==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE, SIGNALING PROTEIN 27-FEB-09 3GFY . COMPND 2 MOLECULE: KLEBSIELLA PNEUMONIAE BLRP1; . SOURCE 2 ORGANISM_SCIENTIFIC: KLEBSIELLA PNEUMONIAE SUBSP. PNEUMONIA . AUTHOR T.BARENDS,E.HARTMANN,J.GRIESE,T.BEITLICH,N.KIRIENKO,D.RYJENK . 746 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33844.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 517 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 97 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 42 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 207 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.7 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 2 2 1 2 0 5 1 2 6 0 1 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 5 2 5 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 . 2 2 1 0 1 2 1 1 4 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 . 3 0 0 0 2 0 0 2 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 M 0 0 116 0, 0.0 54,-0.9 0, 0.0 55,-0.1 0.000 360.0 360.0 360.0 100.6 -33.7 32.6 -16.9 2 2 A L E +A 54 0A 36 80,-0.3 80,-2.9 52,-0.2 2,-0.3 -0.343 360.0 178.1 -68.7 140.9 -31.3 31.7 -19.7 3 3 A T E -AB 53 81A 5 50,-2.5 50,-1.9 78,-0.3 2,-0.4 -0.938 21.8-140.2-141.2 153.9 -30.2 28.1 -20.0 4 4 A T E -AB 52 80A 3 76,-2.6 76,-1.7 -2,-0.3 2,-0.5 -0.989 14.1-171.7-120.3 127.7 -28.0 26.0 -22.3 5 5 A L E -AB 51 79A 0 46,-3.1 46,-3.3 -2,-0.4 2,-0.4 -0.984 5.7-178.7-118.0 125.5 -28.9 22.4 -23.2 6 6 A I E +AB 50 78A 0 72,-2.4 71,-2.9 -2,-0.5 72,-1.7 -0.977 8.3 162.5-121.8 135.7 -26.4 20.2 -25.2 7 7 A Y E -AB 49 76A 7 42,-1.9 42,-2.5 -2,-0.4 2,-0.4 -0.989 25.7-145.1-144.7 156.6 -26.9 16.7 -26.4 8 8 A R E +AB 48 75A 24 67,-2.5 67,-3.4 -2,-0.3 2,-0.3 -0.937 24.7 170.6-115.3 146.2 -25.6 14.1 -28.8 9 9 A S E -A 47 0A 1 38,-2.1 38,-2.0 -2,-0.4 2,-0.3 -0.863 22.9-122.2-141.7 179.6 -27.7 11.5 -30.6 10 10 A Q E -AB 46 72A 6 62,-3.2 62,-2.9 -2,-0.3 36,-0.2 -0.951 17.3-125.2-130.4 148.1 -27.5 8.9 -33.4 11 11 A V - 0 0 21 34,-2.2 60,-0.2 -2,-0.3 3,-0.1 -0.246 30.7-106.0 -77.4 170.0 -29.3 8.3 -36.7 12 12 A H > - 0 0 30 58,-0.5 3,-1.3 1,-0.1 -1,-0.1 -0.912 33.0-165.6 -95.2 106.8 -31.0 5.2 -37.9 13 13 A P T 3 S+ 0 0 71 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.676 82.6 50.8 -71.9 -19.3 -28.5 3.8 -40.4 14 14 A D T 3 S+ 0 0 110 2,-0.1 -2,-0.0 -3,-0.1 -3,-0.0 0.218 99.3 80.0-103.3 13.0 -30.9 1.3 -42.0 15 15 A R S < S- 0 0 138 -3,-1.3 3,-0.1 1,-0.1 -3,-0.0 -0.819 96.5 -79.6-118.1 156.3 -33.7 3.7 -42.6 16 16 A P - 0 0 116 0, 0.0 -4,-0.1 0, 0.0 -2,-0.1 -0.295 62.5 -92.3 -56.4 138.5 -34.2 6.3 -45.4 17 17 A P - 0 0 128 0, 0.0 2,-0.2 0, 0.0 53,-0.0 -0.241 41.2-114.2 -58.6 133.9 -32.1 9.5 -44.7 18 18 A V - 0 0 47 52,-0.2 2,-1.2 -3,-0.1 3,-0.1 -0.477 24.8-116.2 -69.0 134.0 -33.9 12.3 -42.8 19 19 A D > + 0 0 103 -2,-0.2 4,-1.6 1,-0.2 -1,-0.1 -0.641 37.7 180.0 -70.4 98.3 -34.5 15.5 -44.8 20 20 A L H > S+ 0 0 25 -2,-1.2 4,-2.5 2,-0.2 5,-0.2 0.752 73.9 61.5 -78.7 -26.1 -32.4 17.7 -42.6 21 21 A D H > S+ 0 0 124 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.919 107.9 44.5 -62.8 -45.3 -33.0 20.8 -44.7 22 22 A A H > S+ 0 0 50 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.909 114.7 49.1 -64.1 -45.4 -36.8 20.5 -43.9 23 23 A L H X S+ 0 0 42 -4,-1.6 4,-2.9 2,-0.2 -2,-0.2 0.944 113.7 43.7 -60.5 -53.8 -36.1 19.8 -40.2 24 24 A V H X S+ 0 0 15 -4,-2.5 4,-3.4 2,-0.2 5,-0.2 0.888 114.3 49.0 -64.2 -43.2 -33.7 22.7 -39.5 25 25 A H H X S+ 0 0 139 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.899 115.8 44.6 -63.0 -40.8 -35.7 25.3 -41.4 26 26 A R H X S+ 0 0 188 -4,-2.1 4,-1.6 -5,-0.2 -2,-0.2 0.892 115.1 49.4 -66.1 -41.1 -38.8 24.1 -39.5 27 27 A A H X S+ 0 0 21 -4,-2.9 4,-3.0 2,-0.2 -2,-0.2 0.930 111.0 48.2 -63.0 -47.9 -36.8 24.1 -36.3 28 28 A S H X S+ 0 0 37 -4,-3.4 4,-1.8 1,-0.2 -1,-0.2 0.877 112.1 49.7 -61.5 -40.8 -35.4 27.6 -36.9 29 29 A S H < S+ 0 0 80 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.789 117.5 40.0 -69.8 -31.3 -38.8 29.0 -37.7 30 30 A K H X S+ 0 0 97 -4,-1.6 4,-0.7 -3,-0.2 -2,-0.2 0.845 114.6 53.0 -84.8 -37.0 -40.3 27.5 -34.5 31 31 A N H ><>S+ 0 0 6 -4,-3.0 5,-2.9 -5,-0.2 3,-0.5 0.905 99.6 57.4 -66.9 -49.1 -37.3 28.2 -32.2 32 32 A L G ><5S+ 0 0 91 -4,-1.8 3,-1.4 1,-0.2 -1,-0.2 0.860 104.1 49.1 -60.3 -44.0 -36.8 31.9 -32.7 33 33 A P G 345S+ 0 0 107 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.808 111.4 52.5 -64.7 -26.3 -40.3 33.2 -31.7 34 34 A L G <<5S- 0 0 106 -4,-0.7 -2,-0.2 -3,-0.5 -3,-0.1 0.366 122.2-109.2 -86.6 4.2 -40.0 31.1 -28.5 35 35 A G T < 5S+ 0 0 30 -3,-1.4 2,-0.5 1,-0.3 -3,-0.2 0.801 73.6 140.2 71.1 30.0 -36.7 32.6 -27.7 36 36 A I < + 0 0 2 -5,-2.9 -1,-0.3 17,-0.1 2,-0.3 -0.907 22.0 166.7-106.8 130.9 -34.8 29.5 -28.5 37 37 A T E +C 52 0A 3 15,-2.3 15,-2.7 -2,-0.5 2,-0.3 -0.843 13.8 94.9-131.1 172.4 -31.4 29.6 -30.4 38 38 A G E -C 51 0A 0 52,-1.9 55,-0.3 49,-0.5 2,-0.3 -0.896 50.4 -80.0 143.8-167.1 -28.5 27.3 -31.2 39 39 A I E -C 50 0A 0 11,-0.7 11,-2.4 -2,-0.3 2,-0.4 -0.905 15.5-142.7-135.2 160.8 -26.9 24.9 -33.7 40 40 A L E -Cd 49 94A 6 53,-3.3 55,-2.5 -2,-0.3 2,-0.4 -0.992 13.7-158.5-123.5 129.3 -26.9 21.3 -35.0 41 41 A L E -Cd 48 95A 0 7,-3.1 7,-1.5 -2,-0.4 2,-0.4 -0.912 7.9-168.9-106.7 136.5 -23.8 19.4 -36.0 42 42 A F E +Cd 47 96A 21 53,-2.8 55,-2.3 -2,-0.4 56,-0.5 -0.989 19.1 171.9-127.6 129.7 -24.0 16.4 -38.3 43 43 A N - 0 0 43 3,-1.6 4,-0.1 -2,-0.4 -1,-0.1 0.224 64.3 -95.7-116.5 10.1 -21.2 14.0 -39.0 44 44 A G S S+ 0 0 14 2,-0.4 3,-0.1 1,-0.1 52,-0.0 -0.134 120.1 37.0 102.3 -36.3 -23.2 11.5 -41.1 45 45 A L S S+ 0 0 108 1,-0.2 -34,-2.2 -35,-0.1 2,-0.3 0.558 115.0 46.0-119.4 -20.8 -23.9 9.1 -38.1 46 46 A Q E -A 10 0A 6 -36,-0.2 -3,-1.6 25,-0.0 -2,-0.4 -0.945 58.9-146.1-134.0 148.2 -24.5 11.5 -35.2 47 47 A F E -AC 9 42A 13 -38,-2.0 -38,-2.1 -2,-0.3 2,-0.3 -0.825 9.6-171.7-104.1 152.3 -26.2 14.7 -34.2 48 48 A F E -AC 8 41A 2 -7,-1.5 -7,-3.1 -2,-0.3 2,-0.4 -0.933 12.8-175.3-142.5 116.3 -24.9 17.3 -31.8 49 49 A Q E -AC 7 40A 9 -42,-2.5 -42,-1.9 -2,-0.3 2,-0.5 -0.950 17.4-163.1-124.8 133.3 -27.2 20.1 -30.8 50 50 A V E -AC 6 39A 0 -11,-2.4 -11,-0.7 -2,-0.4 2,-0.4 -0.958 14.9-170.6-107.0 126.7 -26.8 23.2 -28.6 51 51 A L E -AC 5 38A 0 -46,-3.3 -46,-3.1 -2,-0.5 2,-0.4 -0.974 2.9-171.3-119.2 134.5 -30.1 24.8 -27.4 52 52 A E E +AC 4 37A 0 -15,-2.7 -15,-2.3 -2,-0.4 2,-0.3 -0.985 36.3 82.4-126.5 136.0 -30.3 28.1 -25.7 53 53 A G E S-A 3 0A 0 -50,-1.9 -50,-2.5 -2,-0.4 -17,-0.1 -0.963 78.5 -28.6 162.9-169.8 -33.4 29.6 -24.0 54 54 A T E > -A 2 0A 58 -2,-0.3 4,-2.1 -52,-0.2 5,-0.2 -0.298 57.1-115.2 -68.4 157.0 -35.4 29.6 -20.8 55 55 A E H > S+ 0 0 72 -54,-0.9 4,-1.6 1,-0.2 -1,-0.1 0.841 117.5 49.9 -59.2 -34.8 -35.3 26.4 -18.6 56 56 A E H > S+ 0 0 130 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.886 110.5 47.2 -74.1 -42.0 -39.1 26.0 -19.3 57 57 A A H > S+ 0 0 24 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.850 114.4 47.1 -68.5 -36.7 -38.9 26.4 -23.1 58 58 A L H X S+ 0 0 3 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.852 109.1 54.0 -75.0 -36.5 -35.9 24.0 -23.4 59 59 A E H X S+ 0 0 96 -4,-1.6 4,-1.6 -5,-0.2 -2,-0.2 0.948 112.1 44.6 -59.5 -51.8 -37.6 21.3 -21.2 60 60 A S H X S+ 0 0 78 -4,-1.8 4,-1.1 2,-0.2 -2,-0.2 0.877 118.6 43.1 -60.3 -43.6 -40.7 21.3 -23.3 61 61 A L H >X S+ 0 0 20 -4,-1.7 4,-2.1 2,-0.2 3,-0.6 0.942 111.7 51.2 -70.7 -49.1 -38.7 21.3 -26.6 62 62 A F H 3X S+ 0 0 2 -4,-3.1 4,-2.5 1,-0.3 -1,-0.2 0.796 105.7 58.9 -61.0 -27.9 -36.1 18.6 -25.5 63 63 A S H 3X S+ 0 0 69 -4,-1.6 4,-1.1 -5,-0.2 -1,-0.3 0.872 107.2 45.2 -67.0 -39.5 -39.1 16.4 -24.5 64 64 A E H << S+ 0 0 110 -4,-1.1 -2,-0.2 -3,-0.6 -1,-0.2 0.852 114.1 51.2 -67.2 -36.7 -40.4 16.5 -28.0 65 65 A I H >< S+ 0 0 22 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.867 105.1 54.7 -69.4 -39.7 -36.9 15.9 -29.3 66 66 A Q H 3< S+ 0 0 86 -4,-2.5 -1,-0.2 1,-0.2 8,-0.2 0.841 110.9 45.5 -63.0 -35.0 -36.3 12.9 -27.0 67 67 A S T 3< S+ 0 0 104 -4,-1.1 -1,-0.2 -5,-0.1 -2,-0.2 0.293 84.8 119.7 -93.1 8.7 -39.5 11.2 -28.4 68 68 A D X - 0 0 39 -3,-1.2 3,-1.1 1,-0.1 -3,-0.0 -0.651 53.9-154.4 -78.2 121.8 -38.6 11.9 -32.0 69 69 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.538 82.1 81.8 -74.3 -6.7 -38.2 8.7 -34.0 70 70 A R T 3 S+ 0 0 113 -59,-0.1 -58,-0.5 -53,-0.0 2,-0.3 0.682 104.2 23.7 -71.6 -20.1 -35.9 10.3 -36.6 71 71 A H < - 0 0 18 -3,-1.1 2,-0.3 -6,-0.2 -60,-0.2 -0.898 68.8-163.1-137.7 171.5 -33.0 9.8 -34.2 72 72 A R E +B 10 0A 38 -62,-2.9 -62,-3.2 -2,-0.3 -5,-0.0 -0.903 60.3 47.6-146.8 172.1 -32.1 7.5 -31.3 73 73 A D E - 0 0 27 -2,-0.3 2,-0.6 -64,-0.2 -1,-0.2 0.930 64.9-168.6 54.2 52.8 -29.6 7.3 -28.4 74 74 A V E - 0 0 15 -8,-0.2 2,-0.5 -65,-0.2 -65,-0.2 -0.636 4.3-172.6 -73.4 116.9 -30.2 10.8 -27.1 75 75 A V E -B 8 0A 1 -67,-3.4 -67,-2.5 -2,-0.6 2,-0.2 -0.955 16.6-139.0-120.8 112.5 -27.5 11.5 -24.6 76 76 A E E +Be 7 311A 57 234,-2.5 236,-3.3 -2,-0.5 237,-0.5 -0.508 24.5 172.2 -71.7 132.6 -27.6 14.7 -22.6 77 77 A L E + 0 0 11 -71,-2.9 2,-0.3 1,-0.4 -70,-0.2 0.686 63.0 13.2-111.0 -30.5 -24.1 16.4 -22.1 78 78 A M E +B 6 0A 22 -72,-1.7 -72,-2.4 2,-0.0 -1,-0.4 -0.987 44.5 165.9-154.6 135.4 -25.0 19.7 -20.5 79 79 A R E +B 5 0A 94 -2,-0.3 2,-0.3 -74,-0.2 -74,-0.2 -0.743 33.8 137.9-149.4 103.3 -27.9 21.5 -18.8 80 80 A D E -B 4 0A 23 -76,-1.7 -76,-2.6 -2,-0.2 2,-0.1 -0.965 56.0 -92.4-146.7 153.8 -26.8 24.6 -17.0 81 81 A Y E -B 3 0A 69 -2,-0.3 2,-0.4 -78,-0.2 -78,-0.3 -0.408 46.4-143.4 -68.2 150.0 -27.9 28.2 -16.3 82 82 A S - 0 0 8 -80,-2.9 -80,-0.3 -29,-0.1 578,-0.1 -0.943 22.6-157.7-131.7 139.9 -26.3 30.7 -18.8 83 83 A A S S+ 0 0 40 -2,-0.4 2,-0.3 576,-0.3 -1,-0.1 0.838 80.2 6.0 -80.4 -37.4 -25.0 34.2 -18.7 84 84 A Y S S- 0 0 91 578,-0.0 2,-0.5 -82,-0.0 -1,-0.2 -0.965 75.8-101.0-148.3 160.1 -25.4 35.1 -22.4 85 85 A R - 0 0 56 -2,-0.3 3,-0.4 1,-0.1 -81,-0.0 -0.746 25.8-170.8 -85.8 123.4 -26.7 33.8 -25.7 86 86 A R S S+ 0 0 34 -2,-0.5 28,-4.2 28,-0.2 -1,-0.1 0.794 83.3 43.0 -84.4 -31.1 -24.0 32.4 -27.9 87 87 A F S > S+ 0 0 3 26,-0.2 3,-1.2 27,-0.2 -49,-0.5 -0.342 78.4 176.1-114.5 53.1 -26.0 31.9 -31.0 88 88 A H T 3 + 0 0 126 -3,-0.4 3,-0.1 1,-0.3 -51,-0.0 -0.315 69.5 16.1 -60.4 129.6 -28.0 35.2 -31.1 89 89 A G T 3 S+ 0 0 60 1,-0.1 2,-0.3 -57,-0.1 -1,-0.3 0.763 100.3 107.2 77.1 26.7 -30.2 35.5 -34.2 90 90 A T < - 0 0 18 -3,-1.2 -52,-1.9 1,-0.1 3,-0.2 -0.796 42.1-178.3-138.5 92.0 -30.0 31.8 -35.1 91 91 A G S S- 0 0 1 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.954 77.2 -30.4 -52.6 -56.0 -33.2 29.8 -34.5 92 92 A M - 0 0 6 -55,-0.1 2,-0.3 -41,-0.1 -1,-0.3 -0.931 65.9-179.6-161.9 147.1 -31.5 26.7 -35.6 93 93 A R - 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0 0 101 0, 0.0 -3,-0.2 0, 0.0 -2,-0.2 0.727 34.2-163.3 -84.0 159.3 -19.7 -25.1 -2.1 226 231 A L > < + 0 0 4 -5,-0.7 3,-0.7 -4,-0.2 2,-0.5 0.897 24.6 171.2 -74.0 -41.4 -18.0 -21.9 -3.2 227 232 A G T 3 - 0 0 48 1,-0.2 -1,-0.2 -5,-0.2 267,-0.0 -0.561 66.8 -10.7 75.5-117.3 -15.4 -23.6 -5.4 228 233 A K T 3 S+ 0 0 141 -2,-0.5 268,-0.8 267,-0.0 2,-0.3 -0.006 110.7 104.8-108.5 26.4 -13.3 -21.2 -7.5 229 234 A H < - 0 0 62 -3,-0.7 -48,-0.2 266,-0.1 -49,-0.1 -0.769 64.0-122.2-112.2 153.4 -15.5 -18.1 -6.8 230 235 A Q E -j 181 0C 4 -50,-1.5 -48,-1.6 -2,-0.3 2,-0.3 -0.240 18.3-149.6 -84.3 176.2 -14.9 -15.1 -4.6 231 236 A L E -jk 182 264C 0 32,-1.2 34,-2.6 -50,-0.2 2,-0.6 -0.818 2.8-157.5-156.0 110.1 -17.0 -13.7 -1.7 232 237 A A E +j 183 0C 2 -50,-1.0 -48,-4.0 -2,-0.3 2,-0.2 -0.942 9.3 178.6 -86.1 128.0 -17.7 -10.3 -0.2 233 238 A I - 0 0 0 -2,-0.6 34,-2.2 32,-0.5 2,-0.3 -0.513 27.4-132.1 -5.5 126.2 -18.7 -9.8 2.9 234 239 A N - 0 0 41 -50,-0.4 2,-0.3 -2,-0.2 -48,-0.1 -0.865 26.0-172.3-103.3 144.8 -19.1 -6.1 3.8 235 240 A L - 0 0 21 32,-2.8 -28,-0.0 -2,-0.3 -24,-0.0 -1.000 24.7-123.7-144.0 142.6 -17.6 -4.7 7.0 236 241 A L > - 0 0 74 -2,-0.3 4,-0.7 1,-0.1 3,-0.3 -0.546 28.2-125.6 -71.6 143.6 -17.7 -1.5 9.0 237 242 A P H >> S+ 0 0 64 0, 0.0 4,-0.8 0, 0.0 3,-0.8 0.876 110.9 56.7 -57.5 -38.6 -14.2 -0.1 9.7 238 243 A G H 3> S+ 0 0 12 1,-0.2 4,-2.0 2,-0.2 3,-0.5 0.826 98.2 59.5 -62.5 -35.5 -15.0 -0.0 13.5 239 244 A S H 34 S+ 0 0 0 -3,-0.3 4,-0.4 1,-0.2 -1,-0.2 0.737 104.3 52.4 -65.8 -23.3 -15.8 -3.8 13.5 240 245 A L H << S+ 0 0 9 -3,-0.8 6,-0.3 -4,-0.7 -1,-0.2 0.718 113.1 42.2 -83.2 -24.7 -12.2 -4.3 12.3 241 246 A Y H < S+ 0 0 76 -4,-0.8 -2,-0.2 -3,-0.5 -1,-0.1 0.738 91.5 87.7 -89.4 -26.4 -10.7 -2.3 15.1 242 247 A H S < S+ 0 0 78 -4,-2.0 -2,-0.1 -5,-0.1 -1,-0.1 0.795 97.9 30.0 -44.3 -44.5 -13.0 -3.7 17.8 243 248 A H S > S- 0 0 71 -4,-0.4 3,-1.3 -3,-0.1 4,-0.2 -0.942 73.8-136.8-118.3 143.0 -10.6 -6.6 18.4 244 249 A P T 3 S+ 0 0 136 0, 0.0 3,-0.2 0, 0.0 4,-0.1 0.768 110.2 41.8 -64.7 -26.9 -6.8 -6.6 18.1 245 250 A D T 3> S+ 0 0 95 1,-0.2 4,-2.6 2,-0.1 5,-0.2 -0.057 76.2 124.0-109.0 31.9 -7.0 -10.0 16.4 246 251 A A H <> S+ 0 0 1 -3,-1.3 4,-2.2 -6,-0.3 5,-0.2 0.899 78.6 45.6 -57.4 -45.4 -10.0 -9.3 14.2 247 252 A V H > S+ 0 0 18 -7,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.907 114.1 49.7 -63.5 -43.1 -8.1 -10.2 11.0 248 253 A G H > S+ 0 0 31 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.822 109.9 51.6 -63.6 -33.7 -6.8 -13.3 12.8 249 254 A W H X S+ 0 0 68 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.891 108.5 49.3 -70.2 -42.8 -10.3 -14.2 13.9 250 255 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.905 109.7 54.6 -60.8 -43.2 -11.7 -13.8 10.3 251 256 A M H X S+ 0 0 23 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.956 110.1 44.4 -50.5 -57.7 -8.9 -16.1 9.2 252 257 A D H X S+ 0 0 112 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.862 113.4 52.6 -57.8 -39.0 -9.8 -18.8 11.7 253 258 A S H < S+ 0 0 20 -4,-2.2 4,-0.4 2,-0.2 -1,-0.2 0.881 112.2 41.7 -69.4 -42.0 -13.5 -18.5 10.8 254 259 A L H <>S+ 0 0 0 -4,-2.5 5,-2.8 2,-0.2 3,-0.4 0.857 114.5 51.6 -75.2 -35.8 -13.2 -18.9 7.0 255 260 A L H ><5S+ 0 0 77 -4,-2.3 3,-1.4 -5,-0.3 -2,-0.2 0.873 107.0 53.5 -67.2 -37.9 -10.6 -21.7 7.3 256 261 A A T 3<5S+ 0 0 93 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.650 107.6 53.1 -68.4 -16.0 -12.9 -23.5 9.7 257 262 A A T 3 5S- 0 0 24 -3,-0.4 -1,-0.3 -4,-0.4 -2,-0.2 0.366 123.7-107.8 -97.9 1.3 -15.5 -23.1 6.9 258 263 A G T < 5S+ 0 0 66 -3,-1.4 -3,-0.2 1,-0.3 2,-0.2 0.749 75.8 130.9 80.5 26.1 -13.2 -24.6 4.4 259 264 A L < - 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