==== 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 TRANSPORT PROTEIN 29-AUG-06 2I6W . COMPND 2 MOLECULE: ACRIFLAVINE RESISTANCE PROTEIN B; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.DAS,Q.S.XU,S.H.KIM . 1019 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43801.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 745 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 115 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 69 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 142 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 381 37.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.1 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 9 2 2 3 2 2 1 3 1 1 1 0 1 1 2 2 0 2 0 0 1 0 0 2 0 0 1 RESIDUES PER ALPHA HELIX . 1 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 0 PARALLEL BRIDGES PER LADDER . 1 5 7 2 3 2 3 0 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 . 4 0 2 0 0 1 0 1 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 0 204 0, 0.0 2,-0.4 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 82.0 4.2 -77.4 78.0 2 2 A P - 0 0 94 0, 0.0 437,-0.1 0, 0.0 438,-0.0 -0.452 360.0 -27.2 -63.4 115.9 3.3 -75.4 74.7 3 3 A N S S- 0 0 78 -2,-0.4 2,-0.8 1,-0.1 437,-0.0 -0.104 116.1 -12.7 70.9-171.6 5.5 -76.8 71.8 4 4 A F - 0 0 103 1,-0.0 -1,-0.1 483,-0.0 3,-0.0 -0.491 69.7-140.9 -70.6 104.0 8.9 -78.4 72.1 5 5 A F - 0 0 100 -2,-0.8 -1,-0.0 -4,-0.2 427,-0.0 0.173 45.8 -67.1 -45.7 177.6 10.4 -77.9 75.6 6 6 A I S S- 0 0 14 1,-0.1 2,-0.2 484,-0.1 485,-0.1 0.123 77.0-131.0 -56.4-167.6 14.1 -77.2 75.8 7 7 A D - 0 0 35 483,-0.1 -1,-0.1 484,-0.1 3,-0.1 -0.473 19.6 -95.8-136.5-158.9 16.0 -80.3 74.7 8 8 A R > - 0 0 164 -2,-0.2 4,-0.8 1,-0.1 3,-0.1 -0.993 51.1-137.6-123.4 105.5 18.5 -83.1 74.6 9 9 A P H >> S+ 0 0 47 0, 0.0 4,-2.1 0, 0.0 3,-1.4 0.863 90.8 49.4 -34.2 -67.2 21.1 -81.4 72.3 10 10 A I H 3> S+ 0 0 122 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.893 100.9 58.2 -48.2 -59.4 21.9 -84.2 70.0 11 11 A F H 3> S+ 0 0 128 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.735 113.6 44.5 -50.9 -20.3 18.5 -85.4 68.9 12 12 A A H XX S+ 0 0 1 -3,-1.4 3,-2.5 -4,-0.8 4,-1.4 0.945 103.4 60.8 -83.4 -62.6 18.0 -81.8 67.7 13 13 A W H 3X S+ 0 0 91 -4,-2.1 4,-2.5 1,-0.3 3,-0.4 0.801 99.7 59.9 -27.0 -52.7 21.4 -81.4 66.0 14 14 A V H 3X S+ 0 0 65 -4,-2.2 4,-2.5 1,-0.3 -1,-0.3 0.901 99.9 53.2 -46.9 -50.6 20.3 -84.3 63.8 15 15 A I H X S+ 0 0 71 -4,-2.5 4,-3.6 1,-0.2 3,-0.7 0.860 112.3 47.8 -33.1 -75.8 22.0 -82.0 59.8 18 18 A I H 3X S+ 0 0 95 -4,-2.5 4,-6.5 1,-0.3 -1,-0.2 0.871 114.2 46.2 -32.4 -67.6 19.3 -83.7 57.8 19 19 A I H 3X S+ 0 0 48 -4,-1.8 4,-2.4 2,-0.2 5,-0.3 0.863 117.5 45.5 -46.4 -43.4 17.7 -80.3 56.7 20 20 A M H X S+ 0 0 38 -4,-6.5 3,-1.1 -5,-0.3 4,-0.8 0.952 114.3 39.4 -45.9 -80.8 18.6 -82.2 52.5 23 23 A G H >< S+ 0 0 0 -4,-2.4 3,-1.0 1,-0.3 4,-0.4 0.798 111.1 61.3 -41.1 -40.7 18.7 -78.6 51.3 24 24 A G H >X S+ 0 0 20 -4,-3.3 4,-2.0 -5,-0.3 3,-1.3 0.936 108.3 40.6 -56.5 -48.1 22.4 -79.0 50.2 25 25 A L H << S+ 0 0 85 -4,-2.1 -1,-0.3 -3,-1.1 -2,-0.2 0.513 105.1 70.3 -77.7 -3.0 21.6 -81.8 47.8 26 26 A A T << S+ 0 0 15 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.502 106.2 38.7 -87.4 -7.3 18.5 -79.7 46.9 27 27 A I T X4 S+ 0 0 41 -3,-1.3 3,-3.3 -4,-0.4 2,-1.7 0.791 108.4 58.0-102.4 -56.7 20.9 -77.3 45.3 28 28 A L T 3< S+ 0 0 138 -4,-2.0 -3,-0.1 1,-0.3 -2,-0.1 0.079 113.5 45.4 -66.1 30.5 23.3 -79.8 43.8 29 29 A K T 3 S+ 0 0 161 -2,-1.7 -1,-0.3 -5,-0.1 -2,-0.1 0.064 120.4 35.7-157.6 18.0 20.2 -81.0 42.0 30 30 A L < + 0 0 33 -3,-3.3 2,-1.8 2,-0.0 360,-0.8 0.062 63.4 161.3-166.6 34.8 18.8 -77.7 40.9 31 31 A P + 0 0 91 0, 0.0 2,-0.2 0, 0.0 -4,-0.1 -0.449 36.7 126.4 -70.6 86.9 21.7 -75.3 39.9 32 32 A V + 0 0 22 -2,-1.8 2,-0.3 358,-0.1 -2,-0.0 -0.646 26.3 157.9-130.3-176.2 19.7 -72.8 37.9 33 33 A A + 0 0 5 -2,-0.2 358,-0.2 2,-0.2 267,-0.1 -0.963 30.4 107.8 176.4-170.3 18.8 -69.1 37.5 34 34 A Q S S- 0 0 49 -2,-0.3 -1,-0.1 299,-0.1 357,-0.1 0.953 93.2 -65.4 76.5 59.5 17.6 -66.3 35.1 35 35 A Y - 0 0 24 354,-0.0 -2,-0.2 3,-0.0 3,-0.1 0.385 64.7 -83.6 50.2 167.1 14.1 -65.7 36.5 36 36 A P - 0 0 30 0, 0.0 2,-0.2 0, 0.0 430,-0.1 0.582 62.3 -72.8 -72.1-132.6 11.2 -68.2 36.5 37 37 A T + 0 0 77 428,-0.2 258,-0.0 1,-0.1 -2,-0.0 -0.621 58.1 153.9-116.7-178.7 9.0 -68.6 33.4 38 38 A I + 0 0 29 1,-0.4 -1,-0.1 -2,-0.2 59,-0.1 0.140 30.1 97.0-169.3 -68.8 6.4 -66.0 32.5 39 39 A A S S- 0 0 15 623,-0.3 -1,-0.4 1,-0.1 257,-0.2 -0.125 84.1 -99.1 -46.6 138.6 5.2 -65.3 29.0 40 40 A P - 0 0 39 0, 0.0 56,-0.2 0, 0.0 55,-0.2 -0.448 57.0 -90.5 -61.1 130.8 1.9 -67.1 28.3 41 41 A P - 0 0 13 0, 0.0 53,-2.3 0, 0.0 2,-0.3 -0.198 56.3-166.1 -45.7 120.3 3.0 -70.2 26.4 42 42 A A E -A 93 0A 13 90,-0.3 253,-0.3 51,-0.2 2,-0.2 -0.849 14.4-172.5-116.2 154.6 3.0 -69.2 22.7 43 43 A V E -A 92 0A 2 49,-2.9 49,-1.4 -2,-0.3 2,-0.2 -0.685 8.4-169.4-128.8 178.6 3.1 -71.3 19.6 44 44 A T E -AB 91 130A 10 86,-0.6 86,-1.0 47,-0.3 47,-0.3 -0.857 14.2-143.0-176.4 139.3 3.5 -70.2 16.0 45 45 A I E - B 0 129A 0 45,-3.2 2,-0.3 -2,-0.2 84,-0.2 -0.734 15.1-165.0-105.9 157.3 3.3 -71.4 12.4 46 46 A S E + B 0 128A 29 82,-0.8 82,-0.5 -2,-0.3 43,-0.2 -0.807 9.3 173.6-152.7 109.7 5.5 -70.3 9.5 47 47 A A - 0 0 6 41,-0.7 41,-0.4 -2,-0.3 2,-0.2 -0.155 13.5-157.1 -96.2-167.9 5.2 -70.8 5.7 48 48 A S - 0 0 38 39,-0.2 39,-0.3 -2,-0.1 77,-0.1 -0.580 6.5-168.9-176.6 106.3 7.2 -69.5 2.8 49 49 A Y > - 0 0 54 37,-2.8 3,-1.4 3,-0.2 73,-0.1 -0.694 37.9-125.2-104.7 75.7 5.8 -69.2 -0.8 50 50 A P T 3 S- 0 0 41 0, 0.0 36,-0.1 0, 0.0 3,-0.1 0.172 85.5 -4.0 -27.1 112.7 9.1 -68.5 -2.6 51 51 A G T 3 S+ 0 0 57 34,-0.5 2,-0.4 1,-0.2 35,-0.1 0.749 100.5 137.5 68.5 28.6 8.8 -65.3 -4.7 52 52 A A < - 0 0 11 -3,-1.4 -1,-0.2 33,-0.2 -3,-0.2 -0.896 52.4-115.7-110.7 134.3 5.1 -64.7 -3.8 53 53 A D > - 0 0 65 -2,-0.4 4,-3.2 1,-0.1 5,-0.3 -0.195 28.2-106.1 -68.7 156.0 3.6 -61.3 -2.9 54 54 A A T 4 S+ 0 0 2 1,-0.2 4,-0.3 2,-0.2 -1,-0.1 0.793 121.2 47.2 -45.6 -39.0 2.1 -60.5 0.5 55 55 A K T >> S+ 0 0 135 2,-0.2 4,-2.8 1,-0.2 3,-0.8 0.924 112.7 45.5 -73.8 -48.0 -1.4 -60.6 -1.0 56 56 A T H 3> S+ 0 0 56 1,-0.2 4,-1.9 2,-0.2 5,-0.3 0.844 118.3 45.8 -63.7 -33.6 -0.9 -64.0 -2.9 57 57 A V H 3<>S+ 0 0 3 -4,-3.2 5,-1.8 3,-0.2 -1,-0.2 0.539 114.3 47.8 -87.6 -4.7 0.7 -65.4 0.3 58 58 A Q H <4>S+ 0 0 19 -3,-0.8 5,-1.3 -5,-0.3 -2,-0.2 0.771 122.1 33.6 -97.1 -40.7 -2.1 -63.9 2.5 59 59 A D H <5S+ 0 0 73 -4,-2.8 5,-0.4 3,-0.2 4,-0.2 0.950 125.6 41.9 -77.3 -53.0 -4.9 -65.1 0.4 60 60 A T T <5S+ 0 0 50 -4,-1.9 -3,-0.2 -5,-0.4 -2,-0.1 0.817 137.0 2.7 -63.9 -38.2 -3.3 -68.4 -0.8 61 61 A V T >5S+ 0 0 1 -5,-0.3 4,-1.2 -4,-0.1 5,-0.2 0.775 120.8 57.2-115.8 -62.2 -1.7 -69.5 2.5 62 62 A T T 44 S+ 0 0 13 -4,-0.5 3,-1.4 -3,-0.4 -2,-0.2 0.840 107.9 53.1 -90.6 -38.9 -6.3 -69.3 9.9 67 67 A Q T 3< S+ 0 0 134 -4,-2.7 -3,-0.1 1,-0.3 -1,-0.1 0.668 106.3 58.2 -67.3 -17.6 -9.7 -70.6 8.9 68 68 A N T 3 S+ 0 0 30 -5,-0.2 2,-0.8 1,-0.1 -1,-0.3 0.114 78.6 96.4-100.2 17.7 -8.5 -74.1 10.0 69 69 A M < + 0 0 14 -3,-1.4 2,-0.3 42,-0.1 3,-0.2 -0.833 54.9 129.5-109.9 88.8 -7.6 -73.1 13.6 70 70 A N + 0 0 77 -2,-0.8 -2,-0.0 1,-0.2 -3,-0.0 -0.892 51.4 29.1-135.5 165.1 -10.8 -74.2 15.5 71 71 A G S S+ 0 0 80 -2,-0.3 2,-0.5 1,-0.2 -1,-0.2 0.946 74.1 157.5 46.8 61.1 -11.5 -76.3 18.5 72 72 A I - 0 0 20 -3,-0.2 -1,-0.2 3,-0.0 2,-0.1 -0.931 46.3-119.6-122.7 108.9 -8.2 -75.4 20.2 73 73 A D S S- 0 0 109 -2,-0.5 33,-0.1 21,-0.0 0, 0.0 -0.202 85.2 -5.9 -46.8 112.6 -8.1 -75.8 24.0 74 74 A N S S+ 0 0 82 1,-0.2 2,-0.2 20,-0.1 20,-0.1 0.393 73.2 163.9 71.5 143.8 -7.2 -72.4 25.4 75 75 A L - 0 0 62 1,-0.0 19,-0.2 17,-0.0 -1,-0.2 -0.507 24.6-172.7 168.6 117.1 -6.4 -69.5 23.1 76 76 A M - 0 0 29 17,-3.0 2,-0.2 1,-0.4 18,-0.1 0.747 69.5 -47.1 -93.1 -25.9 -6.3 -65.9 23.7 77 77 A Y E -C 93 0A 15 16,-0.7 16,-1.9 2,-0.0 2,-0.4 -0.898 43.6-119.1 169.1 162.4 -5.7 -64.8 20.1 78 78 A M E -C 92 0A 10 -2,-0.2 732,-2.3 14,-0.2 2,-0.8 -0.982 17.0-160.5-127.8 124.5 -3.8 -65.4 16.8 79 79 A S - 0 0 37 12,-1.6 730,-0.2 -2,-0.4 13,-0.1 -0.717 17.3-170.6-108.0 85.8 -1.6 -62.6 15.2 80 80 A S - 0 0 2 -2,-0.8 728,-1.6 728,-0.3 2,-0.3 -0.197 6.2-173.4 -74.0 158.4 -0.9 -63.3 11.6 81 81 A N E -D 807 0B 29 726,-0.2 8,-0.6 2,-0.0 726,-0.2 -0.874 12.2-161.4-140.6 171.5 1.5 -61.6 9.1 82 82 A S E -DE 806 88B 0 724,-0.7 724,-1.2 -2,-0.3 6,-0.2 -0.412 13.7-160.5-165.2 83.6 2.2 -61.8 5.4 83 83 A D E >> -DE 805 87B 8 4,-1.6 3,-2.1 722,-0.2 4,-0.5 -0.239 29.7-129.2 -68.4 148.0 5.5 -60.4 4.1 84 84 A S T 34 S+ 0 0 66 720,-1.5 -1,-0.1 1,-0.3 721,-0.1 0.688 107.5 79.4 -64.4 -17.4 6.2 -59.4 0.5 85 85 A T T 34 S- 0 0 42 719,-0.4 -34,-0.5 524,-0.2 -1,-0.3 0.614 119.5-108.0 -63.9 -16.9 9.2 -61.7 1.2 86 86 A G T <4 S+ 0 0 2 -3,-2.1 -37,-2.8 1,-0.3 2,-0.3 0.766 80.5 119.9 92.0 29.7 6.8 -64.6 0.6 87 87 A T E < -E 83 0B 24 -4,-0.5 -4,-1.6 -39,-0.3 -1,-0.3 -0.938 40.3-168.6-128.7 150.6 6.5 -65.6 4.2 88 88 A V E -E 82 0B 2 -41,-0.4 -41,-0.7 -2,-0.3 -6,-0.2 -0.899 0.9-172.9-128.7 161.1 3.6 -65.9 6.7 89 89 A Q - 0 0 84 -8,-0.6 -43,-0.2 -2,-0.3 2,-0.2 -0.411 2.5-169.9-161.7 78.6 3.8 -66.4 10.4 90 90 A I - 0 0 0 -10,-0.2 -45,-3.2 -9,-0.1 2,-0.4 -0.468 11.8-161.1 -69.5 139.7 0.7 -67.0 12.4 91 91 A T E -A 44 0A 30 -47,-0.3 -12,-1.6 -2,-0.2 2,-0.4 -0.977 3.8-162.1-124.7 134.7 1.3 -66.9 16.2 92 92 A L E -AC 43 78A 0 -49,-1.4 -49,-2.9 -2,-0.4 2,-0.4 -0.972 6.6-156.9-119.0 132.3 -1.1 -68.4 18.8 93 93 A T E -AC 42 77A 11 -16,-1.9 -17,-3.0 -2,-0.4 -16,-0.7 -0.889 4.5-157.9-112.9 140.8 -1.0 -67.5 22.4 94 94 A F - 0 0 0 -53,-2.3 4,-0.2 -2,-0.4 3,-0.1 -0.940 30.7 -92.1-123.2 139.7 -2.2 -69.5 25.4 95 95 A E > - 0 0 53 -2,-0.4 3,-1.9 -55,-0.2 -1,-0.1 0.109 63.3 -81.6 -33.8 146.0 -3.3 -68.6 29.0 96 96 A S T 3 S+ 0 0 93 1,-0.2 -1,-0.1 -56,-0.2 3,-0.1 -0.283 119.2 24.2 -58.4 146.6 -0.4 -68.8 31.4 97 97 A G T 3 S+ 0 0 71 1,-0.3 -1,-0.2 -3,-0.1 2,-0.2 0.444 84.0 148.0 80.7 -0.1 0.1 -72.4 32.5 98 98 A T < - 0 0 15 -3,-1.9 -1,-0.3 -4,-0.2 2,-0.1 -0.488 69.5 -83.8 -69.4 136.1 -1.5 -73.9 29.5 99 99 A D > - 0 0 87 -2,-0.2 4,-2.1 1,-0.2 5,-0.3 -0.172 43.4-160.4 -44.5 102.0 0.1 -77.2 28.5 100 100 A A H > S+ 0 0 20 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.951 87.3 39.4 -51.9 -53.1 3.0 -75.9 26.6 101 101 A D H > S+ 0 0 97 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.873 113.5 48.7 -70.0 -44.2 3.5 -79.2 24.9 102 102 A I H > S+ 0 0 88 2,-0.2 4,-2.6 1,-0.2 3,-0.2 0.849 116.2 46.7 -66.8 -31.4 -0.1 -80.4 24.3 103 103 A A H X S+ 0 0 1 -4,-2.1 4,-1.7 2,-0.2 5,-0.3 0.954 104.3 59.3 -71.0 -52.1 -0.8 -77.0 22.8 104 104 A Q H < S+ 0 0 37 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.667 115.9 38.5 -51.2 -16.1 2.3 -77.0 20.7 105 105 A V H < S+ 0 0 60 -4,-0.6 3,-0.5 -3,-0.2 4,-0.3 0.814 103.7 62.7-104.1 -45.3 0.8 -80.2 19.2 106 106 A Q H >X S+ 0 0 37 -4,-2.6 4,-1.7 1,-0.3 3,-1.2 0.915 109.8 45.2 -45.2 -51.4 -3.0 -79.5 18.9 107 107 A V H 3X S+ 0 0 0 -4,-1.7 4,-0.6 1,-0.2 -1,-0.3 0.794 104.6 61.6 -64.2 -32.7 -2.1 -76.6 16.5 108 108 A Q H 34 S+ 0 0 74 -3,-0.5 -1,-0.2 -5,-0.3 -2,-0.2 0.378 114.0 36.7 -78.1 4.7 0.4 -78.8 14.5 109 109 A N H X> S+ 0 0 90 -3,-1.2 4,-0.6 -4,-0.3 3,-0.5 0.586 106.8 58.4-125.8 -32.0 -2.5 -81.1 13.7 110 110 A K H 3< S+ 0 0 50 -4,-1.7 -2,-0.1 1,-0.2 -3,-0.1 0.590 101.3 66.0 -75.6 -10.2 -5.6 -78.9 13.1 111 111 A L T >X S+ 0 0 3 -4,-0.6 4,-2.2 -5,-0.2 3,-1.3 0.803 89.8 62.6 -76.1 -34.2 -3.2 -77.4 10.5 112 112 A Q T <4 S+ 0 0 82 -3,-0.5 -2,-0.2 1,-0.3 -1,-0.2 0.828 86.4 69.4 -61.7 -36.2 -3.4 -80.7 8.6 113 113 A L T 3< S+ 0 0 99 -4,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.402 118.1 27.1 -64.7 7.7 -7.1 -80.3 8.0 114 114 A A T X> S+ 0 0 0 -3,-1.3 3,-3.5 -46,-0.1 4,-0.7 0.493 94.7 91.1-137.1 -35.5 -5.7 -77.5 5.8 115 115 A M G >< S+ 0 0 44 -4,-2.2 3,-1.2 1,-0.3 -3,-0.1 0.811 85.0 57.7 -38.3 -45.7 -2.2 -78.6 4.7 116 116 A P G 34 S+ 0 0 99 0, 0.0 -1,-0.3 0, 0.0 -4,-0.1 0.388 102.0 60.1 -72.1 9.2 -3.5 -80.3 1.5 117 117 A L G <4 S+ 0 0 109 -3,-3.5 -2,-0.2 -5,-0.1 3,-0.1 0.633 81.2 93.5-105.8 -22.2 -5.0 -76.9 0.6 118 118 A L S << S- 0 0 6 -3,-1.2 -57,-0.1 -4,-0.7 5,-0.1 -0.372 92.1 -90.0 -68.4 149.5 -1.7 -74.8 0.5 119 119 A P > - 0 0 25 0, 0.0 4,-1.6 0, 0.0 3,-0.3 -0.063 36.4-109.0 -55.4 167.7 -0.1 -74.6 -3.0 120 120 A Q H > S+ 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0 17 511,-0.2 513,-1.3 1,-0.1 3,-0.1 -0.136 30.4-170.7 -64.1 165.8 24.0 -85.5 -9.0 241 241 A T + 0 0 67 1,-0.2 2,-0.4 511,-0.1 514,-0.2 0.473 56.4 59.2-137.9 -10.1 26.7 -84.3 -6.6 242 242 A S S >> S- 0 0 44 1,-0.1 4,-1.6 512,-0.1 3,-1.5 -0.979 73.9-124.9-134.5 143.0 28.8 -81.7 -8.3 243 243 A T H 3> S+ 0 0 41 -2,-0.4 4,-1.1 1,-0.3 -1,-0.1 0.789 115.4 60.3 -45.5 -28.1 28.3 -78.3 -10.0 244 244 A E H 3> S+ 0 0 122 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.854 97.3 51.7 -71.7 -40.6 29.9 -80.1 -12.9 245 245 A E H <4 S+ 0 0 77 -3,-1.5 3,-0.4 1,-0.2 4,-0.3 0.866 109.8 52.7 -65.1 -36.2 27.4 -82.9 -13.4 246 246 A F H >< S+ 0 0 0 -4,-1.6 3,-1.2 1,-0.2 -1,-0.2 0.844 102.8 58.3 -67.3 -34.7 24.6 -80.3 -13.5 247 247 A G H 3< S+ 0 0 5 -4,-1.1 16,-1.6 -5,-0.3 -1,-0.2 0.759 101.2 56.3 -67.6 -23.8 26.5 -78.4 -16.2 248 248 A K T 3< S+ 0 0 136 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.490 75.9 129.5 -87.3 -3.9 26.4 -81.4 -18.4 249 249 A I < - 0 0 3 -3,-1.2 13,-1.7 -4,-0.3 2,-0.7 -0.130 60.4-121.6 -50.0 147.5 22.6 -81.8 -18.4 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279 A A E -MN 602 286C 2 7,-0.7 7,-2.1 -2,-0.3 2,-0.3 -0.900 12.0-158.6-131.5 160.7 26.1 -60.6 8.6 280 280 A E E -MN 601 285C 48 321,-1.8 321,-2.4 -2,-0.3 2,-0.7 -0.977 13.3-148.2-135.0 143.4 29.5 -59.3 9.8 281 281 A F E > S-MN 600 284C 19 3,-2.8 3,-0.5 -2,-0.3 319,-0.2 -0.839 94.7 -20.9-112.8 87.2 31.2 -59.6 13.2 282 282 A N T 3 S- 0 0 58 317,-0.7 -1,-0.2 -2,-0.7 318,-0.1 0.881 125.9 -53.5 79.3 42.4 33.2 -56.4 13.3 283 283 A G T 3 S+ 0 0 44 1,-0.3 -1,-0.2 316,-0.1 317,-0.1 0.279 114.8 118.0 77.1 -15.1 33.1 -55.8 9.6 284 284 A Q E < S- N 0 281C 83 -3,-0.5 -3,-2.8 1,-0.1 -1,-0.3 -0.740 76.6-107.7 -86.6 130.2 34.5 -59.3 9.1 285 285 A P E + N 0 280C 52 0, 0.0 -141,-0.7 0, 0.0 2,-0.3 -0.265 56.8 152.1 -55.8 144.3 32.2 -61.6 7.2 286 286 A A E -JN 143 279C 0 -7,-2.1 -7,-0.7 -143,-0.2 -143,-0.2 -0.988 34.0-147.1-166.4 167.8 30.6 -64.2 9.4 287 287 A S E +J 142 0C 0 -145,-2.6 -145,-2.1 -2,-0.3 2,-0.3 -0.599 24.2 167.3-128.0-168.4 27.6 -66.5 10.1 288 288 A G E -J 141 0C 0 -110,-0.3 -110,-1.2 -147,-0.3 2,-0.5 -0.998 35.5 -82.8 175.6-175.3 26.1 -67.7 13.3 289 289 A L E -JL 140 177C 0 -149,-2.8 2,-1.4 -2,-0.3 -149,-0.6 -0.925 21.5-164.9-124.8 108.1 23.3 -69.3 15.4 290 290 A G E -JL 139 176C 0 -114,-4.3 -114,-3.3 -2,-0.5 -151,-0.1 -0.613 27.2-174.8 -90.4 76.5 20.3 -67.3 16.4 291 291 A I E + L 0 175C 0 -2,-1.4 -154,-0.6 -153,-0.8 -153,-0.4 -0.124 8.8 178.9 -70.3 162.7 19.0 -69.7 19.1 292 292 A K - 0 0 36 -118,-0.9 2,-0.3 -120,-0.5 -1,-0.1 -0.637 23.9 -96.5-142.1-160.4 15.7 -69.4 21.1 293 293 A L - 0 0 28 -2,-0.2 2,-0.5 -122,-0.1 -159,-0.2 -0.815 21.3-123.0-126.5 166.8 13.7 -71.2 23.8 294 294 A A > - 0 0 8 -2,-0.3 3,-0.7 -121,-0.2 -162,-0.2 -0.965 56.9 -82.0-110.8 127.3 10.8 -73.6 23.9 295 295 A T T 3 S+ 0 0 11 -164,-1.6 -1,-0.1 -163,-0.6 -162,-0.1 0.147 119.2 4.3 -27.2 134.7 7.9 -72.3 26.0 296 296 A G T 3 S+ 0 0 41 -257,-0.2 -1,-0.3 -196,-0.1 -259,-0.1 0.880 100.6 174.1 47.6 39.4 8.6 -73.0 29.6 297 297 A A < - 0 0 18 -3,-0.7 -2,-0.1 1,-0.1 -4,-0.1 0.105 29.5 -83.7 -63.3-172.2 11.9 -74.3 28.5 298 298 A N - 0 0 106 -128,-0.2 4,-0.2 1,-0.2 -1,-0.1 -0.192 50.5 -72.5 -91.0-179.5 14.6 -75.4 30.9 299 299 A A S > S- 0 0 20 1,-0.1 3,-2.2 2,-0.1 4,-0.3 0.378 77.9 -63.6 -54.8-164.7 17.4 -73.6 32.8 300 300 A L T >> S+ 0 0 67 1,-0.3 4,-3.3 2,-0.2 3,-1.6 0.797 118.5 103.4 -57.2 -18.7 20.5 -72.3 31.2 301 301 A D H 3> S+ 0 0 75 1,-0.3 4,-3.1 2,-0.3 -1,-0.3 0.725 70.9 59.2 -32.0 -32.4 20.6 -76.0 30.7 302 302 A T H <4 S+ 0 0 1 -3,-2.2 -1,-0.3 2,-0.2 -132,-0.3 0.982 114.7 32.0 -65.1 -55.5 19.6 -75.1 27.2 303 303 A A H X> S+ 0 0 12 -3,-1.6 4,-1.8 -4,-0.3 3,-1.4 0.817 114.9 61.9 -69.3 -31.2 22.7 -73.0 26.7 304 304 A A H 3< S+ 0 0 48 -4,-3.3 3,-0.3 1,-0.3 -2,-0.2 0.972 112.4 37.4 -57.4 -49.6 24.5 -75.4 29.0 305 305 A A T 3X S+ 0 0 28 -4,-3.1 4,-0.6 -5,-0.3 -135,-0.6 0.180 106.6 66.1 -89.2 16.7 23.7 -78.1 26.4 306 306 A I H <> S+ 0 0 0 -3,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.711 102.9 47.8 -98.2 -35.9 24.2 -75.7 23.3 307 307 A R H < S+ 0 0 103 -4,-1.8 -2,-0.2 -3,-0.3 -1,-0.1 0.099 105.0 67.2 -87.6 18.6 27.9 -75.6 24.2 308 308 A A H > S+ 0 0 45 2,-0.1 4,-0.9 3,-0.1 -1,-0.2 0.783 103.8 37.8-100.3 -53.6 27.5 -79.3 24.5 309 309 A E H X S+ 0 0 70 -4,-0.6 4,-0.7 1,-0.2 3,-0.3 0.892 120.2 47.2 -64.8 -43.4 26.8 -79.9 20.8 310 310 A L H X S+ 0 0 0 -4,-1.7 4,-1.7 1,-0.2 3,-0.2 0.760 97.3 78.1 -68.2 -27.2 29.4 -77.3 19.8 311 311 A A H 4 S+ 0 0 34 1,-0.3 3,-0.3 2,-0.2 -1,-0.2 0.929 105.9 27.3 -46.0 -60.0 31.7 -78.9 22.3 312 312 A K H < S+ 0 0 145 -4,-0.9 4,-0.3 -3,-0.3 -1,-0.3 0.522 110.0 72.3 -84.3 -9.0 32.6 -81.8 20.0 313 313 A M H >< S+ 0 0 23 -4,-0.7 3,-1.1 -3,-0.2 -1,-0.2 0.864 83.2 70.7 -73.4 -36.5 32.0 -79.9 16.7 314 314 A E G >< S+ 0 0 77 -4,-1.7 3,-1.0 -3,-0.3 -1,-0.2 0.726 87.1 64.4 -50.5 -35.2 35.1 -77.7 17.1 315 315 A P G 3 S+ 0 0 78 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.788 103.1 44.8 -63.3 -33.6 37.7 -80.6 16.4 316 316 A F G < S+ 0 0 150 -3,-1.1 -2,-0.2 -4,-0.3 -3,-0.1 0.183 84.8 125.0 -99.3 15.7 36.6 -81.3 12.8 317 317 A F < - 0 0 33 -3,-1.0 3,-0.1 -4,-0.1 -3,-0.0 -0.539 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A K < - 0 0 75 -3,-2.4 -3,-0.5 4,-0.0 -1,-0.3 -0.994 63.3-124.1-136.4 142.5 -0.6 -40.9 33.2 826 836 A S >> - 0 0 81 -2,-0.3 4,-2.2 -5,-0.1 3,-0.5 -0.382 35.4 -98.8 -82.5 160.7 -1.1 -44.6 33.4 827 837 A T H 3> S+ 0 0 45 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.898 121.7 55.4 -39.6 -59.3 -2.1 -47.0 30.6 828 838 A G H 3> S+ 0 0 42 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.864 107.2 47.5 -44.1 -52.6 -5.7 -46.9 31.6 829 839 A E H <> S+ 0 0 89 -3,-0.5 4,-0.9 1,-0.2 -1,-0.2 0.975 115.7 46.0 -55.0 -55.1 -6.0 -43.1 31.4 830 840 A A H X S+ 0 0 0 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.789 115.0 49.7 -58.2 -31.1 -4.2 -43.2 28.0 831 841 A M H X S+ 0 0 27 -4,-2.6 4,-2.2 -5,-0.3 5,-0.3 0.947 95.4 62.3 -77.4 -53.2 -6.5 -46.1 26.8 832 842 A E H X S+ 0 0 96 -4,-2.5 4,-1.1 1,-0.3 -1,-0.2 0.822 109.6 49.4 -41.9 -34.4 -10.1 -45.0 27.6 833 843 A L H >X S+ 0 0 12 -4,-0.9 4,-2.9 -5,-0.3 3,-0.6 0.952 105.2 54.1 -70.9 -52.1 -9.2 -42.2 25.1 834 844 A M H 3X S+ 0 0 1 -4,-1.2 4,-1.1 1,-0.3 -2,-0.2 0.813 107.4 52.4 -53.1 -33.1 -7.9 -44.5 22.5 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