==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 15-NOV-04 1Y0K . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN PA4535; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR B.P.NOCEK,E.EVDOKIMOVA,A.SAVCHENKO,A.EDWARDS,A.JOACHIMIAK,MI . 180 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9365.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 128 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 9.4 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 . 2 1.1 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 . 11 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 30.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.7 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 1 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 1 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 PARALLEL BRIDGES PER LADDER . 0 2 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 0 160 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 135.1 9.8 20.0 34.4 2 2 A N > - 0 0 88 1,-0.1 4,-1.9 4,-0.0 5,-0.1 -0.289 360.0-113.2 -61.7 153.7 10.2 16.6 32.7 3 3 A E H > S+ 0 0 135 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.874 112.9 56.1 -60.9 -40.5 11.6 16.9 29.2 4 4 A A H > S+ 0 0 30 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.924 110.3 44.5 -59.1 -46.3 8.5 15.6 27.5 5 5 A D H > S+ 0 0 70 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.844 112.1 53.4 -70.8 -31.1 6.3 18.3 29.0 6 6 A Y H X S+ 0 0 87 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.936 109.7 47.0 -66.9 -44.7 9.0 21.0 28.3 7 7 A L H X S+ 0 0 21 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.872 110.8 53.9 -63.5 -37.0 9.1 20.0 24.6 8 8 A R H X S+ 0 0 107 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.904 106.5 51.8 -60.3 -43.9 5.2 20.1 24.7 9 9 A L H X S+ 0 0 36 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.940 110.4 48.0 -56.8 -49.1 5.4 23.6 26.1 10 10 A L H X S+ 0 0 11 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.862 110.9 51.9 -64.4 -33.7 7.7 24.7 23.2 11 11 A T H X S+ 0 0 18 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.910 109.6 48.0 -65.9 -44.6 5.4 23.0 20.7 12 12 A R H X S+ 0 0 132 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.900 110.7 53.1 -62.8 -40.2 2.3 24.9 22.0 13 13 A Q H X S+ 0 0 10 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.921 109.0 48.5 -56.1 -47.6 4.4 28.1 21.9 14 14 A A H X S+ 0 0 6 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.917 110.1 52.2 -60.5 -43.9 5.2 27.3 18.2 15 15 A E H X S+ 0 0 80 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.905 107.2 52.8 -57.7 -43.8 1.5 26.7 17.5 16 16 A Q H X S+ 0 0 123 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.881 108.1 49.9 -60.0 -44.0 0.6 30.0 19.1 17 17 A A H X S+ 0 0 2 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.914 112.0 48.5 -61.9 -44.5 3.0 31.9 16.9 18 18 A N H X S+ 0 0 18 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.901 107.8 54.4 -61.8 -42.8 1.6 30.1 13.8 19 19 A D H X S+ 0 0 102 -4,-2.6 4,-0.7 1,-0.2 -1,-0.2 0.918 111.8 45.5 -59.1 -42.8 -2.0 30.9 14.8 20 20 A F H >X S+ 0 0 75 -4,-2.0 4,-1.0 1,-0.2 3,-0.8 0.934 114.1 47.1 -62.6 -48.9 -1.0 34.6 15.0 21 21 A L H >< S+ 0 0 8 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.885 106.3 57.3 -64.3 -39.5 0.9 34.7 11.7 22 22 A S H 3< S+ 0 0 81 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.719 116.1 37.0 -67.0 -19.4 -1.8 32.9 9.7 23 23 A N H << S+ 0 0 138 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.505 96.3 100.4-109.6 -8.2 -4.4 35.6 10.7 24 24 A A S << S- 0 0 17 -4,-1.0 2,-0.1 -3,-0.5 -3,-0.0 -0.401 76.8-106.6 -79.5 155.1 -2.2 38.7 10.7 25 25 A R > - 0 0 211 -2,-0.1 4,-2.8 1,-0.1 5,-0.2 -0.490 36.5-108.0 -76.8 155.8 -2.1 41.3 7.8 26 26 A K H > S+ 0 0 99 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.897 112.3 33.6 -57.8 -57.9 1.0 41.2 5.6 27 27 A W H > S+ 0 0 84 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.911 118.8 53.7 -68.5 -38.6 2.9 44.4 6.5 28 28 A D H > S+ 0 0 58 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.907 108.3 51.2 -58.3 -42.9 1.8 44.1 10.1 29 29 A R H X S+ 0 0 63 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.906 112.3 45.9 -57.3 -47.5 3.2 40.6 10.2 30 30 A E H X S+ 0 0 11 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.905 113.8 47.8 -66.6 -42.8 6.5 41.8 8.8 31 31 A R H X S+ 0 0 40 -4,-3.0 4,-2.8 2,-0.2 -2,-0.2 0.900 108.3 56.2 -63.5 -40.2 6.7 44.7 11.2 32 32 A W H X S+ 0 0 29 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.922 106.0 50.6 -58.9 -44.5 5.8 42.4 14.1 33 33 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.932 110.3 49.7 -58.6 -47.1 8.8 40.2 13.2 34 34 A C H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.918 110.5 50.1 -58.1 -45.2 11.1 43.2 13.2 35 35 A Q H X S+ 0 0 15 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.929 110.0 49.6 -60.6 -44.8 9.7 44.3 16.6 36 36 A R H X S+ 0 0 26 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.896 112.6 48.8 -60.1 -40.7 10.3 40.8 18.1 37 37 A F H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.934 111.6 47.4 -64.9 -47.5 13.8 40.9 16.7 38 38 A L H <>S+ 0 0 0 -4,-2.6 5,-2.7 1,-0.2 4,-0.4 0.897 111.5 52.1 -62.9 -40.1 14.6 44.3 18.1 39 39 A E H ><5S+ 0 0 88 -4,-2.6 3,-1.0 1,-0.2 -1,-0.2 0.897 106.5 54.1 -60.6 -40.6 13.2 43.3 21.5 40 40 A A H 3<5S+ 0 0 11 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.859 113.5 42.0 -58.9 -37.3 15.4 40.2 21.4 41 41 A L T 3<5S- 0 0 11 -4,-1.7 -1,-0.2 2,-0.1 -2,-0.2 0.382 110.7-121.4 -92.9 2.1 18.5 42.5 20.9 42 42 A N T < 5 + 0 0 147 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.910 56.3 157.5 55.1 46.5 17.3 45.1 23.4 43 43 A V < - 0 0 20 -5,-2.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.915 40.1-126.3-103.0 116.5 17.3 47.8 20.7 44 44 A P + 0 0 103 0, 0.0 2,-0.3 0, 0.0 -5,-0.0 -0.292 36.3 168.6 -63.3 145.5 15.0 50.7 21.6 45 45 A Y - 0 0 57 -10,-0.0 2,-0.3 5,-0.0 3,-0.0 -0.991 28.3-144.5-151.7 155.7 12.3 51.8 19.2 46 46 A R > - 0 0 166 -2,-0.3 3,-1.9 1,-0.1 4,-0.3 -0.873 35.8-112.8-113.5 157.2 9.2 54.0 18.9 47 47 A Q G > S+ 0 0 99 -2,-0.3 3,-1.4 1,-0.3 -1,-0.1 0.847 115.8 60.9 -58.4 -36.4 6.3 52.9 16.7 48 48 A E G 3 S+ 0 0 123 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.0 0.617 86.0 78.7 -65.1 -15.7 7.0 55.8 14.3 49 49 A D G < S+ 0 0 45 -3,-1.9 14,-0.5 13,-0.1 2,-0.4 0.675 79.1 80.8 -68.8 -19.5 10.4 54.3 13.5 50 50 A F E < +A 62 0A 15 -3,-1.4 2,-0.3 -4,-0.3 12,-0.2 -0.762 56.9 164.0 -92.8 135.9 9.0 51.6 11.2 51 51 A A E -A 61 0A 45 10,-1.6 10,-3.5 -2,-0.4 -2,-0.0 -0.979 34.6-121.8-144.1 155.6 8.2 52.5 7.6 52 52 A A - 0 0 60 -2,-0.3 8,-0.2 8,-0.2 7,-0.1 -0.806 32.6-125.8 -94.3 141.1 7.4 50.7 4.3 53 53 A P - 0 0 29 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 -0.337 19.6-112.6 -78.2 168.6 9.7 51.6 1.3 54 54 A G S S+ 0 0 82 1,-0.2 2,-0.4 -2,-0.1 -2,-0.0 0.895 102.5 27.1 -63.0 -45.2 8.4 52.8 -2.1 55 55 A E S S- 0 0 154 2,-0.1 -1,-0.2 0, 0.0 0, 0.0 -0.965 94.4 -98.5-122.6 138.3 9.6 49.5 -3.8 56 56 A Q S S+ 0 0 111 -2,-0.4 3,-0.1 -3,-0.1 12,-0.0 -0.790 77.0 88.7 -88.7 140.2 10.0 46.1 -2.3 57 57 A P S S+ 0 0 18 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.611 87.2 42.8 -80.3 163.6 12.5 44.8 -1.4 58 58 A P - 0 0 16 0, 0.0 10,-0.3 0, 0.0 3,-0.1 0.506 67.4-159.5 -85.8-160.0 12.9 45.5 1.4 59 59 A D S S+ 0 0 9 8,-2.4 2,-0.4 1,-0.3 9,-0.2 0.787 72.8 26.2-105.3 -43.7 9.8 45.2 3.6 60 60 A V E - B 0 67A 0 7,-2.3 7,-2.7 -8,-0.2 2,-0.4 -0.988 63.1-152.4-134.4 123.4 10.4 47.3 6.7 61 61 A L E +AB 51 66A 66 -10,-3.5 -10,-1.6 -2,-0.4 2,-0.3 -0.789 20.8 167.6 -91.4 134.9 12.7 50.3 7.1 62 62 A F E > -AB 50 65A 1 3,-1.9 3,-2.8 -2,-0.4 -12,-0.1 -0.846 65.3 -39.5-149.6 113.3 14.1 50.9 10.6 63 63 A K T 3 S- 0 0 125 -14,-0.5 3,-0.1 1,-0.3 -13,-0.1 0.837 126.1 -34.2 39.9 54.9 16.9 53.4 11.4 64 64 A G T 3 S+ 0 0 62 1,-0.3 -1,-0.3 98,-0.1 2,-0.2 0.145 114.2 116.9 92.0 -21.7 19.1 52.6 8.3 65 65 A A E < -B 62 0A 3 -3,-2.8 -3,-1.9 96,-0.1 2,-0.5 -0.561 51.1-157.7 -75.8 143.9 18.1 48.9 8.2 66 66 A G E -B 61 0A 6 -2,-0.2 46,-2.6 -5,-0.2 2,-0.6 -0.815 18.7-157.5-119.4 86.0 16.2 47.6 5.2 67 67 A F E -Bc 60 112A 0 -7,-2.7 -8,-2.4 -2,-0.5 -7,-2.3 -0.555 11.6-167.4 -77.9 117.6 14.6 44.5 6.7 68 68 A E E - c 0 113A 2 44,-2.2 46,-2.5 -2,-0.6 2,-0.4 -0.908 21.3-156.8-100.5 105.4 13.7 41.9 4.1 69 69 A V E + c 0 114A 7 -2,-0.8 2,-0.3 44,-0.2 46,-0.2 -0.713 19.4 167.9 -98.7 130.2 11.4 39.6 6.1 70 70 A F E - c 0 115A 9 44,-2.2 46,-2.8 -2,-0.4 2,-0.4 -0.960 26.7-126.0-138.2 160.6 10.7 36.0 5.3 71 71 A F E - c 0 116A 50 -2,-0.3 2,-0.6 44,-0.2 46,-0.2 -0.897 10.4-167.0-114.2 131.7 9.1 33.0 7.1 72 72 A V E + c 0 117A 11 44,-2.8 46,-2.4 -2,-0.4 2,-0.2 -0.920 33.2 149.4-116.9 96.3 10.7 29.6 7.6 73 73 A L E - c 0 118A 69 -2,-0.6 46,-0.2 44,-0.2 44,-0.0 -0.594 43.0-154.8-120.3 178.9 7.9 27.3 8.8 74 74 A D 0 0 49 44,-0.5 45,-0.1 -2,-0.2 -1,-0.0 0.303 360.0 360.0-136.1 5.1 6.9 23.6 8.6 75 75 A E 0 0 111 45,-0.0 -1,-0.1 46,-0.0 -2,-0.0 -0.896 360.0 360.0 170.5 360.0 3.1 23.8 9.0 76 ! 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 77 105 A R 0 0 230 0, 0.0 44,-0.1 0, 0.0 -69,-0.1 0.000 360.0 360.0 360.0 118.6 6.6 15.2 18.9 78 106 A P - 0 0 21 0, 0.0 2,-0.3 0, 0.0 44,-0.3 -0.020 360.0-151.4 -70.4 149.7 9.6 17.6 18.4 79 107 A Q E -g 122 0B 142 42,-2.2 44,-2.5 -72,-0.0 2,-0.5 -0.837 23.4-114.5-110.1 145.8 13.2 16.7 17.6 80 108 A R E -g 123 0B 90 -2,-0.3 2,-0.4 42,-0.2 45,-0.1 -0.717 32.8-157.4 -83.4 128.3 16.3 18.8 18.4 81 109 A I E -g 124 0B 18 42,-2.6 44,-2.9 -2,-0.5 47,-0.1 -0.903 17.9-114.6-111.3 131.2 18.0 20.1 15.3 82 110 A A E > -g 125 0B 30 -2,-0.4 4,-2.6 42,-0.2 3,-0.2 -0.217 28.3-114.1 -59.1 151.1 21.7 21.1 15.1 83 111 A A H > S+ 0 0 2 42,-0.5 4,-2.8 1,-0.2 5,-0.2 0.858 117.3 56.3 -55.9 -38.0 22.4 24.8 14.5 84 112 A A H > S+ 0 0 38 45,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.921 110.3 43.1 -59.9 -46.8 23.9 23.9 11.1 85 113 A E H > S+ 0 0 107 2,-0.2 4,-0.8 -3,-0.2 -2,-0.2 0.872 113.5 52.4 -69.4 -37.4 20.7 22.1 10.0 86 114 A L H >< S+ 0 0 2 -4,-2.6 3,-1.0 1,-0.2 4,-0.3 0.939 110.1 48.1 -60.3 -49.1 18.5 24.9 11.4 87 115 A Q H >< S+ 0 0 13 -4,-2.8 3,-1.4 1,-0.2 -2,-0.2 0.857 105.8 59.3 -60.8 -34.6 20.5 27.5 9.4 88 116 A A H >< S+ 0 0 54 -4,-1.7 3,-1.6 1,-0.3 -1,-0.2 0.706 87.5 74.8 -69.0 -21.4 20.2 25.3 6.3 89 117 A R T << S+ 0 0 111 -3,-1.0 4,-0.3 -4,-0.8 -1,-0.3 0.693 89.7 60.0 -62.8 -19.6 16.4 25.6 6.5 90 118 A L T <> S+ 0 0 0 -3,-1.4 4,-2.4 -4,-0.3 -1,-0.3 0.623 83.8 86.5 -79.0 -15.6 16.8 29.1 5.2 91 119 A A H <> S+ 0 0 4 -3,-1.6 4,-3.0 1,-0.2 5,-0.3 0.885 79.3 53.9 -63.6 -47.8 18.4 28.0 2.0 92 120 A P H > S+ 0 0 71 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.934 116.5 38.8 -53.8 -48.1 15.5 27.3 -0.3 93 121 A T H > S+ 0 0 51 -4,-0.3 4,-2.7 2,-0.2 5,-0.2 0.917 115.4 52.0 -69.3 -43.8 13.9 30.7 0.2 94 122 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.890 109.2 51.1 -60.6 -38.6 17.2 32.6 0.2 95 123 A R H X S+ 0 0 127 -4,-3.0 4,-2.3 -5,-0.2 -1,-0.2 0.908 111.0 48.1 -62.0 -44.1 18.2 30.9 -3.1 96 124 A K H X S+ 0 0 146 -4,-1.8 4,-2.9 -5,-0.3 -2,-0.2 0.917 114.3 46.2 -64.2 -45.7 14.9 31.9 -4.7 97 125 A K H X S+ 0 0 34 -4,-2.7 4,-3.1 2,-0.2 5,-0.3 0.944 110.7 51.7 -61.2 -50.2 15.3 35.5 -3.5 98 126 A A H X S+ 0 0 12 -4,-2.8 4,-2.2 -5,-0.2 -2,-0.2 0.925 114.7 44.7 -53.5 -45.5 18.9 35.8 -4.6 99 127 A H H X S+ 0 0 110 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.958 113.8 47.4 -61.5 -55.0 17.8 34.6 -8.1 100 128 A N H X S+ 0 0 89 -4,-2.9 4,-1.2 1,-0.2 -2,-0.2 0.898 115.6 45.7 -55.5 -45.1 14.7 36.8 -8.4 101 129 A Y H X>S+ 0 0 20 -4,-3.1 5,-2.8 2,-0.2 4,-0.8 0.861 110.6 52.7 -69.7 -36.9 16.7 39.9 -7.2 102 130 A S H ><5S+ 0 0 71 -4,-2.2 3,-0.7 -5,-0.3 -2,-0.2 0.915 108.4 51.9 -61.5 -42.6 19.7 39.1 -9.6 103 131 A E H 3<5S+ 0 0 141 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.800 113.0 44.7 -64.2 -30.1 17.2 38.8 -12.5 104 132 A R H 3<5S- 0 0 150 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.508 113.1-115.7 -92.3 -7.1 15.7 42.2 -11.6 105 133 A G T <<5 + 0 0 69 -4,-0.8 2,-0.2 -3,-0.7 -3,-0.2 0.807 56.6 163.6 74.9 29.1 19.1 44.0 -11.0 106 134 A I < - 0 0 36 -5,-2.8 2,-1.2 -6,-0.1 -1,-0.2 -0.601 44.8-117.1 -78.9 141.5 18.4 44.6 -7.3 107 135 A D > - 0 0 101 -2,-0.2 3,-1.8 1,-0.2 4,-0.2 -0.686 25.4-170.8 -83.0 97.8 21.3 45.4 -5.1 108 136 A H G > S+ 0 0 24 -2,-1.2 3,-1.9 1,-0.3 34,-1.0 0.814 79.3 72.3 -53.5 -32.5 21.4 42.5 -2.6 109 137 A G G 3 S+ 0 0 24 1,-0.3 -1,-0.3 32,-0.3 32,-0.1 0.443 90.5 55.0 -71.0 -1.3 24.0 44.5 -0.7 110 138 A E G < S+ 0 0 114 -3,-1.8 2,-0.4 32,-0.0 -1,-0.3 0.353 92.0 95.5-105.8 3.3 21.5 47.1 0.6 111 139 A L < - 0 0 7 -3,-1.9 31,-1.9 29,-0.2 32,-1.3 -0.817 56.9-158.2-107.5 132.6 19.2 44.4 2.2 112 140 A D E -cd 67 143A 0 -46,-2.6 -44,-2.2 -2,-0.4 32,-0.2 -0.899 22.9-147.1-104.3 100.9 19.2 43.1 5.7 113 141 A L E -cd 68 144A 0 30,-2.6 32,-2.1 -2,-0.7 2,-0.4 -0.496 16.3-174.3 -75.5 138.5 17.6 39.7 5.6 114 142 A L E -cd 69 145A 0 -46,-2.5 -44,-2.2 30,-0.2 2,-0.5 -0.941 4.9-163.6-137.9 109.8 15.5 38.7 8.6 115 143 A A E -cd 70 146A 0 30,-2.7 32,-2.6 -2,-0.4 2,-0.7 -0.823 11.4-150.8 -95.8 129.0 14.0 35.2 8.9 116 144 A F E -cd 71 147A 2 -46,-2.8 -44,-2.8 -2,-0.5 2,-0.6 -0.909 23.2-164.0 -93.7 113.1 11.2 34.4 11.3 117 145 A V E +c 72 0A 6 30,-2.6 2,-0.3 -2,-0.7 -44,-0.2 -0.894 21.7 156.0-108.4 120.3 11.9 30.7 12.1 118 146 A N E +c 73 0A 6 -46,-2.4 -44,-0.5 -2,-0.6 2,-0.5 -0.846 10.6 177.3-150.5 104.3 9.2 28.6 13.7 119 147 A L - 0 0 15 3,-0.3 3,-0.2 -2,-0.3 -105,-0.1 -0.936 19.3-165.2-115.2 124.7 9.1 24.8 13.3 120 148 A K S S+ 0 0 41 -2,-0.5 -1,-0.1 1,-0.2 -105,-0.1 0.818 94.8 48.7 -73.6 -28.5 6.5 22.7 15.1 121 149 A R S S+ 0 0 124 -43,-0.1 -42,-2.2 -44,-0.1 2,-0.3 0.531 113.4 46.1 -89.1 -8.6 8.5 19.5 14.4 122 150 A A E -g 79 0B 12 -44,-0.3 -3,-0.3 -3,-0.2 -42,-0.2 -0.960 51.5-166.4-140.0 151.7 11.9 20.8 15.6 123 151 A V E -g 80 0B 7 -44,-2.5 -42,-2.6 -2,-0.3 -37,-0.0 -0.993 40.4-103.7-130.2 138.1 13.6 22.7 18.4 124 152 A P E -g 81 0B 12 0, 0.0 2,-1.0 0, 0.0 -42,-0.2 -0.321 21.7-130.3 -63.2 144.8 17.1 24.1 18.0 125 153 A D E > -g 82 0B 47 -44,-2.9 3,-1.6 1,-0.1 -42,-0.5 -0.842 22.7-170.8 -90.4 99.8 20.0 22.2 19.7 126 154 A F T 3 S+ 0 0 64 -2,-1.0 -1,-0.1 1,-0.3 46,-0.1 0.542 77.1 71.6 -74.0 -4.7 21.6 25.2 21.5 127 155 A N T 3 S+ 0 0 158 2,-0.1 -1,-0.3 -3,-0.0 -45,-0.1 0.454 86.7 81.3 -85.2 -0.9 24.6 23.0 22.4 128 156 A T S < S- 0 0 38 -3,-1.6 2,-0.2 -47,-0.1 -47,-0.0 -0.821 82.2-119.6-108.4 142.6 25.7 23.0 18.8 129 157 A P - 0 0 112 0, 0.0 -45,-0.3 0, 0.0 -2,-0.1 -0.527 21.7-115.0 -82.7 148.8 27.7 25.8 17.1 130 158 A F - 0 0 32 -2,-0.2 -46,-0.1 -47,-0.1 -48,-0.0 -0.724 32.6-138.0 -78.4 121.7 26.5 27.9 14.1 131 159 A P - 0 0 49 0, 0.0 -1,-0.0 0, 0.0 -44,-0.0 -0.366 38.9 -75.7 -73.7 158.8 28.8 27.2 11.2 132 160 A P - 0 0 99 0, 0.0 2,-1.7 0, 0.0 3,-0.3 -0.328 42.8-127.7 -50.7 132.5 30.0 30.1 9.0 133 161 A P > + 0 0 16 0, 0.0 4,-2.6 0, 0.0 3,-0.2 -0.402 49.5 155.9 -82.7 62.0 27.0 31.1 6.7 134 162 A T H > + 0 0 69 -2,-1.7 4,-2.4 1,-0.2 5,-0.1 0.850 65.9 50.4 -63.3 -42.0 29.1 30.8 3.5 135 163 A E H > S+ 0 0 65 -3,-0.3 4,-0.8 1,-0.2 -1,-0.2 0.902 114.9 45.0 -63.3 -38.5 26.4 30.2 1.0 136 164 A Y H 4>S+ 0 0 10 -3,-0.2 5,-0.7 2,-0.2 3,-0.4 0.876 110.1 53.5 -78.1 -36.4 24.4 33.2 2.3 137 165 A L H ><5S+ 0 0 66 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.935 106.9 54.1 -55.2 -47.4 27.4 35.4 2.4 138 166 A R H 3<5S+ 0 0 193 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.729 94.5 68.8 -62.6 -22.8 28.0 34.6 -1.2 139 167 A Q T 3<5S- 0 0 28 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.646 109.3-122.3 -73.1 -15.5 24.5 35.6 -2.1 140 168 A G T < 5 + 0 0 32 -3,-1.7 -29,-0.2 -4,-0.4 -3,-0.1 0.438 53.0 155.3 94.0 4.1 25.5 39.2 -1.4 141 169 A W < - 0 0 0 -5,-0.7 -32,-0.3 1,-0.1 -1,-0.2 -0.227 47.7-130.0 -57.3 150.7 23.1 40.4 1.4 142 170 A R S S- 0 0 27 -31,-1.9 16,-3.1 -34,-1.0 2,-0.3 0.871 84.9 -14.3 -68.9 -36.6 24.2 43.2 3.7 143 171 A S E -dE 112 157A 0 -32,-1.3 -30,-2.6 14,-0.2 2,-0.3 -0.972 57.3-151.3-159.6 162.0 23.2 41.1 6.7 144 172 A L E +dE 113 156A 0 12,-2.2 11,-2.1 -2,-0.3 12,-1.6 -0.966 19.6 170.9-145.6 129.4 21.2 38.0 7.7 145 173 A S E -dE 114 154A 0 -32,-2.1 -30,-2.7 -2,-0.3 2,-0.4 -0.929 16.7-149.6-135.2 156.4 19.5 37.5 11.0 146 174 A X E +dE 115 153A 0 7,-2.9 7,-2.5 -2,-0.3 2,-0.3 -0.964 13.3 176.7-125.3 146.5 17.1 34.9 12.5 147 175 A V E +dE 116 152A 2 -32,-2.6 -30,-2.6 -2,-0.4 5,-0.2 -0.993 10.1 151.0-143.5 144.9 14.4 35.2 15.1 148 176 A G - 0 0 2 3,-2.5 3,-0.4 -2,-0.3 -30,-0.2 -0.915 61.9 -78.2-154.2-177.0 11.8 32.8 16.5 149 177 A P S S+ 0 0 4 0, 0.0 31,-0.6 0, 0.0 32,-0.2 0.821 128.4 39.3 -59.9 -26.7 9.9 32.1 19.7 150 178 A T S S- 0 0 24 1,-0.2 25,-2.1 30,-0.1 2,-0.3 0.654 123.1 -9.9 -98.3 -16.8 13.0 30.4 21.2 151 179 A F E - F 0 174A 2 -3,-0.4 -3,-2.5 23,-0.2 2,-0.3 -0.989 45.2-141.6-167.9 166.7 16.0 32.6 20.0 152 180 A A E +EF 147 173A 0 21,-1.5 21,-3.1 -2,-0.3 2,-0.3 -0.983 21.0 173.1-140.4 148.4 17.5 35.4 17.9 153 181 A R E -E 146 0A 42 -7,-2.5 -7,-2.9 -2,-0.3 2,-0.7 -0.941 30.9-138.5-154.9 134.4 20.8 35.6 16.2 154 182 A V E -E 145 0A 1 14,-0.6 16,-0.5 17,-0.5 17,-0.3 -0.862 21.4-169.8 -85.4 114.7 22.6 37.9 13.8 155 183 A L E - 0 0 14 -11,-2.1 2,-0.3 -2,-0.7 -10,-0.2 0.902 64.4 -20.2 -75.9 -44.0 24.3 35.4 11.4 156 184 A F E -E 144 0A 15 -12,-1.6 -12,-2.2 -3,-0.1 -1,-0.3 -0.973 55.0-172.1-158.2 157.4 26.4 38.0 9.6 157 185 A A E -E 143 0A 16 -2,-0.3 -14,-0.2 -14,-0.2 -15,-0.1 -0.890 20.8-134.0-155.8 122.7 26.5 41.8 9.0 158 186 A H > - 0 0 93 -16,-3.1 3,-2.5 -2,-0.3 8,-0.1 -0.271 37.6 -95.7 -72.6 164.2 28.8 43.7 6.7 159 187 A S T 3 S+ 0 0 113 1,-0.3 -1,-0.1 7,-0.0 7,-0.1 0.771 124.4 55.6 -51.8 -31.6 30.6 46.9 7.8 160 188 A G T 3 S+ 0 0 55 -18,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.557 85.2 107.2 -78.7 -10.3 27.8 49.0 6.2 161 189 A A S < S- 0 0 3 -3,-2.5 5,-0.1 -19,-0.2 -96,-0.1 -0.316 88.2 -78.8 -67.8 149.8 25.1 47.3 8.2 162 190 A P >> - 0 0 17 0, 0.0 4,-1.6 0, 0.0 3,-1.1 -0.153 42.3-117.9 -44.3 142.4 23.4 49.3 11.1 163 191 A E H 3> S+ 0 0 148 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.834 111.2 63.6 -59.5 -34.0 25.5 49.3 14.2 164 192 A F H 34 S+ 0 0 30 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.817 105.4 46.9 -62.9 -29.7 22.9 47.4 16.2 165 193 A L H X4 S+ 0 0 0 -3,-1.1 3,-1.3 2,-0.2 -1,-0.2 0.949 113.4 46.3 -70.9 -50.8 23.3 44.4 13.9 166 194 A R H >< S+ 0 0 101 -4,-1.6 3,-1.4 1,-0.3 -2,-0.2 0.872 106.2 60.7 -60.4 -37.1 27.1 44.5 14.0 167 195 A A T 3< S+ 0 0 70 -4,-2.9 -1,-0.3 1,-0.2 -2,-0.2 0.691 103.3 52.3 -62.5 -21.0 27.1 44.9 17.8 168 196 A N T X S+ 0 0 12 -3,-1.3 3,-0.6 -4,-0.4 -14,-0.6 0.234 78.0 123.2-107.6 11.3 25.3 41.5 18.2 169 197 A L T < + 0 0 73 -3,-1.4 -14,-0.1 1,-0.2 3,-0.1 -0.413 65.2 33.2 -63.8 148.1 27.6 39.3 16.1 170 198 A G T 3 S+ 0 0 73 -16,-0.5 2,-0.3 1,-0.2 -1,-0.2 0.645 105.4 77.1 87.8 17.3 29.1 36.2 17.8 171 199 A R < - 0 0 123 -3,-0.6 -17,-0.5 -17,-0.3 2,-0.4 -0.983 60.1-143.0-155.5 153.7 26.2 35.4 20.1 172 200 A S - 0 0 39 -2,-0.3 2,-0.6 -19,-0.1 -19,-0.2 -0.963 16.9-138.5-120.6 143.7 22.7 33.9 20.3 173 201 A I E -F 152 0A 34 -21,-3.1 -21,-1.5 -2,-0.4 2,-0.6 -0.908 16.9-159.6-101.2 121.5 19.9 35.1 22.4 174 202 A L E -F 151 0A 93 -2,-0.6 2,-0.4 -23,-0.2 -23,-0.2 -0.881 7.7-146.9-105.4 122.7 17.9 32.4 24.1 175 203 A F - 0 0 32 -25,-2.1 3,-0.1 -2,-0.6 2,-0.1 -0.696 11.5-127.6 -86.5 132.7 14.4 33.2 25.3 176 204 A D >> - 0 0 120 -2,-0.4 3,-2.3 1,-0.2 4,-0.7 -0.372 56.8 -71.3 -54.9 150.3 12.8 31.7 28.3 177 205 A A T 34 S+ 0 0 39 1,-0.3 -1,-0.2 2,-0.1 -27,-0.1 -0.253 123.5 14.0 -49.4 130.7 9.4 30.2 27.4 178 206 A G T 34 S+ 0 0 55 -29,-0.1 -1,-0.3 -3,-0.1 -28,-0.1 0.239 105.1 90.6 89.2 -12.7 6.9 33.0 26.7 179 207 A V T <4 S+ 0 0 92 -3,-2.3 -2,-0.1 2,-0.2 -29,-0.1 0.823 76.9 58.8 -87.0 -32.9 9.5 35.8 26.4 180 208 A G < 0 0 5 -4,-0.7 -1,-0.1 -31,-0.6 -140,-0.1 0.872 360.0 360.0 -65.7 -40.9 10.2 35.5 22.6 181 209 A L 0 0 63 -32,-0.2 -1,-0.2 -31,-0.0 -2,-0.2 0.630 360.0 360.0 -88.5 360.0 6.6 36.2 21.5