==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 29-AUG-13 4MH6 . COMPND 2 MOLECULE: PUTATIVE TYPE III SECRETION PROTEIN YSCO; . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO PARAHAEMOLYTICUS; . AUTHOR G.MINASOV,Z.WAWRZAK,L.SHUVALOVA,J.WINSOR,I.DUBROVSKA,S.GRIMS . 159 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12843.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 149 93.7 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 142 89.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 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 2 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 -10 A G 0 0 99 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 52.3 85.0 67.1 12.1 2 -9 A T + 0 0 105 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.907 360.0 59.7 71.3 103.1 82.8 64.8 9.9 3 -8 A E S S+ 0 0 108 140,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.418 83.2 97.3 -64.0 81.7 80.2 63.8 11.0 4 -7 A N > + 0 0 87 2,-0.1 4,-1.2 1,-0.1 5,-0.0 -0.045 62.0 91.8-115.9 8.0 80.1 67.6 10.8 5 -6 A L H > S+ 0 0 79 2,-0.2 4,-3.5 1,-0.2 5,-0.1 0.633 72.4 64.7 -75.6 -19.1 78.4 66.4 7.6 6 -5 A Y H > S+ 0 0 24 2,-0.2 4,-2.3 3,-0.2 -1,-0.2 0.814 96.3 54.5 -72.8 -30.1 75.2 66.6 9.7 7 -4 A F H > S+ 0 0 142 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.965 116.3 39.1 -65.2 -47.2 75.8 70.4 10.0 8 -3 A Q H X S+ 0 0 106 -4,-1.2 4,-2.7 2,-0.2 3,-0.5 0.930 113.7 53.9 -66.2 -49.1 75.9 70.4 6.1 9 -2 A S H X S+ 0 0 34 -4,-3.5 4,-2.3 1,-0.2 -1,-0.2 0.924 111.6 46.1 -46.8 -51.4 73.2 67.9 5.7 10 -1 A N H X S+ 0 0 21 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.726 112.8 48.2 -68.5 -25.4 70.9 70.0 7.8 11 0 A A H X S+ 0 0 49 -4,-1.2 4,-2.4 -3,-0.5 -1,-0.2 0.855 110.9 50.5 -83.2 -38.5 71.7 73.2 6.1 12 1 A X H X S+ 0 0 113 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.901 114.7 46.0 -63.6 -41.4 71.2 71.7 2.7 13 2 A I H X S+ 0 0 23 -4,-2.3 4,-3.3 -5,-0.3 5,-0.2 0.917 110.7 50.4 -68.8 -45.8 67.9 70.4 3.8 14 3 A E H X S+ 0 0 118 -4,-1.9 4,-2.9 1,-0.2 -2,-0.2 0.939 113.7 47.1 -57.5 -45.3 66.7 73.6 5.5 15 4 A R H X S+ 0 0 124 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.906 112.6 48.3 -66.0 -41.9 67.6 75.5 2.3 16 5 A L H X S+ 0 0 73 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.935 112.6 49.1 -61.2 -44.2 65.9 73.0 0.1 17 6 A L H X S+ 0 0 7 -4,-3.3 4,-2.9 1,-0.2 5,-0.2 0.929 108.4 53.2 -60.2 -44.2 62.9 73.1 2.3 18 7 A E H X S+ 0 0 92 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.904 108.9 50.3 -57.9 -41.2 62.9 76.9 2.2 19 8 A I H X S+ 0 0 42 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.929 111.7 47.0 -64.1 -44.5 62.9 76.7 -1.6 20 9 A K H X S+ 0 0 44 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.861 111.7 50.7 -65.4 -36.6 60.0 74.3 -1.6 21 10 A K H X S+ 0 0 104 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.923 111.2 49.6 -65.1 -43.0 58.1 76.6 1.0 22 11 A I H X S+ 0 0 61 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.899 110.4 49.4 -60.1 -42.7 58.8 79.5 -1.3 23 12 A R H X S+ 0 0 122 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.851 110.2 51.8 -67.7 -32.6 57.5 77.5 -4.3 24 13 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 101,-0.2 -2,-0.2 0.908 110.0 47.9 -69.1 -41.4 54.4 76.6 -2.4 25 14 A D H X S+ 0 0 89 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.931 112.1 49.6 -65.2 -43.0 53.6 80.2 -1.5 26 15 A R H X S+ 0 0 162 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.868 110.2 51.4 -60.4 -39.7 54.2 81.2 -5.1 27 16 A A H X S+ 0 0 15 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.908 110.7 48.0 -63.2 -44.8 51.8 78.4 -6.1 28 17 A D H X S+ 0 0 49 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.894 112.3 49.2 -60.7 -44.7 49.1 79.7 -3.6 29 18 A K H X S+ 0 0 104 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.854 106.3 55.8 -65.5 -35.9 49.6 83.2 -4.9 30 19 A A H X S+ 0 0 17 -4,-2.0 4,-1.3 -5,-0.2 -1,-0.2 0.855 109.7 48.1 -66.1 -31.5 49.2 82.0 -8.4 31 20 A V H X S+ 0 0 15 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.947 110.1 50.2 -70.4 -50.9 45.9 80.5 -7.4 32 21 A Q H X S+ 0 0 97 -4,-2.6 4,-1.6 1,-0.3 -2,-0.2 0.920 111.8 47.3 -54.9 -45.9 44.8 83.7 -5.6 33 22 A R H X S+ 0 0 137 -4,-2.6 4,-1.9 1,-0.2 -1,-0.3 0.869 111.3 53.0 -63.5 -34.8 45.6 85.8 -8.7 34 23 A Q H X S+ 0 0 1 -4,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.805 103.5 55.1 -71.6 -31.3 43.8 83.2 -10.8 35 24 A E H X S+ 0 0 92 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.849 107.2 52.9 -66.9 -31.7 40.7 83.5 -8.6 36 25 A Y H X S+ 0 0 165 -4,-1.6 4,-2.7 -5,-0.2 -2,-0.2 0.938 107.0 50.3 -67.2 -46.8 40.8 87.2 -9.4 37 26 A R H X S+ 0 0 107 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.908 110.9 50.2 -57.4 -42.5 40.9 86.6 -13.1 38 27 A V H X S+ 0 0 20 -4,-2.1 4,-2.5 1,-0.2 3,-0.3 0.976 112.9 44.9 -61.2 -55.3 37.9 84.2 -12.9 39 28 A A H X S+ 0 0 61 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.867 112.5 53.4 -55.9 -37.9 35.9 86.7 -10.9 40 29 A N H X S+ 0 0 78 -4,-2.7 4,-1.6 -5,-0.2 -1,-0.2 0.905 110.3 45.0 -66.9 -40.5 36.9 89.5 -13.2 41 30 A V H X S+ 0 0 14 -4,-2.2 4,-2.3 -3,-0.3 -2,-0.2 0.875 109.3 56.5 -70.3 -36.8 35.8 87.5 -16.3 42 31 A A H X S+ 0 0 35 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.874 106.3 50.8 -60.9 -37.5 32.5 86.6 -14.7 43 32 A A H X S+ 0 0 47 -4,-1.7 4,-1.9 -5,-0.2 -1,-0.2 0.893 109.9 49.6 -67.0 -41.0 31.8 90.3 -14.1 44 33 A E H X S+ 0 0 78 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.853 110.3 51.3 -64.1 -35.6 32.5 90.9 -17.8 45 34 A L H X S+ 0 0 20 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.941 106.3 53.3 -65.1 -49.0 30.2 88.1 -18.7 46 35 A Q H X S+ 0 0 86 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.916 112.1 45.7 -52.4 -48.3 27.4 89.5 -16.6 47 36 A K H X S+ 0 0 122 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.881 110.1 53.5 -63.2 -43.9 27.8 92.9 -18.4 48 37 A A H X S+ 0 0 10 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.905 109.9 47.7 -59.5 -42.9 27.9 91.4 -21.8 49 38 A E H X S+ 0 0 72 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.858 109.2 53.4 -65.8 -38.1 24.6 89.5 -21.1 50 39 A R H X S+ 0 0 151 -4,-1.8 4,-2.5 -5,-0.2 -1,-0.2 0.907 107.0 53.5 -62.5 -43.5 23.0 92.6 -19.8 51 40 A S H X S+ 0 0 56 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.870 110.5 44.1 -61.3 -43.8 23.9 94.4 -23.1 52 41 A V H X S+ 0 0 26 -4,-1.6 4,-3.2 2,-0.2 -1,-0.2 0.912 111.9 53.8 -67.9 -42.2 22.4 91.8 -25.4 53 42 A A H X S+ 0 0 55 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.954 115.0 40.9 -55.3 -51.8 19.3 91.6 -23.3 54 43 A D H X S+ 0 0 104 -4,-2.5 4,-1.4 1,-0.2 3,-0.4 0.912 117.0 46.7 -61.0 -50.1 18.8 95.3 -23.5 55 44 A Y H X S+ 0 0 51 -4,-2.4 4,-3.4 1,-0.2 5,-0.2 0.912 103.9 62.6 -61.3 -45.1 19.7 95.7 -27.1 56 45 A H H X S+ 0 0 64 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.842 102.2 51.2 -48.7 -42.2 17.6 92.8 -28.2 57 46 A V H X S+ 0 0 75 -4,-1.2 4,-1.8 -3,-0.4 -1,-0.2 0.916 114.0 42.2 -65.2 -47.3 14.4 94.6 -27.0 58 47 A W H X S+ 0 0 162 -4,-1.4 4,-3.4 2,-0.2 5,-0.3 0.937 111.6 56.7 -65.3 -43.8 15.3 97.8 -28.9 59 48 A R H X S+ 0 0 38 -4,-3.4 4,-2.2 1,-0.2 -2,-0.2 0.900 106.8 48.2 -55.8 -45.4 16.3 95.8 -32.0 60 49 A Q H X S+ 0 0 82 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.944 116.1 44.0 -60.3 -49.0 13.0 94.1 -32.2 61 50 A E H X S+ 0 0 102 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.900 113.5 49.4 -61.4 -44.8 11.1 97.3 -31.9 62 51 A E H X S+ 0 0 39 -4,-3.4 4,-1.3 1,-0.2 -1,-0.2 0.820 111.7 50.1 -65.6 -32.9 13.4 99.2 -34.3 63 52 A E H X S+ 0 0 25 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.913 110.7 48.1 -72.5 -43.1 13.0 96.5 -36.8 64 53 A E H X S+ 0 0 129 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.840 107.7 56.7 -66.6 -34.2 9.2 96.4 -36.5 65 54 A R H X S+ 0 0 159 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.903 109.1 46.7 -61.9 -40.2 9.1 100.2 -36.9 66 55 A R H X S+ 0 0 55 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.832 110.9 49.3 -74.7 -33.8 10.9 99.9 -40.1 67 56 A F H X S+ 0 0 104 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.889 113.1 49.6 -69.7 -36.7 8.8 97.1 -41.5 68 57 A A H X S+ 0 0 37 -4,-2.2 4,-3.3 2,-0.2 -2,-0.2 0.927 109.4 49.6 -65.9 -48.3 5.7 99.2 -40.6 69 58 A K H < S+ 0 0 102 -4,-2.4 6,-0.2 1,-0.2 -2,-0.2 0.961 112.7 48.9 -55.5 -51.2 7.0 102.4 -42.2 70 59 A A H <>S+ 0 0 22 -4,-1.9 5,-0.5 1,-0.2 3,-0.5 0.833 117.9 40.0 -57.4 -36.9 7.8 100.4 -45.4 71 60 A K H <5S+ 0 0 164 -4,-1.8 -2,-0.2 1,-0.2 2,-0.2 0.958 115.0 49.4 -78.5 -51.4 4.3 98.8 -45.4 72 61 A Q T <5S+ 0 0 143 -4,-3.3 2,-0.3 -5,-0.1 -1,-0.2 0.014 112.3 49.4 -81.1 26.6 2.2 101.7 -44.4 73 62 A Q T 5S- 0 0 101 -3,-0.5 2,-2.5 -2,-0.2 -1,-0.0 -0.853 84.2-130.7-158.2 122.0 3.7 104.1 -46.9 74 63 A T T 5 - 0 0 147 -2,-0.3 -3,-0.1 0, 0.0 -4,-0.1 -0.476 48.9-175.8 -74.2 69.0 4.0 103.0 -50.6 75 64 A V < - 0 0 33 -2,-2.5 2,-0.2 -5,-0.5 -2,-0.1 -0.135 26.1 -97.0 -68.0 160.7 7.7 104.1 -50.4 76 65 A L >> - 0 0 135 1,-0.1 4,-2.2 4,-0.0 3,-1.3 -0.522 37.9-103.8 -82.7 148.8 10.1 104.1 -53.3 77 66 A L H 3> S+ 0 0 111 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.742 114.2 48.7 -38.3 -49.8 12.6 101.3 -53.8 78 67 A K H 3> S+ 0 0 165 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.811 113.9 47.0 -73.1 -23.5 15.9 102.8 -52.6 79 68 A E H <> S+ 0 0 106 -3,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.878 110.3 53.9 -77.0 -39.7 14.3 104.0 -49.3 80 69 A L H X S+ 0 0 45 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.875 113.3 43.4 -58.1 -37.3 12.7 100.6 -49.0 81 70 A E H X S+ 0 0 97 -4,-2.0 4,-1.4 -5,-0.2 -1,-0.2 0.725 107.7 57.3 -82.6 -21.6 16.3 99.2 -49.3 82 71 A T H X S+ 0 0 73 -4,-1.0 4,-1.7 2,-0.2 -2,-0.2 0.836 108.4 49.2 -73.3 -33.4 17.8 101.9 -47.0 83 72 A L H X S+ 0 0 17 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.894 108.9 52.1 -69.7 -40.9 15.3 100.6 -44.4 84 73 A R H X S+ 0 0 134 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.819 110.0 49.0 -65.8 -31.2 16.4 97.0 -45.1 85 74 A Q H X S+ 0 0 124 -4,-1.4 4,-2.8 2,-0.2 -1,-0.2 0.865 107.1 54.8 -74.6 -35.8 20.0 97.9 -44.6 86 75 A E H X S+ 0 0 75 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.912 109.2 49.0 -61.1 -39.2 19.2 99.7 -41.4 87 76 A I H X S+ 0 0 8 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.923 109.5 51.5 -63.6 -47.2 17.6 96.4 -40.2 88 77 A A H X S+ 0 0 38 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.940 110.7 48.2 -56.0 -48.6 20.7 94.5 -41.3 89 78 A L H X S+ 0 0 90 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.877 110.2 51.9 -61.8 -38.7 22.9 96.8 -39.3 90 79 A L H X S+ 0 0 32 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.899 113.2 45.1 -62.7 -42.6 20.7 96.6 -36.3 91 80 A R H X S+ 0 0 114 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.823 108.8 55.3 -71.1 -35.1 20.9 92.8 -36.5 92 81 A E H X S+ 0 0 107 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.876 105.8 53.4 -64.2 -38.3 24.7 92.7 -37.1 93 82 A R H X S+ 0 0 118 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.870 109.4 47.5 -65.3 -36.3 25.1 94.7 -33.9 94 83 A E H X S+ 0 0 5 -4,-1.2 4,-2.6 2,-0.2 5,-0.2 0.905 109.7 53.4 -71.3 -38.8 23.1 92.2 -32.0 95 84 A A H X S+ 0 0 55 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.909 109.0 49.7 -60.4 -42.3 25.1 89.4 -33.6 96 85 A E H X S+ 0 0 112 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.891 111.4 49.0 -61.3 -42.4 28.3 91.2 -32.4 97 86 A L H X S+ 0 0 23 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.869 112.5 46.3 -67.3 -39.8 26.9 91.5 -28.9 98 87 A K H X S+ 0 0 117 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.801 110.6 55.2 -69.9 -31.3 25.9 87.8 -28.8 99 88 A Q H X S+ 0 0 103 -4,-1.9 4,-2.7 -5,-0.2 -2,-0.2 0.897 103.7 53.8 -67.0 -43.5 29.3 86.9 -30.1 100 89 A R H X S+ 0 0 117 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.902 108.1 50.8 -57.2 -43.6 31.0 88.8 -27.3 101 90 A V H X S+ 0 0 12 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.927 111.1 47.4 -61.9 -45.9 28.9 86.7 -24.7 102 91 A A H X S+ 0 0 48 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.947 113.1 48.9 -58.4 -49.9 30.0 83.5 -26.4 103 92 A E H X S+ 0 0 99 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.888 113.0 47.0 -57.8 -43.7 33.7 84.7 -26.4 104 93 A V H X S+ 0 0 3 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.845 109.4 54.3 -69.9 -35.9 33.5 85.7 -22.8 105 94 A K H X S+ 0 0 107 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.900 109.8 46.9 -63.6 -40.0 31.9 82.4 -21.8 106 95 A V H X S+ 0 0 67 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.908 110.9 53.2 -64.9 -40.5 34.7 80.5 -23.5 107 96 A T H X S+ 0 0 46 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.894 108.0 51.3 -61.7 -39.2 37.1 82.7 -21.7 108 97 A L H X S+ 0 0 8 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.895 109.0 47.6 -69.1 -40.8 35.5 81.9 -18.4 109 98 A E H X S+ 0 0 120 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.867 113.1 51.7 -70.4 -29.0 35.6 78.2 -18.8 110 99 A Q H X S+ 0 0 112 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.884 110.0 47.3 -69.1 -38.6 39.3 78.6 -19.9 111 100 A E H X S+ 0 0 37 -4,-2.2 4,-2.6 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