A I - 0 0 64 -2,-0.4 3,-0.1 1,-0.1 -1,-0.0 -0.063 19.1-177.3 -77.7-176.9 26.9 26.6 17.9 145 172 A L + 0 0 134 1,-0.1 2,-1.0 20,-0.1 -1,-0.1 0.479 57.3 70.4-150.4 -42.0 27.0 26.4 14.2 146 173 A E - 0 0 44 18,-0.2 -1,-0.1 19,-0.1 2,-0.1 -0.740 58.0-173.9 -98.3 98.3 24.0 27.5 12.3 147 174 A T > - 0 0 6 -2,-1.0 4,-3.0 1,-0.1 32,-0.2 -0.388 36.8-112.3 -81.4 164.9 23.4 31.3 12.5 148 175 A A H > S+ 0 0 0 30,-1.8 4,-2.2 -19,-0.6 5,-0.2 0.886 118.2 54.2 -63.8 -40.9 20.3 33.0 11.0 149 176 A A H > S+ 0 0 0 -20,-0.3 4,-1.1 1,-0.2 -1,-0.2 0.916 113.4 43.2 -60.2 -42.3 22.3 34.7 8.3 150 177 A Q H > S+ 0 0 51 2,-0.2 4,-1.8 1,-0.2 3,-0.4 0.926 109.8 55.1 -69.9 -46.2 23.7 31.3 7.3 151 178 A A H <>S+ 0 0 0 -4,-3.0 5,-0.9 1,-0.2 -2,-0.2 0.876 105.9 53.9 -56.1 -38.3 20.3 29.5 7.5 152 179 A M H ><5S+ 0 0 1 -4,-2.2 3,-0.8 1,-0.2 -1,-0.2 0.883 110.1 46.2 -64.3 -38.8 18.8 32.0 5.2 153 180 A L H 3<5S+ 0 0 16 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.782 104.1 62.7 -75.8 -25.9 21.5 31.4 2.5 154 181 A N T 3<5S- 0 0 73 -4,-1.8 -1,-0.2 1,-0.0 -2,-0.2 0.290 95.2-134.3 -85.4 12.3 21.3 27.6 2.8 155 182 A N T < 5 - 0 0 81 -3,-0.8 -3,-0.1 -4,-0.1 -2,-0.1 0.860 39.7-173.6 35.5 52.4 17.7 27.4 1.6 156 183 A L < - 0 0 25 -5,-0.9 2,-0.2 54,-0.2 -1,-0.1 -0.136 17.4-115.7 -69.4 171.1 17.0 24.9 4.4 157 184 A D > - 0 0 64 1,-0.1 4,-2.1 57,-0.0 5,-0.3 -0.662 29.0 -99.4-108.2 162.8 13.8 23.0 5.0 158 185 A A H > S+ 0 0 20 1,-0.2 4,-1.9 -2,-0.2 5,-0.1 0.871 121.5 48.5 -47.2 -46.1 11.2 23.1 7.8 159 186 A E H > S+ 0 0 90 2,-0.2 4,-2.7 1,-0.2 5,-0.4 0.927 107.8 53.0 -63.9 -47.9 12.7 20.0 9.5 160 187 A T H >>S+ 0 0 29 1,-0.2 5,-2.0 2,-0.2 4,-1.6 0.927 110.8 46.8 -55.6 -47.9 16.3 21.1 9.4 161 188 A L H <>S+ 0 0 0 -4,-2.1 5,-3.8 3,-0.2 -1,-0.2 0.915 115.6 50.1 -59.9 -40.4 15.4 24.4 11.0 162 189 A R H <5S+ 0 0 115 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.968 122.9 22.3 -61.4 -64.3 13.4 22.5 13.6 163 190 A K H <5S+ 0 0 124 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.435 139.0 21.5 -91.0 0.6 15.7 19.7 14.8 164 191 A E T <5S+ 0 0 130 -4,-1.6 -3,-0.2 -5,-0.4 -18,-0.2 0.654 123.1 35.9-132.8 -48.7 19.0 21.3 13.9 165 192 A V T S- 0 0 12 3,-0.4 3,-2.3 1,-0.1 -2,-0.3 -0.900 80.5-148.7-120.3 99.8 12.8 28.3 29.1 172 199 A P T 3 S+ 0 0 75 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.732 93.9 53.8 -36.9 -40.3 11.3 25.4 27.1 173 200 A G T 3 S+ 0 0 9 1,-0.1 -48,-1.2 -63,-0.1 2,-0.6 0.791 98.9 71.0 -72.6 -22.8 8.6 27.5 25.4 174 201 A V E < -e 125 0C 0 -3,-2.3 -5,-0.5 -50,-0.2 -3,-0.4 -0.849 64.0-174.7-101.1 113.2 11.1 30.1 24.0 175 202 A D E -e 126 0C 33 -50,-2.7 -48,-2.4 -2,-0.6 2,-0.4 -0.675 7.0-153.0-105.0 158.6 13.5 29.1 21.2 176 203 A V E -eG 127 167C 5 -9,-3.1 -9,-2.8 -2,-0.2 -48,-0.2 -0.991 15.1-149.5-137.0 139.6 16.4 31.0 19.6 177 204 A I E -e 128 0C 0 -50,-1.6 -48,-2.7 -2,-0.4 -29,-0.2 -0.928 40.6-131.0-104.3 106.5 18.1 31.0 16.2 178 205 A P - 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