==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-AUG-08 2ZQ7 . COMPND 2 MOLECULE: BETA-LACTAMASE TOHO-1; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR T.SHIMAMURA,Y.NITANAI,T.UCHIYAMA,H.AGO,H.MATSUZAWA,M.MIYANO . 261 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11336.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 70.5 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 . 40 15.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 5 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 30.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.9 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 0 0 0 0 0 0 2 1 4 1 0 0 0 0 0 0 0 0 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 . 0 1 1 0 1 0 1 1 1 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 . 2 0 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 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 27 A N 0 0 102 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.5 9.1 -1.0 8.6 2 28 A S > - 0 0 57 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.215 360.0-101.8 -65.8 167.8 9.7 -3.2 5.6 3 29 A V H > S+ 0 0 52 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.916 125.2 51.9 -58.4 -43.0 12.6 -5.7 5.6 4 30 A Q H > S+ 0 0 76 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.928 109.9 48.2 -60.1 -45.1 14.6 -3.3 3.5 5 31 A Q H > S+ 0 0 107 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.877 110.2 53.1 -63.1 -37.5 14.0 -0.5 5.9 6 32 A Q H X S+ 0 0 69 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.905 110.2 46.9 -64.7 -41.5 15.0 -2.7 8.8 7 33 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.910 111.2 51.1 -66.6 -41.3 18.3 -3.6 7.0 8 34 A E H X S+ 0 0 97 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.911 111.6 48.5 -60.8 -42.6 19.0 0.0 6.2 9 35 A A H X S+ 0 0 59 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.870 109.1 52.6 -66.2 -38.2 18.4 0.9 9.9 10 36 A L H X S+ 0 0 19 -4,-2.0 4,-1.0 2,-0.2 -2,-0.2 0.949 111.4 46.4 -60.9 -49.0 20.6 -1.9 11.1 11 37 A E H >X>S+ 0 0 23 -4,-2.6 3,-0.9 1,-0.2 5,-0.7 0.925 109.4 54.7 -60.4 -40.6 23.4 -0.7 8.9 12 38 A K H 3<5S+ 0 0 189 -4,-2.5 3,-0.3 1,-0.3 -1,-0.2 0.864 112.5 43.3 -62.2 -35.2 22.9 2.9 10.0 13 39 A S H 3<5S+ 0 0 94 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.632 102.9 74.5 -77.0 -14.8 23.2 1.8 13.7 14 40 A S H <<5S- 0 0 5 -4,-1.0 -1,-0.2 -3,-0.9 -2,-0.2 0.677 89.6-129.9 -82.1 -25.0 26.2 -0.4 12.9 15 41 A G T <5S+ 0 0 52 -4,-0.6 2,-0.3 -3,-0.3 -3,-0.1 0.733 81.8 37.5 72.9 23.7 29.2 1.9 12.3 16 42 A G S >> -AB 230 29A 11 5,-3.0 4,-1.8 -2,-0.5 3,-1.0 -0.882 1.7-162.0 -96.8 109.7 14.5 -18.5 -0.3 25 51 A T T 345S+ 0 0 32 204,-2.2 -1,-0.1 -2,-0.8 205,-0.1 0.565 78.7 79.8 -74.1 -4.6 14.5 -21.7 -2.2 26 52 A A T 345S- 0 0 69 203,-0.3 -1,-0.2 202,-0.2 204,-0.1 0.924 124.4 -4.1 -60.8 -40.8 10.7 -22.1 -1.8 27 53 A D T <45S- 0 0 99 -3,-1.0 -2,-0.2 2,-0.1 -1,-0.1 0.269 96.5-107.7-141.1 7.6 10.1 -19.6 -4.6 28 54 A N T <5 + 0 0 117 -4,-1.8 -3,-0.2 1,-0.2 2,-0.0 0.596 69.0 150.5 71.3 11.1 13.6 -18.4 -5.6 29 55 A S E < -B 24 0A 49 -5,-0.7 -5,-3.0 -6,-0.1 2,-0.3 -0.316 29.7-151.0 -72.1 158.4 12.8 -15.0 -4.0 30 56 A Q E -B 23 0A 84 -7,-0.2 2,-0.5 -3,-0.1 -7,-0.2 -0.968 22.0-153.1-135.7 148.7 15.6 -12.9 -2.5 31 57 A I E -B 22 0A 28 -9,-2.1 -9,-2.5 -2,-0.3 2,-0.4 -0.990 33.6-176.8-120.3 107.4 16.3 -10.3 0.2 32 59 A L E +B 21 0A 53 -2,-0.5 2,-0.3 -11,-0.2 -11,-0.2 -0.937 18.5 171.0-115.9 134.0 19.3 -8.2 -1.1 33 60 A Y E S-B 20 0A 23 -13,-2.5 -13,-2.1 -2,-0.4 4,-0.1 -0.930 83.3 -23.3-145.0 115.5 21.2 -5.4 0.5 34 61 A R S > S+ 0 0 98 -2,-0.3 3,-1.6 -15,-0.2 123,-0.1 0.828 89.9 154.3 50.2 35.8 24.5 -4.1 -1.1 35 62 A A T 3 + 0 0 6 1,-0.3 122,-2.3 -15,-0.2 123,-0.6 0.629 63.5 48.4 -76.9 -12.7 24.4 -7.6 -2.6 36 63 A D T 3 S+ 0 0 127 120,-0.1 2,-0.3 121,-0.1 -1,-0.3 0.276 92.8 99.9-104.6 8.7 26.5 -6.6 -5.7 37 64 A E S < S- 0 0 65 -3,-1.6 2,-0.3 -4,-0.1 120,-0.1 -0.677 76.5-109.6 -94.2 156.4 29.1 -4.8 -3.7 38 65 A R + 0 0 96 -2,-0.3 2,-0.3 117,-0.2 117,-0.2 -0.575 35.3 173.8 -91.2 139.6 32.4 -6.3 -2.9 39 66 A F E -E 154 0B 2 115,-2.6 115,-1.9 -2,-0.3 2,-0.3 -0.990 40.9-100.3-135.8 146.7 33.5 -7.4 0.6 40 67 A A E -E 153 0B 14 -2,-0.3 113,-0.3 113,-0.2 112,-0.1 -0.502 29.3-151.8 -61.6 129.0 36.6 -9.3 1.8 41 68 A M > - 0 0 0 111,-2.5 3,-2.0 -2,-0.3 -1,-0.1 0.743 21.0-178.4 -73.0 -31.7 35.6 -12.9 2.3 42 69 A C G > S- 0 0 0 100,-0.6 3,-2.0 110,-0.5 -1,-0.2 -0.244 71.2 -14.0 52.4-144.2 38.1 -13.7 5.0 43 70 A S G > S+ 0 0 6 167,-0.3 3,-1.9 1,-0.3 4,-0.3 0.559 119.5 85.4 -68.8 -4.4 37.7 -17.4 6.0 44 71 A T G X S+ 0 0 0 -3,-2.0 3,-1.3 1,-0.3 4,-0.4 0.800 79.3 70.0 -61.8 -22.3 34.4 -17.8 4.2 45 72 A S G X> S+ 0 0 1 -3,-2.0 4,-1.4 1,-0.2 3,-0.6 0.661 76.6 80.6 -63.5 -18.4 36.6 -18.4 1.2 46 73 A K H <> S+ 0 0 1 -3,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.812 82.9 63.2 -61.2 -30.6 37.6 -21.8 2.8 47 74 A V H <> S+ 0 0 2 -3,-1.3 4,-2.6 -4,-0.3 -1,-0.2 0.916 102.1 49.2 -57.8 -44.0 34.4 -23.3 1.5 48 75 A M H <> S+ 0 0 2 -3,-0.6 4,-2.0 -4,-0.4 -1,-0.2 0.886 111.0 48.8 -66.5 -39.6 35.5 -22.7 -2.1 49 76 A A H X S+ 0 0 0 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.928 113.6 45.9 -65.4 -45.5 38.9 -24.3 -1.5 50 77 A A H X S+ 0 0 2 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.920 113.0 50.7 -61.9 -43.3 37.4 -27.4 0.2 51 78 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.857 104.9 57.0 -64.0 -35.2 34.7 -27.6 -2.6 52 79 A A H X S+ 0 0 4 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.886 108.9 46.2 -63.1 -39.8 37.4 -27.4 -5.3 53 80 A V H X S+ 0 0 3 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.907 109.9 54.0 -67.9 -42.5 39.1 -30.5 -3.8 54 81 A L H X S+ 0 0 0 -4,-2.4 4,-0.9 1,-0.2 -2,-0.2 0.921 106.5 52.8 -55.7 -43.2 35.8 -32.3 -3.5 55 82 A K H >< S+ 0 0 65 -4,-2.5 3,-1.1 1,-0.2 4,-0.5 0.938 108.6 49.2 -58.4 -46.9 35.3 -31.6 -7.2 56 83 A Q H >< S+ 0 0 69 -4,-1.9 3,-1.5 1,-0.2 4,-0.3 0.884 103.7 61.3 -58.0 -37.0 38.7 -33.2 -8.0 57 84 A S H >< S+ 0 0 6 -4,-2.2 3,-0.9 1,-0.3 -1,-0.2 0.721 86.8 74.2 -66.9 -21.2 37.7 -36.2 -5.8 58 85 A E T << S+ 0 0 79 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.864 108.2 32.8 -51.7 -40.1 34.8 -36.9 -8.2 59 86 A S T < S+ 0 0 110 -3,-1.5 2,-0.3 -4,-0.5 -1,-0.2 0.225 118.4 55.4-108.7 11.0 37.3 -38.2 -10.7 60 87 A D X - 0 0 65 -3,-0.9 3,-1.7 -4,-0.3 4,-0.4 -0.793 60.2-169.2-146.6 96.9 39.9 -39.6 -8.3 61 88 A K T 3 S+ 0 0 178 -2,-0.3 4,-0.1 1,-0.3 -4,-0.1 0.584 87.9 51.2 -66.9 -11.9 38.6 -42.2 -5.9 62 89 A H T 3 S+ 0 0 123 1,-0.1 3,-0.4 2,-0.1 4,-0.3 0.463 85.1 91.1 -99.0 -4.1 41.8 -42.1 -3.8 63 90 A L S X S+ 0 0 4 -3,-1.7 3,-1.8 1,-0.2 29,-0.5 0.904 79.1 53.1 -64.4 -46.8 42.1 -38.4 -3.4 64 91 A L T 3 S+ 0 0 35 -4,-0.4 29,-2.6 1,-0.3 30,-0.4 0.816 112.3 47.0 -64.4 -26.0 40.2 -37.8 -0.1 65 92 A N T 3 S+ 0 0 131 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.373 82.5 126.9 -92.8 5.3 42.4 -40.4 1.6 66 93 A Q < - 0 0 85 -3,-1.8 26,-1.5 -4,-0.3 2,-0.2 -0.441 62.3-120.9 -64.8 129.9 45.7 -39.0 0.2 67 94 A R E -F 91 0C 188 24,-0.2 2,-0.4 -2,-0.2 24,-0.2 -0.528 24.3-166.4 -73.0 138.8 48.2 -38.2 3.0 68 95 A V E -F 90 0C 24 22,-2.2 22,-2.3 -2,-0.2 2,-0.3 -0.994 20.4-128.1-127.4 123.9 49.5 -34.7 3.5 69 96 A E E -F 89 0C 89 -2,-0.4 2,-0.5 20,-0.2 20,-0.2 -0.568 18.0-153.2 -73.5 131.9 52.6 -34.2 5.7 70 97 A I - 0 0 0 18,-2.5 17,-2.6 15,-0.4 2,-0.3 -0.939 16.3-177.6-108.6 125.1 52.2 -31.5 8.4 71 98 A K > - 0 0 106 -2,-0.5 3,-1.9 15,-0.2 4,-0.4 -0.845 40.9-111.7-120.3 156.9 55.4 -29.8 9.6 72 99 A K G > S+ 0 0 170 -2,-0.3 3,-1.9 1,-0.3 -1,-0.1 0.889 117.6 61.0 -51.4 -40.6 56.0 -27.2 12.2 73 100 A S G 3 S+ 0 0 108 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.655 93.9 64.7 -64.3 -15.9 56.9 -24.7 9.4 74 101 A D G < S+ 0 0 41 -3,-1.9 2,-0.3 8,-0.1 -1,-0.3 0.575 77.6 104.1 -79.7 -13.7 53.3 -25.1 8.0 75 102 A L < + 0 0 53 -3,-1.9 3,-0.1 -4,-0.4 4,-0.0 -0.561 37.4 165.7 -74.9 133.3 51.8 -23.5 11.2 76 103 A V - 0 0 35 -2,-0.3 -1,-0.1 1,-0.3 2,-0.1 0.236 56.9 -81.5-131.0 9.4 50.7 -20.0 10.5 77 104 A N S S+ 0 0 130 2,-0.1 28,-0.3 63,-0.0 -1,-0.3 0.041 109.6 51.5 91.9 153.9 48.5 -19.2 13.5 78 105 A Y S S+ 0 0 141 1,-0.1 27,-2.8 26,-0.1 28,-0.2 0.962 70.5 130.2 43.1 63.2 44.9 -20.1 14.1 79 106 A N > + 0 0 13 25,-0.3 4,-2.0 26,-0.2 5,-0.2 -0.499 19.3 161.0-137.1 63.0 45.6 -23.7 13.3 80 107 A P T 4 S+ 0 0 38 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.760 77.7 35.7 -63.2 -28.2 44.0 -25.6 16.1 81 108 A I T >4 S+ 0 0 23 2,-0.1 3,-1.6 17,-0.1 4,-0.4 0.889 113.4 52.7 -91.2 -48.6 43.8 -29.0 14.3 82 109 A A G >4 S+ 0 0 0 1,-0.3 3,-1.9 2,-0.2 4,-0.3 0.861 101.1 63.0 -60.1 -32.9 47.0 -29.0 12.2 83 110 A E G >< S+ 0 0 113 -4,-2.0 3,-0.6 1,-0.3 -1,-0.3 0.782 97.3 58.5 -62.2 -24.3 49.1 -28.2 15.3 84 111 A K G < S+ 0 0 146 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.588 108.0 47.5 -74.7 -12.9 47.9 -31.6 16.7 85 112 A H G X S+ 0 0 70 -3,-1.9 3,-2.5 -4,-0.4 -15,-0.4 0.266 72.0 141.9-119.6 10.9 49.4 -33.4 13.7 86 113 A V T < S+ 0 0 41 -3,-0.6 -15,-0.2 -4,-0.3 3,-0.1 -0.314 77.6 18.2 -59.4 136.3 52.8 -31.9 13.3 87 114 A N T 3 S+ 0 0 140 -17,-2.6 -1,-0.3 1,-0.4 2,-0.1 0.272 122.8 72.9 77.9 -7.0 55.3 -34.6 12.2 88 115 A G S < S- 0 0 29 -3,-2.5 -18,-2.5 -18,-0.3 -1,-0.4 -0.335 83.3-100.7-112.6-162.7 52.4 -36.8 11.1 89 116 A T E -F 69 0C 42 -20,-0.2 2,-0.3 -2,-0.1 -20,-0.2 -0.883 17.0-161.2-121.6 158.9 50.0 -36.7 8.3 90 117 A M E -F 68 0C 2 -22,-2.3 -22,-2.2 -2,-0.3 2,-0.1 -0.981 26.0-122.1-127.9 146.3 46.4 -35.6 7.7 91 118 A T E > -F 67 0C 23 -2,-0.3 4,-2.3 -24,-0.2 -24,-0.2 -0.426 28.0-108.9 -78.7 164.1 44.3 -36.7 4.7 92 119 A L H > S+ 0 0 2 -26,-1.5 4,-2.4 -29,-0.5 -27,-0.2 0.899 122.9 53.2 -59.2 -37.3 42.8 -34.3 2.3 93 120 A A H > S+ 0 0 21 -29,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.928 108.3 49.0 -61.1 -45.1 39.4 -35.1 3.8 94 121 A E H > S+ 0 0 99 -30,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.848 110.3 51.7 -63.6 -34.0 40.7 -34.3 7.3 95 122 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.895 108.9 50.2 -69.2 -40.4 42.1 -31.1 5.9 96 123 A G H X S+ 0 0 1 -4,-2.4 4,-2.3 2,-0.2 5,-0.3 0.940 112.2 48.0 -57.6 -47.2 38.7 -30.2 4.4 97 124 A A H X S+ 0 0 23 -4,-2.5 4,-3.0 1,-0.2 5,-0.4 0.911 113.9 46.0 -60.3 -44.9 37.1 -30.9 7.8 98 125 A A H X S+ 0 0 3 -4,-2.3 6,-2.1 1,-0.2 4,-1.6 0.907 111.9 50.9 -66.7 -43.9 39.6 -28.9 9.7 99 126 A A H < S+ 0 0 0 -4,-2.6 4,-0.4 4,-0.3 -1,-0.2 0.900 121.5 33.2 -58.2 -43.5 39.4 -25.9 7.4 100 127 A L H < S+ 0 0 1 -4,-2.3 108,-0.2 -5,-0.2 -2,-0.2 0.888 124.5 37.9 -84.4 -42.6 35.7 -25.8 7.5 101 128 A Q H < S+ 0 0 39 -4,-3.0 87,-2.2 -5,-0.3 88,-0.3 0.729 134.8 19.9 -88.0 -21.5 34.8 -26.9 11.0 102 129 A Y S < S- 0 0 91 -4,-1.6 -3,-0.2 -5,-0.4 3,-0.2 0.333 97.3-122.6-124.0 -0.3 37.6 -25.2 12.9 103 130 A S - 0 0 9 -4,-0.4 2,-0.3 -5,-0.3 -4,-0.3 0.830 41.3-172.5 58.2 36.0 38.7 -22.6 10.4 104 131 A D > - 0 0 0 -6,-2.1 4,-2.1 1,-0.2 -25,-0.3 -0.418 16.9-159.1 -69.9 121.4 42.2 -24.0 10.5 105 132 A N H > S+ 0 0 8 -27,-2.8 4,-2.3 -2,-0.3 34,-0.3 0.839 90.5 52.6 -71.1 -36.3 44.5 -21.8 8.4 106 133 A T H > S+ 0 0 1 -28,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.914 108.7 51.8 -64.3 -41.6 47.2 -24.5 7.8 107 134 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.933 108.8 50.6 -60.2 -46.5 44.5 -26.8 6.5 108 135 A M H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.935 109.8 50.7 -54.0 -47.6 43.3 -24.0 4.1 109 136 A N H X S+ 0 0 30 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.872 108.2 51.7 -64.2 -36.3 46.8 -23.5 2.9 110 137 A K H X S+ 0 0 40 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.881 110.1 49.7 -66.7 -36.3 47.3 -27.3 2.3 111 138 A L H X S+ 0 0 1 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.945 112.7 46.6 -63.4 -48.2 44.1 -27.3 0.2 112 139 A I H X>S+ 0 0 3 -4,-2.6 5,-2.6 1,-0.2 4,-1.3 0.927 113.4 48.9 -59.4 -46.0 45.2 -24.3 -1.8 113 140 A A H <5S+ 0 0 71 -4,-2.6 3,-0.4 1,-0.2 -1,-0.2 0.913 109.1 52.7 -62.5 -42.4 48.7 -25.8 -2.3 114 141 A H H <5S+ 0 0 61 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.910 109.7 48.8 -57.4 -43.7 47.2 -29.1 -3.4 115 142 A L H <5S- 0 0 20 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.703 124.4-102.1 -69.8 -23.8 45.1 -27.3 -6.0 116 143 A G T <5S- 0 0 48 -4,-1.3 -3,-0.2 -3,-0.4 3,-0.2 0.566 73.4 -44.5 109.1 15.1 48.0 -25.4 -7.4 117 144 A G S >>> S+ 0 0 25 0, 0.0 4,-1.8 0, 0.0 3,-1.1 0.859 124.5 62.9 -54.7 -37.6 44.9 -19.3 -5.1 119 146 A D H 3> S+ 0 0 102 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.766 96.6 58.9 -59.8 -27.9 44.2 -18.8 -8.8 120 147 A K H <> S+ 0 0 111 -3,-1.6 4,-1.7 2,-0.2 -1,-0.3 0.803 103.1 52.2 -72.5 -28.7 43.1 -22.4 -9.1 121 148 A V H <>S+ 0 0 0 -4,-2.5 5,-2.2 1,-0.2 3,-1.2 0.930 110.0 51.9 -56.7 -44.5 34.5 -20.7 -8.7 126 153 A R H ><5S+ 0 0 103 -4,-2.6 3,-2.0 1,-0.3 -1,-0.2 0.874 102.5 59.7 -57.9 -38.7 34.4 -19.5 -12.3 127 154 A S H 3<5S+ 0 0 87 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.710 102.3 53.5 -65.0 -20.4 33.5 -23.1 -13.4 128 155 A L T <<5S- 0 0 18 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.310 127.4 -99.8 -91.7 2.8 30.4 -22.9 -11.2 129 156 A G T < 5S+ 0 0 56 -3,-2.0 2,-0.8 1,-0.3 -3,-0.2 0.523 75.9 144.2 88.8 9.5 29.3 -19.7 -12.9 130 157 A D < + 0 0 4 -5,-2.2 -1,-0.3 -6,-0.2 -2,-0.1 -0.742 21.0 175.8 -88.0 109.8 30.6 -17.4 -10.2 131 158 A E S S+ 0 0 167 -2,-0.8 -1,-0.2 1,-0.1 -5,-0.1 0.392 73.4 48.9 -88.9 -1.2 31.8 -14.3 -12.0 132 159 A T S S+ 0 0 32 -7,-0.1 21,-0.2 23,-0.1 -1,-0.1 0.778 79.6 97.5-113.3 -47.0 32.7 -12.4 -8.8 133 160 A F + 0 0 0 -8,-0.1 2,-0.3 22,-0.1 21,-0.2 -0.230 43.7 175.4 -52.5 136.8 34.7 -14.6 -6.5 134 161 A R - 0 0 77 19,-1.7 2,-0.5 16,-0.1 19,-0.3 -0.967 16.9-164.7-144.7 132.5 38.5 -14.1 -6.5 135 162 A L + 0 0 2 -2,-0.3 -13,-0.3 -17,-0.3 -14,-0.1 -0.975 20.3 158.9-111.1 126.5 41.1 -15.8 -4.2 136 163 A D + 0 0 57 -2,-0.5 2,-0.3 1,-0.2 -17,-0.2 0.624 55.6 33.8-116.6 -29.4 44.5 -14.0 -4.4 137 164 A R - 0 0 34 -19,-0.1 -1,-0.2 -20,-0.1 2,-0.1 -0.859 68.2-117.8-133.7 163.3 46.3 -15.0 -1.2 138 165 A T > - 0 0 61 -2,-0.3 4,-1.8 1,-0.1 -2,-0.1 -0.279 58.7 -42.5 -85.1 178.0 46.9 -17.8 1.3 139 166 A A T 4 S+ 0 0 2 -34,-0.3 -1,-0.1 1,-0.3 -30,-0.0 -0.705 117.0 16.3 -84.8 146.1 46.1 -17.6 5.0 140 167 A P T >4 S+ 0 0 61 0, 0.0 3,-2.1 0, 0.0 -1,-0.3 -0.992 120.6 57.7 -92.5 0.7 46.5 -15.5 7.0 141 168 A T G >4 S+ 0 0 68 1,-0.3 3,-1.8 2,-0.2 -2,-0.2 0.758 90.8 74.5 -67.0 -18.9 47.1 -12.6 4.6 142 169 A L G 3< S+ 0 0 0 -4,-1.8 -100,-0.6 1,-0.3 3,-0.3 0.607 89.6 63.6 -64.8 -5.6 43.7 -13.2 3.0 143 170 A N G < + 0 0 26 -3,-2.1 69,-2.2 1,-0.2 -1,-0.3 0.289 65.0 102.9 -99.9 8.1 42.2 -11.6 6.1 144 171 A T < - 0 0 34 -3,-1.8 -1,-0.2 67,-0.2 -2,-0.1 0.845 57.4-172.1 -63.1 -34.7 43.7 -8.1 5.8 145 172 A A - 0 0 7 -3,-0.3 -105,-0.1 -4,-0.2 -1,-0.1 0.775 6.4-175.6 55.0 41.2 40.3 -6.9 4.5 146 173 A I > - 0 0 66 1,-0.1 3,-2.4 5,-0.1 -1,-0.2 -0.461 35.3 -99.9 -74.4 132.7 41.5 -3.5 3.5 147 174 A P T 3 S+ 0 0 71 0, 0.0 -1,-0.1 0, 0.0 -108,-0.1 -0.263 106.1 7.9 -55.9 131.4 38.6 -1.2 2.4 148 175 A G T 3 S+ 0 0 79 1,-0.3 -2,-0.1 -110,-0.2 -109,-0.0 0.346 91.3 132.6 80.4 -6.3 38.4 -1.1 -1.4 149 176 A D < - 0 0 30 -3,-2.4 -1,-0.3 1,-0.1 -4,-0.0 -0.669 44.8-157.9 -76.6 125.7 41.1 -3.8 -1.9 150 177 A P > + 0 0 57 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.620 55.6 113.1 -80.0 -12.1 39.7 -6.3 -4.5 151 178 A R T 3 S+ 0 0 92 1,-0.2 -6,-0.1 -5,-0.1 -16,-0.1 -0.350 87.1 2.2 -64.0 137.6 41.9 -9.2 -3.3 152 179 A D T 3 S+ 0 0 1 1,-0.2 -111,-2.5 -112,-0.1 -110,-0.5 0.879 104.2 132.6 60.4 42.7 40.1 -12.1 -1.8 153 180 A T E < +E 40 0B 2 -3,-1.0 -19,-1.7 -19,-0.3 2,-0.3 -0.787 27.6 163.8-121.6 162.7 36.6 -10.6 -2.3 154 181 A T E -E 39 0B 0 -115,-1.9 -115,-2.6 -2,-0.3 -21,-0.1 -0.895 36.7-101.4-153.7-174.9 33.2 -11.5 -3.5 155 182 A T > - 0 0 7 -2,-0.3 4,-2.4 -117,-0.2 5,-0.2 -0.828 28.9-116.9-109.1 156.6 29.7 -10.0 -3.3 156 183 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -135,-0.2 0.917 114.9 47.7 -57.6 -43.1 26.9 -11.3 -1.0 157 184 A L H > S+ 0 0 18 -122,-2.3 4,-2.8 2,-0.2 5,-0.2 0.928 111.2 49.3 -65.8 -44.4 24.7 -12.3 -3.9 158 185 A A H > S+ 0 0 4 -123,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.925 114.2 46.4 -59.8 -43.1 27.4 -14.1 -5.8 159 186 A M H X S+ 0 0 4 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.881 111.8 50.4 -68.8 -37.6 28.4 -16.0 -2.7 160 187 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.932 112.2 47.9 -64.2 -45.7 24.8 -16.9 -1.8 161 188 A Q H X S+ 0 0 86 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.929 115.5 44.3 -59.2 -46.9 24.2 -18.1 -5.4 162 189 A T H X S+ 0 0 4 -4,-2.5 4,-2.7 -5,-0.2 -2,-0.2 0.907 111.5 52.2 -69.5 -38.8 27.3 -20.2 -5.3 163 190 A L H X S+ 0 0 2 -4,-2.8 4,-2.4 2,-0.2 5,-0.3 0.907 110.4 49.8 -62.4 -39.7 26.7 -21.6 -1.8 164 191 A K H X>S+ 0 0 60 -4,-2.4 4,-2.7 2,-0.2 5,-1.2 0.949 111.6 48.0 -60.1 -49.3 23.2 -22.6 -3.0 165 192 A N H X5S+ 0 0 27 -4,-2.4 6,-1.8 1,-0.2 4,-0.5 0.899 115.1 46.5 -57.4 -41.9 24.7 -24.3 -6.0 166 193 A L H <5S+ 0 0 2 -4,-2.7 -1,-0.2 5,-0.2 6,-0.2 0.869 124.4 27.4 -66.5 -43.7 27.4 -26.1 -3.8 167 194 A T H <5S+ 0 0 0 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.743 139.7 13.3 -97.1 -28.1 25.1 -27.3 -1.0 168 195 A L H <5S+ 0 0 58 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.1 0.459 119.3 46.4-125.7 -10.7 21.7 -27.8 -2.6 169 196 A G S >< - 0 0 36 -2,-0.3 4,-2.9 -119,-0.1 5,-0.2 -0.251 50.3 -99.8 -56.3 159.6 28.3 -34.9 -7.4 174 201 A E H > S+ 0 0 117 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.885 119.6 47.7 -62.1 -45.3 25.9 -36.2 -4.8 175 202 A T H > S+ 0 0 111 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.929 116.8 44.9 -63.0 -39.3 28.4 -37.9 -2.4 176 203 A Q H > S+ 0 0 27 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.897 111.4 52.0 -72.9 -37.4 30.6 -34.8 -2.5 177 204 A R H X S+ 0 0 52 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.939 111.3 48.7 -56.2 -49.5 27.6 -32.4 -2.0 178 205 A A H X S+ 0 0 33 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.880 109.7 52.1 -61.1 -38.6 26.6 -34.5 0.9 179 206 A Q H X S+ 0 0 64 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.913 108.9 49.7 -64.5 -43.5 30.1 -34.3 2.3 180 207 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.930 111.9 48.7 -59.5 -45.5 30.2 -30.5 2.0 181 208 A V H X S+ 0 0 10 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.921 109.3 52.2 -60.7 -44.6 26.9 -30.3 3.8 182 209 A T H X S+ 0 0 85 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.925 111.0 48.4 -55.7 -47.5 28.1 -32.6 6.6 183 210 A W H < S+ 0 0 16 -4,-2.4 3,-0.4 1,-0.2 -2,-0.2 0.953 112.5 46.9 -59.1 -50.1 31.1 -30.5 7.1 184 211 A L H >< S+ 0 0 4 -4,-2.7 22,-1.8 1,-0.2 3,-1.5 0.891 109.5 53.5 -61.5 -41.2 29.2 -27.2 7.2 185 212 A K H 3< S+ 0 0 94 -4,-2.7 -1,-0.2 20,-0.3 -2,-0.2 0.831 107.8 53.2 -62.4 -31.6 26.6 -28.6 9.6 186 213 A G T 3< S+ 0 0 33 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.293 77.4 138.0 -88.6 11.8 29.4 -29.6 12.0 187 214 A N < - 0 0 14 -3,-1.5 -86,-0.2 1,-0.1 -85,-0.1 -0.326 34.4-169.3 -58.4 138.2 31.0 -26.2 12.1 188 215 A T S S+ 0 0 76 -87,-2.2 3,-0.4 1,-0.1 -1,-0.1 0.521 72.8 66.0-101.8 -10.1 32.1 -25.2 15.6 189 216 A T S S+ 0 0 41 -88,-0.3 3,-0.2 1,-0.2 -1,-0.1 0.395 84.4 70.0 -98.4 0.3 32.9 -21.5 15.1 190 217 A G > > + 0 0 0 1,-0.2 3,-1.6 -3,-0.1 5,-0.6 0.266 52.6 114.0-109.9 12.9 29.5 -20.0 14.3 191 218 A S T 3 5S+ 0 0 98 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.856 86.6 39.2 -51.3 -44.7 27.5 -20.1 17.6 192 219 A A T 3 5S+ 0 0 63 -3,-0.2 59,-0.4 3,-0.1 -1,-0.3 0.387 111.7 62.5 -91.4 2.1 27.3 -16.4 17.9 193 220 A S T X>5S- 0 0 3 -3,-1.6 3,-1.3 57,-0.1 4,-0.5 0.392 119.1 -21.1-102.0-128.7 26.8 -15.5 14.3 194 221 A I G >45S+ 0 0 0 1,-0.3 3,-2.1 2,-0.2 4,-0.3 0.897 132.7 61.4 -50.4 -44.7 23.9 -16.4 12.0 195 222 A R G >4 - 0 0 64 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 -0.328 49.0-122.4 -50.6 136.2 15.1 -20.5 16.0 200 227 A K T 3 S+ 0 0 214 1,-0.3 -2,-0.0 -4,-0.1 -3,-0.0 0.730 106.0 51.5 -65.5 -26.6 17.3 -22.8 18.1 201 228 A S T 3 S+ 0 0 107 2,-0.1 -1,-0.3 0, 0.0 2,-0.2 0.507 80.2 112.3 -92.5 -5.0 16.1 -26.1 16.6 202 229 A W S < S- 0 0 33 -3,-1.6 2,-0.4 -7,-0.1 -4,-0.1 -0.466 72.4-120.0 -66.9 140.3 16.6 -25.1 12.9 203 230 A V E -C 223 0A 70 20,-1.5 20,-3.1 -2,-0.2 2,-0.4 -0.645 39.7-178.9 -82.6 136.0 19.3 -27.2 11.3 204 231 A V E -C 222 0A 9 -2,-0.4 2,-0.4 18,-0.2 18,-0.2 -0.996 24.2-167.5-140.2 139.3 22.1 -25.0 10.0 205 232 A G E +C 221 0A 0 16,-2.7 16,-2.5 -2,-0.4 2,-0.3 -0.984 29.5 158.4-117.8 138.4 25.4 -25.4 8.1 206 233 A D E -C 220 0A 1 -22,-1.8 2,-0.4 -2,-0.4 14,-0.2 -0.989 34.9-148.1-152.8 164.4 27.7 -22.4 8.0 207 234 A K E -C 219 0A 0 12,-2.3 12,-1.8 -2,-0.3 2,-0.1 -0.971 21.4-158.1-135.7 124.5 31.2 -21.0 7.6 208 235 A T E -C 218 0A 15 -2,-0.4 2,-0.3 -108,-0.2 10,-0.3 -0.388 7.1-171.3 -86.3 167.8 32.4 -17.9 9.4 209 236 A G E -C 217 0A 4 8,-2.1 8,-3.0 -166,-0.2 2,-0.3 -0.876 3.7-178.9-162.0 141.7 35.2 -15.5 8.6 210 237 A S E +C 216 0A 62 -2,-0.3 -167,-0.3 6,-0.2 2,-0.3 -0.936 12.9 147.3-133.2 152.8 36.8 -12.6 10.5 211 238 A G E > -C 215 0A 12 4,-2.2 4,-0.5 -2,-0.3 3,-0.3 -0.890 47.4 -45.5-162.2-166.1 39.6 -10.2 9.7 212 240 A D T >4 S+ 0 0 74 -69,-2.2 3,-1.6 -2,-0.3 30,-0.2 -0.072 109.6 49.5 -67.6 174.7 41.0 -6.8 10.1 213 241 A Y T 34 S- 0 0 39 28,-2.6 25,-2.6 1,-0.3 -1,-0.2 0.788 132.0 -77.4 56.9 29.6 38.8 -3.7 9.7 214 242 A G T 34 S+ 0 0 0 27,-0.6 32,-0.4 29,-0.6 2,-0.3 0.807 77.1 178.8 55.0 30.8 36.4 -5.5 12.1 215 243 A T E << +C 211 0A 0 -3,-1.6 -4,-2.2 -4,-0.5 2,-0.4 -0.502 3.7 178.2 -76.0 124.9 35.4 -7.7 9.1 216 244 A T E +CD 210 236A 0 20,-2.7 20,-0.6 -2,-0.3 2,-0.3 -0.974 5.1 168.2-139.4 113.9 32.9 -10.2 10.3 217 245 A N E +CD 209 235A 0 -8,-3.0 -8,-2.1 -2,-0.4 2,-0.3 -0.887 15.3 177.1-131.8 156.6 31.2 -12.6 8.0 218 246 A D E -CD 208 234A 0 16,-2.1 16,-2.7 -2,-0.3 2,-0.4 -0.950 8.3-165.3-158.4 140.9 29.1 -15.8 7.9 219 247 A I E +CD 207 233A 1 -12,-1.8 -12,-2.3 -2,-0.3 2,-0.3 -0.995 22.9 175.5-127.8 134.7 27.6 -17.8 5.1 220 248 A A E -CD 206 232A 0 12,-2.8 12,-2.8 -2,-0.4 2,-0.4 -0.977 33.7-148.9-144.2 150.7 24.9 -20.4 5.9 221 249 A V E -CD 205 231A 1 -16,-2.5 -16,-2.7 -2,-0.3 2,-0.4 -0.975 28.8-162.5-115.2 134.5 22.4 -22.9 4.6 222 250 A I E -CD 204 230A 0 8,-2.9 8,-2.4 -2,-0.4 -18,-0.2 -0.976 13.0-161.8-127.6 129.6 19.4 -23.2 6.8 223 251 A W E -C 203 0A 61 -20,-3.1 -20,-1.5 -2,-0.4 5,-0.1 -0.891 14.6-156.7-114.2 96.0 16.8 -26.0 6.9 224 252 A P - 0 0 13 0, 0.0 3,-0.2 0, 0.0 -22,-0.0 -0.251 25.5-116.1 -61.0 162.7 13.6 -24.9 8.6 225 254 A E S S+ 0 0 151 1,-0.2 3,-0.0 3,-0.0 -2,-0.0 0.786 108.7 16.0 -69.2 -32.3 11.3 -27.6 10.1 226 255 A N S S+ 0 0 131 2,-0.1 2,-0.3 0, 0.0 -1,-0.2 0.050 118.7 64.7-132.6 18.9 8.3 -26.9 7.8 227 256 A H S S- 0 0 114 -3,-0.2 3,-0.1 34,-0.0 34,-0.0 -0.941 84.0 -88.7-145.9 161.5 9.8 -24.9 4.9 228 257 A A - 0 0 32 -2,-0.3 -202,-0.2 1,-0.2 -2,-0.1 -0.250 62.4 -78.8 -66.2 157.5 12.3 -25.1 2.1 229 258 A P - 0 0 25 0, 0.0 -204,-2.2 0, 0.0 2,-0.4 -0.151 37.2-147.2 -61.0 154.4 15.9 -24.2 2.7 230 259 A L E -AD 24 222A 2 -8,-2.4 -8,-2.9 -206,-0.2 2,-0.5 -0.926 2.2-152.3-114.7 144.0 17.2 -20.7 2.9 231 260 A V E -AD 23 221A 0 -208,-2.5 -208,-2.8 -2,-0.4 2,-0.4 -0.985 20.9-174.7-116.9 127.4 20.7 -19.6 1.9 232 261 A L E -AD 22 220A 0 -12,-2.8 -12,-2.8 -2,-0.5 2,-0.5 -0.983 17.3-174.3-133.7 127.4 22.0 -16.6 3.7 233 262 A V E -AD 21 219A 0 -212,-2.6 -212,-2.2 -2,-0.4 2,-0.4 -0.980 6.5-178.8-115.0 126.9 25.2 -14.5 3.4 234 263 A T E +AD 20 218A 0 -16,-2.7 -16,-2.1 -2,-0.5 2,-0.4 -0.971 6.5 175.8-126.1 113.2 25.9 -11.8 6.0 235 264 A Y E +AD 19 217A 0 -216,-3.0 -216,-3.0 -2,-0.4 2,-0.3 -0.899 1.3 177.8-115.8 145.7 29.0 -9.8 5.5 236 265 A F E +AD 18 216A 0 -20,-0.6 -20,-2.7 -2,-0.4 2,-0.3 -0.989 2.9 171.7-150.7 136.9 30.1 -6.8 7.6 237 266 A T E -A 17 0A 13 -220,-2.0 -220,-3.1 -2,-0.3 -23,-0.2 -0.983 15.1-145.9-149.9 157.9 33.1 -4.5 7.6 238 267 A Q - 0 0 17 -25,-2.6 -222,-0.2 -2,-0.3 -23,-0.1 -0.747 22.7-118.4-128.1 162.7 34.2 -1.3 9.4 239 268 A P S S+ 0 0 93 0, 0.0 2,-0.4 0, 0.0 -223,-0.1 0.719 89.1 71.0 -78.3 -21.5 36.2 1.7 8.5 240 269 A E S > S- 0 0 101 -27,-0.1 3,-1.8 1,-0.1 -2,-0.2 -0.820 76.3-133.1-107.6 138.4 39.0 1.4 11.1 241 270 A Q T 3 S+ 0 0 92 -2,-0.4 -28,-2.6 1,-0.3 -27,-0.6 0.812 103.2 41.6 -57.4 -38.7 41.7 -1.2 10.9 242 271 A K T 3 S+ 0 0 194 -29,-0.2 -1,-0.3 -30,-0.2 3,-0.1 0.099 81.1 141.9-104.0 24.3 41.6 -2.4 14.5 243 272 A A < - 0 0 14 -3,-1.8 -29,-0.6 1,-0.1 -28,-0.1 -0.285 57.4-107.2 -58.0 145.4 37.8 -2.4 14.9 244 273 A E - 0 0 139 -31,-0.1 -1,-0.1 1,-0.1 2,-0.1 -0.396 36.8-104.5 -68.9 150.2 36.4 -5.2 17.0 245 274 A N - 0 0 63 -3,-0.1 2,-0.2 -2,-0.1 3,-0.1 -0.425 29.5-150.8 -72.6 158.4 34.6 -7.9 15.1 246 275 A R >> + 0 0 54 -32,-0.4 3,-1.2 1,-0.1 4,-0.9 -0.581 31.4 158.1-137.5 67.1 30.8 -7.8 15.4 247 276 A N H 3> S+ 0 0 50 1,-0.3 4,-2.2 2,-0.2 3,-0.3 0.826 74.7 71.1 -67.5 -20.4 29.1 -11.2 15.1 248 277 A D H 3> S+ 0 0 85 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.825 93.4 56.7 -57.1 -35.4 26.1 -9.7 17.0 249 278 A I H <> S+ 0 0 7 -3,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.891 106.2 49.3 -61.7 -42.2 25.4 -7.7 13.8 250 279 A L H X S+ 0 0 0 -4,-0.9 4,-2.5 -3,-0.3 -2,-0.2 0.920 110.6 49.4 -66.8 -42.7 25.2 -10.9 11.8 251 280 A A H X S+ 0 0 15 -4,-2.2 4,-2.2 -59,-0.4 -2,-0.2 0.915 111.7 49.9 -59.9 -44.4 22.9 -12.5 14.3 252 281 A A H X S+ 0 0 39 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.905 111.0 48.4 -63.1 -42.2 20.7 -9.4 14.2 253 282 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.908 110.0 52.3 -63.6 -42.8 20.6 -9.4 10.4 254 283 A A H X S+ 0 0 0 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.899 108.4 51.0 -59.8 -42.9 19.7 -13.1 10.3 255 284 A K H X S+ 0 0 148 -4,-2.2 4,-0.7 1,-0.2 -1,-0.2 0.920 110.0 50.8 -61.9 -43.5 16.8 -12.5 12.7 256 285 A I H >< S+ 0 0 30 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.922 115.0 39.8 -58.4 -47.7 15.5 -9.7 10.5 257 286 A V H 3< S+ 0 0 1 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.640 114.8 50.3 -86.2 -14.6 15.5 -11.6 7.2 258 287 A T H >< S+ 0 0 8 -4,-1.5 3,-0.7 -5,-0.2 -1,-0.2 0.423 77.8 125.1-101.9 -0.4 14.3 -14.9 8.5 259 288 A H T << S+ 0 0 160 -4,-0.7 2,-0.4 -3,-0.5 -3,-0.0 -0.327 78.5 17.5 -55.8 136.5 11.3 -13.5 10.4 260 289 A G T 3 0 0 70 1,-0.3 -1,-0.2 -2,-0.0 -2,-0.1 -0.235 360.0 360.0 91.5 -44.2 8.0 -15.2 9.2 261 290 A F < 0 0 72 -3,-0.7 -1,-0.3 -2,-0.4 -3,-0.1 -0.089 360.0 360.0 -65.5 360.0 9.9 -18.2 7.7