==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 20-DEC-10 3Q2Y . COMPND 2 MOLECULE: MULTIDRUG-EFFLUX TRANSPORTER 1 REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR S.BACHAS,C.EGINTON,G.GUNIO,H.WADE . 276 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17329.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 193 69.9 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 . 55 19.9 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 . 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 . 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 . 13 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 33.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 1 0 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 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 1 0 2 2 0 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 . 0 1 0 0 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 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 2 A K 0 0 207 0, 0.0 46,-0.1 0, 0.0 45,-0.1 0.000 360.0 360.0 360.0 -69.8 47.9 -28.1 9.9 2 3 A E + 0 0 198 2,-0.1 2,-0.3 43,-0.1 43,-0.0 0.024 360.0 37.5-100.7 30.2 44.7 -29.3 8.3 3 4 A S S S- 0 0 89 41,-0.1 43,-0.3 0, 0.0 2,-0.3 -0.868 86.2 -99.5-154.0-175.5 42.6 -28.6 11.5 4 5 A Y - 0 0 102 -2,-0.3 2,-0.4 41,-0.1 41,-0.2 -0.775 19.4-121.4-114.3 161.4 42.5 -25.9 14.2 5 6 A Y E -A 44 0A 53 39,-3.4 39,-3.0 -2,-0.3 2,-0.0 -0.835 28.5-132.5 -90.3 135.1 43.7 -25.5 17.8 6 7 A S E > -A 43 0A 36 -2,-0.4 4,-2.1 37,-0.2 5,-0.2 -0.246 35.1 -95.8 -69.0 173.2 41.0 -24.8 20.3 7 8 A I H > S+ 0 0 27 35,-0.5 4,-2.1 1,-0.2 5,-0.1 0.946 125.0 51.3 -58.3 -46.9 41.7 -22.0 22.7 8 9 A G H > S+ 0 0 32 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.814 107.8 53.9 -64.7 -30.7 43.1 -24.3 25.5 9 10 A E H > S+ 0 0 94 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.976 109.9 45.1 -67.0 -54.0 45.4 -25.9 23.0 10 11 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 5,-0.3 0.852 110.9 56.6 -55.7 -33.9 46.9 -22.6 21.9 11 12 A S H X>S+ 0 0 24 -4,-2.1 5,-1.3 1,-0.2 4,-1.1 0.928 109.0 42.8 -73.9 -41.1 47.1 -21.6 25.5 12 13 A K H <5S+ 0 0 89 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.901 117.3 50.3 -63.4 -39.7 49.2 -24.6 26.5 13 14 A L H <5S+ 0 0 103 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.790 121.6 28.3 -73.1 -33.0 51.3 -24.2 23.4 14 15 A A H <5S- 0 0 9 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.458 101.0-124.4-110.0 -3.5 52.2 -20.5 23.7 15 16 A N T <5 + 0 0 149 -4,-1.1 2,-0.4 -5,-0.3 -3,-0.2 0.959 67.8 129.9 57.3 54.0 52.0 -20.3 27.5 16 17 A V < - 0 0 16 -5,-1.3 -1,-0.3 -6,-0.2 -2,-0.2 -0.977 61.9-105.4-137.1 141.9 49.4 -17.5 27.3 17 18 A S > - 0 0 59 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.325 16.7-125.3 -73.8 153.7 46.2 -17.6 29.4 18 19 A I H > S+ 0 0 57 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.956 114.8 55.1 -58.7 -47.4 42.9 -18.4 27.8 19 20 A K H > S+ 0 0 160 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.883 108.1 49.9 -51.8 -38.4 41.6 -15.2 29.4 20 21 A A H > S+ 0 0 19 2,-0.2 4,-3.6 1,-0.2 5,-0.3 0.932 110.3 47.8 -68.6 -45.9 44.4 -13.3 27.6 21 22 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.941 111.6 51.7 -58.0 -45.4 43.7 -14.8 24.2 22 23 A R H X S+ 0 0 103 -4,-3.0 4,-1.6 -5,-0.2 -1,-0.2 0.903 114.4 42.8 -57.2 -41.7 40.1 -14.0 24.7 23 24 A Y H X S+ 0 0 133 -4,-1.8 4,-2.1 -5,-0.3 5,-0.3 0.960 109.1 55.2 -75.9 -49.6 41.1 -10.4 25.5 24 25 A Y H <>S+ 0 0 17 -4,-3.6 5,-2.6 1,-0.3 6,-1.8 0.771 109.0 52.9 -48.1 -32.2 43.6 -10.1 22.7 25 26 A D H ><5S+ 0 0 19 -4,-2.1 3,-1.2 -5,-0.3 -1,-0.3 0.916 103.8 53.8 -67.0 -47.3 40.7 -11.1 20.6 26 27 A K H 3<5S+ 0 0 75 -4,-1.6 -2,-0.2 1,-0.3 -3,-0.1 0.868 115.0 41.2 -60.3 -35.9 38.4 -8.3 22.0 27 28 A I T 3<5S- 0 0 30 -4,-2.1 -1,-0.3 3,-0.1 -2,-0.2 0.513 110.5-120.7 -88.1 -6.8 41.0 -5.7 21.1 28 29 A D T < 5S+ 0 0 92 -3,-1.2 -3,-0.2 -4,-0.3 3,-0.2 0.905 77.4 122.5 64.4 41.2 41.9 -7.2 17.7 29 30 A L S - 0 0 33 5,-1.7 4,-2.7 -2,-0.4 5,-0.2 -0.438 17.3-142.5 -65.6 113.6 32.2 -21.3 15.0 37 38 A P T 4 S+ 0 0 107 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.624 96.8 37.6 -55.6 -17.2 29.0 -19.4 14.2 38 39 A D T 4 S+ 0 0 148 3,-0.1 -2,-0.0 0, 0.0 -3,-0.0 0.853 126.5 27.3 -99.5 -51.2 27.0 -21.6 16.6 39 40 A T T 4 S- 0 0 69 2,-0.1 3,-0.1 1,-0.0 -3,-0.0 0.660 88.8-134.5 -89.4 -17.0 29.2 -22.3 19.6 40 41 A S < + 0 0 80 -4,-2.7 2,-0.1 1,-0.2 -1,-0.0 0.580 48.9 159.9 67.5 12.4 31.3 -19.2 19.5 41 42 A Y - 0 0 144 -5,-0.2 -5,-1.7 1,-0.1 2,-0.5 -0.399 39.6-125.6 -66.6 139.6 34.3 -21.4 20.0 42 43 A R E - B 0 35A 69 -7,-0.2 -35,-0.5 -3,-0.1 2,-0.4 -0.775 26.7-171.0 -89.1 129.7 37.6 -19.8 19.0 43 44 A Y E -AB 6 34A 59 -9,-3.1 -9,-2.3 -2,-0.5 -10,-0.5 -0.970 0.8-165.7-123.9 135.1 39.7 -21.8 16.6 44 45 A Y E -A 5 0A 0 -39,-3.0 -39,-3.4 -2,-0.4 2,-0.2 -0.870 13.1-132.6-120.9 150.8 43.3 -21.0 15.7 45 46 A T - 0 0 36 -2,-0.3 4,-0.5 -41,-0.2 -41,-0.1 -0.535 22.7-120.5 -92.2 165.1 45.7 -22.2 12.9 46 47 A D S > S+ 0 0 82 -43,-0.3 3,-1.5 1,-0.2 4,-0.3 0.921 110.4 58.2 -67.4 -43.0 49.3 -23.3 13.3 47 48 A S G > S+ 0 0 93 1,-0.3 3,-0.9 2,-0.2 4,-0.2 0.829 101.0 55.9 -60.5 -33.8 50.6 -20.6 11.0 48 49 A Q G > S+ 0 0 20 1,-0.2 3,-1.7 2,-0.1 4,-0.4 0.680 82.4 85.1 -75.7 -14.6 49.2 -17.9 13.1 49 50 A L G X S+ 0 0 35 -3,-1.5 3,-1.1 -4,-0.5 4,-0.4 0.761 79.7 68.8 -56.2 -22.3 51.0 -19.0 16.3 50 51 A I G X> S+ 0 0 106 -3,-0.9 3,-1.0 -4,-0.3 4,-0.7 0.792 83.0 68.0 -72.0 -25.7 53.9 -17.0 15.2 51 52 A H H <> S+ 0 0 109 -3,-1.7 4,-1.4 1,-0.2 -1,-0.3 0.783 91.3 66.9 -65.0 -18.5 52.2 -13.6 15.6 52 53 A L H <> S+ 0 0 1 -3,-1.1 4,-3.3 -4,-0.4 5,-0.3 0.824 84.6 69.5 -74.1 -29.4 52.3 -14.4 19.3 53 54 A D H <> S+ 0 0 91 -3,-1.0 4,-2.8 -4,-0.4 5,-0.3 0.964 102.4 43.4 -50.8 -56.9 56.0 -14.1 19.5 54 55 A L H X S+ 0 0 42 -4,-0.7 4,-3.0 1,-0.2 5,-0.3 0.943 113.7 52.7 -52.2 -49.7 56.0 -10.4 18.9 55 56 A I H X S+ 0 0 2 -4,-1.4 4,-2.4 1,-0.2 -2,-0.2 0.931 111.9 44.9 -55.7 -45.9 53.1 -10.1 21.3 56 57 A K H X S+ 0 0 81 -4,-3.3 4,-2.9 1,-0.2 -1,-0.2 0.920 114.1 47.0 -69.9 -44.5 54.9 -11.9 24.1 57 58 A S H X S+ 0 0 58 -4,-2.8 4,-1.8 -5,-0.3 5,-0.2 0.953 114.5 46.7 -60.0 -48.9 58.2 -10.2 23.7 58 59 A L H X>S+ 0 0 0 -4,-3.0 5,-2.5 -5,-0.3 4,-0.6 0.900 112.4 51.4 -62.7 -35.8 56.6 -6.7 23.6 59 60 A K H ><5S+ 0 0 127 -4,-2.4 3,-1.3 -5,-0.3 -1,-0.2 0.930 105.4 56.5 -63.5 -43.8 54.5 -7.7 26.6 60 61 A Y H 3<5S+ 0 0 211 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.850 109.9 43.4 -57.1 -37.1 57.6 -8.8 28.4 61 62 A I H 3<5S- 0 0 66 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.482 121.8-109.2 -89.6 -3.1 59.3 -5.3 27.9 62 63 A G T <<5 + 0 0 56 -3,-1.3 -3,-0.2 -4,-0.6 -2,-0.1 0.642 54.2 166.3 88.5 20.7 56.0 -3.7 28.8 63 64 A T < - 0 0 9 -5,-2.5 -1,-0.2 -6,-0.2 5,-0.1 -0.437 44.9-111.9 -56.9 128.5 54.7 -2.2 25.6 64 65 A P >> - 0 0 73 0, 0.0 4,-1.2 0, 0.0 3,-1.1 -0.344 26.4-114.0 -61.3 156.5 51.1 -1.3 26.1 65 66 A L H 3> S+ 0 0 33 1,-0.2 4,-1.2 2,-0.2 3,-0.3 0.868 113.7 56.1 -59.8 -35.6 48.8 -3.5 24.0 66 67 A E H 3> S+ 0 0 118 1,-0.3 4,-0.6 2,-0.2 -1,-0.2 0.706 104.5 54.2 -78.2 -11.7 47.6 -0.7 21.8 67 68 A E H X> S+ 0 0 85 -3,-1.1 4,-2.3 2,-0.2 3,-0.6 0.818 98.6 62.4 -83.5 -33.5 51.1 0.1 20.8 68 69 A M H 3X S+ 0 0 2 -4,-1.2 4,-2.3 -3,-0.3 -2,-0.2 0.876 96.2 60.5 -60.6 -35.3 51.7 -3.5 19.8 69 70 A K H 3< S+ 0 0 78 -4,-1.2 4,-0.4 1,-0.2 -1,-0.3 0.878 108.9 42.3 -57.4 -40.0 49.0 -3.0 17.1 70 71 A K H X< S+ 0 0 140 -3,-0.6 3,-0.8 -4,-0.6 -1,-0.2 0.842 112.2 56.6 -75.4 -33.9 51.1 -0.3 15.6 71 72 A A H >< S+ 0 0 2 -4,-2.3 3,-1.2 1,-0.2 -2,-0.2 0.838 96.6 62.0 -66.7 -33.4 54.2 -2.4 16.1 72 73 A Q T 3< S+ 0 0 67 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.721 94.3 64.4 -62.2 -24.1 52.9 -5.4 14.1 73 74 A D T < S+ 0 0 143 -3,-0.8 2,-0.3 -4,-0.4 -1,-0.3 0.220 82.4 109.7 -91.7 15.7 52.7 -3.4 11.0 74 75 A L < - 0 0 62 -3,-1.2 2,-0.1 4,-0.0 -3,-0.0 -0.685 59.6-140.6-101.4 140.3 56.4 -2.8 10.7 75 76 A E > - 0 0 64 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.393 48.0 -91.5 -77.1 172.3 59.0 -4.1 8.2 76 77 A M H > S+ 0 0 151 1,-0.2 4,-3.0 2,-0.2 3,-0.5 0.952 122.1 52.8 -57.1 -53.8 62.3 -4.9 9.9 77 78 A E H > S+ 0 0 148 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.894 113.0 44.2 -49.3 -52.5 64.0 -1.5 9.5 78 79 A E H > S+ 0 0 53 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.861 114.7 50.7 -60.4 -34.3 61.2 0.4 11.0 79 80 A L H X S+ 0 0 37 -4,-2.0 4,-1.8 -3,-0.5 -2,-0.2 0.808 104.5 57.0 -76.5 -31.6 61.0 -2.3 13.8 80 81 A F H X S+ 0 0 153 -4,-3.0 4,-1.5 2,-0.2 3,-0.2 0.958 109.2 46.9 -52.7 -54.8 64.7 -2.0 14.4 81 82 A A H >X S+ 0 0 47 -4,-2.2 4,-2.0 1,-0.2 3,-1.0 0.969 106.4 57.6 -52.4 -56.7 64.0 1.7 15.0 82 83 A F H 3X S+ 0 0 35 -4,-2.6 4,-2.0 1,-0.3 -1,-0.2 0.851 104.6 53.0 -40.7 -46.1 61.1 0.8 17.3 83 84 A Y H 3X S+ 0 0 91 -4,-1.8 4,-2.6 -3,-0.2 -1,-0.3 0.876 102.0 55.8 -63.3 -38.0 63.5 -1.1 19.4 84 85 A T H X S+ 0 0 44 -4,-2.6 3,-2.0 1,-0.2 4,-1.1 0.931 104.7 53.6 -52.9 -47.6 71.1 5.7 61.4 113 114 A R H 3< S+ 0 0 65 -4,-1.7 3,-0.3 1,-0.3 -1,-0.2 0.843 106.1 54.1 -55.3 -36.8 73.0 8.8 62.8 114 115 A Q T 3< S+ 0 0 42 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.045 111.2 43.5 -94.0 22.0 69.8 9.9 64.5 115 116 A M T <4 S+ 0 0 130 -3,-2.0 -1,-0.2 0, 0.0 -2,-0.2 0.271 106.1 61.1-132.1 -9.1 69.4 6.6 66.3 116 117 A E S < S+ 0 0 151 -4,-1.1 -2,-0.2 -3,-0.3 -3,-0.1 0.076 72.8 148.5-100.0 17.4 73.1 6.4 67.2 117 118 A Y - 0 0 103 1,-0.1 3,-0.2 -5,-0.1 -3,-0.1 -0.323 52.3-134.6 -42.3 129.1 72.6 9.7 69.2 118 119 A P S S- 0 0 86 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.829 74.5 -37.0 -66.1 -34.4 75.1 9.3 72.0 119 120 A A - 0 0 41 3,-0.1 101,-0.4 101,-0.0 2,-0.3 -0.816 63.1-108.1 179.0 157.0 72.4 10.5 74.5 120 121 A L S S+ 0 0 63 -2,-0.2 101,-0.2 1,-0.2 3,-0.1 -0.689 92.6 12.8 -94.4 140.6 69.6 12.9 74.6 121 122 A G S S+ 0 0 15 99,-3.0 2,-0.3 -2,-0.3 -1,-0.2 0.321 102.2 96.3 87.1 -12.8 69.5 16.1 76.5 122 123 A E S S- 0 0 48 -3,-0.3 98,-0.5 98,-0.2 2,-0.4 -0.747 78.6-109.2-102.4 157.7 73.2 16.1 77.3 123 124 A V E -C 219 0B 27 -2,-0.3 2,-0.4 96,-0.1 96,-0.2 -0.759 34.0-174.8 -92.0 131.7 75.8 18.1 75.2 124 125 A F E -C 218 0B 64 94,-2.8 94,-4.1 -2,-0.4 2,-0.6 -0.908 20.7-142.7-119.3 151.0 78.3 16.5 72.9 125 126 A V E +C 217 0B 40 -2,-0.4 2,-0.3 92,-0.3 92,-0.2 -0.956 35.4 169.3-105.5 118.2 81.1 17.8 70.8 126 127 A L E -C 216 0B 52 90,-2.9 90,-2.1 -2,-0.6 2,-0.6 -0.919 37.9-116.7-133.5 160.8 81.3 15.9 67.5 127 128 A D E -C 215 0B 107 -2,-0.3 2,-0.3 88,-0.2 88,-0.2 -0.806 40.6-163.1 -94.6 123.1 83.0 16.0 64.2 128 129 A E E -C 214 0B 49 86,-2.8 86,-1.1 -2,-0.6 2,-0.2 -0.705 16.0-129.2-113.7 152.4 80.6 16.4 61.4 129 130 A E - 0 0 127 -2,-0.3 82,-0.1 84,-0.2 2,-0.0 -0.555 44.6 -85.7 -86.5 162.3 80.4 16.0 57.7 130 131 A E - 0 0 112 -2,-0.2 2,-0.4 83,-0.1 -1,-0.1 -0.378 37.0-159.4 -61.9 145.4 79.1 18.6 55.3 131 132 A I E -D 211 0B 27 80,-1.7 80,-2.4 -3,-0.1 2,-0.2 -0.970 11.3-141.2-128.2 115.9 75.4 18.8 54.7 132 133 A R E +D 210 0B 83 -2,-0.4 61,-1.7 61,-0.3 2,-0.3 -0.508 30.5 174.3 -75.3 145.1 74.3 20.6 51.6 133 134 A I E -DE 209 192B 1 76,-3.7 76,-3.0 59,-0.3 2,-0.4 -0.985 33.3-133.4-147.2 153.3 71.2 22.6 52.0 134 135 A I E -DE 208 191B 1 57,-2.6 57,-2.4 -2,-0.3 2,-0.3 -0.925 36.0-179.1 -98.4 139.1 68.8 25.1 50.3 135 136 A Q E -DE 207 190B 16 72,-2.5 72,-2.6 -2,-0.4 2,-0.3 -0.948 17.7-162.9-139.0 166.0 67.9 28.1 52.5 136 137 A T E -DE 206 189B 25 53,-2.5 53,-1.8 -2,-0.3 70,-0.1 -0.972 39.6 -90.4-142.1 147.7 65.8 31.2 52.4 137 138 A E E - E 0 188B 128 68,-0.6 2,-1.0 -2,-0.3 51,-0.2 -0.423 37.6-136.0 -60.5 129.1 65.8 34.4 54.4 138 139 A A - 0 0 8 49,-2.1 2,-2.2 34,-0.1 -1,-0.1 -0.829 20.1-138.7 -89.7 100.3 63.4 33.8 57.4 139 140 A E - 0 0 99 -2,-1.0 48,-0.1 1,-0.3 49,-0.1 -0.357 68.5 -46.2 -79.1 81.9 61.6 37.1 57.2 140 141 A G S S+ 0 0 57 -2,-2.2 -1,-0.3 46,-0.3 47,-0.1 0.365 101.3 142.3 78.5 -3.9 61.3 37.9 60.9 141 142 A L + 0 0 38 44,-0.1 45,-2.2 46,-0.1 -1,-0.2 -0.138 21.5 168.5 -60.8 158.7 60.1 34.4 61.8 142 143 A G >> - 0 0 5 43,-0.3 3,-1.6 1,-0.0 4,-1.5 -0.942 50.2 -70.7-156.0-173.3 61.0 32.5 64.9 143 144 A P T 34 S+ 0 0 31 0, 0.0 3,-0.2 0, 0.0 42,-0.1 0.825 123.8 53.7 -50.2 -42.1 60.3 29.5 67.1 144 145 A E T 34 S+ 0 0 138 1,-0.2 38,-0.1 37,-0.2 -3,-0.0 0.741 123.3 22.3 -70.4 -21.2 57.0 30.8 68.3 145 146 A N T <4 S+ 0 0 91 -3,-1.6 -1,-0.2 2,-0.1 2,-0.2 0.340 82.2 121.9-136.8 8.2 55.5 31.5 64.9 146 147 A V < - 0 0 40 -4,-1.5 2,-0.3 -3,-0.2 3,-0.0 -0.498 42.1-160.0 -72.7 145.4 57.1 29.4 62.1 147 148 A L >> - 0 0 111 -2,-0.2 4,-0.6 1,-0.1 3,-0.6 -0.808 33.8-116.9-120.1 163.5 54.8 27.1 60.1 148 149 A N H >> S+ 0 0 119 -2,-0.3 3,-1.6 1,-0.2 4,-0.6 0.903 117.2 62.7 -58.9 -39.0 55.2 24.1 57.9 149 150 A A H >4 S+ 0 0 65 1,-0.3 3,-0.8 2,-0.2 4,-0.4 0.763 88.8 70.4 -59.5 -25.0 53.8 26.3 55.2 150 151 A S H <4 S+ 0 0 37 -3,-0.6 3,-0.4 1,-0.3 4,-0.3 0.879 100.2 46.5 -59.4 -35.4 56.9 28.4 55.6 151 152 A Y H S+ 0 0 89 -4,-0.4 4,-1.5 -3,-0.4 -1,-0.2 0.944 112.9 49.0 -62.9 -47.7 58.6 26.9 48.5 154 155 A L H >> S+ 0 0 2 -3,-0.5 4,-2.5 -4,-0.3 3,-0.6 0.942 109.9 53.7 -50.9 -51.6 61.9 25.3 49.6 155 156 A K H 3X S+ 0 0 25 -4,-2.4 4,-3.2 1,-0.3 5,-0.3 0.874 101.9 57.0 -53.5 -41.0 60.2 21.9 49.4 156 157 A K H 3X S+ 0 0 132 -4,-2.2 4,-1.5 -5,-0.3 -1,-0.3 0.866 109.9 47.0 -60.4 -36.2 58.9 22.5 45.9 157 158 A F H X>S+ 0 0 2 -4,-2.5 4,-2.9 1,-0.2 3,-1.4 0.948 112.8 50.5 -45.0 -60.0 63.9 20.0 46.7 159 160 A E H 3X5S+ 0 0 70 -4,-3.2 4,-1.5 1,-0.3 -1,-0.2 0.851 104.6 57.9 -55.8 -37.2 61.1 17.7 45.5 160 161 A S H 3<5S+ 0 0 67 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.826 122.1 25.5 -62.2 -31.2 61.5 18.7 41.9 161 162 A A H <<5S+ 0 0 8 -3,-1.4 -2,-0.2 -4,-1.2 -3,-0.1 0.898 132.1 33.7 -93.5 -57.4 65.2 17.6 42.0 162 163 A D H <5S- 0 0 14 -4,-2.9 2,-0.8 -5,-0.2 -3,-0.2 0.744 78.6-152.3 -74.3 -31.9 65.4 14.9 44.7 163 164 A G S < S+ 0 0 53 -2,-0.3 3,-2.8 1,-0.2 -37,-0.2 0.903 111.8 57.8 -67.8 -44.9 62.2 32.6 73.6 182 183 A D T 3 S+ 0 0 110 1,-0.3 -1,-0.2 -39,-0.1 0, 0.0 0.704 96.1 69.4 -61.6 -18.6 60.4 35.7 72.4 183 184 A E T 3 S+ 0 0 100 -3,-0.5 2,-0.3 2,-0.0 -1,-0.3 0.625 91.0 80.5 -68.9 -15.9 63.9 37.3 72.4 184 185 A M < + 0 0 6 -3,-2.8 2,-0.4 -4,-0.1 -11,-0.0 -0.750 51.1 179.7-112.5 143.7 64.9 35.1 69.5 185 186 A T - 0 0 73 -2,-0.3 -11,-0.5 -43,-0.1 -43,-0.3 -0.992 30.3-115.6-135.7 141.0 64.4 35.3 65.7 186 187 A Y - 0 0 10 -45,-2.2 -46,-0.3 -2,-0.4 -13,-0.3 -0.471 13.4-158.0 -71.9 144.3 65.6 32.9 63.0 187 188 A R S S- 0 0 110 -15,-3.8 -49,-2.1 1,-0.4 2,-0.3 0.945 76.4 -3.5 -83.8 -60.9 68.1 34.2 60.5 188 189 A H E -EG 137 172B 22 -16,-0.8 -16,-3.2 -51,-0.2 -1,-0.4 -0.957 62.0-144.9-127.2 147.9 67.4 31.7 57.7 189 190 A I E +EG 136 171B 4 -53,-1.8 -53,-2.5 -2,-0.3 2,-0.3 -0.861 33.0 171.8-102.7 154.3 65.1 28.7 57.5 190 191 A F E -EG 135 170B 0 -20,-2.6 -20,-2.9 -2,-0.3 -55,-0.2 -0.979 28.9-150.5-159.6 165.2 66.4 25.8 55.5 191 192 A T E -E 134 0B 0 -57,-2.4 -57,-2.6 -2,-0.3 2,-0.2 -0.980 32.6-106.5-143.1 145.4 66.1 22.3 54.4 192 193 A P E -E 133 0B 4 0, 0.0 2,-0.3 0, 0.0 -59,-0.3 -0.537 22.9-136.4 -80.2 145.0 68.7 19.8 53.3 193 194 A V - 0 0 10 -61,-1.7 -61,-0.3 -2,-0.2 -35,-0.0 -0.734 16.3-176.2 -89.7 148.0 69.4 18.6 49.8 194 195 A L + 0 0 25 -2,-0.3 2,-0.1 -36,-0.1 -1,-0.1 0.537 61.1 57.4-115.9 -24.9 70.0 14.9 49.0 195 196 A T - 0 0 28 2,-0.1 -33,-0.1 -37,-0.1 -2,-0.1 -0.432 63.5-142.8-103.6-179.2 70.8 14.9 45.4 196 197 A N + 0 0 134 -2,-0.1 2,-0.4 -35,-0.1 -1,-0.0 -0.129 61.1 125.3-127.5 27.8 73.4 16.4 43.2 197 198 A K S S- 0 0 128 1,-0.1 -2,-0.1 0, 0.0 -35,-0.1 -0.794 74.1 -99.6 -92.2 130.5 71.0 16.9 40.3 198 199 A Q - 0 0 186 -2,-0.4 2,-0.4 1,-0.1 -1,-0.1 -0.193 36.4-121.3 -50.3 132.1 70.8 20.6 39.1 199 200 A I > - 0 0 28 1,-0.1 3,-0.7 -3,-0.0 2,-0.4 -0.683 32.3-110.5 -74.6 128.4 67.8 22.4 40.6 200 201 A S T 3 S- 0 0 88 -2,-0.4 -1,-0.1 1,-0.2 -40,-0.1 -0.447 79.4 -31.7 -63.1 116.4 65.6 23.7 37.7 201 202 A S T 3 S- 0 0 108 -2,-0.4 -1,-0.2 1,-0.1 2,-0.1 0.872 77.0-162.7 39.5 61.7 65.6 27.5 37.5 202 203 A I < - 0 0 56 -3,-0.7 -1,-0.1 1,-0.1 3,-0.0 -0.445 15.8-124.7 -64.8 149.9 66.1 28.1 41.1 203 204 A T > - 0 0 47 -2,-0.1 3,-2.5 1,-0.1 -1,-0.1 -0.769 19.3-105.9-109.3 152.2 65.2 31.7 41.9 204 205 A P T 3 S+ 0 0 131 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.803 111.5 69.5 -42.0 -47.5 67.4 34.3 43.7 205 206 A D T 3 S+ 0 0 78 -69,-0.1 -68,-0.6 2,-0.0 2,-0.3 0.581 91.6 73.8 -58.3 -11.6 65.6 34.2 47.0 206 207 A M E < -D 136 0B 14 -3,-2.5 2,-0.5 -70,-0.1 -70,-0.2 -0.820 69.5-156.2 -94.4 147.0 66.9 30.7 47.5 207 208 A E E -D 135 0B 88 -72,-2.6 -72,-2.5 -2,-0.3 2,-0.7 -0.983 8.1-147.5-119.5 127.5 70.5 30.0 48.4 208 209 A I E +D 134 0B 90 -2,-0.5 2,-0.2 -74,-0.2 -74,-0.2 -0.841 47.5 128.5 -85.5 122.7 72.3 26.8 47.8 209 210 A T E -D 133 0B 43 -76,-3.0 -76,-3.7 -2,-0.7 2,-0.3 -0.837 43.1-113.1-153.6-168.3 74.8 26.3 50.6 210 211 A T E -D 132 0B 32 -78,-0.3 -78,-0.2 -2,-0.2 -80,-0.1 -0.957 19.9-123.6-136.5 159.8 76.1 24.0 53.3 211 212 A I E -D 131 0B 1 -80,-2.4 -80,-1.7 -2,-0.3 3,-0.1 -0.925 59.8-125.1 -90.1 103.2 76.4 23.3 57.0 212 213 A P - 0 0 37 0, 0.0 2,-0.1 0, 0.0 -84,-0.1 0.028 15.9 -94.5 -60.4 156.2 80.2 23.0 56.7 213 214 A K S S+ 0 0 136 -86,-0.1 2,-0.3 -83,-0.1 -84,-0.2 -0.478 75.1 110.2 -60.8 135.7 82.5 20.2 57.8 214 215 A G E S-C 128 0B 16 -86,-1.1 -86,-2.8 -2,-0.1 2,-0.3 -0.989 71.4 -66.8 177.1-177.0 83.7 21.0 61.4 215 216 A R E -CH 127 275B 118 60,-0.6 60,-1.3 -2,-0.3 2,-0.4 -0.784 53.8-165.1 -92.4 148.8 83.6 20.2 65.1 216 217 A Y E -CH 126 274B 0 -90,-2.1 -90,-2.9 -2,-0.3 2,-0.7 -0.999 26.2-137.0-141.7 135.6 80.2 21.0 66.6 217 218 A A E -CH 125 273B 0 56,-2.9 56,-2.0 -2,-0.4 2,-0.3 -0.825 43.2-176.2 -83.9 115.5 78.8 21.4 70.0 218 219 A C E -CH 124 272B 6 -94,-4.1 -94,-2.8 -2,-0.7 2,-0.3 -0.848 27.1-179.8-118.2 157.5 75.5 19.5 69.8 219 220 A I E -CH 123 271B 0 52,-1.6 52,-2.8 -2,-0.3 2,-0.3 -0.944 11.1-176.5-149.4 130.0 72.5 18.7 71.9 220 221 A A E + H 0 270B 12 -98,-0.5 -99,-3.0 -101,-0.4 2,-0.3 -0.934 12.0 150.2-126.6 151.2 69.6 16.5 70.7 221 222 A Y E - H 0 269B 6 48,-2.6 48,-3.6 -2,-0.3 2,-0.5 -0.978 49.6 -88.4-166.6 166.7 66.3 15.6 72.4 222 223 A N E - H 0 268B 52 -2,-0.3 46,-0.2 46,-0.2 5,-0.1 -0.774 62.6-100.8 -86.6 133.3 62.7 14.7 71.9 223 224 A F + 0 0 86 44,-3.1 44,-0.2 -2,-0.5 -1,-0.1 -0.168 49.1 155.8 -69.0 143.2 60.7 17.9 71.7 224 225 A S > - 0 0 40 1,-0.1 4,-1.7 42,-0.1 42,-0.0 -0.908 46.9-122.8-154.7 139.4 58.6 19.4 74.4 225 226 A P H > S+ 0 0 96 0, 0.0 4,-0.7 0, 0.0 3,-0.4 0.899 113.6 50.7 -54.9 -42.1 57.8 23.2 74.6 226 227 A E H >> S+ 0 0 142 1,-0.2 4,-1.1 2,-0.1 3,-0.5 0.952 111.0 47.8 -52.5 -54.1 59.4 23.4 78.1 227 228 A H H 3> S+ 0 0 96 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.655 91.3 79.9 -71.9 -20.9 62.6 21.7 77.0 228 229 A Y H 3X S+ 0 0 17 -4,-1.7 4,-1.5 -3,-0.4 -1,-0.2 0.953 104.9 29.0 -45.3 -63.5 63.2 23.7 73.9 229 230 A F H S+ 0 0 7 -4,-2.0 5,-1.9 -3,-0.2 4,-0.3 0.905 112.1 51.0 -74.4 -44.5 80.2 26.8 75.8 240 241 A A H ><5S+ 0 0 63 -4,-2.4 3,-0.8 -5,-0.2 -2,-0.2 0.877 109.2 52.5 -56.7 -42.6 80.7 29.5 78.4 241 242 A D H 3<5S+ 0 0 95 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.848 116.5 37.3 -66.0 -36.3 82.2 27.0 80.9 242 243 A R T 3<5S- 0 0 141 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.285 104.6-128.2 -98.3 8.5 84.8 25.6 78.5 243 244 A Q T < 5 + 0 0 177 -3,-0.8 -3,-0.2 -4,-0.3 2,-0.2 0.861 45.5 172.7 45.6 44.1 85.4 29.0 77.0 244 245 A L < - 0 0 53 -5,-1.9 2,-0.6 -6,-0.1 -1,-0.2 -0.509 31.4-126.4 -80.0 151.8 84.9 27.7 73.5 245 246 A T - 0 0 95 31,-0.2 31,-1.6 -2,-0.2 2,-0.2 -0.872 20.5-144.0 -98.7 117.9 84.8 30.0 70.5 246 247 A V E - I 0 275B 43 -2,-0.6 29,-0.3 29,-0.2 3,-0.0 -0.531 16.8-176.5 -81.1 147.7 81.8 29.6 68.3 247 248 A V E + 0 0 69 27,-3.5 2,-0.3 -2,-0.2 28,-0.1 0.159 59.7 25.3-131.9 21.0 82.1 30.0 64.6 248 249 A S E S- 0 0 28 26,-0.4 -73,-0.2 3,-0.0 3,-0.1 -0.946 88.1 -75.0-162.0 173.5 78.6 29.8 63.0 249 250 A D E - 0 0 29 -2,-0.3 25,-0.6 -75,-0.1 2,-0.5 -0.176 57.5 -89.4 -63.0 169.8 75.0 30.3 63.8 250 251 A V E -FI 173 273B 1 -77,-3.0 -77,-1.8 23,-0.2 2,-0.5 -0.749 44.8-151.2 -74.1 132.4 73.1 27.9 65.9 251 252 A Y E -FI 172 272B 29 21,-3.1 21,-2.8 -2,-0.5 2,-0.5 -0.959 11.4-167.2-107.0 124.8 71.7 25.4 63.5 252 253 A E E -FI 171 271B 5 -81,-3.3 -81,-2.3 -2,-0.5 2,-0.4 -0.964 4.4-173.8-116.0 129.6 68.4 23.8 64.6 253 254 A L E -FI 170 270B 25 17,-3.0 17,-2.6 -2,-0.5 2,-0.4 -0.953 3.7-167.2-115.2 144.5 66.9 20.7 62.9 254 255 A I E +FI 169 269B 44 -85,-2.1 -85,-2.6 -2,-0.4 15,-0.2 -0.994 9.2 177.1-130.0 131.9 63.6 19.1 63.6 255 256 A I E - I 0 268B 53 13,-2.3 13,-3.1 -2,-0.4 -87,-0.1 -0.987 30.9-115.3-141.3 129.7 62.5 15.7 62.4 256 257 A P E - I 0 267B 23 0, 0.0 11,-0.2 0, 0.0 3,-0.1 -0.341 11.0-153.6 -57.4 134.4 59.3 13.7 62.9 257 258 A I S S+ 0 0 79 9,-2.7 2,-0.3 1,-0.2 10,-0.1 0.756 82.6 1.3 -74.6 -30.5 59.8 10.4 64.9 258 259 A H - 0 0 52 8,-0.6 8,-0.3 2,-0.1 -1,-0.2 -0.936 56.5-140.7-149.8 171.5 56.8 9.1 63.1 259 260 A Y + 0 0 139 -2,-0.3 6,-0.1 -3,-0.1 3,-0.0 -0.092 54.1 134.0-130.7 30.8 54.2 10.1 60.5 260 261 A S - 0 0 52 1,-0.1 3,-0.4 4,-0.1 -2,-0.1 -0.713 42.9-163.9 -85.9 126.9 51.1 8.5 62.0 261 262 A P S S+ 0 0 136 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.688 93.3 60.3 -69.9 -18.6 47.8 10.5 62.3 262 263 A K S S+ 0 0 100 2,-0.1 2,-0.2 -3,-0.0 -2,-0.0 0.633 100.7 58.8 -90.4 -14.5 46.7 7.9 64.8 263 264 A K S S- 0 0 54 -3,-0.4 2,-0.2 1,-0.1 3,-0.1 -0.708 99.7 -86.2-113.0 165.2 49.5 8.5 67.3 264 265 A Q - 0 0 180 -2,-0.2 -4,-0.1 1,-0.1 -2,-0.1 -0.514 54.8-108.2 -67.8 134.1 50.5 11.6 69.2 265 266 A E - 0 0 136 -2,-0.2 2,-0.3 -4,-0.1 -1,-0.1 -0.211 42.9-175.7 -64.5 156.2 52.9 13.6 67.1 266 267 A E - 0 0 82 -8,-0.3 -9,-2.7 -3,-0.1 -8,-0.6 -0.936 8.1-160.9-159.8 136.4 56.5 13.6 68.2 267 268 A Y E - I 0 256B 67 -2,-0.3 -44,-3.1 -11,-0.2 2,-0.6 -0.918 17.1-139.1-127.2 142.5 59.7 15.3 67.1 268 269 A R E -HI 222 255B 21 -13,-3.1 -13,-2.3 -2,-0.4 2,-0.4 -0.859 24.2-162.3 -88.0 125.0 63.4 15.0 67.4 269 270 A V E -HI 221 254B 1 -48,-3.6 -48,-2.6 -2,-0.6 2,-0.4 -0.897 8.1-176.3-105.7 136.4 65.1 18.4 67.9 270 271 A E E -HI 220 253B 34 -17,-2.6 -17,-3.0 -2,-0.4 2,-0.5 -0.996 2.5-173.4-132.0 126.5 68.8 18.8 67.3 271 272 A M E +HI 219 252B 0 -52,-2.8 -52,-1.6 -2,-0.4 2,-0.4 -0.985 13.0 170.1-119.6 119.0 70.7 22.0 68.0 272 273 A K E -HI 218 251B 2 -21,-2.8 -21,-3.1 -2,-0.5 2,-0.4 -0.967 14.5-172.5-132.9 152.6 74.3 22.4 66.9 273 274 A I E -HI 217 250B 0 -56,-2.0 -56,-2.9 -2,-0.4 2,-0.3 -0.998 26.9-116.6-138.7 141.4 76.9 25.1 66.7 274 275 A R E -H 216 0B 80 -25,-0.6 -27,-3.5 -2,-0.4 -26,-0.4 -0.575 28.8-173.0 -80.7 135.3 80.3 25.1 65.2 275 276 A I E HI 215 246B 6 -60,-1.3 -60,-0.6 -2,-0.3 -29,-0.2 -0.844 360.0 360.0-120.9 163.4 83.4 25.7 67.5 276 277 A L 0 0 103 -31,-1.6 -31,-0.2 -2,-0.3 -62,-0.0 -0.400 360.0 360.0 -80.1 360.0 87.1 26.2 66.5