==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 15-DEC-11 3V50 . COMPND 2 MOLECULE: BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: KLEBSIELLA PNEUMONIAE; . AUTHOR K.WEI,F.VAN DEN AKKER . 265 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11295.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 70.2 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 . 38 14.3 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 . 6 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 35.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.3 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 1 0 0 1 2 2 1 0 1 0 1 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 2 0 1 0 0 1 2 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 . 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 26 A S 0 0 71 0, 0.0 254,-0.0 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 143.8 12.0 -3.0 -9.6 2 27 A P - 0 0 33 0, 0.0 259,-0.1 0, 0.0 260,-0.1 -0.152 360.0 -63.9 -72.8 179.6 12.1 -3.4 -13.4 3 28 A Q > - 0 0 93 1,-0.1 4,-2.6 258,-0.1 5,-0.2 -0.246 54.7-104.7 -61.5 152.6 10.3 -1.1 -15.9 4 29 A P H > S+ 0 0 4 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.904 120.5 44.6 -46.1 -55.2 6.5 -1.0 -15.7 5 30 A L H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.876 113.5 51.4 -61.0 -39.0 5.9 -3.1 -18.9 6 31 A E H > S+ 0 0 110 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.895 111.5 47.5 -63.5 -42.0 8.7 -5.6 -17.8 7 32 A Q H X S+ 0 0 23 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.891 108.9 54.1 -66.3 -40.9 7.0 -6.0 -14.4 8 33 A I H X S+ 0 0 0 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.939 109.9 47.9 -58.7 -44.4 3.5 -6.4 -16.1 9 34 A K H X S+ 0 0 116 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.919 109.7 51.8 -62.7 -44.9 5.0 -9.3 -18.2 10 35 A L H X S+ 0 0 68 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.871 106.3 55.6 -58.8 -39.3 6.6 -10.9 -15.2 11 36 A S H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 6,-0.3 0.920 107.4 47.8 -62.1 -43.9 3.3 -10.8 -13.4 12 37 A E H X>S+ 0 0 29 -4,-1.9 4,-2.0 2,-0.2 5,-0.6 0.913 113.5 49.1 -60.8 -42.2 1.5 -12.7 -16.2 13 38 A S H <5S+ 0 0 94 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.912 116.1 42.0 -62.8 -44.6 4.4 -15.3 -16.2 14 39 A Q H <5S+ 0 0 121 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.875 123.2 37.0 -73.2 -35.7 4.2 -15.7 -12.4 15 40 A L H <5S- 0 0 5 -4,-2.7 228,-0.4 -5,-0.2 -2,-0.2 0.648 93.1-136.3 -89.2 -16.2 0.4 -15.7 -12.2 16 41 A S T <5S+ 0 0 95 -4,-2.0 2,-0.2 1,-0.3 -3,-0.2 0.784 71.4 106.7 57.1 31.1 -0.4 -17.7 -15.4 17 42 A G S -A 232 0A 36 5,-2.6 4,-2.2 -2,-0.3 207,-0.3 -0.523 27.4-146.8 -64.5 128.7 -2.4 11.6 -17.2 26 51 A L T 4 S+ 0 0 21 205,-2.7 -1,-0.2 -2,-0.3 206,-0.1 0.896 92.3 47.9 -67.5 -39.8 -5.5 12.7 -15.4 27 52 A A T 4 S+ 0 0 77 204,-0.5 -1,-0.2 1,-0.1 205,-0.1 0.918 130.6 14.4 -70.7 -40.8 -5.5 16.3 -16.7 28 53 A S T 4 S- 0 0 72 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.662 91.5-120.8-111.9 -21.9 -4.8 15.6 -20.4 29 54 A G < + 0 0 17 -4,-2.2 2,-0.1 1,-0.3 -3,-0.1 0.510 49.1 165.2 87.4 5.5 -5.5 11.9 -21.1 30 55 A R - 0 0 131 -6,-0.1 -5,-2.6 1,-0.1 2,-0.5 -0.394 34.3-134.7 -54.9 122.6 -2.0 11.3 -22.3 31 56 A T E +B 24 0A 75 -7,-0.2 -7,-0.2 1,-0.2 3,-0.1 -0.747 31.1 170.9 -85.0 122.0 -1.5 7.5 -22.4 32 57 A L E + 0 0 32 -9,-3.0 2,-0.4 -2,-0.5 -8,-0.2 0.803 67.2 14.8 -97.5 -40.7 1.8 6.5 -20.8 33 58 A T E +B 23 0A 8 -10,-1.3 -10,-2.1 -29,-0.0 -1,-0.4 -0.997 62.3 177.4-138.6 135.2 1.6 2.7 -20.6 34 59 A A E +B 22 0A 53 -2,-0.4 2,-0.4 -12,-0.2 -12,-0.2 -0.986 4.4 168.9-141.2 128.1 -0.9 0.4 -22.2 35 60 A W E S-B 21 0A 58 -14,-2.5 -14,-2.9 -2,-0.4 4,-0.1 -0.961 80.7 -17.8-142.6 121.1 -0.9 -3.4 -22.0 36 61 A R S > S+ 0 0 73 -2,-0.4 3,-1.5 -16,-0.2 123,-0.1 0.844 87.1 156.9 48.4 37.3 -3.9 -5.4 -23.2 37 62 A A T 3 + 0 0 12 1,-0.3 122,-2.5 -16,-0.1 123,-0.5 0.695 67.2 44.1 -70.1 -17.7 -5.7 -2.1 -23.0 38 63 A D T 3 S+ 0 0 139 120,-0.1 -1,-0.3 119,-0.1 2,-0.3 0.275 93.2 103.4-107.9 7.7 -8.4 -3.1 -25.5 39 64 A E S < S- 0 0 61 -3,-1.5 2,-0.2 -4,-0.1 120,-0.1 -0.656 76.2-107.5 -90.4 149.7 -9.0 -6.5 -24.1 40 65 A R + 0 0 84 -2,-0.3 117,-0.2 117,-0.2 -2,-0.1 -0.531 37.8 172.8 -81.6 138.7 -12.0 -7.3 -21.9 41 66 A F E -E 156 0B 0 115,-2.5 115,-2.4 -2,-0.2 2,-0.2 -0.992 40.8 -98.1-139.0 144.8 -11.8 -7.8 -18.2 42 67 A P E -E 155 0B 6 0, 0.0 113,-0.3 0, 0.0 196,-0.2 -0.464 26.6-150.6 -61.1 130.9 -14.5 -8.3 -15.5 43 68 A M > + 0 0 3 111,-2.3 3,-1.7 -2,-0.2 112,-0.1 0.812 27.9 175.3 -69.2 -34.3 -15.1 -4.9 -13.8 44 69 A M G > - 0 0 1 110,-0.6 3,-1.8 100,-0.4 -1,-0.1 -0.252 68.6 -16.6 55.0-147.3 -16.1 -6.5 -10.5 45 70 A S G > S+ 0 0 20 167,-0.3 3,-1.8 1,-0.3 -1,-0.3 0.590 121.3 85.0 -66.3 -9.9 -16.8 -3.9 -7.7 46 71 A T G X> S+ 0 0 0 -3,-1.7 3,-1.3 1,-0.3 4,-0.6 0.745 73.6 74.6 -63.2 -17.8 -14.9 -1.3 -9.7 47 72 A F H <> S+ 0 0 1 -3,-1.8 4,-2.5 1,-0.2 -1,-0.3 0.745 76.2 80.2 -64.2 -20.5 -18.2 -0.6 -11.5 48 73 A K H <> S+ 0 0 0 -3,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.788 86.9 55.1 -62.0 -27.2 -19.4 1.2 -8.4 49 74 A V H <> S+ 0 0 0 -3,-1.3 4,-1.6 -4,-0.2 -1,-0.2 0.945 110.2 44.5 -69.2 -45.1 -17.5 4.3 -9.3 50 75 A V H X S+ 0 0 2 -4,-0.6 4,-2.0 1,-0.2 -2,-0.2 0.900 110.2 57.6 -64.9 -41.1 -19.2 4.6 -12.7 51 76 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.938 107.9 45.4 -50.7 -51.4 -22.6 3.8 -11.0 52 77 A a H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.769 105.8 60.9 -72.2 -22.6 -22.2 6.8 -8.7 53 78 A G H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.917 106.5 47.5 -61.2 -43.7 -21.1 8.9 -11.7 54 79 A A H X S+ 0 0 4 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.899 110.6 51.6 -63.9 -43.3 -24.6 8.1 -13.1 55 80 A V H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.939 110.0 48.9 -55.5 -50.2 -26.3 9.0 -9.8 56 81 A L H X S+ 0 0 1 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.852 105.9 57.0 -61.6 -35.2 -24.5 12.3 -9.7 57 82 A A H X S+ 0 0 28 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.915 107.5 49.0 -62.0 -39.8 -25.5 13.0 -13.3 58 83 A R H X>S+ 0 0 70 -4,-1.8 5,-2.6 2,-0.2 6,-1.0 0.880 109.9 51.0 -64.8 -38.7 -29.1 12.6 -12.2 59 84 A V H ><5S+ 0 0 38 -4,-2.0 3,-1.3 4,-0.2 -2,-0.2 0.936 109.2 51.1 -61.6 -45.8 -28.5 14.9 -9.2 60 85 A D H 3<5S+ 0 0 60 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.859 109.4 50.6 -58.8 -37.6 -27.1 17.5 -11.6 61 86 A A H 3<5S- 0 0 68 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.544 117.5-114.0 -77.8 -10.4 -30.2 17.2 -13.8 62 87 A G T <<5S+ 0 0 61 -3,-1.3 -3,-0.2 -4,-0.6 -2,-0.1 0.604 90.2 111.6 84.5 14.4 -32.4 17.7 -10.8 63 88 A D S - 0 0 116 -2,-0.3 3,-1.1 1,-0.1 29,-0.4 -0.999 16.6-143.1-133.5 136.6 -30.9 14.3 -4.5 66 91 A L T 3 S+ 0 0 24 -2,-0.4 29,-2.9 1,-0.2 30,-0.5 0.800 105.9 57.3 -64.4 -24.7 -28.0 13.0 -2.5 67 92 A E T 3 S+ 0 0 135 27,-0.2 -1,-0.2 26,-0.2 2,-0.1 0.675 77.0 116.7 -73.9 -20.7 -30.2 13.9 0.5 68 93 A R < - 0 0 94 -3,-1.1 26,-1.9 25,-0.1 2,-0.4 -0.295 62.7-134.9 -63.1 127.8 -33.1 11.7 -0.5 69 94 A K E -F 93 0C 98 24,-0.2 2,-0.5 25,-0.1 24,-0.3 -0.677 14.9-158.9 -87.1 127.9 -33.7 8.9 2.0 70 95 A I E -F 92 0C 23 22,-3.2 22,-2.1 -2,-0.4 2,-0.4 -0.910 2.7-157.0-105.7 128.4 -34.3 5.4 0.6 71 96 A H + 0 0 116 -2,-0.5 2,-0.3 20,-0.2 17,-0.1 -0.859 20.2 172.9-103.8 138.2 -36.0 2.9 2.9 72 97 A Y - 0 0 10 -2,-0.4 2,-0.3 15,-0.3 19,-0.1 -0.852 24.1-116.1-140.6 175.8 -35.5 -0.8 2.1 73 98 A R > - 0 0 167 -2,-0.3 3,-1.9 1,-0.1 4,-0.4 -0.773 27.6-112.2-119.6 158.0 -36.2 -4.2 3.5 74 99 A Q G > S+ 0 0 144 -2,-0.3 3,-1.6 1,-0.3 -1,-0.1 0.847 116.2 63.3 -57.5 -33.9 -34.1 -7.1 4.8 75 100 A Q G 3 S+ 0 0 164 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.671 94.9 62.2 -65.7 -15.5 -35.1 -9.1 1.7 76 101 A D G < S+ 0 0 65 -3,-1.9 -1,-0.3 2,-0.0 2,-0.2 0.603 82.8 104.3 -82.0 -13.8 -33.4 -6.5 -0.5 77 102 A L < - 0 0 42 -3,-1.6 2,-0.2 -4,-0.4 4,-0.1 -0.498 50.0-170.9 -76.1 139.4 -30.0 -7.3 1.1 78 103 A V - 0 0 45 -2,-0.2 30,-0.3 1,-0.1 29,-0.1 -0.645 45.5 -51.3-114.7 176.6 -27.4 -9.3 -0.8 79 104 A D S S+ 0 0 125 -2,-0.2 28,-0.1 28,-0.1 -1,-0.1 -0.252 116.7 22.7 -55.8 127.3 -24.0 -10.8 0.3 80 105 A Y + 0 0 132 27,-0.1 27,-2.9 26,-0.1 28,-0.5 0.967 63.7 153.1 78.3 86.7 -21.7 -8.2 2.0 81 106 A S > + 0 0 7 25,-0.2 4,-2.3 26,-0.2 5,-0.2 -0.420 1.5 158.2-138.9 57.9 -23.7 -5.3 3.4 82 107 A P T 4 S+ 0 0 41 0, 0.0 -1,-0.1 0, 0.0 23,-0.1 0.777 82.7 26.3 -62.3 -31.0 -21.7 -3.9 6.4 83 108 A V T >4 S+ 0 0 33 2,-0.1 3,-1.6 -3,-0.1 4,-0.3 0.864 120.9 50.7 -95.0 -49.4 -23.4 -0.5 6.3 84 109 A S G >4 S+ 0 0 0 1,-0.3 3,-1.6 2,-0.2 7,-0.1 0.820 101.6 62.3 -65.4 -30.0 -26.8 -1.2 4.7 85 110 A E G 3< S+ 0 0 119 -4,-2.3 3,-0.5 1,-0.3 -1,-0.3 0.721 98.9 59.1 -66.9 -16.9 -27.6 -4.0 7.1 86 111 A K G < S+ 0 0 154 -3,-1.6 -1,-0.3 -5,-0.2 3,-0.2 0.508 101.8 54.5 -86.1 -8.2 -27.4 -1.4 10.0 87 112 A H <> + 0 0 42 -3,-1.6 4,-2.1 -4,-0.3 -15,-0.3 -0.072 59.0 120.0-125.3 36.4 -30.1 0.8 8.6 88 113 A L T 4 S+ 0 0 59 -3,-0.5 -16,-0.2 1,-0.2 -1,-0.1 0.815 85.4 42.9 -66.3 -30.1 -33.2 -1.4 8.1 89 114 A A T 4 S+ 0 0 100 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.886 127.6 24.5 -82.6 -39.8 -35.2 0.8 10.5 90 115 A D T 4 S- 0 0 77 1,-0.2 -2,-0.2 -4,-0.1 -1,-0.1 0.536 94.3-138.9-112.2 -7.5 -34.1 4.3 9.4 91 116 A G < - 0 0 1 -4,-2.1 2,-0.3 -7,-0.1 -20,-0.2 -0.099 16.7 -98.7 78.1 177.4 -33.0 4.0 5.7 92 117 A M E -F 70 0C 1 -22,-2.1 -22,-3.2 -4,-0.1 2,-0.1 -0.991 26.7-114.8-137.9 145.5 -30.0 5.6 4.0 93 118 A T E > -F 69 0C 31 -2,-0.3 4,-2.5 -24,-0.3 -24,-0.2 -0.402 31.9-111.4 -73.3 159.3 -29.6 8.7 1.8 94 119 A V H > S+ 0 0 0 -26,-1.9 4,-2.2 -29,-0.4 5,-0.2 0.917 122.1 49.5 -55.0 -43.8 -28.6 8.3 -1.8 95 120 A G H > S+ 0 0 12 -29,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.901 109.3 51.2 -64.8 -40.7 -25.3 10.0 -0.9 96 121 A E H > S+ 0 0 89 -30,-0.5 4,-2.7 2,-0.2 -1,-0.2 0.872 107.8 54.1 -61.8 -36.1 -24.8 7.6 2.0 97 122 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.924 108.9 47.1 -66.6 -43.2 -25.5 4.7 -0.3 98 123 A a H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-0.4 0.924 112.9 49.8 -62.0 -43.6 -22.8 5.9 -2.7 99 124 A A H X>S+ 0 0 28 -4,-2.4 4,-2.7 1,-0.2 5,-0.6 0.926 112.7 47.0 -59.8 -43.3 -20.4 6.4 0.1 100 125 A A H X5S+ 0 0 3 -4,-2.7 6,-2.3 3,-0.2 4,-1.3 0.912 114.6 46.6 -65.7 -42.9 -21.2 2.9 1.5 101 126 A A H X5S+ 0 0 0 -4,-2.7 4,-0.6 4,-0.2 -2,-0.2 0.942 123.4 31.6 -62.6 -50.2 -20.8 1.3 -2.0 102 127 A I H <5S+ 0 0 0 -4,-2.8 89,-0.2 -5,-0.2 108,-0.2 0.876 129.0 33.2 -80.5 -41.6 -17.5 3.0 -2.9 103 128 A T H <5S+ 0 0 14 -4,-2.7 87,-2.9 -5,-0.4 88,-0.5 0.717 132.8 26.3 -91.9 -20.8 -15.8 3.4 0.5 104 129 A M H < - 0 0 0 -6,-2.3 4,-1.3 1,-0.2 -25,-0.2 -0.444 16.0-166.5 -67.0 118.6 -21.3 -2.4 0.4 107 132 A N H > S+ 0 0 16 -27,-2.9 4,-1.9 -2,-0.3 34,-0.2 0.831 84.1 51.3 -77.5 -36.2 -23.1 -4.6 -2.2 108 133 A S H > S+ 0 0 1 -28,-0.5 4,-2.8 -30,-0.3 5,-0.2 0.897 106.9 55.6 -69.0 -39.8 -26.7 -3.9 -1.2 109 134 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.925 107.7 49.8 -54.0 -45.5 -26.0 -0.2 -1.4 110 135 A A H X S+ 0 0 0 -4,-1.3 4,-2.4 1,-0.2 -1,-0.2 0.902 110.5 49.4 -59.2 -43.4 -24.8 -0.7 -5.0 111 136 A N H X S+ 0 0 19 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.902 109.4 51.3 -64.3 -41.3 -27.9 -2.7 -5.9 112 137 A L H X S+ 0 0 29 -4,-2.8 4,-1.4 1,-0.2 -2,-0.2 0.931 113.9 44.5 -60.4 -45.1 -30.2 -0.0 -4.4 113 138 A L H X S+ 0 0 0 -4,-2.3 4,-0.9 -5,-0.2 -2,-0.2 0.860 108.2 58.2 -64.2 -38.5 -28.4 2.7 -6.4 114 139 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.8 1,-0.2 3,-0.9 0.911 102.7 54.1 -60.3 -42.3 -28.4 0.5 -9.5 115 140 A A H ><5S+ 0 0 59 -4,-2.2 3,-1.7 1,-0.2 -1,-0.2 0.915 103.7 56.7 -56.0 -43.5 -32.2 0.3 -9.3 116 141 A T H 3<5S+ 0 0 27 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.714 108.1 46.3 -64.6 -23.0 -32.4 4.2 -9.3 117 142 A V T <<5S- 0 0 18 -4,-0.9 -1,-0.3 -3,-0.9 -2,-0.2 0.256 130.0 -90.1-102.3 11.1 -30.5 4.5 -12.6 118 143 A G T <>5 - 0 0 52 -3,-1.7 4,-1.7 -4,-0.2 3,-0.3 0.743 65.7 -86.9 89.2 26.2 -32.5 1.8 -14.4 119 144 A G H > S+ 0 0 9 0, 0.0 4,-2.3 0, 0.0 17,-0.5 0.869 141.7 52.5 -49.4 -40.4 -27.6 -2.7 -15.5 121 146 A A H > S+ 0 0 76 -3,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.923 109.0 49.1 -65.7 -43.7 -29.3 -1.7 -18.8 122 147 A G H X S+ 0 0 22 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.878 111.9 48.1 -62.3 -40.0 -29.7 1.9 -17.5 123 148 A L H X S+ 0 0 2 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.894 110.9 51.1 -68.0 -39.7 -26.1 2.2 -16.4 124 149 A T H X S+ 0 0 24 -4,-2.3 4,-2.3 13,-0.3 -2,-0.2 0.908 108.8 51.5 -62.7 -40.1 -24.9 0.8 -19.7 125 150 A A H X S+ 0 0 42 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.914 107.8 52.5 -63.2 -41.7 -27.1 3.4 -21.5 126 151 A F H X S+ 0 0 35 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.910 107.6 52.1 -57.5 -44.7 -25.5 6.1 -19.4 127 152 A L H ><>S+ 0 0 2 -4,-2.2 5,-2.7 1,-0.2 3,-0.5 0.925 108.8 49.7 -58.7 -45.1 -22.0 4.8 -20.4 128 153 A R H ><5S+ 0 0 78 -4,-2.3 3,-1.5 1,-0.2 -1,-0.2 0.890 106.5 57.5 -60.4 -37.4 -23.1 5.0 -24.1 129 154 A Q H 3<5S+ 0 0 146 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.780 106.8 47.4 -64.7 -29.9 -24.3 8.6 -23.5 130 155 A I T <<5S- 0 0 13 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.292 127.2 -99.3 -94.5 9.6 -20.8 9.7 -22.3 131 156 A G T < 5S+ 0 0 39 -3,-1.5 2,-0.8 1,-0.2 -3,-0.2 0.677 78.7 135.8 84.8 17.8 -19.2 8.0 -25.3 132 157 A D < + 0 0 5 -5,-2.7 -1,-0.2 -6,-0.2 -2,-0.2 -0.895 21.7 172.0 -95.2 108.6 -18.1 4.7 -23.7 133 158 A N + 0 0 119 -2,-0.8 -1,-0.1 -3,-0.1 -5,-0.1 0.283 69.9 46.8-100.4 9.4 -19.1 2.1 -26.4 134 159 A V S S+ 0 0 45 -7,-0.1 21,-0.2 23,-0.1 -1,-0.1 0.771 82.6 87.2-118.8 -50.2 -17.4 -0.8 -24.8 135 160 A T + 0 0 0 -8,-0.1 2,-0.4 22,-0.1 21,-0.2 -0.271 54.6 179.9 -61.5 140.2 -18.1 -1.1 -21.0 136 161 A R - 0 0 75 19,-2.5 19,-0.5 16,-0.1 2,-0.5 -0.989 22.6-159.8-146.7 134.4 -21.2 -3.0 -20.2 137 162 A L + 0 0 3 -17,-0.5 -13,-0.3 -2,-0.4 -14,-0.1 -0.968 20.8 160.6-109.9 135.0 -23.0 -4.0 -17.0 138 163 A D + 0 0 58 -2,-0.5 2,-0.2 1,-0.1 -17,-0.2 0.634 56.0 41.0-122.4 -30.8 -25.4 -6.9 -17.4 139 164 A R - 0 0 31 -19,-0.1 2,-0.1 5,-0.1 -1,-0.1 -0.701 69.7-118.8-123.1 171.7 -26.0 -8.2 -13.9 140 165 A W > - 0 0 100 -2,-0.2 4,-1.8 1,-0.1 2,-0.3 -0.439 55.8 -42.7 -95.8 172.1 -26.6 -7.1 -10.3 141 166 A E T 4 S+ 0 0 4 1,-0.3 -1,-0.1 -34,-0.2 -96,-0.0 -0.636 119.6 15.0 -67.7 138.1 -24.6 -7.7 -7.1 142 167 A T T >4 S+ 0 0 37 -2,-0.3 3,-1.1 -64,-0.1 -1,-0.3 -0.990 120.3 55.5-107.5 3.8 -23.4 -10.3 -6.4 143 168 A E G >4 S+ 0 0 111 -3,-0.3 3,-1.6 1,-0.2 -2,-0.2 0.728 88.0 83.1 -62.8 -22.1 -23.6 -12.3 -9.7 144 169 A L G 3< S+ 0 0 2 -4,-1.8 -100,-0.4 1,-0.3 3,-0.3 0.596 85.8 53.7 -67.6 -13.0 -21.7 -9.7 -11.7 145 170 A N G < + 0 0 38 -3,-1.1 69,-2.2 1,-0.2 -1,-0.3 0.112 67.1 116.3-107.5 25.5 -18.2 -10.8 -10.7 146 171 A E < - 0 0 61 -3,-1.6 -1,-0.2 67,-0.2 -2,-0.1 0.805 57.6-160.3 -60.1 -31.2 -18.6 -14.5 -11.7 147 172 A A - 0 0 10 -3,-0.3 93,-0.2 1,-0.2 70,-0.1 0.870 10.4-171.2 53.0 46.9 -15.8 -13.9 -14.3 148 173 A L > - 0 0 48 1,-0.1 3,-1.9 5,-0.1 -1,-0.2 -0.460 34.7 -97.1 -65.3 137.3 -16.6 -16.9 -16.6 149 174 A P T 3 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.349 106.8 5.6 -57.6 132.2 -14.0 -17.4 -19.2 150 175 A G T 3 S+ 0 0 83 1,-0.2 2,-0.5 -3,-0.1 -2,-0.1 0.509 93.5 135.7 74.0 6.5 -15.0 -15.8 -22.5 151 176 A D < - 0 0 33 -3,-1.9 -1,-0.2 1,-0.1 -4,-0.0 -0.781 40.3-163.5 -91.3 123.2 -18.1 -14.2 -21.0 152 177 A A > + 0 0 35 -2,-0.5 3,-0.9 -3,-0.1 -1,-0.1 0.571 51.5 116.3 -82.8 -11.1 -18.6 -10.6 -22.1 153 178 A R T 3 S+ 0 0 88 1,-0.2 -6,-0.1 -15,-0.1 -16,-0.1 -0.290 81.8 5.0 -60.4 141.5 -21.1 -9.7 -19.4 154 179 A D T 3 S+ 0 0 0 1,-0.2 -111,-2.3 -112,-0.1 -110,-0.6 0.842 100.2 137.5 60.6 39.1 -20.1 -7.1 -16.8 155 180 A T E < +E 42 0B 0 -3,-0.9 -19,-2.5 -19,-0.5 2,-0.3 -0.770 30.6 177.1-117.2 160.2 -16.8 -6.2 -18.5 156 181 A T E -E 41 0B 0 -115,-2.4 -115,-2.5 -2,-0.3 3,-0.1 -0.798 27.0-120.7-135.7-178.0 -14.7 -3.2 -19.4 157 182 A T > - 0 0 5 -2,-0.3 4,-2.8 -117,-0.2 5,-0.3 -0.934 27.1-116.8-119.4 154.3 -11.3 -2.6 -21.1 158 183 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.927 117.1 49.0 -53.4 -42.9 -8.5 -0.8 -19.3 159 184 A A H > S+ 0 0 26 -122,-2.5 4,-2.2 2,-0.2 5,-0.2 0.901 113.4 45.8 -62.4 -43.4 -8.6 1.9 -22.0 160 185 A S H > S+ 0 0 19 -123,-0.5 4,-2.7 2,-0.2 -1,-0.2 0.917 113.7 48.1 -67.3 -45.6 -12.4 2.4 -21.8 161 186 A M H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.923 112.6 48.5 -64.4 -43.4 -12.5 2.4 -18.0 162 187 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.3 -1,-0.2 0.941 113.6 46.9 -59.7 -46.7 -9.6 4.9 -17.8 163 188 A A H X S+ 0 0 33 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.908 113.2 49.1 -63.0 -40.2 -11.3 7.2 -20.4 164 189 A T H X S+ 0 0 1 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.918 110.7 49.1 -68.3 -42.2 -14.6 6.9 -18.6 165 190 A L H X S+ 0 0 2 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.925 110.8 51.2 -61.7 -43.8 -13.2 7.8 -15.2 166 191 A R H X>S+ 0 0 72 -4,-2.5 4,-2.4 -5,-0.2 5,-0.6 0.925 109.8 50.7 -58.9 -43.2 -11.4 10.7 -16.7 167 192 A K H X5S+ 0 0 42 -4,-2.4 4,-1.4 1,-0.2 6,-0.6 0.915 113.1 44.9 -58.6 -44.7 -14.7 11.9 -18.2 168 193 A L H <5S+ 0 0 1 -4,-2.4 6,-0.2 1,-0.2 -1,-0.2 0.888 120.4 39.0 -70.1 -38.3 -16.5 11.6 -14.9 169 194 A L H <5S+ 0 0 14 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.752 134.7 7.9 -84.1 -28.1 -13.8 13.3 -12.9 170 195 A T H <5S+ 0 0 39 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.590 98.4 85.4-132.0 -14.0 -12.6 16.1 -15.2 171 196 A S S < - 0 0 47 -2,-0.3 4,-2.8 -119,-0.2 5,-0.2 -0.142 37.0-103.7 -61.2 163.5 -21.0 19.7 -12.2 176 201 A A H > S+ 0 0 44 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.937 123.8 48.4 -57.2 -48.4 -18.0 21.0 -10.2 177 202 A R H > S+ 0 0 194 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.901 112.0 49.5 -60.4 -40.8 -19.6 19.8 -7.0 178 203 A S H > S+ 0 0 6 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.915 109.6 50.1 -66.7 -43.0 -20.4 16.4 -8.4 179 204 A Q H X S+ 0 0 22 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.901 112.3 49.2 -57.2 -43.6 -16.8 15.9 -9.8 180 205 A R H X S+ 0 0 176 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.866 110.5 50.6 -64.8 -38.8 -15.5 16.9 -6.3 181 206 A Q H X S+ 0 0 57 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.923 108.8 49.6 -65.3 -45.9 -17.8 14.4 -4.7 182 207 A L H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.929 112.9 48.4 -60.9 -43.7 -16.9 11.5 -6.9 183 208 A L H X S+ 0 0 60 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.927 109.7 51.6 -59.6 -46.7 -13.2 12.2 -6.2 184 209 A Q H X S+ 0 0 88 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.896 105.4 55.8 -63.9 -38.4 -13.7 12.4 -2.5 185 210 A W H < S+ 0 0 11 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.924 110.1 45.8 -57.8 -43.2 -15.5 9.1 -2.4 186 211 A M H >< S+ 0 0 1 -4,-1.8 22,-1.9 1,-0.2 3,-1.4 0.902 110.8 52.7 -66.2 -38.7 -12.5 7.5 -4.0 187 212 A V H 3< S+ 0 0 35 -4,-2.5 -1,-0.2 20,-0.3 -2,-0.2 0.885 107.7 54.3 -58.9 -36.3 -10.1 9.3 -1.6 188 213 A D T 3< S+ 0 0 54 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.344 73.6 142.4 -85.5 6.0 -12.2 7.9 1.3 189 214 A D < - 0 0 0 -3,-1.4 -86,-0.2 19,-0.2 -85,-0.1 -0.241 25.1-178.6 -50.4 127.4 -12.0 4.2 0.3 190 215 A R S S+ 0 0 137 -87,-2.9 -1,-0.2 3,-0.2 -86,-0.2 0.562 70.1 70.0-102.4 -13.0 -11.6 2.1 3.5 191 216 A V S S- 0 0 74 -88,-0.5 4,-0.1 -89,-0.2 -1,-0.1 0.949 128.6 -11.2 -70.6 -49.1 -11.4 -1.3 1.8 192 217 A A S > S+ 0 0 10 16,-0.1 4,-3.0 3,-0.1 5,-0.2 0.633 114.4 86.9-124.0 -24.4 -7.9 -0.8 0.3 193 218 A G H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.903 93.0 43.8 -48.7 -60.6 -7.0 2.9 0.7 194 219 A P H > S+ 0 0 65 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.894 115.5 49.8 -55.3 -41.4 -5.5 2.8 4.2 195 220 A L H > S+ 0 0 118 2,-0.2 4,-0.8 1,-0.2 -2,-0.2 0.942 111.4 48.5 -61.7 -49.0 -3.5 -0.4 3.4 196 221 A I H >X S+ 0 0 36 -4,-3.0 3,-1.1 1,-0.2 4,-0.8 0.915 110.1 52.1 -58.1 -45.4 -2.1 1.1 0.1 197 222 A R H >< S+ 0 0 103 -4,-2.7 3,-0.8 1,-0.2 -1,-0.2 0.879 101.4 61.6 -56.2 -38.2 -1.1 4.3 2.0 198 223 A S H 3< S+ 0 0 89 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.743 113.0 36.1 -62.9 -24.2 0.7 2.2 4.6 199 224 A V H << S+ 0 0 110 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.391 96.3 97.6-110.6 -0.4 3.0 0.9 1.8 200 225 A L S << S- 0 0 31 -3,-0.8 3,-0.1 -4,-0.8 6,-0.0 -0.701 79.9-110.8 -85.5 142.2 3.3 4.0 -0.4 201 226 A P > - 0 0 64 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.296 50.4 -79.2 -62.0 155.0 6.4 6.2 0.1 202 227 A A T 3 S+ 0 0 106 1,-0.2 25,-0.2 25,-0.0 3,-0.1 -0.241 116.5 33.7 -49.6 139.0 5.8 9.5 1.7 203 228 A G T 3 S+ 0 0 29 1,-0.2 25,-3.2 -3,-0.1 2,-0.6 0.365 83.4 123.8 98.4 -4.3 4.4 12.1 -0.8 204 229 A W < - 0 0 39 -3,-1.4 2,-0.2 23,-0.2 -1,-0.2 -0.828 51.3-142.9 -98.2 122.2 2.3 9.8 -3.0 205 230 A F E -C 225 0A 44 20,-3.0 20,-1.2 -2,-0.6 2,-0.4 -0.569 20.1-173.3 -73.7 137.3 -1.4 10.6 -3.4 206 231 A I E +C 224 0A 12 -2,-0.2 2,-0.3 18,-0.2 18,-0.2 -0.996 18.1 159.6-135.2 136.8 -3.8 7.6 -3.6 207 232 A A E +C 223 0A 0 16,-1.7 16,-2.5 -2,-0.4 2,-0.3 -0.963 26.9 152.4-138.0 147.0 -7.6 7.4 -4.3 208 233 A D E -C 222 0A 0 -22,-1.9 2,-0.3 -2,-0.3 14,-0.2 -0.997 41.5-147.8-163.8 161.6 -9.1 4.1 -5.5 209 234 A K E -C 221 0A 4 12,-2.1 12,-2.5 -2,-0.3 2,-0.2 -0.941 28.4-163.2-137.6 129.7 -11.8 1.5 -5.9 210 235 A T E -C 220 0A 10 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.569 5.0-168.2-105.1 166.8 -10.8 -2.2 -5.9 211 236 A G E -C 219 0A 3 8,-2.3 8,-2.4 -2,-0.2 2,-0.3 -0.984 5.9-166.8-150.3 158.4 -12.6 -5.3 -7.0 212 237 A A E +C 218 0A 33 -2,-0.3 -167,-0.3 6,-0.2 6,-0.3 -0.980 14.7 163.5-144.1 151.4 -12.3 -9.1 -6.8 213 238 A G - 0 0 15 4,-2.6 3,-0.5 -2,-0.3 -67,-0.2 -0.856 38.6 -59.9-151.7-171.6 -14.0 -12.0 -8.6 214 240 A E S > S+ 0 0 93 -69,-2.2 3,-2.0 -2,-0.3 26,-0.3 -0.240 106.2 30.5 -75.5 166.7 -13.9 -15.6 -9.5 215 241 A R T 3 S- 0 0 108 1,-0.3 26,-1.6 24,-0.1 25,-0.6 0.810 138.8 -52.9 54.6 34.8 -11.1 -17.5 -11.4 216 242 A G T 3 S+ 0 0 7 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.2 0.384 87.8 163.3 88.8 -3.3 -8.5 -15.1 -10.0 217 243 A A < + 0 0 0 -3,-2.0 -4,-2.6 -72,-0.1 2,-0.3 -0.196 6.9 153.9 -56.1 135.7 -10.2 -11.9 -11.1 218 244 A R E +CD 212 238A 32 20,-1.7 20,-2.7 -6,-0.3 2,-0.3 -0.975 10.3 162.6-160.3 145.9 -8.8 -8.8 -9.3 219 245 A G E -CD 211 237A 2 -8,-2.4 -8,-2.3 -2,-0.3 2,-0.3 -1.000 20.3-158.3-165.6 168.4 -8.6 -5.1 -10.1 220 246 A I E -CD 210 236A 19 16,-2.4 16,-2.5 -2,-0.3 2,-0.5 -0.976 7.4-161.0-154.9 136.1 -8.1 -1.5 -9.2 221 247 A V E +CD 209 235A 0 -12,-2.5 -12,-2.1 -2,-0.3 2,-0.3 -0.993 36.6 167.9-114.3 125.9 -9.0 1.8 -10.6 222 248 A A E -CD 208 234A 8 12,-2.5 12,-2.9 -2,-0.5 2,-0.4 -0.950 40.9-140.8-142.7 153.5 -6.8 4.5 -9.0 223 249 A L E +CD 207 233A 2 -16,-2.5 -16,-1.7 -2,-0.3 2,-0.3 -0.974 38.3 169.0-111.7 133.6 -5.5 8.0 -9.0 224 250 A L E +CD 206 232A 12 8,-2.4 8,-2.5 -2,-0.4 -18,-0.2 -0.993 6.6 133.1-146.1 142.8 -1.9 8.2 -8.1 225 251 A G E -C 205 0A 0 -20,-1.2 -20,-3.0 -2,-0.3 3,-0.4 -0.887 42.3-101.2 178.2 163.1 1.0 10.6 -8.1 226 252 A P S > S+ 0 0 17 0, 0.0 3,-1.6 0, 0.0 -22,-0.2 -0.210 95.8 43.6 -79.9 178.4 3.9 12.2 -6.3 227 254 A N T 3 S- 0 0 145 1,-0.3 -23,-0.2 -25,-0.2 3,-0.1 0.816 129.4 -74.1 52.3 32.2 4.0 15.6 -4.6 228 255 A N T 3 S+ 0 0 117 -25,-3.2 2,-0.4 -3,-0.4 -1,-0.3 0.760 100.8 130.3 55.1 33.3 0.6 14.7 -3.1 229 256 A K < - 0 0 127 -3,-1.6 2,-2.0 -26,-0.3 -24,-0.4 -0.913 67.9-124.8-119.4 140.5 -1.2 15.2 -6.5 230 257 A A + 0 0 18 -2,-0.4 -5,-0.2 1,-0.2 -204,-0.1 -0.574 51.3 155.1 -76.8 77.7 -3.6 13.0 -8.4 231 258 A E + 0 0 42 -2,-2.0 -205,-2.7 -7,-0.2 -204,-0.5 0.874 52.3 26.6 -79.3 -38.7 -1.4 13.1 -11.4 232 259 A R E -AD 25 224A 7 -8,-2.5 -8,-2.4 -207,-0.3 2,-0.5 -0.930 61.7-133.4-132.7 149.1 -2.4 9.8 -13.2 233 260 A I E -AD 24 223A 0 -209,-3.1 -209,-2.7 -2,-0.3 2,-0.5 -0.864 27.0-170.2 -89.2 130.5 -5.2 7.4 -13.6 234 261 A V E -AD 23 222A 8 -12,-2.9 -12,-2.5 -2,-0.5 2,-0.5 -0.994 5.2-176.3-126.3 123.0 -4.0 3.8 -13.2 235 262 A V E +AD 22 221A 0 -213,-2.4 -213,-2.0 -2,-0.5 2,-0.4 -0.990 5.4 175.2-119.1 123.0 -6.3 0.9 -14.1 236 263 A I E +AD 21 220A 4 -16,-2.5 -16,-2.4 -2,-0.5 2,-0.4 -0.994 1.5 177.3-130.3 125.6 -5.1 -2.6 -13.5 237 264 A Y E -AD 20 219A 1 -217,-2.8 -217,-2.9 -2,-0.4 2,-0.4 -0.948 7.7-165.9-123.0 147.3 -7.3 -5.8 -14.0 238 265 A L E +AD 19 218A 2 -20,-2.7 -20,-1.7 -2,-0.4 2,-0.3 -0.975 12.4 172.4-126.6 144.4 -6.3 -9.4 -13.7 239 266 A R E +A 18 0A 19 -221,-2.2 -221,-2.1 -2,-0.4 -23,-0.1 -0.994 49.4 21.5-148.8 156.1 -8.2 -12.5 -14.9 240 267 A D S S+ 0 0 58 -25,-0.6 -24,-0.2 -26,-0.3 -1,-0.1 0.912 76.2 131.5 58.9 51.7 -7.9 -16.3 -15.3 241 268 A T - 0 0 4 -26,-1.6 -1,-0.2 -224,-0.2 -225,-0.1 -0.995 50.8-150.5-128.7 140.3 -5.2 -17.0 -12.8 242 269 A P + 0 0 121 0, 0.0 -26,-0.1 0, 0.0 -226,-0.1 0.351 57.0 129.0 -86.5 8.0 -5.4 -19.8 -10.2 243 270 A A - 0 0 19 -228,-0.4 -2,-0.1 1,-0.1 -27,-0.1 -0.155 65.4 -94.8 -69.8 155.6 -3.2 -17.8 -7.8 244 271 A S > - 0 0 50 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.220 32.7-113.2 -58.5 152.7 -3.9 -17.0 -4.2 245 272 A M H > S+ 0 0 83 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.915 118.7 56.0 -50.5 -47.0 -5.5 -13.7 -3.2 246 273 A A H > S+ 0 0 51 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.922 109.0 45.3 -54.7 -46.3 -2.2 -12.7 -1.5 247 274 A E H > S+ 0 0 103 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.879 111.8 50.9 -70.1 -37.2 -0.1 -13.3 -4.7 248 275 A R H X S+ 0 0 25 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.924 113.0 47.3 -62.3 -45.4 -2.6 -11.5 -7.0 249 276 A N H X S+ 0 0 56 -4,-2.8 4,-2.5 -5,-0.2 -2,-0.2 0.914 111.8 50.5 -60.6 -44.7 -2.4 -8.5 -4.5 250 277 A Q H X S+ 0 0 126 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.862 109.0 51.0 -62.9 -37.7 1.4 -8.7 -4.4 251 278 A Q H X S+ 0 0 24 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.909 110.8 47.6 -69.8 -41.1 1.7 -8.7 -8.2 252 279 A I H X S+ 0 0 22 -4,-2.0 4,-2.1 2,-0.2 3,-0.2 0.935 112.0 50.5 -62.0 -43.9 -0.6 -5.6 -8.6 253 280 A A H X S+ 0 0 61 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.890 107.2 55.9 -60.2 -39.7 1.4 -3.9 -5.9 254 281 A G H X S+ 0 0 17 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.841 104.6 50.8 -61.1 -37.4 4.6 -4.8 -7.8 255 282 A I H X S+ 0 0 0 -4,-1.7 4,-1.9 -3,-0.2 -1,-0.2 0.928 110.4 51.1 -63.3 -42.7 3.3 -3.1 -10.9 256 283 A G H X S+ 0 0 19 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.887 107.3 53.3 -58.3 -41.8 2.6 -0.1 -8.7 257 284 A A H X S+ 0 0 32 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.894 107.1 51.2 -62.8 -39.7 6.2 -0.3 -7.4 258 285 A A H X S+ 0 0 0 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.869 109.9 49.8 -64.6 -38.6 7.6 -0.2 -11.0 259 286 A L H < S+ 0 0 1 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.916 112.0 48.4 -63.5 -43.4 5.5 2.9 -11.7 260 287 A I H >< S+ 0 0 36 -4,-2.3 3,-0.8 1,-0.2 -2,-0.2 0.917 114.0 44.7 -64.3 -47.0 6.8 4.6 -8.6 261 288 A E H 3< S+ 0 0 105 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.781 125.0 34.0 -69.2 -26.8 10.4 3.8 -9.3 262 289 A H T 3< S+ 0 0 44 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 -0.372 76.8 137.3-126.8 52.3 10.2 4.8 -12.9 263 290 A W < + 0 0 11 -3,-0.8 2,-1.8 1,-0.2 -1,-0.1 0.804 47.1 80.9 -70.4 -35.5 7.6 7.6 -12.8 264 291 A Q 0 0 157 -3,-0.1 -1,-0.2 -4,-0.1 -4,-0.0 -0.492 360.0 360.0 -87.0 79.2 9.2 10.1 -15.2 265 292 A R 0 0 91 -2,-1.8 -233,-0.0 -3,-0.0 -2,-0.0 -0.836 360.0 360.0-123.1 360.0 8.2 8.9 -18.7