==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 26-JUL-11 3T56 . COMPND 2 MOLECULE: CATION EFFLUX SYSTEM PROTEIN CUSA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.-C.SU,F.LONG,E.W.YU . 1673 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 71921.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1186 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 345 20.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 9 0.5 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 . 134 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 193 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 452 27.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.2 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 5 6 5 3 2 6 6 3 3 2 3 3 2 2 0 0 0 0 0 1 0 0 0 0 1 0 1 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 8 11 8 12 9 5 5 1 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 1 5 4 1 2 0 0 0 1 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 4 A W >> 0 0 204 0, 0.0 4,-1.1 0, 0.0 3,-0.9 0.000 360.0 360.0 360.0 -58.7 -68.7 41.6 -14.1 2 5 A I H 3> + 0 0 78 1,-0.2 4,-0.9 2,-0.2 489,-0.0 0.691 360.0 64.8 -71.5 -19.9 -67.7 43.7 -11.1 3 6 A I H 3> S+ 0 0 17 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.795 99.2 53.4 -73.4 -28.1 -64.1 43.9 -12.3 4 7 A R H <> S+ 0 0 154 -3,-0.9 4,-1.1 2,-0.2 -2,-0.2 0.900 104.4 53.2 -72.4 -41.9 -65.2 45.8 -15.4 5 8 A R H X S+ 0 0 127 -4,-1.1 4,-1.7 1,-0.2 -1,-0.2 0.816 109.0 55.2 -57.3 -28.7 -67.0 48.4 -13.2 6 9 A S H < S+ 0 0 4 -4,-0.9 -2,-0.2 485,-0.3 -1,-0.2 0.956 104.0 47.7 -70.5 -53.6 -63.7 48.6 -11.5 7 10 A V H >< S+ 0 0 15 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.672 108.4 60.8 -63.0 -15.2 -61.6 49.4 -14.5 8 11 A A H 3< S+ 0 0 74 -4,-1.1 2,-0.7 1,-0.3 -1,-0.2 0.931 110.4 37.3 -73.2 -50.4 -64.3 52.0 -15.2 9 12 A N T 3X S+ 0 0 62 -4,-1.7 4,-0.7 1,-0.2 5,-0.4 -0.454 81.7 159.8 -95.2 58.5 -63.6 53.7 -11.9 10 13 A R H <> + 0 0 145 -2,-0.7 4,-0.7 -3,-0.6 -1,-0.2 0.914 68.3 28.8 -43.2 -65.0 -59.8 53.2 -12.3 11 14 A F H >> S+ 0 0 131 -3,-0.2 4,-1.6 2,-0.1 3,-0.6 0.985 111.2 58.2 -67.7 -65.2 -58.6 55.9 -9.9 12 15 A L H >> S+ 0 0 121 1,-0.2 4,-1.9 2,-0.2 3,-0.8 0.811 103.4 46.3 -39.8 -69.6 -61.2 56.4 -7.2 13 16 A V H 3X S+ 0 0 54 -4,-0.7 4,-2.8 1,-0.3 -1,-0.2 0.858 110.3 55.9 -47.5 -44.8 -61.6 53.0 -5.5 14 17 A L H X S+ 0 0 29 -4,-1.9 4,-3.6 -5,-0.2 3,-0.8 0.912 105.9 51.8 -66.9 -43.6 -60.4 54.7 -1.3 17 20 A A H 3X S+ 0 0 12 -4,-2.8 4,-0.6 1,-0.3 -2,-0.2 0.871 108.7 49.9 -61.7 -38.9 -58.6 51.4 -0.5 18 21 A L H 3X S+ 0 0 59 -4,-1.9 4,-1.2 2,-0.2 -1,-0.3 0.585 113.5 48.1 -77.1 -10.0 -55.5 53.4 0.6 19 22 A F H <> S+ 0 0 142 -3,-0.8 4,-2.5 -4,-0.4 -2,-0.2 0.817 110.7 47.0 -90.8 -44.9 -57.8 55.5 2.7 20 23 A L H X S+ 0 0 82 -4,-3.6 4,-0.7 1,-0.2 -2,-0.2 0.698 111.6 60.9 -59.8 -18.4 -59.5 52.4 4.2 21 24 A S H X S+ 0 0 21 -4,-0.6 4,-2.5 -5,-0.3 -2,-0.2 0.950 108.3 34.8 -76.1 -52.7 -55.8 51.5 4.5 22 25 A I H < S+ 0 0 107 -4,-1.2 -2,-0.2 2,-0.3 -1,-0.1 0.774 118.4 53.8 -75.2 -26.2 -54.7 54.4 6.8 23 26 A W H X S+ 0 0 139 -4,-2.5 4,-2.1 2,-0.2 3,-0.5 0.800 109.2 51.1 -68.7 -31.4 -58.1 54.1 8.4 24 27 A G H < S+ 0 0 0 -4,-0.7 4,-0.5 -5,-0.2 -2,-0.3 0.930 102.5 56.8 -67.4 -47.3 -57.0 50.5 8.8 25 28 A T T < S+ 0 0 52 -4,-2.5 4,-0.4 1,-0.2 -1,-0.2 0.533 116.1 38.8 -65.2 -4.7 -53.7 51.5 10.3 26 29 A W T > S+ 0 0 179 -3,-0.5 4,-0.7 2,-0.2 -1,-0.2 0.627 97.6 71.4-113.6 -27.8 -55.8 53.3 12.9 27 30 A T T < S+ 0 0 2 -4,-2.1 356,-0.4 1,-0.2 -2,-0.2 0.554 108.7 46.0 -59.7 -4.7 -58.6 50.8 13.4 28 31 A I T 4 S+ 0 0 30 -4,-0.5 -1,-0.2 -5,-0.1 -2,-0.2 0.819 84.5 84.0-100.0 -47.4 -55.6 49.0 15.0 29 32 A I T 4 S+ 0 0 85 -4,-0.4 2,-2.9 1,-0.3 -2,-0.1 0.641 74.2 77.8 -43.6 -24.3 -54.0 51.7 17.2 30 33 A N S < S+ 0 0 74 -4,-0.7 -1,-0.3 1,-0.2 354,-0.2 -0.382 83.0 121.1 -70.7 59.5 -56.5 50.8 19.9 31 34 A T + 0 0 34 -2,-2.9 -1,-0.2 352,-0.1 -2,-0.1 0.971 9.6 121.0 -97.8 -70.8 -54.0 48.0 20.1 32 35 A P - 0 0 43 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 -0.103 69.2-116.0 13.2-113.4 -51.9 46.9 23.1 33 36 A V - 0 0 2 3,-0.0 262,-0.7 352,-0.0 2,-0.5 -0.853 13.7-129.6 173.0 153.9 -53.2 43.3 23.4 34 37 A D B -a 385 0A 16 350,-0.7 352,-1.8 349,-0.3 353,-0.1 -0.959 9.3-165.2-115.3 109.5 -55.0 40.7 25.5 35 38 A A S S+ 0 0 15 -2,-0.5 352,-0.2 1,-0.3 -1,-0.1 0.853 86.2 19.3 -55.5 -30.1 -52.9 37.6 25.8 36 39 A L + 0 0 33 -3,-0.1 -1,-0.3 350,-0.1 3,-0.1 -0.875 40.9 155.1-152.1 112.0 -56.3 36.2 27.0 37 40 A P + 0 0 37 0, 0.0 -1,-0.1 0, 0.0 348,-0.0 -0.378 59.9 116.2-104.0 44.6 -59.9 37.2 26.8 38 41 A D + 0 0 9 95,-0.0 429,-0.1 432,-0.0 432,-0.1 0.393 39.3 119.8 -96.2 -0.4 -60.3 33.4 27.3 39 42 A L - 0 0 23 -3,-0.1 2,-0.2 1,-0.1 617,-0.1 -0.295 62.9-125.2 -70.4 146.5 -62.1 33.6 30.7 40 43 A S - 0 0 30 616,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.529 23.9-174.6 -76.9 160.5 -65.5 32.3 31.4 41 44 A D + 0 0 50 -2,-0.2 2,-2.1 55,-0.1 -1,-0.1 0.428 49.8 106.4-140.2 -5.7 -67.8 34.9 32.9 42 45 A V + 0 0 25 52,-0.1 52,-1.3 61,-0.0 2,-0.3 -0.202 67.0 89.5 -77.3 49.6 -71.1 33.2 33.8 43 46 A Q E -B 93 0B 29 -2,-2.1 2,-0.5 50,-0.2 50,-0.2 -0.952 54.0-165.5-151.0 127.1 -70.2 33.5 37.5 44 47 A V E -B 92 0B 7 48,-1.3 48,-2.3 -2,-0.3 2,-0.3 -0.955 21.7-138.1-112.7 127.9 -70.8 36.1 40.2 45 48 A I E -B 91 0B 14 -2,-0.5 82,-3.0 83,-0.2 2,-0.5 -0.669 16.2-172.2 -91.3 137.3 -68.8 35.8 43.4 46 49 A I E -BC 90 126B 10 44,-2.5 44,-1.4 -2,-0.3 2,-0.7 -0.954 6.9-169.9-130.0 111.1 -70.4 36.4 46.8 47 50 A K E -BC 89 125B 21 78,-3.5 78,-1.8 -2,-0.5 2,-0.5 -0.853 7.0-173.6-114.4 103.7 -68.0 36.5 49.8 48 51 A T E -B 88 0B 2 40,-2.0 40,-3.5 -2,-0.7 2,-0.5 -0.812 18.7-151.0 -91.4 128.6 -69.2 36.5 53.3 49 52 A S E -B 87 0B 35 -2,-0.5 38,-0.2 74,-0.5 74,-0.2 -0.888 52.1 -23.4-114.7 128.1 -66.4 37.0 55.8 50 53 A Y + 0 0 117 36,-3.4 -1,-0.2 -2,-0.5 37,-0.2 0.878 59.6 155.7 49.2 60.8 -66.0 35.8 59.4 51 54 A P S S- 0 0 31 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.874 78.7 -41.0 -73.7 -36.2 -69.6 35.2 60.7 52 55 A G - 0 0 26 34,-0.1 2,-1.7 67,-0.0 34,-0.3 -0.867 62.0 -96.2 177.9 152.7 -68.1 32.7 63.2 53 56 A Q S S+ 0 0 101 -2,-0.2 32,-0.1 -3,-0.1 0, 0.0 -0.534 77.6 116.7 -85.6 79.1 -65.5 30.0 63.2 54 57 A A >>> - 0 0 35 -2,-1.7 2,-2.8 30,-0.2 3,-1.8 -0.700 46.4-163.6-146.6 88.9 -67.7 27.0 62.6 55 58 A P T 345S+ 0 0 9 0, 0.0 744,-0.2 0, 0.0 30,-0.1 -0.156 88.8 48.7 -67.8 45.2 -67.1 25.0 59.4 56 59 A Q T 345S+ 0 0 99 -2,-2.8 28,-0.0 28,-0.1 742,-0.0 0.338 125.7 13.7-152.7 -15.1 -70.4 23.2 59.8 57 60 A I T <>5S+ 0 0 86 -3,-1.8 4,-3.5 3,-0.1 5,-0.4 0.563 116.8 61.8-131.7 -41.0 -73.1 25.9 60.5 58 61 A V H X5S+ 0 0 18 -4,-1.6 4,-1.8 1,-0.2 5,-0.1 0.918 125.2 23.5 -54.7 -43.6 -71.4 29.3 59.7 59 62 A E H 4<>S+ 0 0 86 -4,-3.5 3,-3.7 2,-0.2 5,-1.3 0.938 116.2 49.8 -81.0 -54.2 -76.1 28.6 56.8 62 65 A V T 3<5S+ 0 0 8 -4,-1.8 -1,-0.2 -5,-0.4 -3,-0.2 0.803 121.5 41.2 -55.7 -22.4 -74.4 31.2 54.6 63 66 A T T 3 5S+ 0 0 30 -6,-0.2 -1,-0.3 3,-0.2 -2,-0.2 0.212 120.3 51.6-101.4 11.6 -74.7 28.2 52.3 64 67 A Y T <>5S+ 0 0 130 -3,-3.7 4,-2.8 -7,-0.1 3,-0.3 0.623 122.5 12.3-110.0 -89.1 -78.1 27.6 53.6 65 68 A P H >5S+ 0 0 10 0, 0.0 4,-0.9 0, 0.0 -3,-0.2 0.841 131.2 53.8 -61.6 -28.6 -80.5 30.6 53.7 66 69 A L H >X S+ 0 0 20 -4,-0.9 4,-1.7 -5,-0.3 3,-1.0 0.852 105.4 55.5 -75.3 -36.7 -82.1 32.5 47.9 70 73 A M T 3< S+ 0 0 7 -4,-0.8 7,-0.3 1,-0.3 -1,-0.2 0.449 102.2 59.0 -75.7 0.3 -79.7 31.9 45.1 71 74 A L T 34 S+ 0 0 104 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.2 0.630 108.3 46.1 -89.1 -23.1 -81.9 29.0 44.2 72 75 A S T <4 S+ 0 0 68 -3,-1.0 -2,-0.2 -4,-0.4 -3,-0.1 0.765 88.5 101.1 -91.0 -30.7 -84.7 31.6 43.9 73 76 A V S >< S- 0 0 2 -4,-1.7 3,-0.9 1,-0.1 34,-0.1 -0.276 80.4-105.9 -60.5 138.0 -82.9 34.3 41.8 74 77 A P T 3 S+ 0 0 51 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.119 106.7 37.2 -55.9 163.3 -83.8 34.3 38.1 75 78 A G T 3 S+ 0 0 32 1,-0.2 20,-0.1 31,-0.0 -2,-0.1 0.618 89.8 163.2 64.0 11.6 -81.1 33.0 35.7 76 79 A A < + 0 0 43 -3,-0.9 -1,-0.2 1,-0.2 -5,-0.1 -0.313 13.4 140.5 -65.4 142.7 -80.5 30.4 38.4 77 80 A K + 0 0 130 16,-0.3 2,-0.4 -7,-0.3 -1,-0.2 0.334 65.2 0.4-142.1 -70.3 -78.6 27.3 37.6 78 81 A T - 0 0 31 15,-0.4 15,-1.0 2,-0.0 2,-0.6 -0.995 49.3-156.0-136.0 140.2 -76.2 26.1 40.2 79 82 A V E +D 92 0B 8 -2,-0.4 2,-0.2 13,-0.2 725,-0.2 -0.799 19.4 178.3-118.3 89.3 -75.2 27.4 43.6 80 83 A R E -D 91 0B 27 11,-1.2 11,-1.9 -2,-0.6 2,-0.3 -0.608 6.5-167.4 -86.7 150.1 -71.7 26.3 44.7 81 84 A G E -D 90 0B 0 9,-0.2 9,-0.3 -2,-0.2 2,-0.1 -0.755 16.6-153.5-149.8 98.2 -70.3 27.4 48.0 82 85 A F E -D 89 0B 9 7,-0.8 7,-2.4 -2,-0.3 2,-0.3 -0.445 22.8-170.4 -57.8 140.8 -66.8 27.2 49.3 83 86 A S E +DE 88 799B 3 716,-1.6 716,-0.8 5,-0.2 5,-0.2 -0.860 17.7 145.3-150.3 103.0 -67.1 27.2 53.0 84 87 A Q - 0 0 2 3,-3.1 2,-1.8 -2,-0.3 -30,-0.2 -0.131 54.4 -26.2-125.0-154.3 -64.0 27.5 55.2 85 88 A F S S- 0 0 61 1,-0.3 -32,-0.1 712,-0.1 -35,-0.1 -0.495 123.9 -38.6 -71.6 85.4 -62.5 28.8 58.4 86 89 A G S S+ 0 0 0 -2,-1.8 -36,-3.4 -34,-0.3 2,-0.4 0.474 121.8 104.8 73.5 1.5 -64.8 31.8 59.0 87 90 A D E -B 49 0B 11 -38,-0.2 -3,-3.1 -37,-0.2 2,-0.5 -0.950 52.2-161.1-119.2 137.6 -65.0 32.6 55.3 88 91 A S E -BD 48 83B 1 -40,-3.5 -40,-2.0 -2,-0.4 2,-0.5 -0.941 6.5-174.2-118.2 116.0 -67.8 31.9 52.9 89 92 A Y E -BD 47 82B 0 -7,-2.4 -7,-0.8 -2,-0.5 2,-0.4 -0.908 4.3-179.6-108.9 133.0 -67.3 31.8 49.2 90 93 A V E -BD 46 81B 7 -44,-1.4 -44,-2.5 -2,-0.5 2,-0.5 -0.997 9.9-165.5-133.0 132.4 -70.3 31.4 46.8 91 94 A Y E -BD 45 80B 23 -11,-1.9 -11,-1.2 -2,-0.4 2,-0.2 -0.922 7.0-159.3-122.6 106.7 -70.2 31.3 43.0 92 95 A V E -BD 44 79B 3 -48,-2.3 -48,-1.3 -2,-0.5 2,-0.3 -0.578 15.5-157.6 -80.2 145.9 -73.4 31.7 41.1 93 96 A I E +B 43 0B 34 -15,-1.0 -15,-0.4 -50,-0.2 -16,-0.3 -0.892 13.1 176.0-131.9 156.9 -73.4 30.4 37.5 94 97 A F - 0 0 18 -52,-1.3 2,-0.3 -2,-0.3 -52,-0.1 -0.630 40.2 -54.7-139.7-168.4 -75.4 31.0 34.3 95 98 A E > - 0 0 114 -2,-0.2 3,-1.5 -20,-0.1 -1,-0.0 -0.626 53.1-116.5 -79.0 141.0 -75.9 30.3 30.6 96 99 A D T 3 S+ 0 0 99 -2,-0.3 -55,-0.1 1,-0.3 -1,-0.1 0.836 109.8 50.5 -47.8 -46.0 -72.8 30.9 28.5 97 100 A G T 3 S+ 0 0 76 2,-0.1 -1,-0.3 -55,-0.0 -2,-0.0 0.682 80.9 122.9 -71.3 -19.1 -74.3 33.7 26.3 98 101 A T < - 0 0 37 -3,-1.5 -57,-0.1 1,-0.1 -4,-0.1 -0.051 69.1-109.5 -53.1 141.4 -75.6 35.8 29.2 99 102 A D > - 0 0 89 1,-0.1 4,-1.7 -57,-0.0 3,-0.4 -0.559 27.2-123.6 -71.8 131.2 -74.4 39.4 29.5 100 103 A P H >> S+ 0 0 40 0, 0.0 4,-1.3 0, 0.0 3,-0.6 0.875 107.2 39.0 -38.7 -65.0 -72.0 39.9 32.5 101 104 A Y H 3> S+ 0 0 102 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.772 105.2 66.5 -68.8 -29.0 -73.9 42.7 34.3 102 105 A W H 3> S+ 0 0 105 -3,-0.4 4,-0.8 1,-0.2 -1,-0.3 0.946 103.4 49.8 -50.0 -49.1 -77.3 41.1 33.5 103 106 A A H XX S+ 0 0 2 -4,-1.7 4,-2.8 -3,-0.6 3,-1.2 0.934 109.9 48.3 -54.8 -53.2 -76.1 38.4 35.8 104 107 A R H 3X S+ 0 0 62 -4,-1.3 4,-2.5 1,-0.3 -1,-0.2 0.905 105.6 57.5 -59.5 -44.2 -75.0 40.7 38.6 105 108 A S H 3< S+ 0 0 63 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.686 113.4 41.5 -62.7 -18.5 -78.2 42.7 38.5 106 109 A R H X< S+ 0 0 65 -3,-1.2 3,-2.7 -4,-0.8 4,-0.5 0.871 111.9 51.2 -91.0 -51.6 -80.1 39.4 39.2 107 110 A V H >X S+ 0 0 0 -4,-2.8 3,-1.0 1,-0.3 4,-0.6 0.842 104.8 63.5 -47.6 -34.0 -77.7 38.0 41.8 108 111 A L T 3< S+ 0 0 75 -4,-2.5 4,-0.5 -5,-0.3 -1,-0.3 0.467 85.0 74.0 -77.1 -1.9 -78.1 41.4 43.4 109 112 A E T <> S+ 0 0 62 -3,-2.7 4,-0.7 1,-0.2 -1,-0.2 0.804 107.5 29.8 -78.5 -28.8 -81.9 40.8 44.1 110 113 A Y H <> S+ 0 0 33 -3,-1.0 4,-1.0 -4,-0.5 -2,-0.2 0.390 103.3 73.7-117.8 -1.2 -81.3 38.3 46.9 111 114 A L H X S+ 0 0 14 -4,-0.6 4,-1.1 2,-0.1 13,-0.2 0.768 103.4 46.7 -74.8 -28.7 -78.0 39.6 48.3 112 115 A N H > S+ 0 0 93 -4,-0.5 4,-0.6 2,-0.2 3,-0.3 0.966 110.9 45.9 -77.3 -58.4 -80.1 42.5 49.7 113 116 A Q H >< S+ 0 0 119 -4,-0.7 3,-0.9 1,-0.2 4,-0.3 0.915 117.5 47.7 -47.5 -47.7 -83.0 40.6 51.2 114 117 A V H >X S+ 0 0 7 -4,-1.0 3,-2.0 1,-0.2 4,-0.6 0.807 89.0 81.9 -68.4 -34.5 -80.5 38.2 52.7 115 118 A Q H >< S+ 0 0 61 -4,-1.1 3,-1.0 -3,-0.3 -1,-0.2 0.795 86.9 60.4 -40.6 -37.8 -78.2 40.8 54.2 116 119 A G T << S+ 0 0 67 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.811 96.5 56.6 -65.9 -33.6 -80.5 41.2 57.1 117 120 A K T <4 S+ 0 0 141 -3,-2.0 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-1,-0.2 0.914 113.3 40.5 -47.4 -48.8 -53.2 50.4 28.5 297 300 A V H X S+ 0 0 2 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.955 112.6 54.6 -63.7 -52.9 -53.9 50.1 32.2 298 301 A I H X S+ 0 0 1 -4,-2.7 4,-2.0 1,-0.2 3,-0.5 0.903 111.6 44.7 -46.6 -50.8 -50.5 48.6 33.0 299 302 A A H X S+ 0 0 42 -4,-3.2 4,-1.7 1,-0.3 -1,-0.2 0.882 109.1 54.7 -65.9 -41.0 -48.7 51.6 31.4 300 303 A A H X S+ 0 0 46 -4,-1.8 4,-0.6 -5,-0.4 -1,-0.3 0.742 109.6 52.0 -63.5 -22.0 -51.0 54.1 33.1 301 304 A V H >X S+ 0 0 1 -4,-1.5 4,-0.8 -3,-0.5 3,-0.5 0.934 102.9 53.9 -78.1 -51.5 -50.0 52.5 36.3 302 305 A K H >X S+ 0 0 47 -4,-2.0 4,-1.4 1,-0.3 3,-1.2 0.895 109.9 48.0 -50.9 -47.8 -46.2 52.7 35.9 303 306 A D H 3X S+ 0 0 112 -4,-1.7 4,-1.1 1,-0.3 -1,-0.3 0.803 105.7 59.3 -65.6 -29.0 -46.3 56.4 35.3 304 307 A K H << S+ 0 0 49 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.2 0.633 103.7 53.1 -74.7 -13.6 -48.6 56.8 38.3 305 308 A L H X< S+ 0 0 9 -3,-1.2 3,-1.7 -4,-0.8 -2,-0.2 0.819 103.1 53.6 -87.5 -36.8 -45.8 55.3 40.4 306 309 A E H >< S+ 0 0 115 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88.6 64.3 -59.0 -48.5 -46.7 43.9 29.6 326 329 A Q H > S+ 0 0 85 -3,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.829 115.1 31.3 -45.4 -40.8 -43.4 42.0 29.4 327 330 A L H X S+ 0 0 12 -4,-0.5 4,-2.0 -3,-0.4 5,-0.3 0.936 114.7 58.0 -81.4 -54.7 -45.2 39.1 27.8 328 331 A I H X S+ 0 0 1 -4,-2.8 4,-1.4 1,-0.2 -2,-0.2 0.826 115.2 39.3 -43.6 -40.3 -47.9 41.0 26.0 329 332 A D H X S+ 0 0 55 -4,-3.4 4,-2.9 2,-0.2 5,-0.3 0.936 111.5 54.6 -78.2 -50.0 -45.2 42.9 24.1 330 333 A R H X S+ 0 0 92 -4,-1.3 4,-0.8 -5,-0.5 660,-0.6 0.701 114.4 45.9 -54.7 -19.2 -42.9 39.9 23.7 331 334 A A H X S+ 0 0 9 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.799 114.1 43.9 -93.9 -35.7 -45.9 38.3 22.0 332 335 A I H X S+ 0 0 37 -4,-1.4 4,-1.1 -5,-0.3 -2,-0.2 0.697 112.9 54.5 -82.2 -20.2 -47.0 41.2 19.8 333 336 A D H X S+ 0 0 118 -4,-2.9 4,-2.7 2,-0.2 -3,-0.2 0.922 107.6 47.9 -76.5 -47.0 -43.3 41.8 18.8 334 337 A N H X S+ 0 0 27 -4,-0.8 4,-2.1 -5,-0.3 -2,-0.2 0.933 113.9 46.4 -58.1 -49.4 -42.8 38.3 17.6 335 338 A L H X S+ 0 0 4 -4,-1.4 4,-2.0 2,-0.2 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3<>S+ 0 0 2 -4,-1.1 5,-0.8 -5,-0.2 -1,-0.3 0.361 91.6 55.8 -79.3 3.3 -59.7 44.2 13.0 379 382 A H H <45S+ 0 0 83 -3,-2.3 -2,-0.2 3,-0.3 -1,-0.2 0.702 95.3 60.7-103.1 -32.4 -61.8 47.0 14.5 380 383 A F H <5S+ 0 0 157 -4,-0.6 -2,-0.2 1,-0.2 -3,-0.1 0.834 128.5 18.4 -61.1 -32.4 -65.2 45.2 14.1 381 384 A Q T <5S- 0 0 65 -4,-0.8 -1,-0.2 93,-0.0 4,-0.2 0.562 112.7-130.0-108.3 -18.2 -63.6 42.6 16.4 382 385 A G T > 5 - 0 0 15 -6,-0.2 3,-1.0 -5,-0.2 -3,-0.3 0.673 3.0-129.9 68.5 125.0 -60.8 44.9 17.7 383 386 A L T 3 - 0 0 0 -352,-1.8 4,-0.6 -2,-0.6 3,-0.2 0.487 52.5 -93.9 81.9 157.1 -55.0 38.1 21.1 387 390 A I H > S+ 0 0 16 -352,-0.2 4,-4.8 1,-0.2 5,-0.3 0.732 114.1 75.9 -74.9 -26.8 -52.1 36.9 19.0 388 391 A M H > S+ 0 0 7 1,-0.3 4,-2.5 2,-0.3 6,-0.2 0.823 90.7 52.8 -58.1 -35.4 -54.7 34.9 17.1 389 392 A S H > S+ 0 0 4 -4,-0.5 4,-0.6 2,-0.2 -1,-0.3 0.913 120.0 33.8 -64.6 -43.6 -55.9 38.1 15.4 390 393 A L H < S+ 0 0 17 -4,-0.6 4,-0.4 -3,-0.2 -2,-0.3 0.807 119.1 53.3 -78.2 -33.3 -52.3 38.8 14.3 391 394 A G H X S+ 0 0 0 -4,-4.8 4,-1.7 1,-0.2 -3,-0.2 0.819 107.1 51.5 -72.6 -31.5 -51.6 35.1 13.9 392 395 A G H X S+ 0 0 0 -4,-2.5 4,-0.8 -5,-0.3 -1,-0.2 0.741 109.6 49.7 -75.2 -25.0 -54.6 34.7 11.6 393 396 A I H < S+ 0 0 9 -4,-0.6 -1,-0.2 2,-0.2 -2,-0.2 0.542 115.6 44.5 -87.8 -9.2 -53.3 37.6 9.5 394 397 A A H >4 S+ 0 0 1 -4,-0.4 3,-0.6 -6,-0.2 -2,-0.2 0.658 108.1 57.3-100.3 -25.6 -49.9 35.8 9.5 395 398 A I H 3< S+ 0 0 20 -4,-1.7 3,-0.2 1,-0.2 -2,-0.2 0.798 115.2 35.8 -74.5 -29.7 -51.4 32.4 8.8 396 399 A A T 3X S+ 0 0 12 -4,-0.8 4,-1.1 1,-0.2 -1,-0.2 0.010 81.3 102.9-118.2 26.4 -53.2 33.6 5.6 397 400 A V H <> S+ 0 0 10 -3,-0.6 4,-1.1 1,-0.2 5,-0.2 0.751 78.8 63.1 -74.4 -23.9 -50.6 36.0 4.2 398 401 A G H > S+ 0 0 6 -3,-0.2 4,-0.7 -4,-0.2 -1,-0.2 0.862 108.2 36.8 -68.6 -38.4 -49.7 33.3 1.7 399 402 A A H > S+ 0 0 20 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.727 105.5 68.5 -87.9 -23.8 -53.0 33.2 0.0 400 403 A M H < S+ 0 0 10 -4,-1.1 4,-0.4 1,-0.2 -2,-0.2 0.887 108.5 37.7 -62.9 -39.5 -53.7 36.9 0.2 401 404 A V H >X S+ 0 0 0 -4,-1.1 4,-2.1 1,-0.2 3,-0.9 0.769 104.4 73.0 -80.4 -27.9 -50.9 37.6 -2.3 402 405 A D H 3X S+ 0 0 5 -4,-0.7 4,-2.2 1,-0.2 5,-0.3 0.881 89.0 60.1 -51.1 -43.9 -51.8 34.4 -4.2 403 406 A A H 3X S+ 0 0 7 -4,-1.4 4,-0.8 1,-0.2 -1,-0.2 0.840 111.7 38.8 -57.2 -36.6 -54.9 36.1 -5.6 404 407 A A H <> S+ 0 0 0 -3,-0.9 4,-2.6 -4,-0.4 3,-0.4 0.968 114.0 49.2 -78.7 -59.2 -52.9 38.9 -7.3 405 408 A I H X S+ 0 0 1 -4,-2.1 4,-2.1 1,-0.3 -2,-0.2 0.851 108.7 54.7 -51.8 -42.7 -49.9 37.0 -8.6 406 409 A V H X S+ 0 0 11 -4,-2.2 4,-1.5 -5,-0.3 -1,-0.3 0.913 109.8 47.0 -58.8 -44.5 -52.0 34.3 -10.2 407 410 A M H < S+ 0 0 15 -4,-0.8 4,-0.3 -3,-0.4 3,-0.3 0.931 108.8 56.1 -60.7 -46.5 -53.9 37.0 -12.1 408 411 A I H >X S+ 0 0 3 -4,-2.6 4,-1.9 1,-0.2 3,-1.2 0.880 106.0 50.2 -52.2 -43.1 -50.6 38.6 -13.1 409 412 A E H 3X S+ 0 0 2 -4,-2.1 4,-1.3 1,-0.3 5,-0.3 0.826 101.7 60.0 -71.0 -32.0 -49.4 35.4 -14.6 410 413 A N H 3< S+ 0 0 17 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.530 111.3 45.3 -70.3 -4.3 -52.6 35.0 -16.7 411 414 A A H <4 S+ 0 0 5 -3,-1.2 4,-0.5 -4,-0.3 -2,-0.2 0.750 102.7 62.6-103.7 -39.5 -51.6 38.3 -18.1 412 415 A H H >X S+ 0 0 45 -4,-1.9 3,-1.7 1,-0.2 4,-0.8 0.967 114.4 30.5 -50.3 -67.4 -47.9 37.6 -18.8 413 416 A K T 3< S+ 0 0 94 -4,-1.3 -1,-0.2 1,-0.3 4,-0.2 0.715 111.0 68.0 -69.8 -20.4 -48.3 34.8 -21.3 414 417 A R T 34 S+ 0 0 84 -5,-0.3 4,-0.4 1,-0.2 -1,-0.3 0.573 104.2 46.0 -73.3 -8.4 -51.5 36.4 -22.5 415 418 A L T <> S+ 0 0 80 -3,-1.7 4,-0.6 -4,-0.5 -2,-0.2 0.611 99.0 68.0-100.0 -22.8 -49.2 39.1 -23.7 416 419 A E T < S+ 0 0 94 -4,-0.8 -2,-0.2 1,-0.2 -3,-0.1 0.440 101.4 51.3 -75.3 0.6 -46.8 36.5 -25.2 417 420 A E T > S+ 0 0 55 -4,-0.2 4,-1.4 2,-0.1 5,-0.3 0.760 105.7 48.5-104.4 -37.7 -49.6 35.8 -27.7 418 421 A W T 4 S+ 0 0 66 -4,-0.4 4,-0.5 1,-0.2 -2,-0.2 0.521 112.5 52.4 -82.6 -5.6 -50.4 39.2 -29.0 419 422 A Q T < S+ 0 0 80 -4,-0.6 -1,-0.2 2,-0.1 -2,-0.1 0.645 109.6 46.8-100.0 -22.0 -46.7 39.9 -29.5 420 423 A H T 4 S+ 0 0 147 -5,-0.1 -2,-0.2 -4,-0.1 -3,-0.1 0.748 122.6 34.5 -89.1 -28.4 -46.1 36.8 -31.6 421 424 A Q S < S+ 0 0 148 -4,-1.4 -3,-0.2 2,-0.1 -2,-0.1 0.906 122.7 44.3 -88.6 -55.5 -49.2 37.3 -33.8 422 425 A H S S- 0 0 103 -4,-0.5 0, 0.0 -5,-0.3 0, 0.0 -0.367 101.1 -93.1 -79.4 168.0 -49.1 41.1 -34.0 423 426 A P - 0 0 81 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.303 22.0-131.8 -66.9-158.2 -45.8 43.0 -34.5 424 427 A D S S+ 0 0 107 -4,-0.1 3,-0.1 3,-0.0 -4,-0.0 0.466 90.0 67.5-134.6 -16.2 -43.5 44.4 -31.8 425 428 A A S S+ 0 0 97 1,-0.2 2,-0.3 0, 0.0 0, 0.0 0.295 95.4 56.8 -99.2 9.0 -42.8 47.9 -32.9 426 429 A T + 0 0 111 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.844 55.4 143.9-146.0 107.1 -46.3 49.4 -32.4 427 430 A L - 0 0 133 -2,-0.3 2,-0.1 -3,-0.1 -3,-0.0 -0.989 17.9-178.4-142.7 132.9 -48.3 49.3 -29.2 428 431 A D > - 0 0 103 -2,-0.3 4,-0.7 1,-0.0 -2,-0.0 -0.204 45.9 -85.6-110.7-159.2 -50.6 52.0 -27.8 429 432 A N H > S+ 0 0 101 2,-0.2 4,-1.7 1,-0.1 5,-0.1 0.795 121.3 56.9 -82.7 -31.8 -52.8 52.4 -24.7 430 433 A K H > S+ 0 0 123 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.911 102.7 54.2 -65.7 -44.0 -55.8 50.6 -26.1 431 434 A T H > S+ 0 0 37 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.872 110.4 45.7 -60.2 -39.6 -53.8 47.4 -26.7 432 435 A R H X S+ 0 0 109 -4,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.857 110.6 53.5 -74.4 -34.9 -52.6 47.2 -23.2 433 436 A W H X S+ 0 0 88 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.918 109.2 51.0 -58.4 -43.2 -56.0 47.9 -21.8 434 437 A Q H X S+ 0 0 64 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.810 109.4 47.6 -69.5 -34.2 -57.3 45.0 -23.9 435 438 A V H X S+ 0 0 1 -4,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.870 108.9 54.7 -75.0 -36.7 -54.7 42.5 -22.7 436 439 A I H X S+ 0 0 28 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.908 110.8 46.4 -59.9 -42.5 -55.4 43.4 -19.1 437 440 A T H X S+ 0 0 24 -4,-1.9 4,-1.3 2,-0.2 3,-0.3 0.936 111.3 50.7 -64.9 -47.3 -59.1 42.7 -19.6 438 441 A D H X S+ 0 0 62 -4,-2.1 4,-1.4 1,-0.2 3,-0.4 0.900 109.5 51.8 -55.5 -43.0 -58.3 39.4 -21.4 439 442 A A H X S+ 0 0 2 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.834 112.0 46.7 -62.0 -33.5 -56.1 38.5 -18.5 440 443 A S H < S+ 0 0 10 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.648 106.4 59.5 -85.3 -16.5 -59.0 39.3 -16.1 441 444 A V H < S+ 0 0 60 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.1 0.925 109.3 35.1 -80.1 -47.0 -61.6 37.4 -18.0 442 445 A E H < S+ 0 0 77 -4,-1.4 4,-0.4 1,-0.2 -2,-0.1 0.899 131.6 28.5 -80.2 -43.1 -60.3 33.8 -18.1 443 446 A V S X S+ 0 0 2 -4,-0.9 4,-1.2 -5,-0.3 -1,-0.2 0.433 107.4 86.9 -93.5 -0.7 -58.7 33.6 -14.7 444 447 A G H > S+ 0 0 20 2,-0.2 4,-1.2 3,-0.1 3,-0.3 0.993 89.4 33.1 -63.3 -73.8 -61.1 36.1 -13.3 445 448 A P H >> S+ 0 0 76 0, 0.0 4,-1.7 0, 0.0 3,-1.0 0.938 115.1 56.9 -50.3 -60.4 -64.2 34.3 -12.2 446 449 A A H 3> S+ 0 0 12 -4,-0.4 4,-1.7 1,-0.3 -2,-0.2 0.837 102.7 54.9 -41.2 -51.2 -62.4 31.1 -11.0 447 450 A L H 3X S+ 0 0 19 -4,-1.2 4,-1.5 -3,-0.3 -1,-0.3 0.878 109.3 46.8 -55.1 -43.9 -60.1 33.0 -8.6 448 451 A F H X S+ 0 0 42 -4,-1.7 4,-1.9 1,-0.3 3,-0.6 0.862 106.3 54.2 -40.7 -46.6 -65.2 31.5 -6.3 450 453 A S H 3X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 3,-0.4 0.948 103.9 50.8 -52.7 -58.6 -62.3 29.9 -4.5 451 454 A L H 3X S+ 0 0 12 -4,-1.5 4,-0.9 -3,-0.3 -1,-0.2 0.678 109.0 54.0 -62.0 -18.0 -61.8 32.7 -1.9 452 455 A L H < S+ 0 0 2 -4,-0.9 3,-2.5 -5,-0.3 4,-0.4 0.771 88.0 83.2 -89.4 -30.0 -63.6 28.2 7.8 459 462 A I G >X S+ 0 0 80 -4,-1.0 3,-2.5 1,-0.3 4,-0.5 0.832 75.2 72.1 -41.6 -47.2 -67.1 29.3 8.9 460 463 A P G 34 S+ 0 0 9 0, 0.0 -1,-0.3 0, 0.0 4,-0.1 0.523 86.1 68.5 -54.8 -4.5 -67.6 26.1 11.1 461 464 A I G X4 S+ 0 0 1 -3,-2.5 3,-1.9 1,-0.2 -2,-0.2 0.797 84.3 68.1 -82.6 -31.1 -65.1 27.6 13.5 462 465 A F T <4 S+ 0 0 148 -3,-2.5 -1,-0.2 -4,-0.4 -3,-0.1 0.831 95.7 58.2 -50.9 -33.4 -67.5 30.4 14.5 463 466 A T T 3< S+ 0 0 57 -4,-0.5 2,-0.4 2,-0.1 -1,-0.3 0.619 74.0 115.6 -78.7 -13.7 -69.6 27.6 16.1 464 467 A L < - 0 0 10 -3,-1.9 2,-0.5 -4,-0.1 390,-0.1 -0.443 65.0-138.9 -59.4 113.4 -66.7 26.5 18.4 465 468 A E - 0 0 106 -2,-0.4 3,-0.3 388,-0.3 2,-0.3 -0.666 49.7 -13.8 -87.1 120.2 -68.2 27.2 21.8 466 469 A G S > S- 0 0 10 -2,-0.5 4,-2.4 1,-0.2 5,-0.2 -0.699 111.4 -6.9 110.8-149.5 -66.0 28.8 24.5 467 470 A Q H > S+ 0 0 9 -2,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.861 132.2 48.4 -61.3 -41.7 -62.3 29.4 25.3 468 471 A E H > S+ 0 0 0 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.908 111.3 51.7 -64.0 -42.0 -61.1 27.5 22.2 469 472 A G H 4 S+ 0 0 10 1,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.887 111.9 45.6 -60.4 -41.1 -63.6 29.4 20.1 470 473 A R H < S+ 0 0 82 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.771 109.0 58.7 -71.0 -27.1 -62.3 32.6 21.5 471 474 A L H < S+ 0 0 6 -4,-1.6 4,-0.3 -5,-0.2 -2,-0.2 0.894 124.6 18.1 -71.5 -41.0 -58.8 31.4 20.9 472 475 A F S X S+ 0 0 4 -4,-2.1 4,-1.5 2,-0.1 -1,-0.2 0.155 105.8 91.3-116.1 18.0 -59.2 30.8 17.2 473 476 A G H > S+ 0 0 10 -4,-0.4 4,-2.0 2,-0.2 -3,-0.2 0.962 90.4 41.0 -75.5 -57.7 -62.3 33.0 16.8 474 477 A P H >> S+ 0 0 27 0, 0.0 4,-4.9 0, 0.0 3,-0.6 0.955 117.9 50.6 -50.1 -50.8 -60.5 36.3 16.0 475 478 A L H 3> S+ 0 0 2 -4,-0.3 4,-0.8 1,-0.3 5,-0.2 0.882 108.1 52.1 -54.2 -41.3 -58.2 34.1 13.9 476 479 A A H 3X S+ 0 0 8 -4,-1.5 4,-0.8 -7,-0.2 -1,-0.3 0.810 120.8 34.3 -65.2 -30.6 -61.4 32.7 12.3 477 480 A F H X S+ 0 0 7 -4,-2.0 4,-2.8 2,-0.2 3,-0.8 0.831 106.5 53.3 -89.9 -39.9 -61.0 41.9 1.2 486 489 A A H 3X S+ 0 0 2 -4,-1.0 4,-2.3 -5,-0.3 -2,-0.2 0.746 106.7 55.9 -66.5 -23.0 -58.0 41.1 -1.0 487 490 A A H 3< S+ 0 0 13 -4,-1.1 -1,-0.3 2,-0.2 -2,-0.2 0.678 109.8 46.2 -78.2 -19.7 -60.5 39.4 -3.3 488 491 A L H <4 S+ 0 0 105 -3,-0.8 -2,-0.2 2,-0.2 4,-0.2 0.841 115.9 43.4 -87.4 -41.3 -62.3 42.8 -3.4 489 492 A L H >X>S+ 0 0 31 -4,-2.8 4,-3.3 1,-0.2 3,-1.5 0.923 112.6 52.7 -66.9 -45.8 -59.1 44.8 -3.9 490 493 A A T 3<5S+ 0 0 7 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.692 113.0 46.3 -64.1 -17.8 -57.8 42.3 -6.5 491 494 A I T 345S+ 0 0 30 -4,-0.1 -485,-0.3 -3,-0.1 -1,-0.3 0.399 128.5 23.7-104.8 0.2 -61.1 42.7 -8.3 492 495 A V T <45S+ 0 0 21 -3,-1.5 -478,-0.2 -4,-0.2 -2,-0.2 0.402 138.8 12.7-139.2 -7.2 -61.2 46.5 -8.2 493 496 A V T >X5S+ 0 0 2 -4,-3.3 3,-1.5 -5,-0.1 4,-1.2 0.570 103.7 71.5-136.7 -61.8 -57.6 47.5 -7.8 494 497 A I H >>> S+ 0 0 4 0, 0.0 4,-1.1 0, 0.0 3,-1.0 0.872 106.9 52.8 -57.3 -39.3 -55.4 44.8 -12.2 496 499 A I H <> S+ 0 0 26 -3,-1.5 4,-2.1 1,-0.3 5,-0.3 0.769 104.3 55.8 -70.5 -26.2 -55.1 48.6 -12.6 497 500 A L H << S+ 0 0 23 -4,-1.2 -1,-0.3 -3,-0.7 4,-0.1 0.548 111.1 44.4 -83.7 -7.6 -51.8 48.6 -10.7 498 501 A M H << S+ 0 0 28 -3,-1.0 -2,-0.2 -4,-0.6 -1,-0.2 0.551 116.5 45.5-107.4 -15.9 -50.3 46.1 -13.2 499 502 A G H < S+ 0 0 14 -4,-1.1 -2,-0.2 -5,-0.2 -3,-0.2 0.904 111.9 48.5 -86.3 -56.2 -51.7 47.8 -16.3 500 503 A Y < 0 0 179 -4,-2.1 -3,-0.2 1,-0.2 -2,-0.1 0.913 360.0 360.0 -45.6 -47.9 -50.7 51.3 -15.4 501 504 A W 0 0 83 -5,-0.3 -1,-0.2 -4,-0.1 -139,-0.1 -0.708 360.0 360.0 -83.1 360.0 -47.3 49.9 -14.6 502 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 503 517 A L > 0 0 154 0, 0.0 3,-0.8 0, 0.0 -150,-0.0 0.000 360.0 360.0 360.0 8.9 -34.4 29.6 -15.2 504 518 A N T 3> + 0 0 29 1,-0.2 4,-0.5 2,-0.1 3,-0.4 0.466 360.0 70.2 -60.6 1.6 -38.1 28.6 -15.4 505 519 A R H >> S+ 0 0 139 1,-0.2 4,-2.0 2,-0.2 2,-1.5 0.929 87.5 57.6 -79.6 -54.9 -36.9 26.1 -18.0 506 520 A F H <4 S+ 0 0 133 -3,-0.8 -1,-0.2 1,-0.3 -2,-0.1 -0.036 108.5 49.0 -73.2 36.4 -35.0 23.8 -15.6 507 521 A L H 3> S+ 0 0 48 -2,-1.5 4,-0.7 -3,-0.4 -1,-0.3 0.363 107.7 49.9-138.1 -28.4 -38.2 23.3 -13.6 508 522 A I H X S+ 0 0 25 -4,-0.7 3,-2.2 2,-0.1 4,-0.5 0.951 105.0 48.6 -87.6 -76.4 -41.6 18.2 -14.1 512 526 A H H >X S+ 0 0 0 -4,-1.2 4,-2.3 1,-0.3 3,-0.8 0.653 94.5 72.4 -52.8 -29.6 -43.1 16.9 -17.3 513 527 A P H 34 S+ 0 0 63 0, 0.0 -1,-0.3 0, 0.0 4,-0.1 0.885 108.4 37.8 -51.4 -38.2 -40.8 13.9 -17.8 514 528 A L H <4 S+ 0 0 103 -3,-2.2 4,-0.4 -4,-0.2 -2,-0.2 0.517 110.5 65.6 -89.1 -7.6 -42.6 12.3 -14.9 515 529 A L H X< S+ 0 0 12 -3,-0.8 3,-2.0 -4,-0.5 4,-0.3 0.941 93.8 54.1 -75.7 -52.3 -45.9 13.7 -16.1 516 530 A L T 3< S+ 0 0 103 -4,-2.3 3,-0.4 1,-0.3 -1,-0.2 0.656 104.5 60.9 -57.8 -13.4 -46.1 11.8 -19.4 517 531 A K T > S+ 0 0 123 -5,-0.3 3,-1.3 1,-0.2 4,-0.4 0.731 88.8 66.8 -85.8 -25.3 -45.8 8.7 -17.1 518 532 A V T < S+ 0 0 11 -3,-2.0 7,-0.2 -4,-0.4 -1,-0.2 0.528 100.3 55.0 -70.4 -3.7 -48.9 9.5 -15.2 519 533 A L T 3 S+ 0 0 31 -3,-0.4 -1,-0.2 -4,-0.3 -2,-0.2 0.415 72.2 96.2-112.3 -3.5 -50.7 8.7 -18.5 520 534 A H S < S- 0 0 147 -3,-1.3 -2,-0.1 1,-0.3 -1,-0.1 0.906 118.9 -10.9 -47.2 -43.6 -49.2 5.3 -19.0 521 535 A W S > S- 0 0 131 -4,-0.4 4,-1.3 1,-0.1 -1,-0.3 -0.801 71.3-152.2-159.4 117.4 -52.5 4.3 -17.4 522 536 A P H > S+ 0 0 20 0, 0.0 4,-0.6 0, 0.0 3,-0.3 0.921 92.1 44.2 -58.5 -52.7 -54.7 7.0 -15.8 523 537 A K H > S+ 0 0 108 1,-0.2 4,-1.1 2,-0.2 3,-0.1 0.792 108.6 56.2 -67.7 -33.7 -56.5 4.9 -13.1 524 538 A T H > S+ 0 0 45 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.834 106.5 49.8 -71.2 -32.3 -53.5 3.0 -11.9 525 539 A T H < S+ 0 0 23 -4,-1.3 4,-0.4 -3,-0.3 -1,-0.2 0.687 107.3 59.1 -74.1 -18.7 -51.6 6.2 -11.1 526 540 A L H X S+ 0 0 53 -4,-0.6 4,-0.8 -5,-0.2 -2,-0.2 0.793 107.1 43.9 -79.0 -30.5 -54.8 7.2 -9.3 527 541 A L H X S+ 0 0 82 -4,-1.1 4,-2.1 2,-0.2 3,-0.4 0.906 105.1 58.0 -82.6 -45.7 -54.7 4.2 -6.9 528 542 A V H < S+ 0 0 96 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.701 110.7 48.1 -59.5 -18.2 -51.0 4.2 -6.0 529 543 A A H >4 S+ 0 0 9 -4,-0.4 3,-0.8 2,-0.1 -1,-0.3 0.773 106.9 54.7 -89.2 -32.0 -51.6 7.7 -4.8 530 544 A A H >< S+ 0 0 28 -4,-0.8 3,-1.9 -3,-0.4 4,-0.5 0.811 97.7 63.2 -71.8 -31.5 -54.7 6.8 -2.8 531 545 A L T 3X S+ 0 0 96 -4,-2.1 4,-1.0 1,-0.3 -1,-0.2 0.623 85.6 75.7 -69.2 -11.6 -52.8 4.1 -0.8 532 546 A S T <4 S+ 0 0 45 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.577 87.8 62.2 -72.8 -9.9 -50.7 7.0 0.5 533 547 A V T X> S+ 0 0 44 -3,-1.9 4,-1.1 2,-0.2 3,-1.1 0.835 97.4 54.5 -79.4 -37.2 -53.8 7.7 2.7 534 548 A L H 3> S+ 0 0 95 -4,-0.5 4,-1.0 1,-0.2 -2,-0.2 0.825 101.3 59.8 -64.2 -31.9 -53.5 4.3 4.3 535 549 A T H 3< S+ 0 0 67 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.635 102.6 52.9 -73.5 -13.6 -49.9 5.1 5.3 536 550 A V H <4 S+ 0 0 20 -3,-1.1 -1,-0.2 -4,-0.2 -2,-0.2 0.773 100.8 59.7 -89.1 -29.6 -51.1 8.1 7.3 537 551 A L H >< S+ 0 0 109 -4,-1.1 3,-0.7 -3,-0.2 -2,-0.2 0.827 102.4 53.9 -67.1 -33.4 -53.6 6.1 9.3 538 552 A W G >< S+ 0 0 200 -4,-1.0 3,-1.4 1,-0.2 -1,-0.2 0.983 107.9 45.3 -67.0 -59.3 -50.9 3.8 10.7 539 553 A P G > S+ 0 0 11 0, 0.0 3,-0.6 0, 0.0 4,-0.5 0.259 83.5 95.2 -72.7 13.6 -48.5 6.6 12.1 540 554 A L G < S+ 0 0 104 -3,-0.7 2,-0.3 1,-0.2 -2,-0.1 0.607 76.5 73.3 -65.9 -11.1 -51.6 8.2 13.6 541 555 A N G < S+ 0 0 145 -3,-1.4 -1,-0.2 1,-0.1 3,-0.1 -0.252 84.0 59.6-104.4 43.1 -50.3 6.1 16.4 542 556 A K S < S+ 0 0 142 -3,-0.6 -1,-0.1 -2,-0.3 -2,-0.1 0.579 93.4 49.2-129.2 -58.0 -47.2 8.1 17.5 543 557 A V - 0 0 39 -4,-0.5 -1,-0.2 1,-0.1 364,-0.1 -0.263 65.2-152.2 -82.2 173.0 -48.1 11.6 18.6 544 558 A G - 0 0 14 362,-0.3 364,-1.1 -3,-0.1 -1,-0.1 0.100 14.5-114.8-115.9-132.0 -50.8 12.7 21.1 545 559 A G - 0 0 4 362,-0.3 275,-0.1 -2,-0.0 364,-0.1 -0.439 14.6-163.6 176.8 104.3 -52.9 15.8 21.5 546 560 A E - 0 0 23 273,-0.1 272,-0.0 -2,-0.1 364,-0.0 -0.231 34.6-116.3 -75.3 175.6 -53.1 18.5 24.2 547 561 A F S S+ 0 0 1 1,-0.3 363,-1.1 362,-0.1 364,-0.1 0.847 96.8 3.9 -80.5 -37.2 -56.1 20.8 24.3 548 562 A L S S- 0 0 4 361,-0.2 -1,-0.3 362,-0.1 360,-0.0 -0.989 87.2 -96.1-150.3 138.7 -53.9 23.9 23.7 549 563 A P - 0 0 2 0, 0.0 2,-1.2 0, 0.0 445,-0.1 -0.324 50.7-106.7 -52.9 126.0 -50.2 24.4 22.9 550 564 A Q - 0 0 83 443,-0.1 2,-0.3 1,-0.0 441,-0.1 -0.412 38.8-154.9 -62.3 94.9 -48.4 25.1 26.2 551 565 A I - 0 0 41 -2,-1.2 2,-0.6 442,-0.1 102,-0.2 -0.558 7.9-143.2 -75.4 134.9 -47.8 28.9 25.8 552 566 A N - 0 0 39 -2,-0.3 2,-0.2 98,-0.0 439,-0.2 -0.875 16.4-173.2-113.8 112.2 -44.8 30.0 27.9 553 567 A E - 0 0 8 -2,-0.6 -226,-0.0 2,-0.3 -227,-0.0 -0.588 38.7-112.8 -90.7 159.8 -44.6 33.4 29.6 554 568 A G S S+ 0 0 26 -2,-0.2 62,-0.8 61,-0.1 -1,-0.1 0.874 100.0 76.8 -57.9 -37.8 -41.5 34.6 31.4 555 569 A D E -Q 615 0G 4 60,-0.2 2,-0.3 -232,-0.1 -2,-0.3 -0.363 68.1-162.1 -74.9 155.5 -43.4 34.4 34.7 556 570 A L E -Q 614 0G 5 58,-1.9 58,-3.2 94,-0.2 2,-0.6 -0.968 9.3-141.8-148.3 125.4 -43.9 31.0 36.3 557 571 A L E -QR 613 649G 3 92,-1.9 92,-3.0 -2,-0.3 2,-0.6 -0.772 9.7-164.7-100.1 117.8 -46.4 29.9 39.0 558 572 A Y E +QR 612 648G 0 54,-2.9 54,-2.6 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119.9 39.4 -91.1 -48.9 -64.8 31.4 74.0 734 748 A T H <5S+ 0 0 82 -4,-3.5 6,-1.8 3,-0.2 -3,-0.2 0.815 139.0 9.3 -71.5 -32.2 -65.5 34.2 71.5 735 749 A S T <5S+ 0 0 6 -4,-1.8 -3,-0.2 -5,-0.3 23,-0.2 0.747 129.4 45.2-121.1 -41.7 -63.6 36.9 73.4 736 750 A A T -L 750 0D 43 3,-1.2 3,-2.7 -2,-1.2 2,-0.1 -0.775 54.1 -83.5-105.9 89.0 -57.8 57.3 62.7 748 762 A G T 3 S- 0 0 69 -2,-0.9 -1,-0.1 1,-0.3 0, 0.0 -0.315 111.7 -7.0 56.4-120.9 -58.4 59.9 59.9 749 763 A I T 3 S+ 0 0 133 -2,-0.1 2,-0.3 -3,-0.1 -1,-0.3 0.211 128.5 80.1 -88.0 14.2 -58.7 58.0 56.6 750 764 A A E < - L 0 747D 9 -3,-2.7 -3,-1.2 2,-0.0 2,-0.3 -0.824 58.3-162.8-117.4 161.2 -57.6 54.8 58.4 751 765 A R E - L 0 746D 142 -2,-0.3 -5,-0.2 -5,-0.2 -2,-0.0 -0.915 8.8-176.6-144.7 118.5 -59.5 52.3 60.6 752 766 A Y E - L 0 745D 20 -7,-1.4 -7,-2.9 -2,-0.3 -569,-0.2 -0.875 26.7-111.1-115.8 147.6 -57.7 49.7 62.8 753 767 A P E - L 0 744D 9 0, 0.0 -569,-3.0 0, 0.0 2,-0.4 -0.341 20.5-156.8 -79.3 154.3 -59.4 47.0 64.9 754 768 A I E +kL 184 743D 1 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0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 876 890 A A 0 0 56 0, 0.0 -2,-0.1 0, 0.0 -430,-0.1 0.000 360.0 360.0 360.0 0.7 -68.1 27.9 -11.1 877 891 A F - 0 0 27 -4,-0.3 2,-1.0 2,-0.0 -3,-0.2 0.418 360.0-155.4-143.9 -23.2 -68.1 24.6 -13.0 878 892 A R + 0 0 227 -5,-0.3 2,-0.3 1,-0.1 -4,-0.1 0.110 55.5 117.0 71.7 -26.7 -71.7 23.4 -12.8 879 893 A R > - 0 0 120 -2,-1.0 4,-0.6 -6,-0.2 -1,-0.1 -0.598 48.3-164.1 -83.3 132.0 -70.7 19.8 -13.2 880 894 A V H >> S+ 0 0 90 -2,-0.3 4,-1.4 2,-0.2 3,-1.3 0.939 88.0 56.0 -77.6 -51.4 -71.4 17.3 -10.4 881 895 A G H 34 S+ 0 0 18 1,-0.3 4,-0.3 2,-0.2 -1,-0.2 0.694 109.0 52.2 -55.8 -18.6 -69.2 14.4 -11.4 882 896 A E H 3> S+ 0 0 12 2,-0.1 4,-0.8 1,-0.1 3,-0.4 0.751 101.7 58.9 -86.9 -28.6 -66.3 17.0 -11.4 883 897 A A H > S+ 0 0 26 -3,-0.4 4,-1.7 -4,-0.3 3,-1.3 0.946 95.1 61.1 -61.1 -50.8 -63.0 14.8 -7.3 886 900 A I H >X S+ 0 0 8 -4,-0.8 3,-0.9 1,-0.3 4,-0.7 0.895 102.3 50.3 -42.8 -56.8 -62.1 17.9 -5.3 887 901 A I H 3< S+ 0 0 61 -4,-1.0 3,-0.3 1,-0.3 -1,-0.3 0.782 111.6 48.8 -57.9 -29.2 -63.0 16.4 -2.0 888 902 A S H << S+ 0 0 66 -3,-1.3 4,-0.5 -4,-0.9 -1,-0.3 0.714 105.7 56.8 -85.9 -21.6 -60.9 13.3 -2.7 889 903 A S H << S+ 0 0 8 -4,-1.7 4,-0.4 -3,-0.9 -1,-0.2 0.529 102.3 60.7 -81.7 -7.3 -57.9 15.3 -3.7 890 904 A V S >X S+ 0 0 16 -4,-0.7 4,-1.6 -3,-0.3 3,-1.1 0.884 89.0 62.8 -86.4 -44.4 -58.0 17.1 -0.3 891 905 A P H 3> S+ 0 0 44 0, 0.0 4,-2.8 0, 0.0 -2,-0.1 0.828 99.4 58.1 -53.2 -35.1 -57.5 14.2 2.1 892 906 A F H 3> S+ 0 0 9 -4,-0.5 4,-0.8 1,-0.2 -2,-0.2 0.870 103.4 52.7 -62.9 -36.0 -54.1 13.6 0.6 893 907 A A H <> S+ 0 0 5 -3,-1.1 4,-1.1 -4,-0.4 3,-0.5 0.861 108.6 49.8 -65.6 -35.3 -53.3 17.2 1.6 894 908 A L H >X S+ 0 0 63 -4,-1.6 4,-1.5 1,-0.2 3,-0.6 0.925 100.8 64.8 -63.6 -44.3 -54.4 16.3 5.1 895 909 A V H 3X S+ 0 0 16 -4,-2.8 4,-1.3 1,-0.3 -1,-0.2 0.768 102.1 50.0 -49.0 -30.0 -52.1 13.3 4.8 896 910 A G H 3X S+ 0 0 9 -4,-0.8 4,-1.4 -3,-0.5 109,-0.3 0.862 102.3 58.0 -79.3 -38.5 -49.2 15.7 4.7 897 911 A G H X S+ 0 0 37 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A H 3< S+ 0 0 15 -4,-1.6 -1,-0.3 -3,-0.5 -2,-0.2 0.511 104.9 61.5 -81.6 -6.2 -57.7 25.9 6.8 919 933 A L H XX S+ 0 0 1 -3,-0.6 3,-0.9 -4,-0.5 4,-0.6 0.838 105.6 42.7 -84.0 -40.1 -55.9 23.2 4.8 920 934 A A H 3X S+ 0 0 36 -4,-1.6 4,-1.0 1,-0.2 3,-0.2 0.715 102.3 71.5 -74.8 -21.5 -59.0 22.1 3.1 921 935 A G H 3< S+ 0 0 6 -4,-0.8 4,-0.4 1,-0.2 -1,-0.2 0.648 98.2 49.3 -64.3 -14.8 -59.7 25.8 2.7 922 936 A V H <> S+ 0 0 27 -3,-0.9 4,-2.6 2,-0.1 -1,-0.2 0.720 95.0 73.7 -94.0 -26.6 -56.9 25.7 0.2 923 937 A A H X S+ 0 0 16 -4,-0.6 4,-3.0 1,-0.2 5,-0.2 0.910 92.1 53.6 -51.1 -53.2 -58.3 22.7 -1.7 924 938 A A H X S+ 0 0 7 -4,-1.0 4,-1.9 1,-0.2 -1,-0.2 0.904 110.9 46.2 -52.6 -47.9 -61.1 24.7 -3.4 925 939 A E H > S+ 0 0 14 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.946 111.6 52.9 -58.7 -47.9 -58.6 27.2 -4.7 926 940 A F H X S+ 0 0 12 -4,-2.6 4,-1.3 1,-0.3 5,-0.3 0.871 108.1 50.0 -54.9 -43.0 -56.4 24.3 -5.8 927 941 A G H X S+ 0 0 4 -4,-3.0 4,-2.2 1,-0.2 -1,-0.3 0.846 109.3 53.3 -65.2 -34.4 -59.3 22.8 -7.7 928 942 A V H X S+ 0 0 6 -4,-1.9 4,-1.0 -5,-0.2 -2,-0.2 0.878 103.6 55.4 -68.1 -39.5 -60.0 26.2 -9.3 929 943 A V H < S+ 0 0 19 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.874 122.9 23.4 -64.6 -38.5 -56.4 26.6 -10.6 930 944 A M H X S+ 0 0 1 -4,-1.3 4,-3.0 2,-0.2 5,-0.2 0.785 116.1 59.3-101.0 -32.6 -56.3 23.3 -12.5 931 945 A L H X S+ 0 0 2 -4,-2.2 4,-1.4 -5,-0.3 -3,-0.2 0.737 108.9 48.8 -71.3 -20.6 -59.9 22.5 -13.2 932 946 A M H X S+ 0 0 9 -4,-1.0 4,-2.4 -5,-0.2 -1,-0.2 0.831 112.7 47.2 -82.3 -36.1 -60.2 25.8 -15.1 933 947 A Y H > S+ 0 0 14 -4,-0.5 4,-2.8 -5,-0.2 -2,-0.2 0.919 113.6 48.2 -66.7 -45.0 -57.0 25.0 -17.1 934 948 A L H X S+ 0 0 4 -4,-3.0 4,-1.6 2,-0.2 -2,-0.2 0.928 112.9 47.2 -63.2 -47.8 -58.3 21.5 -17.8 935 949 A R H >< S+ 0 0 36 -4,-1.4 3,-0.7 -5,-0.2 5,-0.2 0.975 112.8 51.2 -53.9 -56.4 -61.7 22.8 -18.9 936 950 A H H >X S+ 0 0 69 -4,-2.4 3,-2.8 1,-0.3 4,-2.7 0.887 105.5 52.9 -48.1 -53.1 -60.0 25.4 -21.0 937 951 A A H 3< S+ 0 0 1 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.854 115.9 42.2 -54.8 -35.1 -57.6 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