==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE 09-OCT-07 2RHO . COMPND 2 MOLECULE: CELL DIVISION PROTEIN FTSZ; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR S.LOVELL,Z.HALLORAN,K.HJERRILD,D.SHERIDAN,A.BURGIN, . 607 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25769.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 471 77.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 87 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 6.4 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 . 1 0.2 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 . 42 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 204 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.2 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 4 2 1 1 2 1 3 0 0 2 2 3 0 1 0 1 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 2 3 3 2 2 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 3 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 1 1 0 2 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 12 A A 0 0 99 0, 0.0 2,-0.9 0, 0.0 84,-0.1 0.000 360.0 360.0 360.0 -47.4 65.4 26.8 52.9 2 13 A S + 0 0 26 82,-0.2 84,-2.2 25,-0.1 85,-2.0 -0.860 360.0 171.7 -93.6 95.2 67.5 27.9 56.0 3 14 A I E -a 87 0A 1 -2,-0.9 25,-2.7 23,-0.5 2,-0.4 -0.938 10.9-167.6-109.4 120.8 70.0 25.0 56.3 4 15 A K E -ab 88 28A 30 83,-3.0 85,-3.0 -2,-0.5 2,-0.5 -0.913 11.4-164.0-113.0 136.6 72.8 25.3 58.7 5 16 A V E -ab 89 29A 0 23,-2.2 25,-2.2 -2,-0.4 2,-0.5 -0.986 13.3-171.0-115.8 120.2 75.9 23.1 59.0 6 17 A I E -ab 90 30A 0 83,-3.0 85,-2.0 -2,-0.5 2,-0.3 -0.955 7.7-155.9-123.6 112.6 77.7 23.6 62.3 7 18 A G E -ab 91 31A 0 23,-2.5 25,-1.8 -2,-0.5 2,-0.5 -0.715 9.2-153.9 -91.2 142.3 81.1 22.1 62.9 8 19 A V E > -ab 92 32A 1 83,-2.5 4,-0.8 -2,-0.3 85,-0.5 -0.938 51.2 -21.0-129.0 117.7 82.1 21.4 66.5 9 20 A G H > S- 0 0 4 23,-2.3 4,-2.5 -2,-0.5 5,-0.2 -0.196 101.6 -47.0 76.4-176.7 85.7 21.2 67.6 10 21 A G H > S+ 0 0 38 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.922 135.5 44.0 -55.9 -57.6 88.8 20.5 65.5 11 22 A G H > S+ 0 0 34 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.935 115.8 47.4 -58.1 -49.1 87.6 17.6 63.6 12 23 A G H X S+ 0 0 0 -4,-0.8 4,-1.9 1,-0.2 -1,-0.2 0.865 112.0 50.0 -61.3 -40.4 84.2 19.0 62.8 13 24 A N H X S+ 0 0 8 -4,-2.5 4,-1.4 2,-0.2 30,-0.3 0.853 108.3 52.9 -69.4 -32.6 85.6 22.4 61.7 14 25 A N H X S+ 0 0 73 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.901 108.5 50.9 -68.6 -38.8 88.1 20.6 59.4 15 26 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.880 107.2 52.7 -63.0 -40.1 85.1 18.8 57.9 16 27 A V H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.830 106.9 54.7 -63.8 -30.0 83.3 22.0 57.4 17 28 A N H X S+ 0 0 8 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.948 106.0 49.6 -67.3 -48.6 86.5 23.2 55.6 18 29 A R H X S+ 0 0 24 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.924 111.1 51.9 -57.6 -40.9 86.4 20.3 53.2 19 30 A M H <>S+ 0 0 0 -4,-2.2 5,-2.1 1,-0.2 3,-0.2 0.912 109.8 47.1 -57.6 -46.8 82.8 21.2 52.5 20 31 A I H ><5S+ 0 0 45 -4,-1.9 3,-1.4 1,-0.2 -1,-0.2 0.894 111.0 52.9 -63.8 -37.2 83.6 24.8 51.8 21 32 A E H 3<5S+ 0 0 65 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.732 108.2 50.0 -71.5 -25.5 86.5 23.7 49.5 22 33 A N T 3<5S- 0 0 65 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.068 111.5-126.2 -98.6 21.3 84.1 21.4 47.5 23 34 A E T < 5 - 0 0 144 -3,-1.4 2,-0.2 1,-0.1 -3,-0.2 0.819 34.6-172.8 40.9 44.6 81.8 24.4 47.2 24 35 A V < - 0 0 10 -5,-2.1 3,-0.2 1,-0.1 2,-0.2 -0.575 17.8-150.5 -62.2 134.1 78.9 22.4 48.7 25 36 A Q + 0 0 145 -2,-0.2 166,-0.1 1,-0.1 167,-0.1 -0.506 59.7 46.0-107.5 174.3 75.9 24.8 48.2 26 37 A G S S+ 0 0 40 1,-0.2 -23,-0.5 -2,-0.2 2,-0.3 0.425 91.1 97.2 81.0 1.9 72.6 25.8 49.8 27 38 A V - 0 0 15 -3,-0.2 2,-0.5 -25,-0.1 -23,-0.2 -0.946 64.6-137.3-130.8 140.6 74.0 25.8 53.3 28 39 A E E -b 4 0A 88 -25,-2.7 -23,-2.2 -2,-0.3 2,-0.3 -0.884 28.5-142.0 -92.9 126.9 75.2 28.4 55.8 29 40 A Y E -b 5 0A 29 -2,-0.5 17,-1.1 -25,-0.2 2,-0.4 -0.679 18.6-176.8 -93.5 141.2 78.4 27.3 57.7 30 41 A I E -bc 6 46A 4 -25,-2.2 -23,-2.5 -2,-0.3 2,-0.4 -0.996 10.7-154.7-134.9 136.5 79.2 27.9 61.4 31 42 A A E -bc 7 47A 0 15,-2.3 17,-3.4 -2,-0.4 2,-0.4 -0.954 11.2-171.2-117.2 136.3 82.3 27.0 63.2 32 43 A V E +bc 8 48A 0 -25,-1.8 -23,-2.3 -2,-0.4 2,-0.3 -0.978 15.1 148.9-128.1 131.5 82.4 26.4 66.9 33 44 A N E - c 0 49A 6 15,-1.9 17,-1.9 -2,-0.4 -2,-0.0 -0.981 45.5-147.5-158.3 154.2 85.4 25.9 69.2 34 45 A T S S+ 0 0 0 -2,-0.3 2,-0.8 15,-0.2 25,-0.7 0.771 91.1 79.6 -83.1 -31.5 86.7 26.5 72.7 35 46 A D B > -G 58 0B 51 23,-0.3 4,-2.1 1,-0.2 23,-0.2 -0.689 63.9-167.5 -78.8 104.4 90.2 26.9 71.1 36 47 A A H > S+ 0 0 36 21,-1.9 4,-1.9 -2,-0.8 -1,-0.2 0.838 84.7 56.6 -63.0 -36.6 90.5 30.4 69.7 37 48 A Q H 4 S+ 0 0 170 20,-0.6 4,-0.5 1,-0.2 -1,-0.2 0.971 111.6 41.1 -59.1 -59.6 93.7 29.5 67.7 38 49 A A H >4 S+ 0 0 33 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.852 107.7 64.0 -55.2 -38.6 92.1 26.6 65.9 39 50 A L H >< S+ 0 0 11 -4,-2.1 3,-2.7 1,-0.3 -1,-0.2 0.956 96.4 56.6 -56.8 -48.7 89.0 28.7 65.4 40 51 A N T 3< S+ 0 0 132 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.648 96.8 64.6 -60.4 -13.9 90.8 31.3 63.2 41 52 A L T < S+ 0 0 135 -3,-1.4 -1,-0.3 -4,-0.5 2,-0.2 0.428 82.6 106.1 -84.1 2.1 91.9 28.5 60.9 42 53 A S < - 0 0 9 -3,-2.7 -28,-0.1 -4,-0.2 -11,-0.1 -0.553 60.4-154.8 -79.0 147.8 88.3 27.9 59.9 43 54 A K + 0 0 116 -30,-0.3 -1,-0.1 -2,-0.2 -14,-0.1 0.365 57.6 119.1 -98.4 1.9 87.0 29.0 56.5 44 55 A A - 0 0 2 1,-0.1 -14,-0.1 -31,-0.1 -2,-0.1 -0.392 67.1-134.2 -69.6 146.3 83.4 29.4 57.8 45 56 A E S S+ 0 0 186 -16,-0.2 2,-0.5 1,-0.1 -15,-0.1 0.937 94.8 52.7 -65.7 -50.2 81.9 32.8 57.6 46 57 A V E S-c 30 0A 64 -17,-1.1 -15,-2.3 2,-0.0 2,-0.5 -0.808 70.8-173.7 -92.6 125.2 80.5 32.7 61.1 47 58 A K E -c 31 0A 80 -2,-0.5 2,-0.5 -17,-0.2 -15,-0.2 -0.984 2.8-168.2-125.6 120.6 83.1 31.7 63.8 48 59 A M E -c 32 0A 21 -17,-3.4 -15,-1.9 -2,-0.5 2,-0.6 -0.946 9.1-160.3-120.7 115.7 81.8 31.2 67.3 49 60 A Q E -c 33 0A 83 -2,-0.5 3,-0.3 -17,-0.2 2,-0.3 -0.874 18.9-162.2 -93.6 120.8 84.1 30.9 70.3 50 61 A I + 0 0 0 -17,-1.9 7,-0.2 -2,-0.6 21,-0.2 -0.718 62.1 21.0-105.8 153.5 82.3 29.2 73.1 51 62 A G >> + 0 0 0 19,-0.9 4,-2.6 -2,-0.3 5,-0.5 0.914 64.2 164.4 59.6 44.2 83.2 29.1 76.8 52 63 A A H >5S+ 0 0 48 -3,-0.3 4,-2.2 1,-0.2 6,-0.1 0.932 78.1 40.2 -51.6 -50.2 85.3 32.3 76.7 53 64 A K H 45S+ 0 0 117 2,-0.2 318,-0.3 1,-0.2 319,-0.2 0.857 118.0 46.3 -70.1 -39.0 85.2 32.6 80.5 54 65 A L H 45S+ 0 0 8 1,-0.1 -2,-0.2 317,-0.1 -1,-0.2 0.882 132.6 15.5 -75.5 -39.9 85.6 28.9 81.3 55 66 A T H ><5S- 0 0 13 -4,-2.6 3,-1.8 -5,-0.1 -3,-0.2 0.557 84.2-140.1-114.8 -13.1 88.4 28.1 78.9 56 67 A R T 3< - 0 0 9 -3,-0.1 3,-2.0 -2,-0.1 6,-0.3 0.133 53.2-123.9-107.1 15.0 88.7 22.0 76.6 61 72 A G T 3 - 0 0 74 -3,-0.4 -2,-0.1 1,-0.3 5,-0.0 0.794 66.5 -61.3 42.8 43.1 91.9 19.8 77.3 62 73 A A T 3 S+ 0 0 43 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.680 105.6 126.6 64.7 23.9 90.3 16.6 76.2 63 74 A N X> - 0 0 20 -3,-2.0 4,-1.5 1,-0.1 3,-1.1 -0.918 48.4-159.5-116.1 105.7 87.5 16.8 78.9 64 75 A P H 3> S+ 0 0 28 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.783 90.7 65.6 -54.4 -26.7 83.9 16.5 77.6 65 76 A E H 3> S+ 0 0 24 294,-0.3 4,-2.9 1,-0.2 5,-0.2 0.921 103.2 46.8 -62.2 -39.7 82.6 18.2 80.8 66 77 A V H <> S+ 0 0 19 -3,-1.1 4,-2.5 -6,-0.3 -1,-0.2 0.886 110.8 51.2 -67.9 -42.7 84.4 21.4 79.8 67 78 A G H X S+ 0 0 0 -4,-1.5 4,-2.2 30,-0.3 -2,-0.2 0.935 112.8 47.2 -58.1 -47.3 83.1 21.2 76.2 68 79 A K H X S+ 0 0 70 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.959 115.5 43.4 -57.9 -53.6 79.5 20.7 77.6 69 80 A K H X S+ 0 0 58 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.825 110.1 57.8 -67.7 -24.5 79.9 23.6 80.1 70 81 A A H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -19,-0.9 0.961 108.8 44.8 -65.5 -49.8 81.5 25.8 77.4 71 82 A A H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.2 7,-0.2 0.862 112.1 53.0 -63.3 -35.1 78.5 25.4 75.2 72 83 A E H >< S+ 0 0 60 -4,-2.2 3,-1.6 1,-0.2 4,-0.2 0.925 106.1 52.9 -65.7 -40.9 76.2 26.0 78.3 73 84 A E H 3< S+ 0 0 52 -4,-2.5 3,-0.3 1,-0.3 -1,-0.2 0.884 115.1 42.1 -58.9 -37.4 78.1 29.3 79.0 74 85 A S T 3X S+ 0 0 8 -4,-1.7 4,-2.1 1,-0.2 3,-0.4 0.190 78.3 125.3 -97.3 16.3 77.4 30.3 75.4 75 86 A K H <> S+ 0 0 106 -3,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.854 74.3 46.2 -36.1 -55.0 73.8 29.0 75.3 76 87 A E H > S+ 0 0 116 -3,-0.3 4,-2.5 -4,-0.2 -1,-0.2 0.877 110.5 51.0 -70.4 -38.1 72.3 32.4 74.2 77 88 A Q H > S+ 0 0 109 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.880 109.1 52.1 -64.8 -35.7 74.9 33.0 71.4 78 89 A I H X S+ 0 0 1 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.916 109.1 51.4 -66.4 -40.2 74.2 29.5 70.0 79 90 A E H >X S+ 0 0 74 -4,-1.9 4,-1.1 -5,-0.2 3,-0.7 0.953 110.7 47.1 -59.1 -51.1 70.5 30.3 70.0 80 91 A E H >< S+ 0 0 108 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.919 110.0 53.1 -56.5 -46.9 71.0 33.6 68.1 81 92 A A H 3< S+ 0 0 25 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.785 116.8 38.7 -58.6 -27.5 73.3 31.9 65.6 82 93 A L H X< S+ 0 0 1 -4,-1.3 3,-1.8 -3,-0.7 -1,-0.2 0.476 81.1 130.5-106.1 -6.0 70.7 29.2 64.8 83 94 A K T << S+ 0 0 126 -4,-1.1 -3,-0.0 -3,-0.8 27,-0.0 -0.179 75.0 18.5 -54.6 138.6 67.5 31.3 64.9 84 95 A G T 3 S+ 0 0 60 1,-0.3 2,-0.3 29,-0.2 -1,-0.3 0.489 85.8 145.6 82.8 3.8 65.3 30.7 61.8 85 96 A A < - 0 0 12 -3,-1.8 -1,-0.3 1,-0.2 -82,-0.2 -0.577 32.4-173.1 -77.2 134.4 66.9 27.4 60.8 86 97 A D S S+ 0 0 74 -84,-2.2 30,-2.9 1,-0.3 2,-0.4 0.693 81.0 22.8 -84.4 -32.2 64.6 24.8 59.3 87 98 A M E -ad 3 116A 1 -85,-2.0 -83,-3.0 28,-0.3 2,-0.4 -0.998 65.1-172.9-145.0 135.6 67.4 22.3 59.3 88 99 A V E -ad 4 117A 1 28,-3.0 30,-2.3 -2,-0.4 2,-0.4 -0.996 5.3-165.0-132.6 122.0 70.6 22.0 61.3 89 100 A F E -ad 5 118A 0 -85,-3.0 -83,-3.0 -2,-0.4 2,-0.5 -0.922 7.6-161.4-101.7 136.8 73.5 19.5 60.8 90 101 A V E -ad 6 119A 0 28,-2.0 30,-2.5 -2,-0.4 2,-0.4 -0.971 10.8-173.7-121.9 110.9 76.0 19.2 63.7 91 102 A T E +ad 7 120A 1 -85,-2.0 -83,-2.5 -2,-0.5 2,-0.3 -0.893 15.8 141.6-108.1 145.2 79.4 17.6 62.7 92 103 A A E -ad 8 121A 0 28,-1.2 30,-1.3 -2,-0.4 2,-0.6 -0.980 50.1-113.0-169.9 156.9 82.1 16.6 65.0 93 104 A G E > - d 0 122A 25 -85,-0.5 3,-0.5 -2,-0.3 2,-0.3 -0.906 40.1-138.4 -94.8 123.6 84.7 14.0 65.7 94 105 A M T 3 S+ 0 0 6 28,-2.3 42,-0.2 -2,-0.6 3,-0.1 -0.675 74.2 62.8 -86.5 140.8 83.7 12.3 68.9 95 106 A G T 3 S+ 0 0 2 1,-0.4 -1,-0.2 -2,-0.3 40,-0.2 -0.088 84.8 70.4 142.4 -39.3 86.5 11.5 71.4 96 107 A G S < S- 0 0 12 -3,-0.5 -1,-0.4 39,-0.1 4,-0.1 0.196 89.0 -93.0 -87.4-149.0 88.0 14.8 72.6 97 108 A G S > S+ 0 0 6 -34,-0.1 4,-1.2 3,-0.1 5,-0.3 0.857 109.7 40.4-103.1 -46.6 86.5 17.6 74.7 98 109 A T H >>S+ 0 0 14 3,-0.2 4,-2.3 2,-0.2 5,-0.6 0.927 120.0 41.9 -77.9 -43.5 84.9 20.2 72.6 99 110 A G H >5S+ 0 0 6 1,-0.2 4,-2.2 3,-0.2 -5,-0.1 0.987 118.8 43.6 -63.8 -57.5 83.2 17.9 70.1 100 111 A T H 45S+ 0 0 6 -7,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.803 125.1 33.7 -56.9 -36.3 82.0 15.3 72.5 101 112 A G H X5S+ 0 0 7 -4,-1.2 4,-0.6 2,-0.1 -1,-0.2 0.863 124.2 36.5 -94.9 -43.3 80.8 17.8 75.1 102 113 A A H X5S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.3 5,-0.3 0.810 101.9 70.7 -84.1 -34.1 79.5 20.8 73.1 103 114 A A H X S+ 0 0 17 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.912 111.5 50.5 -57.5 -42.3 75.0 17.5 72.1 105 116 A V H X S+ 0 0 21 -4,-0.6 4,-2.1 1,-0.2 -2,-0.2 0.904 113.2 45.4 -61.1 -42.1 74.2 20.9 73.7 106 117 A I H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.879 111.9 52.0 -71.3 -37.3 74.2 22.6 70.4 107 118 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.3 -2,-0.2 0.911 110.3 48.8 -62.7 -41.4 72.1 19.8 68.9 108 119 A Q H X S+ 0 0 70 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.891 108.6 52.6 -70.1 -38.8 69.5 20.2 71.7 109 120 A I H X S+ 0 0 10 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.951 110.6 49.4 -59.9 -47.1 69.4 23.9 71.3 110 121 A A H <>S+ 0 0 0 -4,-2.2 5,-2.1 2,-0.2 -2,-0.2 0.892 112.3 46.0 -59.7 -45.1 68.7 23.4 67.6 111 122 A K H ><5S+ 0 0 61 -4,-2.3 3,-2.6 35,-0.3 -1,-0.2 0.940 109.8 54.9 -61.4 -46.9 65.9 20.8 68.2 112 123 A D H 3<5S+ 0 0 119 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.858 103.6 55.9 -56.0 -35.0 64.4 23.0 70.9 113 124 A L T 3<5S- 0 0 76 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.416 124.0-105.2 -77.8 3.5 64.2 25.8 68.3 114 125 A G T < 5S+ 0 0 62 -3,-2.6 -3,-0.2 1,-0.3 -2,-0.1 0.518 71.2 146.2 84.8 7.2 62.2 23.5 66.0 115 126 A A < - 0 0 6 -5,-2.1 2,-0.7 1,-0.1 -1,-0.3 -0.460 60.3-113.7 -73.7 144.3 65.0 22.7 63.5 116 127 A L E -d 87 0A 13 -30,-2.9 -28,-3.0 -2,-0.1 2,-0.6 -0.775 44.5-155.0 -71.4 115.6 65.2 19.3 61.9 117 128 A T E +d 88 0A 0 -2,-0.7 31,-3.0 -30,-0.2 32,-1.4 -0.899 19.8 177.6-111.1 110.7 68.4 18.3 63.6 118 129 A V E -de 89 149A 1 -30,-2.3 -28,-2.0 -2,-0.6 2,-0.4 -0.942 14.0-153.2-112.1 132.1 70.7 15.7 62.0 119 130 A G E -de 90 150A 0 30,-3.2 32,-3.2 -2,-0.4 2,-0.4 -0.878 9.0-172.6-102.1 141.8 74.1 14.8 63.6 120 131 A V E +de 91 151A 0 -30,-2.5 -28,-1.2 -2,-0.4 2,-0.3 -0.928 25.3 151.4-135.4 106.1 77.0 13.5 61.6 121 132 A V E -de 92 152A 0 30,-2.5 32,-2.9 -2,-0.4 2,-0.4 -0.879 35.8-127.4-136.8 158.7 79.9 12.3 63.8 122 133 A T E -de 93 153A 7 -30,-1.3 -28,-2.3 -2,-0.3 30,-0.0 -0.880 11.8-138.3-108.8 145.0 82.8 9.9 63.9 123 134 A R E - e 0 154A 75 30,-2.6 32,-2.0 -2,-0.4 33,-0.2 -0.803 45.3-102.8 -89.6 140.0 83.7 7.3 66.4 124 135 A P - 0 0 4 0, 0.0 32,-0.3 0, 0.0 -1,-0.1 -0.195 34.8 -90.3 -75.1 160.8 87.5 7.4 66.8 125 136 A F > - 0 0 0 30,-0.2 3,-2.1 1,-0.1 4,-0.2 -0.372 32.9-123.3 -59.5 140.7 90.2 5.1 65.4 126 137 A T G > S+ 0 0 90 1,-0.3 3,-1.9 2,-0.2 -1,-0.1 0.843 110.0 67.3 -53.1 -36.0 91.0 2.2 67.7 127 138 A F G 3 S+ 0 0 103 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.531 84.4 73.8 -65.0 -5.9 94.7 3.3 67.6 128 139 A E G < S- 0 0 55 -3,-2.1 4,-0.3 1,-0.2 -1,-0.3 0.547 109.5-105.0 -85.3 -10.6 93.7 6.5 69.5 129 140 A G <> - 0 0 32 -3,-1.9 4,-1.8 -4,-0.2 3,-0.4 0.052 24.1 -81.4 104.9 153.9 93.3 4.5 72.8 130 141 A R H > S+ 0 0 176 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.781 122.6 58.9 -60.8 -30.3 90.5 3.1 75.0 131 142 A K H > S+ 0 0 135 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.895 105.1 48.2 -69.6 -41.1 90.0 6.4 76.8 132 143 A R H > S+ 0 0 90 -3,-0.4 4,-2.3 -4,-0.3 -2,-0.2 0.896 112.6 50.9 -62.5 -40.1 89.1 8.2 73.5 133 144 A Q H X S+ 0 0 31 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.903 110.7 48.2 -61.7 -41.6 86.7 5.3 72.7 134 145 A L H X S+ 0 0 114 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.940 112.6 46.5 -66.3 -46.8 85.1 5.6 76.1 135 146 A Q H X S+ 0 0 40 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.890 113.2 51.2 -61.7 -41.0 84.7 9.4 75.9 136 147 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 -42,-0.2 -2,-0.2 0.928 106.4 52.7 -62.0 -51.0 83.3 9.0 72.3 137 148 A A H X S+ 0 0 43 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.918 108.8 52.7 -49.8 -44.5 80.7 6.3 73.3 138 149 A G H X S+ 0 0 43 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.938 112.5 42.5 -61.1 -48.0 79.5 8.7 76.0 139 150 A G H X S+ 0 0 4 -4,-2.0 4,-3.0 2,-0.2 -1,-0.2 0.791 108.0 59.8 -70.2 -31.5 79.0 11.6 73.6 140 151 A I H X S+ 0 0 3 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.978 109.6 42.8 -61.0 -48.6 77.5 9.4 70.9 141 152 A S H X S+ 0 0 64 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.923 113.3 52.4 -66.1 -39.6 74.6 8.4 73.3 142 153 A A H < S+ 0 0 45 -4,-2.0 3,-0.4 -5,-0.2 4,-0.4 0.945 109.9 50.2 -55.4 -49.6 74.3 12.0 74.5 143 154 A M H >X S+ 0 0 0 -4,-3.0 3,-1.6 1,-0.2 4,-0.7 0.858 103.2 59.2 -53.4 -44.7 74.0 13.1 70.9 144 155 A K H >< S+ 0 0 44 -4,-2.1 3,-0.6 1,-0.3 -1,-0.2 0.859 103.9 50.9 -59.9 -36.8 71.3 10.5 70.1 145 156 A E T 3< S+ 0 0 136 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.607 113.8 47.4 -68.9 -14.1 69.0 12.0 72.8 146 157 A A T <4 S+ 0 0 4 -3,-1.6 -35,-0.3 -4,-0.4 2,-0.3 0.426 105.6 59.5-113.0 -2.1 69.6 15.5 71.2 147 158 A V << - 0 0 0 -4,-0.7 -29,-0.2 -3,-0.6 3,-0.2 -0.796 69.6-131.8-123.6 164.8 69.1 14.9 67.5 148 159 A D S S+ 0 0 45 -31,-3.0 2,-0.3 1,-0.3 -30,-0.2 0.874 101.6 5.9 -77.5 -42.4 66.4 13.7 65.1 149 160 A T E -e 118 0A 3 -32,-1.4 -30,-3.2 58,-0.1 2,-0.6 -0.990 65.1-158.0-141.0 135.1 69.0 11.4 63.4 150 161 A L E -e 119 0A 0 58,-0.5 63,-3.3 61,-0.4 2,-0.6 -0.935 6.4-161.4-112.3 110.5 72.6 10.6 64.4 151 162 A I E -ef 120 213A 0 -32,-3.2 -30,-2.5 -2,-0.6 2,-0.6 -0.815 12.3-163.2 -85.7 123.5 74.8 9.3 61.6 152 163 A V E -e 121 0A 7 61,-2.4 63,-0.2 -2,-0.6 -30,-0.2 -0.948 5.6-163.4-119.1 114.6 77.8 7.6 63.2 153 164 A I E -e 122 0A 2 -32,-2.9 -30,-2.6 -2,-0.6 2,-0.9 -0.833 14.2-142.0 -97.4 117.9 80.9 6.9 61.1 154 165 A P E >> -e 123 0A 12 0, 0.0 3,-1.3 0, 0.0 4,-0.6 -0.742 7.3-153.0 -84.4 111.6 83.3 4.3 62.5 155 166 A N H >> S+ 0 0 5 -32,-2.0 3,-1.3 -2,-0.9 4,-0.8 0.801 87.6 69.5 -54.2 -33.1 86.8 5.6 61.7 156 167 A D H >4 S+ 0 0 55 -32,-0.3 3,-1.2 1,-0.3 4,-0.3 0.889 94.3 57.1 -52.3 -39.3 88.3 2.1 61.7 157 168 A R H X4 S+ 0 0 85 -3,-1.3 3,-1.4 1,-0.3 -1,-0.3 0.754 90.1 71.4 -69.9 -21.6 86.4 1.3 58.6 158 169 A I H XX S+ 0 0 0 -3,-1.3 3,-2.2 -4,-0.6 4,-1.7 0.897 90.6 61.5 -56.7 -36.2 88.0 4.2 56.7 159 170 A L T << S+ 0 0 60 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.712 95.8 60.1 -64.9 -20.4 91.2 2.1 56.8 160 171 A E T <4 S+ 0 0 103 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.294 111.4 40.9 -85.3 8.8 89.4 -0.5 54.8 161 172 A I T <4 S+ 0 0 76 -3,-2.2 -2,-0.2 1,-0.2 -3,-0.1 0.700 110.7 50.3-116.8 -65.8 88.9 2.1 52.0 162 173 A V S < S- 0 0 27 -4,-1.7 -1,-0.2 1,-0.1 9,-0.0 -0.307 103.1 -89.6 -63.4 159.8 92.1 4.0 51.7 163 174 A D > - 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