==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 16-MAR-10 3M77 . COMPND 2 MOLECULE: TELLURITE RESISTANCE PROTEIN TEHA HOMOLOG; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR Y.-H.CHEN,W.A.HENDRICKSON,NEW YORK CONSORTIUM ON MEMBRANE PR . 305 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14234.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 81.6 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 . 6 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 16.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 184 60.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.3 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 1 0 0 1 0 0 0 2 1 0 1 0 0 0 0 0 0 0 2 1 0 1 0 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 7 A F 0 0 37 0, 0.0 306,-0.1 0, 0.0 55,-0.0 0.000 360.0 360.0 360.0 134.7 13.3 -35.7 -23.0 2 8 A P + 0 0 46 0, 0.0 305,-3.3 0, 0.0 50,-0.0 0.695 360.0 64.2 -62.0 -24.4 11.6 -32.8 -21.2 3 9 A L S S- 0 0 1 303,-0.2 2,-0.2 49,-0.1 303,-0.1 -0.881 74.2-146.4-107.7 111.6 14.0 -32.6 -18.3 4 10 A P > - 0 0 37 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.543 23.2-124.4 -67.2 139.1 17.6 -31.6 -19.1 5 11 A T G > S+ 0 0 8 1,-0.3 3,-2.0 -2,-0.2 4,-0.1 0.839 107.4 68.2 -57.9 -31.7 19.9 -33.4 -16.7 6 12 A G G > S+ 0 0 21 1,-0.3 3,-2.4 2,-0.2 -1,-0.3 0.688 77.7 82.0 -62.0 -17.7 21.4 -30.0 -15.6 7 13 A Y G X + 0 0 22 -3,-2.1 3,-2.3 1,-0.3 -1,-0.3 0.707 69.3 81.4 -65.7 -15.3 18.1 -29.1 -14.0 8 14 A F G <> S+ 0 0 0 -3,-2.0 4,-1.8 1,-0.3 -1,-0.3 0.681 72.8 78.5 -60.2 -14.4 19.2 -31.1 -11.0 9 15 A D H <> S+ 0 0 11 -3,-2.4 4,-2.4 2,-0.2 -1,-0.3 0.736 84.7 65.7 -60.3 -23.6 21.2 -28.0 -10.1 10 16 A I H <> S+ 0 0 10 -3,-2.3 4,-2.3 2,-0.2 5,-0.2 0.989 105.8 35.2 -69.5 -57.8 17.8 -26.7 -8.9 11 17 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.3 0.859 115.7 60.7 -63.7 -28.8 17.3 -29.1 -6.0 12 18 A L H X S+ 0 0 9 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.966 108.9 40.4 -55.7 -55.0 21.1 -29.0 -5.4 13 19 A G H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.912 117.7 47.5 -63.8 -43.5 21.0 -25.2 -4.8 14 20 A L H X S+ 0 0 14 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.892 114.0 47.7 -64.6 -41.8 17.8 -25.3 -2.7 15 21 A A H X S+ 0 0 1 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.926 112.3 47.7 -66.6 -46.8 19.0 -28.2 -0.6 16 22 A A H X S+ 0 0 13 -4,-2.7 4,-1.9 -5,-0.3 -1,-0.2 0.889 111.6 51.5 -63.0 -36.1 22.4 -26.8 0.1 17 23 A L H X S+ 0 0 5 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.893 105.4 55.4 -68.5 -38.1 20.8 -23.5 1.0 18 24 A S H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.932 107.4 50.4 -54.9 -45.1 18.4 -25.3 3.4 19 25 A L H X S+ 0 0 24 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.883 106.9 54.4 -65.0 -36.9 21.5 -26.8 5.1 20 26 A A H < S+ 0 0 0 -4,-1.9 4,-0.3 1,-0.2 3,-0.3 0.930 110.6 44.8 -60.4 -49.2 23.1 -23.3 5.4 21 27 A W H >< S+ 0 0 53 -4,-2.2 3,-1.9 1,-0.2 4,-0.3 0.884 106.3 61.7 -64.0 -33.3 20.0 -21.9 7.2 22 28 A F H >< S+ 0 0 48 -4,-2.3 3,-1.5 1,-0.3 4,-0.2 0.885 97.2 59.4 -57.8 -39.5 19.9 -25.1 9.4 23 29 A H T 3< S+ 0 0 74 -4,-1.5 -1,-0.3 -3,-0.3 3,-0.2 0.617 100.9 55.4 -68.8 -11.1 23.2 -24.1 10.7 24 30 A L T X> S+ 0 0 20 -3,-1.9 4,-3.2 -4,-0.3 3,-0.5 0.371 75.6 100.5 -97.5 4.0 21.9 -20.7 12.0 25 31 A E T <4 S+ 0 0 48 -3,-1.5 7,-0.2 -4,-0.3 6,-0.1 0.850 81.7 48.2 -62.5 -35.8 19.1 -22.1 14.1 26 32 A N T 34 S+ 0 0 140 -4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.705 116.8 44.0 -78.4 -21.6 21.0 -21.8 17.5 27 33 A L T <4 S+ 0 0 61 -3,-0.5 -2,-0.2 1,-0.3 -1,-0.2 0.873 135.9 10.8 -82.5 -40.1 21.9 -18.2 16.7 28 34 A F >< - 0 0 121 -4,-3.2 3,-2.2 1,-0.1 4,-0.3 -0.904 68.5-156.3-143.6 104.0 18.5 -17.3 15.4 29 35 A P T > S+ 0 0 103 0, 0.0 3,-1.7 0, 0.0 4,-0.4 0.777 89.7 65.7 -56.7 -32.6 15.7 -19.7 16.0 30 36 A A T 3> S+ 0 0 82 1,-0.3 4,-1.4 2,-0.2 3,-0.5 0.695 84.0 77.8 -65.1 -16.6 13.5 -18.5 13.1 31 37 A A H <> S+ 0 0 5 -3,-2.2 4,-2.7 -7,-0.3 -1,-0.3 0.808 83.4 65.2 -61.6 -29.7 16.2 -19.8 10.8 32 38 A R H <> S+ 0 0 66 -3,-1.7 4,-3.0 -4,-0.3 -1,-0.2 0.925 99.5 49.3 -62.9 -40.8 14.9 -23.3 11.3 33 39 A M H > S+ 0 0 126 -3,-0.5 4,-2.7 -4,-0.4 5,-0.2 0.931 112.0 48.9 -63.3 -42.8 11.5 -22.6 9.7 34 40 A V H X S+ 0 0 55 -4,-1.4 4,-2.5 1,-0.2 5,-0.2 0.944 113.7 47.6 -59.1 -48.1 13.3 -21.1 6.7 35 41 A S H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.905 111.4 49.4 -57.4 -47.2 15.6 -24.1 6.5 36 42 A D H X S+ 0 0 32 -4,-3.0 4,-2.4 2,-0.2 5,-0.2 0.915 111.3 49.4 -63.2 -43.5 12.7 -26.6 6.8 37 43 A V H X S+ 0 0 79 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.965 113.9 44.7 -61.4 -49.2 10.7 -24.8 4.0 38 44 A L H X S+ 0 0 33 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.892 113.6 52.0 -59.5 -40.4 13.7 -24.7 1.6 39 45 A G H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.875 109.9 47.1 -66.1 -39.1 14.4 -28.4 2.5 40 46 A I H X S+ 0 0 97 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.919 114.5 46.9 -66.6 -46.0 10.9 -29.5 1.8 41 47 A V H X S+ 0 0 68 -4,-2.5 4,-2.6 -5,-0.2 5,-0.3 0.942 113.4 49.0 -62.1 -45.4 10.8 -27.7 -1.5 42 48 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.917 112.7 47.7 -59.7 -44.5 14.2 -29.0 -2.5 43 49 A S H X S+ 0 0 12 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.878 111.3 50.5 -66.3 -39.2 13.2 -32.6 -1.6 44 50 A A H X S+ 0 0 55 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.918 112.2 46.4 -63.8 -46.5 9.9 -32.3 -3.5 45 51 A V H X S+ 0 0 34 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.911 112.2 52.6 -61.0 -43.0 11.7 -31.0 -6.6 46 52 A W H X S+ 0 0 30 -4,-2.4 4,-2.9 -5,-0.3 5,-0.2 0.939 107.2 50.7 -59.1 -48.1 14.2 -33.8 -6.2 47 53 A I H X S+ 0 0 90 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.928 112.1 48.3 -54.6 -46.3 11.5 -36.5 -6.0 48 54 A L H X S+ 0 0 85 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.934 113.8 45.3 -62.5 -45.5 9.9 -35.1 -9.2 49 55 A F H X S+ 0 0 5 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.879 111.6 52.1 -69.9 -35.5 13.2 -35.0 -11.1 50 56 A I H X S+ 0 0 48 -4,-2.9 4,-2.6 -5,-0.2 -1,-0.2 0.930 110.3 48.5 -63.6 -43.9 14.3 -38.4 -10.0 51 57 A L H X S+ 0 0 113 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.905 112.1 50.3 -64.1 -39.5 11.0 -39.9 -11.1 52 58 A M H X S+ 0 0 36 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.916 110.3 48.4 -62.9 -42.9 11.5 -38.1 -14.5 53 59 A Y H X S+ 0 0 15 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.885 108.1 54.8 -67.9 -35.5 15.0 -39.4 -14.9 54 60 A A H X S+ 0 0 48 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.917 108.4 49.7 -60.0 -40.0 13.7 -42.9 -14.1 55 61 A Y H X S+ 0 0 126 -4,-2.1 4,-2.8 1,-0.2 5,-0.4 0.891 109.2 52.4 -64.0 -41.7 11.2 -42.4 -16.9 56 62 A K H X S+ 0 0 12 -4,-2.2 4,-2.5 1,-0.2 8,-0.3 0.913 109.6 48.9 -60.2 -42.7 14.1 -41.3 -19.1 57 63 A L H < S+ 0 0 75 -4,-2.5 -1,-0.2 1,-0.2 4,-0.2 0.879 116.9 41.2 -64.8 -39.4 16.1 -44.4 -18.3 58 64 A R H < S+ 0 0 165 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.878 133.5 17.5 -76.4 -41.5 13.2 -46.7 -19.0 59 65 A Y H < S+ 0 0 136 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.577 131.7 37.6-115.5 -10.1 11.8 -45.1 -22.1 60 66 A Y >X + 0 0 85 -4,-2.5 3,-1.4 -5,-0.4 4,-1.2 -0.206 68.3 143.5-132.1 39.5 14.5 -42.8 -23.5 61 67 A F H 3> + 0 0 105 1,-0.3 4,-3.0 -4,-0.2 5,-0.2 0.812 65.2 60.9 -59.3 -36.3 17.6 -45.0 -22.8 62 68 A E H 3> S+ 0 0 119 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.853 102.8 54.2 -63.9 -25.8 19.5 -44.1 -25.9 63 69 A E H <> S+ 0 0 81 -3,-1.4 4,-1.9 -7,-0.2 -1,-0.2 0.911 110.2 46.3 -69.2 -40.2 19.5 -40.4 -24.8 64 70 A V H X S+ 0 0 12 -4,-1.2 4,-2.8 -8,-0.3 5,-0.2 0.929 110.8 52.8 -65.6 -46.6 21.0 -41.5 -21.5 65 71 A R H X S+ 0 0 129 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.922 110.5 47.5 -55.1 -45.7 23.5 -43.7 -23.3 66 72 A A H X S+ 0 0 47 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.901 113.0 46.9 -66.0 -41.0 24.6 -40.8 -25.4 67 73 A E H < S+ 0 0 12 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.902 112.2 52.2 -67.4 -38.5 24.9 -38.3 -22.5 68 74 A Y H < S+ 0 0 55 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.908 112.5 43.4 -62.4 -43.8 26.9 -40.9 -20.5 69 75 A H H < S+ 0 0 93 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.716 89.4 103.9 -82.0 -15.4 29.4 -41.6 -23.3 70 76 A S S X S- 0 0 22 -4,-1.4 4,-1.5 -5,-0.2 5,-0.2 -0.451 70.2-141.2 -63.7 132.0 29.9 -37.9 -24.1 71 77 A P T 4 S+ 0 0 25 0, 0.0 -1,-0.2 0, 0.0 56,-0.1 0.573 101.4 32.5 -73.6 -7.8 33.2 -36.6 -22.7 72 78 A V T >4 S+ 0 0 24 -5,-0.1 3,-1.0 60,-0.1 4,-0.3 0.744 119.3 44.9-106.1 -52.8 31.4 -33.4 -21.9 73 79 A R G >4 S+ 0 0 124 1,-0.2 3,-1.1 2,-0.1 4,-0.5 0.719 93.1 79.2 -75.0 -15.4 27.7 -34.2 -21.0 74 80 A F G >< S+ 0 0 0 -4,-1.5 3,-1.6 1,-0.2 4,-0.5 0.862 81.7 69.6 -58.5 -34.0 28.5 -37.2 -18.8 75 81 A S G X S+ 0 0 2 -3,-1.0 3,-1.5 1,-0.3 4,-0.3 0.808 85.8 63.4 -57.5 -34.1 29.4 -34.9 -15.9 76 82 A F G X S+ 0 0 37 -3,-1.1 3,-1.8 1,-0.3 4,-0.3 0.771 88.1 71.5 -67.4 -23.3 25.8 -33.6 -15.3 77 83 A I G X S+ 0 0 20 -3,-1.6 3,-2.1 -4,-0.5 -1,-0.3 0.847 84.4 70.0 -59.0 -29.5 24.8 -37.2 -14.3 78 84 A A G <> S+ 0 0 1 -3,-1.5 4,-2.1 -4,-0.5 -1,-0.3 0.742 82.0 73.1 -61.6 -21.8 26.8 -36.7 -11.2 79 85 A L H <> S+ 0 0 0 -3,-1.8 4,-2.5 -4,-0.3 -1,-0.3 0.773 88.1 64.8 -59.2 -25.0 24.2 -34.1 -10.0 80 86 A I H <> S+ 0 0 26 -3,-2.1 4,-2.1 -4,-0.3 -2,-0.2 0.987 108.0 33.9 -69.5 -55.3 21.9 -37.1 -9.4 81 87 A P H > S+ 0 0 17 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.877 116.8 58.1 -68.8 -30.0 23.9 -38.7 -6.6 82 88 A I H X S+ 0 0 2 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.972 110.7 41.1 -59.6 -50.0 25.0 -35.3 -5.3 83 89 A T H X S+ 0 0 1 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.842 109.6 59.7 -69.8 -32.0 21.4 -34.2 -4.8 84 90 A T H X S+ 0 0 12 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.929 109.2 44.6 -57.6 -44.0 20.5 -37.6 -3.4 85 91 A M H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.909 111.8 51.1 -69.0 -41.5 23.0 -37.1 -0.7 86 92 A L H X S+ 0 0 16 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.898 110.0 49.7 -64.6 -39.9 22.0 -33.5 -0.0 87 93 A V H X S+ 0 0 1 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.929 109.6 52.2 -64.6 -41.7 18.3 -34.6 0.3 88 94 A G H X S+ 0 0 0 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.934 107.2 53.2 -53.3 -44.7 19.5 -37.3 2.7 89 95 A D H < S+ 0 0 19 -4,-2.6 4,-0.4 1,-0.2 -2,-0.2 0.894 111.0 46.3 -60.8 -41.6 21.3 -34.5 4.7 90 96 A I H >< S+ 0 0 0 -4,-2.1 3,-1.6 1,-0.2 4,-0.2 0.944 111.6 50.5 -60.0 -50.5 18.1 -32.6 4.9 91 97 A L H >X S+ 0 0 42 -4,-2.8 4,-2.9 1,-0.3 3,-2.1 0.733 89.2 80.9 -68.9 -20.0 16.0 -35.6 5.9 92 98 A Y T 3< S+ 0 0 79 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.804 83.4 64.2 -52.7 -31.6 18.5 -36.5 8.7 93 99 A R T <4 S+ 0 0 40 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.733 118.9 23.8 -67.3 -22.9 16.8 -33.8 10.9 94 100 A W T <4 S+ 0 0 119 -3,-2.1 -2,-0.2 -4,-0.2 -1,-0.2 0.678 139.6 12.3-109.9 -33.4 13.6 -35.9 10.7 95 101 A N X - 0 0 66 -4,-2.9 4,-2.2 1,-0.1 -1,-0.2 -0.703 53.7-174.7-155.6 90.2 14.6 -39.5 10.0 96 102 A P H > S+ 0 0 62 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.758 85.1 60.0 -62.7 -25.7 18.3 -40.5 10.3 97 103 A L H > S+ 0 0 128 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.958 109.6 39.2 -67.0 -50.9 17.6 -44.0 9.0 98 104 A I H > S+ 0 0 84 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.918 115.4 54.8 -66.1 -39.1 16.2 -42.9 5.7 99 105 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.921 106.6 50.6 -58.3 -45.3 18.8 -40.1 5.5 100 106 A E H X S+ 0 0 61 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.905 108.2 52.5 -65.1 -39.3 21.6 -42.7 5.9 101 107 A V H X S+ 0 0 75 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.956 112.1 45.4 -59.3 -48.7 20.3 -44.9 3.1 102 108 A L H X S+ 0 0 24 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.907 111.3 52.9 -62.3 -40.6 20.2 -42.0 0.7 103 109 A I H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.923 112.6 44.0 -63.3 -42.7 23.7 -40.8 1.7 104 110 A W H X S+ 0 0 86 -4,-2.4 4,-3.0 2,-0.2 5,-0.4 0.899 112.6 51.9 -70.1 -40.0 25.2 -44.3 1.1 105 111 A I H X S+ 0 0 97 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.933 113.6 44.6 -58.9 -45.4 23.3 -44.7 -2.2 106 112 A G H X S+ 0 0 1 -4,-2.7 4,-2.4 -5,-0.2 -2,-0.2 0.867 115.0 48.4 -67.9 -35.3 24.6 -41.3 -3.4 107 113 A T H X S+ 0 0 4 -4,-2.1 4,-2.3 -5,-0.2 5,-0.2 0.956 115.7 41.4 -69.4 -52.3 28.2 -42.1 -2.1 108 114 A I H X S+ 0 0 104 -4,-3.0 4,-2.7 1,-0.2 5,-0.3 0.934 116.4 52.6 -59.3 -45.1 28.4 -45.5 -3.7 109 115 A G H X S+ 0 0 30 -4,-2.4 4,-2.6 -5,-0.4 -2,-0.2 0.930 111.4 43.3 -59.7 -47.3 26.7 -44.2 -6.8 110 116 A Q H X S+ 0 0 2 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.910 114.7 49.6 -67.9 -37.8 29.1 -41.2 -7.3 111 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