==== 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 OXIDOREDUCTASE 21-MAY-05 2CSG . COMPND 2 MOLECULE: PUTATIVE CYTOPLASMIC PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR Y.KIM,H.LI,F.COLLART,A.JOACHIMIAK,MIDWEST CENTER FOR STRUCTU . 417 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16941.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 258 61.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 10.6 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 . 20 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 117 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.2 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 4 1 3 0 1 0 1 1 0 0 0 0 2 1 0 0 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 4 5 2 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 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 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 T > 0 0 108 0, 0.0 3,-0.8 0, 0.0 21,-0.0 0.000 360.0 360.0 360.0 156.5 28.1 69.5 20.5 2 4 A P T 3 + 0 0 128 0, 0.0 17,-0.1 0, 0.0 16,-0.1 0.620 360.0 69.7 -55.1 -11.1 26.9 66.0 19.4 3 5 A F T 3 S+ 0 0 2 15,-0.1 16,-0.2 16,-0.1 2,-0.1 0.659 77.3 86.0 -91.3 -16.8 27.2 65.3 23.2 4 6 A T < - 0 0 34 -3,-0.8 2,-0.3 15,-0.1 208,-0.2 -0.333 53.4-156.9 -86.8 161.4 24.3 67.3 24.9 5 7 A H - 0 0 61 206,-3.2 3,-0.1 203,-0.1 -2,-0.0 -0.997 15.4-171.5-137.6 137.7 20.6 66.3 25.5 6 8 A E S S+ 0 0 149 -2,-0.3 2,-0.3 206,-0.2 -1,-0.1 0.599 85.0 41.9 -98.1 -20.1 17.6 68.7 26.0 7 9 A T S S- 0 0 105 237,-0.1 237,-0.1 201,-0.0 3,-0.1 -0.771 112.9 -73.4-118.2 168.7 15.5 65.7 26.9 8 10 A L - 0 0 71 -2,-0.3 -2,-0.1 237,-0.1 237,-0.0 -0.484 56.9-115.7 -68.1 116.3 16.3 62.7 29.0 9 11 A P - 0 0 6 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.214 9.7-136.4 -54.6 140.6 18.7 60.4 27.1 10 12 A A S S+ 0 0 113 1,-0.3 -2,-0.1 2,-0.1 4,-0.0 0.717 104.0 35.7 -68.6 -25.0 17.2 57.0 26.2 11 13 A D > + 0 0 81 1,-0.1 4,-2.2 2,-0.0 -1,-0.3 -0.843 69.9 179.4-130.2 92.3 20.6 55.6 27.2 12 14 A P H > S+ 0 0 39 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.947 83.1 51.7 -57.4 -50.2 22.1 57.5 30.1 13 15 A K H > S+ 0 0 121 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.913 111.5 48.0 -57.1 -43.1 25.2 55.4 30.4 14 16 A A H > S+ 0 0 34 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.924 114.2 46.9 -59.1 -45.7 25.9 55.9 26.7 15 17 A A H X S+ 0 0 6 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.869 111.0 50.3 -67.6 -40.0 25.3 59.6 27.0 16 18 A I H X S+ 0 0 11 -4,-3.2 4,-2.8 2,-0.2 -2,-0.2 0.954 108.8 53.7 -62.1 -51.1 27.5 60.0 30.1 17 19 A R H X S+ 0 0 110 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.905 111.7 43.9 -43.0 -56.5 30.4 58.1 28.3 18 20 A Q H X S+ 0 0 93 -4,-1.9 4,-2.8 1,-0.2 -1,-0.2 0.859 111.7 53.1 -66.8 -38.6 30.3 60.5 25.3 19 21 A M H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.938 109.5 49.3 -60.4 -48.6 30.0 63.6 27.4 20 22 A K H X S+ 0 0 0 -4,-2.8 4,-3.0 277,-0.2 3,-0.4 0.969 112.7 46.2 -55.8 -57.3 33.1 62.6 29.5 21 23 A Q H X S+ 0 0 135 -4,-2.4 4,-1.6 1,-0.3 -2,-0.2 0.923 113.8 48.8 -52.8 -50.6 35.2 61.9 26.3 22 24 A A H X S+ 0 0 21 -4,-2.8 4,-1.7 1,-0.2 -1,-0.3 0.849 116.4 44.1 -54.8 -35.8 34.1 65.1 24.7 23 25 A L H X S+ 0 0 0 -4,-2.2 4,-1.5 -3,-0.4 5,-0.2 0.905 106.6 54.0 -85.3 -43.1 34.9 67.1 27.9 24 26 A R H X S+ 0 0 56 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.862 113.6 49.6 -53.0 -35.9 38.3 65.6 28.9 25 27 A A H < S+ 0 0 81 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.897 109.4 48.0 -71.4 -44.4 39.2 66.6 25.3 26 28 A Q H < S+ 0 0 95 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.655 117.5 43.0 -72.6 -15.7 37.9 70.1 25.6 27 29 A I H < S- 0 0 20 -4,-1.5 2,-0.6 1,-0.3 -2,-0.2 0.776 87.5-154.3-101.3 -32.8 39.7 70.7 28.9 28 30 A G S < S+ 0 0 50 -4,-1.8 2,-1.4 -5,-0.2 -1,-0.3 -0.848 76.0 24.8 93.5-121.0 43.1 69.2 28.4 29 31 A D > + 0 0 106 -2,-0.6 4,-1.7 1,-0.2 5,-0.1 -0.648 67.9 178.8 -85.8 92.1 44.6 68.1 31.7 30 32 A V H > S+ 0 0 13 -2,-1.4 4,-2.9 1,-0.2 5,-0.2 0.911 78.7 54.4 -54.6 -49.8 41.5 67.6 33.8 31 33 A Q H > S+ 0 0 68 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.883 106.8 51.5 -57.0 -42.3 43.5 66.4 36.9 32 34 A A H > S+ 0 0 38 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.881 112.2 46.0 -62.3 -40.6 45.7 69.6 36.8 33 35 A V H X S+ 0 0 10 -4,-1.7 4,-3.2 -3,-0.2 -2,-0.2 0.928 112.2 50.7 -67.0 -47.8 42.5 71.8 36.7 34 36 A F H X S+ 0 0 16 -4,-2.9 4,-3.0 2,-0.2 -2,-0.2 0.926 111.3 49.2 -53.5 -49.2 40.9 69.8 39.5 35 37 A D H X S+ 0 0 83 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.926 111.5 47.9 -59.0 -46.8 44.0 70.2 41.6 36 38 A R H >X S+ 0 0 102 -4,-2.2 4,-1.7 2,-0.2 3,-0.6 0.969 114.0 47.9 -56.3 -53.3 44.2 74.0 41.0 37 39 A L H 3X S+ 0 0 8 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.895 110.1 52.5 -52.3 -46.2 40.5 74.2 41.8 38 40 A S H 3X S+ 0 0 18 -4,-3.0 4,-3.7 1,-0.2 -1,-0.2 0.797 103.4 57.2 -64.0 -32.5 41.0 72.2 44.9 39 41 A A H S+ 0 0 39 -4,-2.5 5,-2.0 2,-0.2 4,-1.3 0.916 110.6 53.0 -54.9 -45.7 36.4 81.1 61.8 52 54 A K H ><5S+ 0 0 78 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.940 108.9 49.4 -56.7 -49.3 34.9 78.0 63.5 53 55 A A H 3<5S+ 0 0 90 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.870 106.2 56.2 -57.9 -42.7 37.8 77.8 65.9 54 56 A Q H 3<5S- 0 0 123 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.822 120.7-107.2 -56.1 -32.7 37.5 81.5 66.9 55 57 A G T <<5S+ 0 0 61 -4,-1.3 -3,-0.2 -3,-0.8 -2,-0.1 0.437 73.1 138.7 107.8 5.9 33.8 80.9 67.8 56 58 A Q < - 0 0 96 -5,-2.0 2,-0.3 -6,-0.2 -1,-0.3 -0.369 57.1-118.7 -74.9 157.0 32.3 82.7 64.9 57 59 A P - 0 0 51 0, 0.0 4,-0.1 0, 0.0 269,-0.1 -0.687 17.6-147.0 -82.7 156.0 29.3 81.5 62.9 58 60 A V S S+ 0 0 5 267,-0.4 268,-0.1 -2,-0.3 25,-0.1 0.833 76.8 86.9 -91.5 -36.1 30.4 80.9 59.4 59 61 A W S S- 0 0 1 266,-0.3 2,-0.4 1,-0.1 27,-0.1 -0.355 91.9-112.7 -56.5 127.3 27.0 82.0 58.1 60 62 A P - 0 0 1 0, 0.0 27,-2.7 0, 0.0 2,-0.6 -0.582 30.1-146.7 -57.1 124.8 26.7 85.7 57.5 61 63 A I B -a 87 0A 64 -2,-0.4 27,-0.2 25,-0.2 25,-0.0 -0.900 17.7-176.1 -98.4 115.6 24.2 87.0 60.1 62 64 A I - 0 0 2 25,-3.2 27,-0.4 -2,-0.6 10,-0.0 -0.929 21.6-133.9-119.7 112.4 22.2 89.9 58.8 63 65 A P > - 0 0 48 0, 0.0 4,-1.7 0, 0.0 3,-0.2 -0.381 14.1-131.9 -67.6 138.6 19.7 91.6 61.2 64 66 A F H > S+ 0 0 29 25,-2.4 4,-3.3 1,-0.2 5,-0.2 0.839 103.4 64.4 -63.5 -34.0 16.3 92.2 59.6 65 67 A S H > S+ 0 0 69 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.953 103.9 45.3 -47.2 -59.3 16.3 95.8 60.9 66 68 A E H 4>S+ 0 0 83 -3,-0.2 5,-2.6 1,-0.2 6,-0.3 0.927 114.8 49.2 -50.5 -49.5 19.3 96.7 58.7 67 69 A L H ><5S+ 0 0 13 -4,-1.7 3,-1.6 1,-0.2 -1,-0.2 0.939 111.4 49.0 -54.8 -49.9 17.8 94.9 55.7 68 70 A A H 3<5S+ 0 0 46 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.789 115.4 43.9 -61.5 -32.3 14.5 96.7 56.3 69 71 A M T 3<5S- 0 0 123 -4,-2.0 -1,-0.3 -3,-0.2 -2,-0.2 0.179 111.1-117.5-101.8 14.2 16.2 100.0 56.5 70 72 A G T < 5S+ 0 0 64 -3,-1.6 -3,-0.2 -4,-0.2 -4,-0.1 0.740 75.2 129.1 58.6 27.0 18.5 99.5 53.5 71 73 A N < + 0 0 103 -5,-2.6 2,-0.4 -6,-0.2 -4,-0.2 -0.181 21.0 134.0-110.5 41.0 21.6 99.7 55.7 72 74 A I - 0 0 34 -6,-0.3 -10,-0.0 -5,-0.2 0, 0.0 -0.762 51.7-128.8 -85.2 131.9 23.5 96.5 54.7 73 75 A S > - 0 0 57 -2,-0.4 4,-1.6 1,-0.1 5,-0.1 -0.072 15.5-112.7 -75.2 176.1 27.1 97.3 54.1 74 76 A D H > S+ 0 0 141 2,-0.2 4,-2.7 1,-0.1 5,-0.1 0.870 116.8 57.9 -71.6 -39.1 29.3 96.4 51.2 75 77 A A H > S+ 0 0 73 2,-0.2 4,-2.0 1,-0.2 -1,-0.1 0.868 108.1 45.2 -60.1 -41.5 31.3 94.0 53.4 76 78 A T H > S+ 0 0 36 2,-0.2 4,-2.4 1,-0.2 3,-0.5 0.988 111.5 50.8 -66.1 -60.5 28.2 92.0 54.3 77 79 A R H X S+ 0 0 78 -4,-1.6 4,-1.2 1,-0.3 -2,-0.2 0.872 113.6 48.5 -40.8 -45.4 27.0 91.9 50.7 78 80 A A H X S+ 0 0 56 -4,-2.7 4,-1.7 1,-0.2 -1,-0.3 0.903 109.3 51.4 -61.7 -44.8 30.5 90.6 49.8 79 81 A E H X S+ 0 0 67 -4,-2.0 4,-2.4 -3,-0.5 6,-0.2 0.833 105.9 53.8 -65.5 -37.7 30.5 88.0 52.6 80 82 A V H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-0.3 0.871 110.6 48.9 -66.0 -35.0 27.2 86.5 51.5 81 83 A K H < S+ 0 0 75 -4,-1.2 -2,-0.2 -5,-0.3 -1,-0.2 0.823 112.2 47.2 -73.9 -32.7 28.7 86.1 48.1 82 84 A R H < S+ 0 0 91 -4,-1.7 199,-0.2 1,-0.1 -2,-0.2 0.888 122.3 35.1 -71.7 -37.9 31.8 84.5 49.4 83 85 A R H < S- 0 0 13 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.672 92.9-138.3 -96.5 -23.4 29.8 82.1 51.6 84 86 A G S < S+ 0 0 0 -4,-2.3 254,-3.4 -5,-0.2 2,-0.3 0.576 73.1 70.0 76.7 9.6 26.8 81.4 49.5 85 87 A C E - B 0 337A 0 -5,-0.3 2,-0.3 252,-0.3 252,-0.2 -0.971 54.5-168.7-150.7 167.6 24.4 81.6 52.4 86 88 A A E - B 0 336A 0 250,-2.2 250,-2.4 -2,-0.3 2,-0.5 -0.959 15.9-144.7-159.4 136.1 22.8 84.0 54.9 87 89 A V E -aB 61 335A 0 -27,-2.7 -25,-3.2 -2,-0.3 2,-0.8 -0.905 13.1-155.0 -94.2 129.9 20.8 84.0 58.1 88 90 A I E > - B 0 334A 0 246,-2.7 3,-1.2 -2,-0.5 246,-0.6 -0.844 16.3-153.7-101.7 91.8 18.2 86.9 58.4 89 91 A K T 3 S+ 0 0 48 -2,-0.8 -25,-2.4 -27,-0.4 -24,-0.2 -0.381 76.9 10.3 -60.5 138.7 17.8 87.3 62.2 90 92 A G T 3 S+ 0 0 45 240,-0.2 -1,-0.2 -27,-0.2 243,-0.2 0.720 75.3 151.3 62.8 22.9 14.4 88.7 63.2 91 93 A H S < S+ 0 0 1 -3,-1.2 242,-0.2 1,-0.1 -2,-0.1 0.904 78.3 16.3 -50.8 -44.4 13.0 88.3 59.7 92 94 A F S S- 0 0 2 240,-1.5 -1,-0.1 239,-0.0 -2,-0.1 -0.964 97.7 -99.1-126.4 148.8 9.7 88.0 61.5 93 95 A P > - 0 0 79 0, 0.0 4,-1.9 0, 0.0 5,-0.1 -0.429 34.8-120.6 -60.5 139.4 8.7 88.9 65.1 94 96 A R H > S+ 0 0 118 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.840 111.2 56.4 -48.4 -46.0 8.7 85.8 67.3 95 97 A E H > S+ 0 0 171 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.975 107.3 48.5 -49.2 -57.2 5.1 86.2 68.2 96 98 A Q H > S+ 0 0 63 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.848 113.9 46.5 -57.6 -41.0 4.0 86.1 64.5 97 99 A A H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.968 113.9 46.4 -65.7 -54.7 6.1 83.0 63.8 98 100 A L H X S+ 0 0 57 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.880 111.9 51.5 -55.2 -41.5 4.9 81.1 66.9 99 101 A A H X S+ 0 0 51 -4,-3.3 4,-2.0 -5,-0.3 -1,-0.2 0.876 109.7 51.3 -66.3 -35.8 1.3 82.0 66.2 100 102 A W H X S+ 0 0 9 -4,-1.7 4,-2.3 -5,-0.3 -2,-0.2 0.949 107.3 52.3 -60.5 -53.9 1.8 80.7 62.6 101 103 A D H X S+ 0 0 16 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.875 108.8 50.4 -49.4 -44.1 3.2 77.5 64.0 102 104 A Q H X S+ 0 0 139 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.898 107.7 52.3 -65.8 -41.1 0.1 77.0 66.2 103 105 A S H X S+ 0 0 48 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.875 107.7 53.9 -61.9 -35.7 -2.2 77.7 63.2 104 106 A M H X S+ 0 0 1 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.985 106.4 51.3 -59.1 -58.1 -0.3 75.0 61.4 105 107 A L H X S+ 0 0 82 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.907 114.5 43.0 -42.4 -51.9 -0.9 72.5 64.2 106 108 A D H X S+ 0 0 76 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.829 111.2 54.6 -71.6 -32.0 -4.6 73.2 64.1 107 109 A Y H X S+ 0 0 16 -4,-2.4 4,-0.9 -3,-0.3 -2,-0.2 0.942 113.7 41.9 -63.9 -48.7 -4.8 73.2 60.3 108 110 A L H ><>S+ 0 0 16 -4,-3.2 5,-1.9 1,-0.2 3,-0.8 0.969 117.5 48.3 -59.9 -51.5 -3.2 69.7 60.3 109 111 A D H ><5S+ 0 0 99 -4,-2.9 3,-1.6 -5,-0.3 -2,-0.2 0.901 108.3 51.8 -54.8 -48.6 -5.4 68.6 63.3 110 112 A K H 3<5S+ 0 0 122 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.673 113.8 44.3 -70.1 -17.1 -8.7 69.8 62.0 111 113 A N T <<5S- 0 0 16 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.204 111.1-120.4-112.5 10.2 -8.2 68.0 58.6 112 114 A H T X>5 + 0 0 102 -3,-1.6 4,-1.7 -4,-0.2 3,-0.7 0.804 46.2 169.1 64.5 38.5 -7.0 64.8 60.3 113 115 A F H 3>< + 0 0 18 -5,-1.9 4,-2.3 1,-0.2 -4,-0.1 0.910 67.0 53.6 -48.5 -66.1 -3.6 64.7 58.6 114 116 A D H 34 S+ 0 0 130 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.719 110.9 49.6 -47.7 -33.3 -1.8 61.9 60.6 115 117 A E H <4 S+ 0 0 142 -3,-0.7 -1,-0.2 1,-0.1 -2,-0.2 0.994 116.7 38.2 -63.9 -62.8 -4.7 59.5 59.9 116 118 A V H < S+ 0 0 78 -4,-1.7 -2,-0.2 -5,-0.2 2,-0.1 0.717 84.3 115.7 -66.3 -30.8 -4.9 60.1 56.1 117 119 A Y < + 0 0 42 -4,-2.3 -5,-0.0 -5,-0.2 -4,-0.0 -0.206 28.8 165.9 -56.7 114.4 -1.1 60.5 55.2 118 120 A K + 0 0 169 -2,-0.1 -1,-0.1 274,-0.0 -4,-0.0 0.879 43.8 60.0 -92.3 -46.6 0.0 57.6 52.9 119 121 A G - 0 0 23 2,-0.0 2,-0.2 16,-0.0 16,-0.1 0.328 48.5-168.9 -61.1-170.6 3.5 58.8 51.6 120 122 A P - 0 0 90 0, 0.0 12,-0.0 0, 0.0 15,-0.0 -0.045 52.7-161.6 -45.6 129.5 6.4 59.7 51.1 121 123 A G + 0 0 33 -2,-0.2 2,-0.3 269,-0.1 270,-0.1 0.518 67.7 40.3 -78.9 -3.3 4.7 60.2 47.7 122 124 A D - 0 0 28 268,-0.1 3,-0.1 127,-0.1 127,-0.1 -0.888 59.3-149.1-144.8 158.2 8.3 60.3 46.2 123 125 A N > + 0 0 61 -2,-0.3 3,-1.2 183,-0.2 126,-0.1 -0.324 43.5 141.5-127.7 53.1 11.8 58.7 46.3 124 126 A F T 3 S+ 0 0 22 1,-0.2 184,-3.1 183,-0.1 3,-0.3 0.704 72.6 51.2 -61.8 -21.8 13.9 61.8 45.3 125 127 A F T > + 0 0 28 6,-0.2 3,-3.0 182,-0.2 -1,-0.2 0.182 61.9 121.2-109.1 14.0 16.7 60.8 47.8 126 128 A G T < S+ 0 0 43 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.717 74.5 63.7 -50.3 -22.4 17.4 57.1 46.9 127 129 A T T 3 S+ 0 0 42 -3,-0.3 2,-0.3 181,-0.1 -1,-0.3 0.390 93.7 79.4 -81.7 0.2 20.9 58.2 46.3 128 130 A L S < S- 0 0 15 -3,-3.0 3,-0.2 1,-0.1 184,-0.1 -0.871 71.6-141.0-118.8 144.1 21.4 59.3 50.0 129 131 A S S S+ 0 0 122 -2,-0.3 2,-0.9 1,-0.3 -1,-0.1 0.940 107.0 45.4 -64.1 -50.1 22.2 57.3 53.1 130 132 A A S S+ 0 0 13 1,-0.1 69,-2.2 66,-0.1 -1,-0.3 -0.847 72.4 151.2 -91.7 97.7 19.8 59.5 55.1 131 133 A S + 0 0 26 -2,-0.9 -6,-0.2 67,-0.2 -1,-0.1 0.468 47.7 76.4-109.4 -5.0 16.8 59.6 52.7 132 134 A R + 0 0 146 65,-0.2 65,-0.6 -3,-0.1 64,-0.3 -0.834 54.3 179.4-117.3 92.3 13.9 60.1 55.1 133 135 A P - 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0 0 52 1,-0.1 4,-1.1 -262,-0.0 -1,-0.1 0.029 31.3-106.1 -68.6-172.3 -1.9 90.7 48.8 409 411 A I H > S+ 0 0 110 2,-0.2 4,-1.4 -260,-0.1 5,-0.1 0.783 130.2 47.2 -81.5 -41.5 -0.9 93.3 46.2 410 412 A H H > S+ 0 0 54 -261,-0.2 4,-3.2 2,-0.2 3,-0.4 0.952 112.2 50.7 -54.0 -51.9 2.5 91.4 46.4 411 413 A G H > S+ 0 0 0 1,-0.3 4,-1.7 2,-0.2 -230,-0.2 0.895 108.2 49.2 -60.7 -47.7 0.6 88.1 46.1 412 414 A K H <>S+ 0 0 84 -4,-1.1 5,-1.4 1,-0.2 -1,-0.3 0.805 117.2 43.7 -61.0 -31.5 -1.4 89.1 43.1 413 415 A R H ><5S+ 0 0 122 -4,-1.4 3,-1.4 -3,-0.4 -2,-0.2 0.854 107.7 56.5 -81.6 -39.2 1.8 90.3 41.4 414 416 A A H 3<5S+ 0 0 7 -4,-3.2 -233,-0.7 1,-0.3 -2,-0.2 0.790 114.8 40.4 -64.0 -30.1 3.9 87.3 42.5 415 417 A L T 3<5S- 0 0 2 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.316 122.3-116.6 -93.6 5.9 1.4 85.2 40.7 416 418 A G T < 5 0 0 27 -3,-1.4 -3,-0.3 1,-0.2 -2,-0.1 0.987 360.0 360.0 54.1 81.1 1.2 87.8 37.9 417 419 A I < 0 0 110 -5,-1.4 -1,-0.2 0, 0.0 -2,-0.1 -0.986 360.0 360.0-138.6 360.0 -2.4 89.1 38.1