==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE 13-AUG-13 4M8I . COMPND 2 MOLECULE: CELL DIVISION PROTEIN FTSZ; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS EPIDERMIDIS; . AUTHOR A.S.HALAVATY,G.MINASOV,J.WINSOR,I.DUBROVSKA,E.V.FILIPPOVA,D. . 311 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14186.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 233 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 6.1 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 . 1 0.3 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 . 17 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 34.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 1 0 2 0 2 0 0 0 1 2 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 1 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 PARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 1 1 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 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 11 A L 0 0 160 0, 0.0 191,-0.0 0, 0.0 190,-0.0 0.000 360.0 360.0 360.0 151.4 -2.9 16.9 9.4 2 12 A A - 0 0 23 1,-0.1 2,-0.6 85,-0.1 84,-0.1 -0.191 360.0-122.6 -52.9 132.9 -3.0 13.1 9.0 3 13 A T - 0 0 61 82,-0.3 84,-2.3 25,-0.0 85,-2.1 -0.757 29.1-163.7 -82.9 116.1 -6.6 11.7 8.3 4 14 A L E -a 88 0A 7 -2,-0.6 25,-2.0 23,-0.5 2,-0.4 -0.838 8.2-177.2-105.0 137.0 -7.6 9.1 10.9 5 15 A K E -ab 89 29A 13 83,-1.9 85,-2.7 -2,-0.4 2,-0.5 -0.999 13.8-158.0-135.6 139.0 -10.5 6.7 10.4 6 16 A V E -ab 90 30A 0 23,-2.5 25,-2.3 -2,-0.4 2,-0.5 -0.986 13.0-165.5-115.8 127.2 -11.9 4.1 12.8 7 17 A I E -ab 91 31A 0 83,-3.2 85,-2.9 -2,-0.5 2,-0.5 -0.966 6.3-158.0-121.3 122.2 -13.8 1.3 11.2 8 18 A G E -ab 92 32A 0 23,-2.6 25,-2.7 -2,-0.5 2,-0.5 -0.856 10.9-165.3 -98.8 129.0 -16.1 -1.1 13.1 9 19 A V E > -ab 93 33A 0 83,-2.5 4,-0.7 -2,-0.5 85,-0.5 -0.976 52.0 -13.3-122.1 120.4 -16.8 -4.4 11.4 10 20 A G H > S- 0 0 1 23,-2.4 4,-2.7 -2,-0.5 5,-0.2 -0.224 105.2 -46.4 82.3-174.6 -19.6 -6.7 12.6 11 21 A G H > S+ 0 0 39 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.958 135.8 41.9 -63.5 -55.4 -21.6 -6.4 15.8 12 22 A G H > S+ 0 0 38 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.888 117.0 49.3 -58.8 -41.5 -18.8 -5.9 18.3 13 23 A G H X S+ 0 0 0 -4,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.899 111.0 49.2 -63.6 -47.4 -17.0 -3.5 16.1 14 24 A N H X S+ 0 0 4 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.929 110.2 52.5 -54.3 -49.0 -20.2 -1.5 15.4 15 25 A N H X S+ 0 0 73 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.903 108.1 50.2 -56.4 -46.4 -20.8 -1.4 19.2 16 26 A A H X S+ 0 0 8 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.920 110.8 50.2 -59.0 -44.2 -17.3 -0.1 19.9 17 27 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.940 110.5 48.8 -61.3 -47.2 -17.8 2.6 17.2 18 28 A N H X S+ 0 0 31 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.920 113.3 46.5 -60.3 -44.3 -21.1 3.7 18.7 19 29 A R H X S+ 0 0 55 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.870 111.9 51.0 -67.9 -37.0 -19.7 3.9 22.2 20 30 A M H X S+ 0 0 1 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.886 109.3 50.6 -64.8 -39.7 -16.6 5.8 21.0 21 31 A I H < S+ 0 0 50 -4,-2.4 4,-0.3 -5,-0.2 -2,-0.2 0.926 111.5 49.3 -63.4 -43.3 -18.8 8.3 19.2 22 32 A D H < S+ 0 0 116 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.893 108.7 52.5 -59.8 -42.5 -20.9 8.7 22.5 23 33 A H H < S- 0 0 120 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.881 120.3-106.7 -64.7 -39.7 -17.7 9.2 24.5 24 34 A G < - 0 0 38 -4,-2.0 2,-0.4 -5,-0.1 -3,-0.1 0.399 38.7-172.0 112.5 115.1 -16.6 12.0 22.2 25 35 A M > - 0 0 24 -4,-0.3 3,-0.5 3,-0.1 2,-0.2 -0.968 10.4-151.2-137.8 121.5 -13.8 12.0 19.6 26 36 A N T 3 S+ 0 0 124 -2,-0.4 3,-0.1 1,-0.2 162,-0.1 -0.627 75.6 6.2 -89.9 148.5 -12.5 15.0 17.7 27 37 A N T 3 S+ 0 0 135 -2,-0.2 -23,-0.5 1,-0.2 2,-0.4 0.769 96.6 117.8 53.3 33.5 -11.0 14.8 14.2 28 38 A V < - 0 0 14 -3,-0.5 2,-0.5 -25,-0.1 -23,-0.2 -0.994 53.4-147.1-125.1 137.0 -11.7 11.1 13.7 29 39 A E E -b 5 0A 53 -25,-2.0 -23,-2.5 -2,-0.4 2,-0.4 -0.909 15.5-149.9-100.7 134.1 -14.0 9.8 10.9 30 40 A F E -b 6 0A 7 -2,-0.5 17,-0.9 -25,-0.2 2,-0.4 -0.815 10.7-169.4-107.1 143.1 -16.0 6.7 11.8 31 41 A I E -bc 7 47A 0 -25,-2.3 -23,-2.6 -2,-0.4 2,-0.5 -0.999 7.5-155.9-131.2 130.7 -17.1 4.0 9.4 32 42 A A E -bc 8 48A 0 15,-2.7 17,-2.9 -2,-0.4 2,-0.4 -0.930 12.5-177.1-109.6 123.7 -19.6 1.2 10.2 33 43 A I E +bc 9 49A 1 -25,-2.7 -23,-2.4 -2,-0.5 2,-0.3 -0.989 18.2 140.3-123.0 123.7 -19.5 -2.0 8.2 34 44 A N E - c 0 50A 3 15,-2.0 17,-2.1 -2,-0.4 -2,-0.0 -0.992 52.2-141.6-158.0 158.5 -21.9 -4.8 8.7 35 45 A T S S+ 0 0 0 -2,-0.3 2,-0.8 15,-0.2 -1,-0.1 0.771 87.0 88.0 -82.1 -34.1 -24.0 -7.5 7.1 36 46 A D > - 0 0 46 1,-0.2 4,-2.2 -3,-0.1 23,-0.2 -0.552 57.8-171.2 -75.5 103.9 -26.8 -6.8 9.6 37 47 A G H > S+ 0 0 8 21,-2.5 4,-2.3 -2,-0.8 -1,-0.2 0.813 83.3 58.5 -64.8 -34.7 -29.0 -4.0 8.3 38 48 A Q H > S+ 0 0 153 20,-0.6 4,-0.8 2,-0.2 -1,-0.2 0.937 109.9 43.7 -61.6 -44.2 -30.9 -3.7 11.6 39 49 A A H >> S+ 0 0 27 1,-0.2 3,-0.7 2,-0.2 4,-0.6 0.899 111.8 53.5 -68.5 -44.1 -27.7 -2.9 13.5 40 50 A L H >< S+ 0 0 8 -4,-2.2 3,-1.5 1,-0.2 -1,-0.2 0.918 101.8 59.3 -58.3 -40.7 -26.4 -0.6 10.8 41 51 A N H 3< S+ 0 0 129 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.828 108.4 46.0 -57.6 -27.5 -29.7 1.4 11.0 42 52 A L H << S+ 0 0 131 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.521 87.5 118.7 -91.3 -6.3 -28.9 2.1 14.6 43 53 A S << - 0 0 8 -3,-1.5 -28,-0.1 -4,-0.6 -11,-0.0 -0.330 55.5-152.2 -63.8 141.6 -25.2 3.0 14.0 44 54 A K + 0 0 133 3,-0.0 -1,-0.1 -2,-0.0 -14,-0.1 0.428 57.2 123.0 -89.0 -4.2 -24.2 6.5 15.0 45 55 A A - 0 0 7 1,-0.1 -14,-0.1 -5,-0.1 -16,-0.0 -0.319 63.6-139.6 -66.9 142.7 -21.4 6.5 12.3 46 56 A E S S+ 0 0 134 -16,-0.2 2,-0.4 1,-0.1 -15,-0.1 0.658 94.6 45.5 -69.6 -21.4 -21.3 9.2 9.6 47 57 A S E S-c 31 0A 27 -17,-0.9 -15,-2.7 2,-0.0 2,-0.4 -0.997 70.8-179.2-130.7 124.7 -20.4 6.5 7.0 48 58 A K E -c 32 0A 94 -2,-0.4 2,-0.5 -17,-0.2 -15,-0.2 -0.982 7.5-171.1-127.3 134.6 -22.2 3.1 6.8 49 59 A I E -c 33 0A 16 -17,-2.9 -15,-2.0 -2,-0.4 2,-0.7 -0.969 9.4-157.5-127.7 117.7 -21.6 0.3 4.5 50 60 A Q E -c 34 0A 75 -2,-0.5 2,-0.3 -17,-0.2 3,-0.3 -0.843 20.4-166.2 -90.9 118.4 -23.9 -2.7 4.3 51 61 A I + 0 0 0 -17,-2.1 21,-0.2 -2,-0.7 7,-0.1 -0.749 58.0 17.3-103.0 153.6 -22.0 -5.6 2.9 52 62 A G >> + 0 0 0 19,-0.8 4,-2.5 -2,-0.3 3,-0.5 0.731 62.2 156.5 61.7 31.7 -23.3 -9.0 1.5 53 63 A E H 3> S+ 0 0 61 -3,-0.3 4,-2.3 1,-0.2 5,-0.2 0.885 76.2 48.9 -51.6 -43.8 -27.0 -8.0 1.0 54 64 A K H 34 S+ 0 0 178 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 0.790 114.4 44.9 -69.0 -31.9 -27.3 -10.8 -1.6 55 65 A L H <4 S+ 0 0 82 -3,-0.5 -2,-0.2 1,-0.1 -1,-0.2 0.848 130.4 19.8 -79.3 -39.6 -25.8 -13.4 0.6 56 66 A T H >< S- 0 0 13 -4,-2.5 3,-1.4 3,-0.1 -2,-0.2 0.480 90.6-129.4-111.4 -9.3 -27.6 -12.6 3.8 57 67 A R T 3< S- 0 0 231 -4,-2.3 -4,-0.2 -5,-0.4 -3,-0.1 0.828 81.1 -48.0 56.9 37.5 -30.7 -10.6 2.7 58 68 A G T 3 S+ 0 0 18 1,-0.3 -21,-2.5 -6,-0.3 -20,-0.6 0.446 116.6 115.6 85.1 -0.3 -29.8 -7.9 5.3 59 69 A L S < S- 0 0 123 -3,-1.4 -1,-0.3 -23,-0.2 -3,-0.1 -0.481 71.9 -93.2 -90.0 166.0 -29.2 -10.4 8.1 60 70 A G - 0 0 30 -2,-0.2 -1,-0.2 -24,-0.1 -23,-0.0 -0.062 44.8 -93.4 -63.4 179.8 -26.0 -11.1 9.9 61 71 A A > - 0 0 13 1,-0.0 3,-1.7 -25,-0.0 6,-0.2 0.395 45.2-125.6 -83.0 -3.4 -23.6 -13.8 8.9 62 72 A G T 3 - 0 0 76 1,-0.3 -1,-0.0 5,-0.1 -3,-0.0 0.888 69.6 -59.0 58.6 38.7 -25.1 -16.4 11.4 63 73 A A T 3 S+ 0 0 40 1,-0.2 -1,-0.3 2,-0.1 33,-0.0 0.571 104.4 133.6 68.6 13.7 -21.6 -17.0 12.9 64 74 A N X> - 0 0 70 -3,-1.7 4,-1.5 1,-0.2 3,-0.8 -0.855 39.2-168.4-102.5 103.6 -20.2 -18.1 9.5 65 75 A P H 3> S+ 0 0 19 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.788 86.6 61.9 -60.1 -29.2 -16.8 -16.4 8.7 66 76 A E H 3> S+ 0 0 106 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.823 104.4 49.8 -66.6 -28.3 -16.8 -17.5 5.1 67 77 A I H <> S+ 0 0 51 -3,-0.8 4,-2.7 2,-0.2 -1,-0.2 0.909 110.0 49.7 -73.5 -42.4 -20.0 -15.4 4.6 68 78 A G H X S+ 0 0 0 -4,-1.5 4,-2.0 30,-0.2 -2,-0.2 0.923 113.6 46.6 -59.6 -44.6 -18.4 -12.4 6.3 69 79 A K H X S+ 0 0 75 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.944 113.3 47.1 -62.3 -51.0 -15.3 -12.8 4.0 70 80 A K H X S+ 0 0 98 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.907 111.6 52.6 -61.9 -38.3 -17.4 -13.2 0.8 71 81 A A H X S+ 0 0 0 -4,-2.7 4,-1.0 2,-0.2 -19,-0.8 0.904 110.9 45.5 -62.4 -44.9 -19.6 -10.3 1.7 72 82 A A H >< S+ 0 0 0 -4,-2.0 3,-0.8 1,-0.2 -2,-0.2 0.935 112.8 49.9 -66.4 -45.2 -16.6 -8.0 2.2 73 83 A E H >< S+ 0 0 80 -4,-2.7 3,-1.3 1,-0.2 -2,-0.2 0.890 108.3 54.6 -57.4 -42.2 -15.0 -9.2 -1.0 74 84 A E H 3< S+ 0 0 74 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.704 113.8 41.7 -58.4 -31.0 -18.3 -8.5 -2.8 75 85 A S T S+ 0 0 83 -3,-1.3 4,-2.9 1,-0.2 5,-0.2 0.902 72.4 52.6 -49.7 -47.5 -14.6 -4.1 -2.1 77 87 A E H > S+ 0 0 136 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.904 110.1 47.3 -59.0 -40.4 -15.3 -1.0 -4.2 78 88 A Q H > S+ 0 0 96 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.904 112.4 49.2 -70.0 -40.2 -17.6 0.5 -1.6 79 89 A I H X S+ 0 0 0 -4,-2.4 4,-1.6 -7,-0.2 -2,-0.2 0.926 111.4 50.6 -62.6 -44.0 -15.0 -0.2 1.2 80 90 A E H X S+ 0 0 52 -4,-2.9 4,-2.2 -5,-0.2 3,-0.4 0.949 109.3 51.2 -59.2 -46.5 -12.3 1.4 -1.0 81 91 A D H < S+ 0 0 110 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.908 109.6 49.6 -58.3 -42.9 -14.4 4.5 -1.6 82 92 A A H < S+ 0 0 16 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.802 116.4 41.7 -66.5 -31.6 -15.0 4.9 2.2 83 93 A I H >< S+ 0 0 2 -4,-1.6 3,-2.5 -3,-0.4 -1,-0.2 0.726 82.3 128.0 -87.3 -26.7 -11.3 4.6 3.1 84 94 A Q T 3< S+ 0 0 134 -4,-2.2 3,-0.1 1,-0.3 27,-0.0 0.001 76.2 16.5 -43.3 133.9 -9.9 6.7 0.2 85 95 A G T 3 S+ 0 0 56 1,-0.3 -82,-0.3 29,-0.3 -1,-0.3 0.197 88.1 140.7 86.1 -11.4 -7.5 9.4 1.4 86 96 A A < - 0 0 9 -3,-2.5 -1,-0.3 1,-0.1 -82,-0.2 -0.371 34.6-169.8 -65.4 140.2 -7.0 8.0 4.9 87 97 A D S S+ 0 0 67 -84,-2.3 30,-2.5 1,-0.3 2,-0.3 0.714 79.6 19.8 -93.7 -29.3 -3.5 8.2 6.3 88 98 A M E -ad 4 117A 0 -85,-2.1 -83,-1.9 28,-0.3 2,-0.4 -0.991 67.3-170.9-144.3 135.4 -4.3 5.9 9.3 89 99 A V E -ad 5 118A 0 28,-2.6 30,-2.5 -2,-0.3 2,-0.5 -0.994 7.1-161.7-130.3 128.7 -7.1 3.4 9.7 90 100 A F E -ad 6 119A 0 -85,-2.7 -83,-3.2 -2,-0.4 2,-0.5 -0.948 10.7-161.9-104.9 127.3 -8.0 1.5 12.9 91 101 A V E -ad 7 120A 0 28,-2.7 30,-2.4 -2,-0.5 2,-0.4 -0.973 9.2-173.5-114.8 123.0 -10.2 -1.6 12.3 92 102 A T E +ad 8 121A 14 -85,-2.9 -83,-2.5 -2,-0.5 2,-0.3 -0.947 14.9 144.0-122.3 139.6 -12.0 -3.0 15.3 93 103 A A E -ad 9 122A 3 28,-1.3 30,-1.6 -2,-0.4 2,-0.5 -0.986 47.8-109.7-163.2 158.1 -14.1 -6.2 15.5 94 104 A G E - d 0 123A 21 -85,-0.5 3,-0.5 -2,-0.3 7,-0.4 -0.883 36.6-140.9 -92.9 123.7 -15.0 -9.1 17.7 95 105 A M S S+ 0 0 6 28,-2.4 42,-0.2 -2,-0.5 3,-0.1 -0.649 76.6 53.7 -84.1 144.9 -13.4 -12.3 16.5 96 106 A G S S+ 0 0 0 1,-0.5 -1,-0.2 -2,-0.3 41,-0.2 0.025 89.9 79.6 123.5 -32.4 -15.5 -15.5 16.7 97 107 A G S S- 0 0 14 -3,-0.5 -1,-0.5 39,-0.1 -29,-0.0 0.104 88.7-101.5 -84.2-161.2 -18.6 -14.6 14.8 98 108 A G S > S+ 0 0 5 -34,-0.2 4,-1.8 3,-0.1 5,-0.3 0.853 107.8 40.6 -95.8 -49.5 -19.1 -14.4 11.0 99 109 A T H >>S+ 0 0 10 2,-0.2 4,-2.7 3,-0.2 5,-0.7 0.960 120.1 39.1 -74.9 -54.6 -18.9 -10.8 10.0 100 110 A G H >5S+ 0 0 6 3,-0.2 4,-1.9 1,-0.2 -5,-0.2 0.981 120.0 47.2 -56.5 -49.4 -16.0 -9.5 12.2 101 111 A T H 45S+ 0 0 8 -7,-0.4 -2,-0.2 1,-0.2 -1,-0.2 0.897 124.5 29.5 -61.0 -44.7 -14.0 -12.7 11.8 102 112 A G H <5S+ 0 0 9 -4,-1.8 4,-0.5 2,-0.1 -1,-0.2 0.848 127.7 36.7 -86.9 -39.7 -14.4 -12.9 8.0 103 113 A A H X5S+ 0 0 0 -4,-2.7 4,-2.5 -5,-0.3 3,-0.2 0.806 100.8 69.6 -90.1 -33.5 -14.7 -9.3 6.9 104 114 A A H X S+ 0 0 15 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.880 111.3 50.3 -65.0 -30.8 -9.2 -8.9 7.6 106 116 A V H > S+ 0 0 14 -4,-0.5 4,-2.4 -3,-0.2 -2,-0.2 0.935 111.7 48.0 -68.8 -45.4 -10.6 -8.0 4.1 107 117 A V H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.924 112.6 48.7 -59.4 -45.0 -11.2 -4.4 5.3 108 118 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.915 109.3 51.8 -66.4 -43.5 -7.8 -4.2 6.8 109 119 A K H X S+ 0 0 121 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.919 110.0 49.9 -62.6 -40.2 -6.0 -5.5 3.7 110 120 A I H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.951 110.4 50.3 -60.3 -48.8 -7.9 -2.9 1.6 111 121 A A H <>S+ 0 0 0 -4,-2.4 5,-2.2 2,-0.2 -2,-0.2 0.899 115.7 42.1 -58.4 -43.3 -6.8 -0.1 4.0 112 122 A K H ><5S+ 0 0 64 -4,-2.5 3,-2.6 35,-0.3 -2,-0.2 0.980 109.1 56.8 -68.6 -54.2 -3.2 -1.2 3.8 113 123 A E H 3<5S+ 0 0 106 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.838 106.1 53.8 -42.1 -41.7 -3.2 -1.8 0.1 114 124 A M T 3<5S- 0 0 68 -4,-2.1 -1,-0.3 -5,-0.2 -29,-0.3 -0.016 126.3 -97.7 -94.2 33.7 -4.3 1.8 -0.4 115 125 A G T < 5S+ 0 0 66 -3,-2.6 2,-0.2 1,-0.2 -3,-0.2 0.336 75.2 137.9 76.0 3.1 -1.4 3.2 1.7 116 126 A A < - 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