==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 19-JUL-10 2XL4 . COMPND 2 MOLECULE: LMO0438 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES; . AUTHOR A.LEBRETON,V.JOB,T.THAMNAM,A.CAMEJO,P.J.MATTEI,B.REGNAULT,D. . 147 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8726.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 78.9 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 . 0 0.0 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 . 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 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.0 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 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 1 1 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 . 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 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 56 A R 0 0 280 0, 0.0 2,-0.3 0, 0.0 74,-0.1 0.000 360.0 360.0 360.0 97.7 12.5 14.4 30.6 2 57 A P + 0 0 27 0, 0.0 2,-0.3 0, 0.0 74,-0.3 -0.408 360.0 158.6 -69.5 122.5 14.0 12.2 27.7 3 58 A K - 0 0 171 -2,-0.3 2,-0.9 72,-0.1 65,-0.3 -0.979 48.0-101.7-140.2 150.5 17.9 12.1 27.6 4 59 A L - 0 0 14 -2,-0.3 5,-0.1 64,-0.1 62,-0.0 -0.640 42.8-145.8 -71.4 104.5 20.5 9.9 26.1 5 60 A S > - 0 0 53 -2,-0.9 4,-2.2 1,-0.1 3,-0.4 -0.231 26.0-105.8 -64.5 160.2 21.8 7.7 29.0 6 61 A T H > S+ 0 0 121 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.909 125.4 53.9 -48.2 -48.0 25.4 6.6 29.2 7 62 A K H > S+ 0 0 152 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.871 107.0 51.7 -54.7 -38.1 24.2 3.1 28.3 8 63 A D H > S+ 0 0 21 -3,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.850 109.4 48.9 -70.0 -38.9 22.5 4.7 25.2 9 64 A L H X S+ 0 0 45 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.878 111.5 50.0 -66.5 -41.3 25.8 6.4 24.2 10 65 A A H X S+ 0 0 57 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.900 111.1 48.8 -62.5 -40.6 27.6 3.1 24.6 11 66 A L H X S+ 0 0 52 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.956 111.1 50.0 -70.2 -44.6 25.1 1.3 22.5 12 67 A I H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.2 5,-0.2 0.944 112.5 46.5 -52.7 -53.4 25.3 3.9 19.8 13 68 A K H X S+ 0 0 89 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.878 114.9 46.5 -59.9 -40.1 29.1 3.8 19.7 14 69 A A H X S+ 0 0 54 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.882 114.6 48.3 -67.4 -44.1 29.1 0.0 19.6 15 70 A D H X S+ 0 0 10 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.927 107.4 53.0 -67.4 -47.5 26.4 -0.1 16.9 16 71 A L H X S+ 0 0 0 -4,-3.3 4,-2.7 1,-0.2 5,-0.3 0.944 110.0 50.2 -47.3 -50.7 28.0 2.4 14.6 17 72 A A H X S+ 0 0 35 -4,-1.6 4,-2.1 1,-0.3 -1,-0.2 0.875 112.3 45.0 -64.0 -40.2 31.2 0.4 14.7 18 73 A E H X S+ 0 0 80 -4,-1.7 4,-1.8 2,-0.2 -1,-0.3 0.850 112.1 53.4 -70.5 -30.9 29.5 -2.8 13.9 19 74 A F H X S+ 0 0 1 -4,-2.3 4,-1.9 -3,-0.2 -2,-0.2 0.914 110.6 46.0 -71.2 -44.7 27.4 -1.1 11.2 20 75 A E H X S+ 0 0 5 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.892 109.2 55.3 -64.7 -42.8 30.5 0.3 9.4 21 76 A A H X S+ 0 0 34 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.923 108.8 48.0 -56.9 -40.2 32.3 -3.0 9.7 22 77 A R H X S+ 0 0 60 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.887 107.9 55.2 -68.2 -32.3 29.3 -4.6 7.9 23 78 A E H X S+ 0 0 18 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.938 108.3 50.0 -61.5 -39.1 29.5 -1.9 5.3 24 79 A L H X S+ 0 0 91 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.944 109.3 48.6 -71.9 -46.1 33.1 -2.9 4.8 25 80 A S H X S+ 0 0 45 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.830 108.5 54.5 -57.6 -36.5 32.4 -6.6 4.4 26 81 A S H X S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 -1,-0.2 0.946 105.9 54.1 -62.6 -46.6 29.7 -5.9 1.8 27 82 A E H X S+ 0 0 80 -4,-2.0 4,-2.9 1,-0.2 5,-0.3 0.950 108.9 47.1 -49.6 -56.6 32.2 -3.9 -0.1 28 83 A K H X S+ 0 0 145 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.882 115.1 45.6 -57.1 -41.5 34.7 -6.9 -0.2 29 84 A I H X S+ 0 0 19 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.906 112.9 50.9 -68.3 -40.7 31.9 -9.3 -1.3 30 85 A L H X S+ 0 0 7 -4,-3.2 4,-3.0 2,-0.2 3,-0.4 0.971 111.9 46.5 -62.0 -50.9 30.6 -6.9 -3.8 31 86 A K H X S+ 0 0 127 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.926 112.9 49.9 -59.0 -44.0 34.1 -6.4 -5.4 32 87 A D H <>S+ 0 0 39 -4,-2.5 5,-2.9 -5,-0.3 4,-0.3 0.829 112.8 46.9 -66.1 -29.2 34.8 -10.1 -5.4 33 88 A T H <5S+ 0 0 11 -4,-1.7 3,-0.5 -3,-0.4 -2,-0.2 0.896 111.9 48.0 -79.2 -45.2 31.5 -10.7 -7.1 34 89 A I H <5S+ 0 0 102 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.926 115.2 47.3 -55.9 -42.2 31.9 -8.0 -9.8 35 90 A K T <5S- 0 0 137 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.676 111.6-130.9 -75.3 -12.6 35.4 -9.3 -10.4 36 91 A E T 5 - 0 0 163 -3,-0.5 -3,-0.2 -4,-0.3 -4,-0.1 0.924 29.2-169.8 56.9 52.6 33.9 -12.8 -10.5 37 92 A E > < - 0 0 57 -5,-2.9 3,-2.1 3,-0.2 -1,-0.1 -0.424 35.0-109.6 -62.0 143.7 36.3 -14.6 -8.1 38 93 A S T 3 S+ 0 0 122 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.760 117.4 45.7 -49.6 -32.9 35.7 -18.4 -8.3 39 94 A W T 3 S+ 0 0 132 1,-0.2 2,-0.5 -7,-0.0 -1,-0.3 0.609 102.8 73.1 -84.1 -6.7 34.2 -18.6 -4.7 40 95 A S < + 0 0 2 -3,-2.1 -1,-0.2 -8,-0.2 -4,-0.2 -0.439 57.5 152.0-116.1 54.4 32.0 -15.6 -5.3 41 96 A D > - 0 0 98 -2,-0.5 4,-2.2 -3,-0.3 5,-0.2 -0.125 63.8 -90.6 -75.7-177.5 29.1 -16.5 -7.7 42 97 A L H > S+ 0 0 68 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.805 125.9 55.4 -76.7 -24.2 25.8 -14.7 -7.5 43 98 A D H > S+ 0 0 105 2,-0.2 4,-2.5 3,-0.2 -1,-0.2 0.908 108.8 49.3 -68.3 -42.8 24.3 -17.1 -5.0 44 99 A F H > S+ 0 0 63 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.973 113.3 46.8 -56.5 -51.1 27.2 -16.5 -2.7 45 100 A A H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 5,-0.4 0.916 113.9 46.9 -57.3 -49.3 26.8 -12.7 -3.1 46 101 A N H X S+ 0 0 29 -4,-2.7 4,-2.0 2,-0.2 5,-0.2 0.923 111.7 49.7 -63.5 -43.9 23.0 -12.8 -2.5 47 102 A D H X S+ 0 0 99 -4,-2.5 4,-1.8 -5,-0.2 -2,-0.2 0.987 120.1 36.0 -59.8 -51.3 23.2 -15.0 0.6 48 103 A N H X S+ 0 0 51 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.871 117.0 49.7 -70.0 -41.8 25.9 -12.8 2.3 49 104 A I H X S+ 0 0 0 -4,-2.9 4,-2.8 -5,-0.3 -1,-0.2 0.904 109.4 53.0 -65.9 -42.1 24.8 -9.4 1.1 50 105 A N H X S+ 0 0 88 -4,-2.0 4,-2.3 -5,-0.4 -2,-0.2 0.926 109.8 49.3 -57.8 -45.7 21.2 -10.2 2.3 51 106 A Q H X S+ 0 0 127 -4,-1.8 4,-2.8 -5,-0.2 5,-0.2 0.926 112.2 48.2 -56.0 -46.3 22.6 -11.2 5.8 52 107 A X H X S+ 0 0 19 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.902 108.0 52.8 -70.6 -39.6 24.6 -8.0 5.9 53 108 A I H X S+ 0 0 6 -4,-2.8 4,-3.1 2,-0.2 -1,-0.2 0.971 112.9 45.7 -51.4 -53.0 21.7 -5.8 4.9 54 109 A G H X S+ 0 0 36 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.946 113.7 47.6 -63.1 -48.3 19.6 -7.3 7.7 55 110 A T H X S+ 0 0 39 -4,-2.8 4,-2.3 2,-0.2 3,-0.2 0.960 113.3 49.8 -51.0 -51.6 22.3 -7.0 10.3 56 111 A X H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.897 109.9 50.6 -56.8 -42.6 22.8 -3.4 9.2 57 112 A K H X S+ 0 0 98 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.832 107.0 54.2 -62.7 -38.2 19.1 -2.7 9.5 58 113 A R H X S+ 0 0 137 -4,-2.4 4,-3.5 -3,-0.2 5,-0.2 0.952 109.7 47.1 -59.2 -52.5 19.0 -4.2 13.1 59 114 A Y H X S+ 0 0 22 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.926 112.1 51.1 -57.1 -43.0 21.8 -1.8 14.2 60 115 A Q H X S+ 0 0 4 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.2 0.910 114.6 42.4 -59.6 -43.8 20.0 1.0 12.5 61 116 A Q H X S+ 0 0 94 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.830 109.4 57.3 -73.8 -35.4 16.8 0.1 14.3 62 117 A E H < S+ 0 0 52 -4,-3.5 3,-0.4 2,-0.2 -2,-0.2 0.983 114.7 40.2 -57.0 -50.4 18.5 -0.6 17.7 63 118 A I H >< S+ 0 0 1 -4,-2.6 3,-1.8 -5,-0.2 -2,-0.2 0.947 114.6 50.1 -63.1 -50.0 19.8 3.0 17.5 64 119 A L H 3< S+ 0 0 14 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.718 108.7 56.3 -60.3 -21.6 16.6 4.6 16.1 65 120 A S T 3< S+ 0 0 77 -4,-1.7 -1,-0.3 -3,-0.4 2,-0.3 0.228 71.0 121.0-104.1 15.8 14.7 2.9 18.8 66 121 A I S X> S- 0 0 9 -3,-1.8 3,-2.9 1,-0.1 4,-2.5 -0.589 76.6-115.1 -69.7 137.5 16.6 4.3 21.9 67 122 A D H 3> S+ 0 0 104 1,-0.3 4,-2.6 -2,-0.3 -1,-0.1 0.881 114.7 44.5 -53.2 -48.2 14.0 6.1 23.9 68 123 A A H 34 S+ 0 0 1 -65,-0.3 -1,-0.3 2,-0.2 -64,-0.1 0.517 112.5 54.7 -68.6 -8.3 15.5 9.6 23.5 69 124 A I H X4 S+ 0 0 0 -3,-2.9 3,-1.8 2,-0.1 -2,-0.2 0.881 108.8 46.3 -85.3 -51.1 16.0 8.8 19.8 70 125 A K H 3< S+ 0 0 99 -4,-2.5 3,-0.4 1,-0.3 -2,-0.2 0.955 121.8 37.8 -48.0 -54.1 12.4 8.0 19.2 71 126 A R T >< S+ 0 0 95 -4,-2.6 3,-1.9 -5,-0.3 -1,-0.3 -0.059 78.8 136.9 -92.6 35.1 11.4 11.1 21.2 72 127 A A G X + 0 0 0 -3,-1.8 3,-1.6 1,-0.3 8,-0.5 0.737 60.3 66.0 -48.2 -34.5 14.3 13.2 19.7 73 128 A S G 3 S+ 0 0 105 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.656 103.4 46.6 -71.1 -15.2 12.0 16.3 19.1 74 129 A E G < S+ 0 0 110 -3,-1.9 -1,-0.3 -6,-0.1 2,-0.2 -0.002 105.4 79.2-109.7 20.5 11.6 16.8 22.9 75 130 A A S < S- 0 0 21 -3,-1.6 5,-0.1 1,-0.3 -72,-0.1 -0.631 95.9 -52.0-122.2 178.7 15.3 16.3 23.6 76 131 A S > - 0 0 70 -74,-0.3 4,-2.1 -2,-0.2 -1,-0.3 0.007 52.0-114.0 -48.5 159.2 18.4 18.5 23.4 77 132 A A H > S+ 0 0 83 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.990 118.8 53.9 -56.2 -57.0 19.1 20.2 20.0 78 133 A D H > S+ 0 0 67 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.791 108.5 50.8 -46.4 -34.1 22.2 18.1 19.6 79 134 A T H > S+ 0 0 3 2,-0.2 4,-2.5 1,-0.1 3,-0.5 0.975 109.4 46.8 -74.6 -52.5 20.2 14.9 20.1 80 135 A E H X S+ 0 0 64 -4,-2.1 4,-2.4 -8,-0.5 -2,-0.2 0.922 112.4 51.1 -43.0 -57.7 17.4 15.7 17.6 81 136 A A H X S+ 0 0 55 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.749 108.3 53.2 -58.5 -31.7 20.0 16.7 15.0 82 137 A F H X S+ 0 0 0 -4,-1.1 4,-2.4 -3,-0.5 5,-0.3 0.905 109.1 49.4 -68.1 -46.4 21.8 13.4 15.6 83 138 A K H X S+ 0 0 36 -4,-2.5 4,-2.2 2,-0.2 3,-0.4 0.991 111.7 46.1 -56.1 -64.7 18.7 11.4 15.0 84 139 A K H X S+ 0 0 125 -4,-2.4 4,-1.9 1,-0.2 3,-0.3 0.884 116.7 43.9 -43.2 -59.3 17.7 13.1 11.7 85 140 A I H X S+ 0 0 15 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.837 112.2 51.2 -59.4 -39.1 21.3 12.9 10.2 86 141 A F H X S+ 0 0 1 -4,-2.4 4,-2.5 -3,-0.4 5,-0.3 0.818 108.6 53.5 -70.8 -30.2 21.9 9.2 11.3 87 142 A K H X S+ 0 0 110 -4,-2.2 4,-1.8 -3,-0.3 -2,-0.2 0.931 114.3 40.2 -64.7 -47.2 18.6 8.2 9.8 88 143 A E H X S+ 0 0 56 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.876 118.8 47.6 -70.4 -37.9 19.6 9.8 6.4 89 144 A W H X S+ 0 0 6 -4,-2.5 4,-2.0 -5,-0.2 5,-0.2 0.958 115.2 42.8 -66.1 -47.2 23.2 8.5 6.6 90 145 A S H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.873 112.6 53.5 -73.2 -36.8 22.3 5.0 7.6 91 146 A E H X S+ 0 0 71 -4,-1.8 4,-2.8 -5,-0.3 -1,-0.2 0.929 110.0 47.1 -57.5 -51.8 19.5 4.7 5.1 92 147 A F H X S+ 0 0 4 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.914 111.6 50.7 -60.8 -47.3 21.7 5.8 2.1 93 148 A K H X S+ 0 0 4 -4,-2.0 4,-1.1 1,-0.2 -1,-0.2 0.896 115.3 42.4 -58.7 -40.7 24.4 3.4 3.1 94 149 A I H X S+ 0 0 3 -4,-2.3 4,-2.0 -5,-0.2 3,-0.3 0.927 114.2 48.8 -70.8 -45.3 22.1 0.5 3.3 95 150 A E H X S+ 0 0 58 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.884 106.6 59.5 -64.9 -32.0 20.0 1.3 0.2 96 151 A R H X S+ 0 0 64 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.841 106.5 45.3 -66.5 -37.3 23.3 1.7 -1.8 97 152 A I H X S+ 0 0 3 -4,-1.1 4,-2.2 -3,-0.3 -1,-0.2 0.887 111.2 54.3 -69.8 -39.2 24.3 -1.8 -1.0 98 153 A Q H X S+ 0 0 44 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.890 110.8 46.8 -58.9 -41.0 20.8 -3.0 -1.9 99 154 A V H X S+ 0 0 5 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.910 108.3 53.8 -72.3 -39.3 21.1 -1.3 -5.2 100 155 A T H X S+ 0 0 37 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.928 111.7 43.2 -68.7 -40.8 24.4 -2.6 -6.0 101 156 A I H X S+ 0 0 3 -4,-2.2 4,-0.7 2,-0.2 -1,-0.2 0.878 112.1 55.7 -65.9 -37.8 23.4 -6.2 -5.4 102 157 A D H ><>S+ 0 0 29 -4,-2.0 3,-2.3 -5,-0.2 5,-2.1 0.979 106.9 50.9 -52.6 -55.9 20.2 -5.6 -7.4 103 158 A L H ><5S+ 0 0 71 -4,-3.1 3,-2.5 1,-0.3 -2,-0.2 0.855 104.8 55.4 -51.2 -41.3 22.3 -4.4 -10.3 104 159 A L H 3<5S+ 0 0 52 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.700 106.9 51.5 -73.5 -12.7 24.4 -7.5 -10.2 105 160 A N T <<5S- 0 0 44 -3,-2.3 -1,-0.3 -4,-0.7 -2,-0.2 0.205 123.5-108.5 -98.7 13.3 21.2 -9.4 -10.5 106 161 A G T < 5S+ 0 0 68 -3,-2.5 2,-0.5 1,-0.3 -3,-0.2 0.750 73.8 140.5 66.1 22.9 20.3 -7.2 -13.6 107 162 A K < + 0 0 117 -5,-2.1 -1,-0.3 -6,-0.1 -2,-0.2 -0.866 22.8 172.8 -95.2 134.7 17.6 -5.4 -11.6 108 163 A K > + 0 0 107 -2,-0.5 4,-1.4 2,-0.1 3,-0.2 0.546 53.5 91.3-120.5 -11.3 17.4 -1.7 -12.4 109 164 A D H > S+ 0 0 140 1,-0.2 4,-2.2 2,-0.2 3,-0.4 0.914 90.0 48.7 -49.5 -49.6 14.3 -0.4 -10.7 110 165 A S H > S+ 0 0 13 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.805 106.7 54.2 -72.7 -29.9 16.2 0.5 -7.4 111 166 A E H > S+ 0 0 40 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.796 109.8 50.2 -63.2 -34.3 19.1 2.5 -9.2 112 167 A A H X S+ 0 0 47 -4,-1.4 4,-1.6 -3,-0.4 -2,-0.2 0.919 115.0 41.7 -72.0 -44.5 16.3 4.5 -10.9 113 168 A V H X S+ 0 0 82 -4,-2.2 4,-3.3 2,-0.2 5,-0.3 0.913 112.8 56.7 -63.9 -42.0 14.7 5.2 -7.5 114 169 A F H X S+ 0 0 4 -4,-2.8 4,-3.3 1,-0.2 -2,-0.2 0.929 108.2 44.1 -57.2 -55.5 18.2 5.7 -6.0 115 170 A K H < S+ 0 0 133 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.840 115.2 50.0 -58.4 -38.4 19.2 8.5 -8.4 116 171 A K H < S+ 0 0 179 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.970 116.6 41.0 -65.2 -51.6 15.8 10.2 -8.0 117 172 A T H < S+ 0 0 76 -4,-3.3 -2,-0.2 1,-0.3 -3,-0.2 0.867 125.8 34.8 -71.0 -31.4 16.0 10.0 -4.2 118 173 A Y S < S+ 0 0 22 -4,-3.3 3,-0.5 -5,-0.3 -1,-0.3 -0.692 70.1 173.4-117.7 80.5 19.7 11.0 -4.1 119 174 A P S S+ 0 0 115 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.783 80.2 31.8 -57.0 -32.8 20.1 13.5 -6.9 120 175 A N S > S+ 0 0 95 -3,-0.1 4,-2.9 1,-0.1 5,-0.2 -0.773 72.1 178.0-131.0 84.5 23.6 14.3 -6.0 121 176 A Q H > S+ 0 0 66 -3,-0.5 4,-2.1 -2,-0.4 -1,-0.1 0.753 77.1 47.6 -62.9 -33.6 25.2 11.2 -4.4 122 177 A I H > S+ 0 0 131 2,-0.2 4,-2.3 3,-0.2 5,-0.3 0.892 115.3 43.0 -79.8 -38.8 28.7 12.6 -3.7 123 178 A I H > S+ 0 0 71 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.974 115.2 52.1 -70.7 -47.8 27.6 15.8 -2.1 124 179 A F H X S+ 0 0 30 -4,-2.9 4,-2.7 2,-0.2 5,-0.3 0.889 113.3 43.9 -47.2 -48.4 25.0 13.8 -0.2 125 180 A K H X S+ 0 0 60 -4,-2.1 4,-2.3 2,-0.2 5,-0.3 0.999 117.0 43.8 -62.4 -64.5 27.7 11.3 1.0 126 181 A K H X S+ 0 0 108 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.915 120.3 44.5 -39.3 -56.7 30.3 14.0 1.9 127 182 A V H X S+ 0 0 35 -4,-3.3 4,-2.3 -5,-0.3 5,-0.3 0.943 111.8 46.0 -66.5 -56.0 27.7 16.1 3.6 128 183 A R H X S+ 0 0 63 -4,-2.7 4,-1.0 -5,-0.3 -1,-0.2 0.841 115.9 49.0 -59.9 -29.9 25.6 13.6 5.6 129 184 A T H X S+ 0 0 10 -4,-2.3 4,-2.4 -5,-0.3 -1,-0.2 0.910 108.2 52.2 -80.2 -32.8 28.8 12.1 6.9 130 185 A N H X S+ 0 0 93 -4,-2.3 4,-2.1 -5,-0.3 -2,-0.2 0.917 113.1 45.0 -60.8 -46.9 30.3 15.4 7.9 131 186 A K H X S+ 0 0 123 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.674 109.1 56.5 -71.6 -20.4 27.3 16.4 9.9 132 187 A L H X S+ 0 0 0 -4,-1.0 4,-2.4 -5,-0.3 -2,-0.2 0.938 107.6 49.0 -72.6 -45.0 27.1 12.9 11.4 133 188 A Q H X S+ 0 0 35 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.948 112.6 46.8 -53.8 -50.4 30.6 13.4 12.7 134 189 A T H X S+ 0 0 73 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.934 110.8 51.6 -66.8 -42.2 29.8 16.7 14.1 135 190 A A H X S+ 0 0 6 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.861 112.7 46.9 -56.4 -39.7 26.5 15.5 15.8 136 191 A L H ><>S+ 0 0 0 -4,-2.4 5,-1.9 2,-0.2 3,-0.8 0.974 111.1 51.4 -61.4 -56.8 28.5 12.6 17.4 137 192 A N H ><5S+ 0 0 92 -4,-2.8 3,-1.8 1,-0.3 -2,-0.2 0.892 111.2 48.2 -43.8 -55.0 31.2 15.0 18.5 138 193 A N H 3<5S+ 0 0 82 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.709 108.5 53.0 -62.2 -29.2 28.5 17.3 20.1 139 194 A L T <<5S- 0 0 24 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.283 116.2-118.5 -88.5 12.1 26.9 14.4 21.8 140 195 A K T < 5 + 0 0 189 -3,-1.8 2,-0.7 1,-0.2 -3,-0.2 0.779 66.2 142.6 53.0 35.8 30.4 13.5 23.3 141 196 A V < - 0 0 6 -5,-1.9 2,-2.4 -6,-0.1 -1,-0.2 -0.929 47.2-145.9-100.7 111.9 30.5 10.1 21.6 142 197 A G + 0 0 62 -2,-0.7 2,-0.5 -3,-0.1 -5,-0.1 -0.497 49.1 136.6 -83.8 70.0 34.2 9.8 20.7 143 198 A Y - 0 0 34 -2,-2.4 2,-0.7 -10,-0.1 -6,-0.1 -0.989 41.3-156.1-121.4 123.6 33.5 7.9 17.5 144 199 A E - 0 0 159 -2,-0.5 -2,-0.1 -8,-0.1 -11,-0.0 -0.857 23.9-125.9 -98.2 113.3 35.4 8.7 14.4 145 200 A L - 0 0 4 -2,-0.7 -128,-0.0 1,-0.1 -16,-0.0 -0.297 17.6-121.6 -61.0 142.7 33.5 7.7 11.3 146 201 A L 0 0 108 1,-0.2 -1,-0.1 -129,-0.0 -2,-0.0 0.889 360.0 360.0 -55.2 -39.0 35.6 5.5 9.0 147 202 A D 0 0 112 -18,-0.0 -1,-0.2 -21,-0.0 -2,-0.1 0.912 360.0 360.0 -80.4 360.0 34.9 8.1 6.3