==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 15-SEP-06 2IDG . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN AF0160; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR M.ZHAO,M.ZHANG,J.CHANG,L.CHEN,H.XU,Y.LI,Z.J.LIU,J.P.ROSE, . 487 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24012.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 375 77.0 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 . 6 1.2 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 . 15 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 277 56.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 3.1 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 9 0 3 0 3 0 0 3 0 0 0 0 0 4 2 1 4 1 0 0 0 0 0 0 0 0 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 . 3 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 1 A X >> 0 0 100 0, 0.0 4,-1.5 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 -79.2 27.7 12.9 8.4 2 2 A T H 3> + 0 0 26 2,-0.2 4,-1.3 1,-0.2 5,-0.3 0.863 360.0 81.2 -47.6 -30.2 28.2 9.3 9.4 3 3 A I H 34 S+ 0 0 84 1,-0.3 -1,-0.2 2,-0.2 103,-0.0 0.482 105.6 20.1 -7.1 -78.2 29.7 11.4 12.1 4 4 A G H <> S+ 0 0 25 -3,-0.6 4,-1.9 2,-0.2 -1,-0.3 -0.095 99.8 79.4 140.7 -82.6 26.8 11.7 13.3 5 5 A R H X S+ 0 0 15 -4,-1.5 4,-2.1 1,-0.2 5,-0.2 0.937 102.8 50.2 -57.2 -47.1 24.1 9.2 12.3 6 6 A A H X S+ 0 0 11 -4,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.840 107.1 53.0 -64.0 -38.2 25.5 6.7 14.8 7 7 A K H > S+ 0 0 115 -5,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.942 109.9 48.0 -64.9 -46.5 25.6 9.2 17.7 8 8 A V H X S+ 0 0 11 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.902 112.4 48.2 -61.3 -44.8 21.9 10.1 17.2 9 9 A Y H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.928 112.7 47.7 -62.7 -47.1 20.8 6.5 17.0 10 10 A A H X S+ 0 0 45 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.940 114.8 46.8 -57.6 -47.7 22.7 5.4 20.1 11 11 A T H X S+ 0 0 10 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.936 112.4 48.6 -59.7 -51.5 21.3 8.5 22.1 12 12 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.896 111.8 51.1 -58.0 -42.5 17.7 7.9 20.9 13 13 A S H X S+ 0 0 15 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.918 111.1 46.8 -59.7 -47.4 18.1 4.3 21.9 14 14 A K H X S+ 0 0 34 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.930 110.4 53.3 -63.2 -43.1 19.4 5.1 25.4 15 15 A I H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.970 110.7 45.4 -56.5 -55.2 16.6 7.7 25.9 16 16 A F H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.867 111.4 53.5 -58.5 -38.1 13.8 5.3 25.1 17 17 A Y H < S+ 0 0 70 -4,-2.2 4,-0.5 2,-0.2 6,-0.3 0.922 110.0 47.8 -61.8 -44.5 15.4 2.6 27.2 18 18 A H H ><>S+ 0 0 38 -4,-2.8 3,-1.9 1,-0.2 5,-1.2 0.952 110.9 50.8 -57.8 -48.2 15.5 5.1 30.1 19 19 A L H 3<5S+ 0 0 12 -4,-2.8 3,-0.4 1,-0.3 -2,-0.2 0.833 100.4 63.3 -63.5 -32.5 11.8 6.1 29.6 20 20 A F T 3<5S+ 0 0 48 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.768 113.4 36.4 -51.6 -22.3 10.8 2.4 29.6 21 21 A Y T < 5S- 0 0 92 -3,-1.9 -1,-0.2 -4,-0.5 -2,-0.2 0.419 112.2-110.7-113.5 -14.1 12.0 2.3 33.2 22 22 A D T 5 + 0 0 101 -3,-0.4 -3,-0.2 -4,-0.3 -4,-0.1 -0.230 66.9 150.5 -98.7 61.5 11.1 5.3 34.3 23 23 A E < - 0 0 92 -5,-1.2 -1,-0.3 -6,-0.3 2,-0.3 -0.019 48.2-110.2 -48.0 158.4 14.7 6.5 34.5 24 24 A A - 0 0 81 -3,-0.1 -1,-0.1 1,-0.0 3,-0.0 -0.682 32.7-106.5 -92.6 153.5 15.5 10.1 34.0 25 25 A I - 0 0 9 -2,-0.3 5,-0.1 1,-0.1 -10,-0.1 -0.712 35.0-116.3 -85.2 116.2 17.4 11.2 30.9 26 26 A P >> - 0 0 59 0, 0.0 4,-2.1 0, 0.0 3,-1.0 -0.255 24.5-123.9 -47.8 137.7 21.0 12.1 31.8 27 27 A K H 3> S+ 0 0 160 1,-0.3 4,-2.0 2,-0.2 -2,-0.1 0.617 111.8 64.5 -70.4 -7.4 21.2 15.8 31.0 28 28 A D H 3> S+ 0 0 101 2,-0.2 4,-1.8 3,-0.1 -1,-0.3 0.854 103.9 43.7 -72.7 -42.8 24.1 14.9 28.7 29 29 A C H <> S+ 0 0 19 -3,-1.0 4,-1.7 2,-0.2 -2,-0.2 0.873 112.9 53.7 -69.0 -37.6 21.7 12.8 26.5 30 30 A R H X S+ 0 0 89 -4,-2.1 4,-3.2 2,-0.2 5,-0.3 0.963 105.5 55.1 -52.1 -54.3 19.3 15.7 26.8 31 31 A E H X S+ 0 0 108 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.892 104.9 51.3 -48.8 -53.1 22.1 18.0 25.6 32 32 A I H < S+ 0 0 17 -4,-1.8 3,-0.4 1,-0.2 -1,-0.2 0.913 117.5 37.4 -53.1 -49.2 22.7 15.9 22.4 33 33 A I H >< S+ 0 0 1 -4,-1.7 3,-2.0 1,-0.2 -2,-0.2 0.893 110.6 58.4 -76.6 -39.3 19.1 15.9 21.3 34 34 A E H >< S+ 0 0 83 -4,-3.2 3,-1.5 1,-0.3 -1,-0.2 0.666 88.3 78.0 -65.0 -15.5 18.3 19.5 22.4 35 35 A K T 3< S+ 0 0 143 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.745 87.5 59.4 -61.4 -22.9 21.1 20.6 20.1 36 36 A F T < S- 0 0 125 -3,-2.0 -1,-0.3 1,-0.4 -2,-0.2 0.106 132.6 -69.4 -90.5 19.9 18.5 20.1 17.3 37 37 A G S < S- 0 0 39 -3,-1.5 -1,-0.4 2,-0.1 2,-0.1 -0.089 74.3 -50.2 97.8 154.6 16.2 22.6 18.9 38 38 A E + 0 0 186 -3,-0.1 2,-0.3 -2,-0.1 -4,-0.1 -0.361 62.6 152.7 -71.1 130.6 14.1 22.5 22.1 39 39 A I - 0 0 39 -2,-0.1 2,-0.3 105,-0.0 -2,-0.1 -0.937 33.8-121.5-144.4 166.5 11.9 19.5 22.8 40 40 A D - 0 0 76 -2,-0.3 104,-0.5 1,-0.0 102,-0.0 -0.807 2.7-153.1-115.0 156.9 10.6 17.7 25.9 41 41 A F + 0 0 14 -2,-0.3 2,-2.3 102,-0.1 -16,-0.1 -0.042 45.3 140.1-112.0 29.0 10.9 14.1 27.1 42 42 A N + 0 0 144 2,-0.0 2,-0.4 0, 0.0 -1,-0.1 -0.325 27.1 126.6 -81.3 62.7 7.7 14.1 29.1 43 43 A L - 0 0 29 -2,-2.3 2,-0.2 99,-0.0 99,-0.0 -0.944 51.5-131.1-119.3 141.1 6.5 10.5 28.3 44 44 A R >> - 0 0 57 -2,-0.4 4,-2.5 1,-0.1 3,-0.7 -0.559 18.4-121.3 -92.1 152.9 5.5 7.8 30.7 45 45 A S H 3> S+ 0 0 22 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.836 109.0 68.1 -58.8 -36.1 6.7 4.2 30.7 46 46 A V H 34 S+ 0 0 124 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.900 111.4 33.6 -52.2 -44.1 3.1 2.9 30.4 47 47 A L H X4 S+ 0 0 67 -3,-0.7 3,-1.8 2,-0.1 4,-0.3 0.966 118.4 52.1 -70.5 -55.2 3.0 4.4 26.9 48 48 A V H >< S+ 0 0 0 -4,-2.5 3,-2.0 1,-0.3 -2,-0.2 0.817 99.1 63.2 -57.4 -37.9 6.6 3.8 26.0 49 49 A R T 3< S+ 0 0 27 -4,-3.4 -1,-0.3 1,-0.3 -2,-0.1 0.823 103.2 51.6 -56.1 -29.5 6.5 0.1 27.0 50 50 A E T < S+ 0 0 106 -3,-1.8 2,-2.8 -4,-0.4 -1,-0.3 0.459 74.2 110.7 -90.6 -1.6 4.0 -0.4 24.2 51 51 A L < + 0 0 3 -3,-2.0 40,-2.2 -4,-0.3 2,-0.4 -0.341 48.3 134.5 -74.5 65.9 6.0 1.3 21.4 52 52 A R B >> -A 90 0A 45 -2,-2.8 4,-3.0 38,-0.2 3,-1.6 -0.906 65.2-123.4-118.6 144.1 6.6 -1.9 19.6 53 53 A G H 3> S+ 0 0 0 36,-2.2 4,-2.8 -2,-0.4 -1,-0.1 0.898 112.0 52.0 -49.1 -48.2 6.3 -2.6 15.8 54 54 A S H 34 S+ 0 0 28 1,-0.2 -1,-0.3 2,-0.2 -3,-0.1 0.599 116.9 39.6 -72.5 -13.2 3.8 -5.4 16.3 55 55 A V H <4 S+ 0 0 58 -3,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.781 120.6 42.3 -92.9 -42.0 1.6 -3.2 18.5 56 56 A L H < S+ 0 0 10 -4,-3.0 2,-1.4 1,-0.1 -2,-0.2 0.835 94.0 78.0 -82.1 -37.8 1.9 0.0 16.5 57 57 A I >< - 0 0 27 -4,-2.8 3,-1.2 -5,-0.3 -1,-0.1 -0.637 60.7-179.2 -76.5 94.2 1.7 -1.2 13.0 58 58 A K T 3 S+ 0 0 146 -2,-1.4 -1,-0.2 1,-0.3 -2,-0.0 0.832 74.2 61.4 -67.5 -36.1 -2.1 -1.6 12.9 59 59 A D T 3 S+ 0 0 148 -3,-0.1 -1,-0.3 2,-0.1 -2,-0.1 0.447 78.2 124.9 -70.2 -0.5 -2.3 -2.9 9.3 60 60 A X < - 0 0 24 -3,-1.2 2,-0.1 1,-0.1 5,-0.0 -0.477 68.3-118.7 -70.7 122.4 -0.1 -5.9 10.4 61 61 A P >> - 0 0 54 0, 0.0 4,-2.2 0, 0.0 3,-1.4 -0.398 21.2-127.0 -57.9 133.9 -1.7 -9.3 9.6 62 62 A Q H 3> S+ 0 0 139 1,-0.3 4,-1.5 2,-0.2 5,-0.1 0.776 106.7 59.8 -60.5 -32.7 -2.2 -11.2 12.9 63 63 A S H 34 S+ 0 0 13 1,-0.2 -1,-0.3 2,-0.2 170,-0.1 0.802 111.3 41.1 -65.4 -33.6 -0.3 -14.2 11.7 64 64 A L H X> S+ 0 0 36 -3,-1.4 3,-2.1 2,-0.1 4,-0.7 0.865 108.9 61.8 -76.3 -38.9 2.7 -12.1 11.2 65 65 A A H 3< S+ 0 0 31 -4,-2.2 3,-0.3 1,-0.3 4,-0.3 0.780 100.0 53.8 -60.2 -28.1 2.1 -10.2 14.5 66 66 A E T 3< S+ 0 0 135 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.1 0.447 119.5 32.4 -92.2 3.7 2.4 -13.4 16.5 67 67 A V T <> S+ 0 0 35 -3,-2.1 4,-2.0 -5,-0.1 -2,-0.2 0.236 86.9 104.7-132.0 9.5 5.8 -14.2 15.1 68 68 A Y H X S+ 0 0 11 -4,-0.7 4,-2.6 -3,-0.3 5,-0.1 0.841 78.7 53.0 -65.5 -36.2 7.2 -10.7 14.5 69 69 A E H > S+ 0 0 60 -4,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.930 110.1 48.7 -64.3 -44.9 9.5 -10.7 17.5 70 70 A S H > S+ 0 0 45 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.859 109.8 53.2 -59.0 -39.6 11.0 -14.0 16.2 71 71 A V H X S+ 0 0 2 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.904 109.0 49.0 -61.9 -44.3 11.3 -12.3 12.8 72 72 A X H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.935 107.2 54.0 -59.4 -49.5 13.2 -9.4 14.4 73 73 A K H X S+ 0 0 94 -4,-2.6 4,-3.2 1,-0.2 5,-0.2 0.878 104.9 57.2 -53.8 -39.6 15.6 -11.7 16.2 74 74 A D H X S+ 0 0 48 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.934 106.4 46.7 -55.4 -51.8 16.4 -13.3 12.8 75 75 A F H X S+ 0 0 14 -4,-1.5 4,-0.8 1,-0.2 -2,-0.2 0.938 115.4 47.3 -57.6 -48.8 17.5 -10.0 11.3 76 76 A Y H ><>S+ 0 0 3 -4,-2.2 5,-2.2 2,-0.2 3,-1.1 0.920 109.7 51.1 -55.5 -50.7 19.6 -9.3 14.4 77 77 A E H ><5S+ 0 0 151 -4,-3.2 3,-1.6 1,-0.3 -1,-0.2 0.896 104.8 59.1 -62.2 -37.0 21.2 -12.8 14.5 78 78 A R H 3<5S+ 0 0 145 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.771 110.6 41.4 -57.9 -31.0 22.2 -12.5 10.9 79 79 A Y T <<5S- 0 0 49 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.152 116.1-108.5-108.8 20.8 24.2 -9.3 11.7 80 80 A G T < 5S+ 0 0 55 -3,-1.6 2,-0.4 1,-0.2 -3,-0.2 0.923 75.6 135.7 54.0 44.3 25.8 -10.5 14.9 81 81 A F < - 0 0 27 -5,-2.2 2,-0.4 -8,-0.2 -1,-0.2 -0.916 36.5-163.9-116.0 149.7 23.7 -8.2 16.9 82 82 A Q - 0 0 83 -2,-0.4 -9,-0.0 -3,-0.1 -5,-0.0 -0.981 16.9-123.3-139.0 126.9 21.9 -9.2 20.1 83 83 A A - 0 0 47 -2,-0.4 2,-0.2 1,-0.1 4,-0.1 0.278 16.8-117.5 -45.8 170.1 19.1 -7.4 21.9 84 84 A S - 0 0 51 2,-0.1 -1,-0.1 3,-0.1 9,-0.0 -0.270 56.9 -76.0 -87.7-164.4 18.8 -6.1 25.5 85 85 A E S S+ 0 0 113 -2,-0.2 3,-0.1 2,-0.0 -2,-0.1 0.665 105.3 98.6 -74.1 -18.4 16.1 -7.6 27.7 86 86 A L S S- 0 0 12 1,-0.1 -2,-0.1 2,-0.1 -3,-0.0 -0.200 92.8 -77.5 -65.1 160.2 13.4 -5.6 25.9 87 87 A H > - 0 0 81 1,-0.1 3,-2.4 2,-0.1 6,-0.3 -0.360 42.7-120.0 -57.1 138.1 11.2 -7.1 23.1 88 88 A A T 3 S+ 0 0 2 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.704 111.9 53.1 -60.5 -23.3 13.1 -7.3 19.8 89 89 A D T 3 S+ 0 0 0 4,-0.1 -36,-2.2 5,-0.1 2,-0.3 0.233 79.6 122.8 -96.5 13.4 10.5 -5.1 18.1 90 90 A H B X> S-A 52 0A 1 -3,-2.4 4,-2.2 -38,-0.2 3,-1.2 -0.584 71.7-124.1 -77.3 136.3 10.8 -2.3 20.7 91 91 A I H 3> S+ 0 0 0 -40,-2.2 4,-2.6 -2,-0.3 5,-0.2 0.838 111.1 57.1 -48.9 -36.4 11.7 1.0 19.2 92 92 A A H 3> S+ 0 0 2 2,-0.2 4,-2.0 -41,-0.2 -1,-0.3 0.880 109.8 43.3 -64.9 -39.1 14.7 1.2 21.6 93 93 A V H <> S+ 0 0 2 -3,-1.2 4,-2.6 -6,-0.3 -2,-0.2 0.939 113.5 50.1 -71.7 -47.0 16.1 -2.1 20.4 94 94 A E H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.905 112.1 49.0 -58.6 -44.3 15.5 -1.4 16.7 95 95 A L H X S+ 0 0 0 -4,-2.6 4,-1.8 -5,-0.3 -1,-0.2 0.930 110.3 51.1 -60.4 -45.2 17.2 2.0 17.2 96 96 A A H X S+ 0 0 24 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.877 106.6 54.8 -58.3 -38.7 20.1 0.3 19.0 97 97 A F H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.941 106.1 51.9 -60.4 -47.6 20.5 -2.2 16.1 98 98 A X H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.874 106.5 52.6 -55.9 -42.6 20.8 0.7 13.7 99 99 A S H X S+ 0 0 9 -4,-1.8 4,-2.8 1,-0.2 5,-0.2 0.896 107.1 53.5 -67.4 -34.4 23.6 2.3 15.7 100 100 A K H X S+ 0 0 71 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.948 111.9 44.9 -56.5 -47.6 25.5 -1.0 15.7 101 101 A L H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.929 115.1 47.2 -64.4 -44.9 25.2 -1.1 11.9 102 102 A V H X S+ 0 0 0 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.871 111.5 50.5 -68.3 -35.7 26.2 2.6 11.5 103 103 A E H X S+ 0 0 82 -4,-2.8 4,-1.5 2,-0.2 -1,-0.2 0.883 109.0 50.9 -71.0 -33.4 29.2 2.2 13.9 104 104 A R H X S+ 0 0 95 -4,-2.2 4,-1.6 -5,-0.2 -2,-0.2 0.856 106.2 58.5 -65.9 -34.4 30.4 -0.8 12.0 105 105 A E H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.867 99.8 56.0 -58.4 -41.7 30.0 1.4 8.9 106 106 A I H X S+ 0 0 56 -4,-1.5 4,-3.2 1,-0.2 3,-0.4 0.971 106.0 50.2 -56.1 -55.0 32.5 4.0 10.4 107 107 A S H X S+ 0 0 50 -4,-1.5 4,-2.8 1,-0.3 -1,-0.2 0.891 112.6 48.2 -47.6 -44.0 35.1 1.4 10.7 108 108 A L H <>S+ 0 0 28 -4,-1.6 5,-1.5 2,-0.2 -1,-0.3 0.802 110.5 49.7 -72.5 -31.8 34.5 0.4 7.1 109 109 A A H <5S+ 0 0 50 -4,-2.3 -2,-0.2 -3,-0.4 -1,-0.2 0.926 111.2 50.4 -68.3 -44.4 34.7 4.0 6.0 110 110 A Q H <5S+ 0 0 150 -4,-3.2 -2,-0.2 -5,-0.2 -3,-0.2 0.929 116.4 43.2 -58.6 -54.0 37.9 4.4 7.9 111 111 A Q T <5S- 0 0 83 -4,-2.8 2,-0.2 -5,-0.2 0, 0.0 -0.266 105.9-114.3 -68.6 177.2 39.3 1.3 6.2 112 112 A X T 5 + 0 0 184 1,-0.1 2,-1.3 -2,-0.1 3,-0.2 -0.388 57.9 149.1-118.8 61.5 38.4 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