==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 23-NOV-11 3USG . COMPND 2 MOLECULE: TRANSPORTER; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR H.WANG,J.ELFERICH,E.GOUAUX . 503 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18983.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 404 80.3 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 . 5 1.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 316 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 28 5.6 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 1 0 3 2 3 2 0 0 1 1 1 1 2 1 1 0 1 1 1 0 1 0 0 0 1 1 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 . 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 5 A R 0 0 97 0, 0.0 2,-0.1 0, 0.0 261,-0.0 0.000 360.0 360.0 360.0 144.5 46.5 18.3 21.1 2 6 A E - 0 0 55 261,-0.0 2,-0.3 1,-0.0 178,-0.0 -0.443 360.0-164.4 -74.2 149.8 47.9 16.3 18.2 3 7 A H - 0 0 48 -2,-0.1 179,-0.2 260,-0.0 260,-0.2 -0.935 27.8 -93.6-135.8 156.8 45.6 15.7 15.2 4 8 A W - 0 0 4 258,-1.5 260,-0.2 -2,-0.3 178,-0.1 -0.486 32.7-142.3 -65.6 137.6 45.3 13.4 12.2 5 9 A A S S+ 0 0 70 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.946 74.8 11.6 -70.8 -50.6 46.9 15.2 9.2 6 10 A T > - 0 0 58 1,-0.1 4,-1.9 176,-0.1 -1,-0.1 -0.832 68.9-119.2-128.0 164.4 44.5 14.1 6.5 7 11 A R H > S+ 0 0 117 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.902 116.0 52.1 -68.1 -41.7 41.1 12.4 6.2 8 12 A L H > S+ 0 0 105 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.950 108.7 49.9 -57.4 -51.7 42.5 9.5 4.2 9 13 A G H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.889 110.7 50.9 -55.1 -42.7 45.2 9.0 6.9 10 14 A L H X S+ 0 0 1 -4,-1.9 4,-2.8 2,-0.2 5,-0.3 0.952 111.1 47.7 -57.5 -52.4 42.5 9.0 9.5 11 15 A I H X S+ 0 0 15 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.925 114.3 45.0 -56.7 -50.2 40.4 6.4 7.7 12 16 A L H X S+ 0 0 25 -4,-2.9 4,-1.8 2,-0.2 -1,-0.2 0.802 112.3 53.5 -67.8 -29.0 43.4 4.1 7.0 13 17 A A H X S+ 0 0 3 -4,-2.0 4,-1.8 -5,-0.3 -2,-0.2 0.955 112.1 42.9 -68.2 -51.1 44.5 4.5 10.7 14 18 A M H X S+ 0 0 1 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.884 114.3 51.5 -60.2 -41.0 41.1 3.5 12.0 15 19 A A H X S+ 0 0 0 -4,-2.5 4,-3.1 -5,-0.3 -1,-0.2 0.861 107.7 52.3 -65.3 -36.8 40.8 0.7 9.5 16 20 A G H < S+ 0 0 1 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.839 108.4 52.8 -65.4 -34.1 44.3 -0.5 10.6 17 21 A N H < S+ 0 0 0 -4,-1.8 -2,-0.2 -5,-0.1 -1,-0.2 0.977 118.5 34.5 -61.5 -57.5 42.9 -0.4 14.1 18 22 A A H < S+ 0 0 1 -4,-2.7 2,-0.3 231,-0.1 4,-0.2 0.982 106.2 71.2 -59.1 -64.3 39.9 -2.6 13.2 19 23 A V S < S+ 0 0 0 -4,-3.1 2,-0.2 -5,-0.1 329,-0.1 -0.429 74.0 97.7 -69.4 121.7 41.4 -4.9 10.5 20 24 A G S >> S- 0 0 0 485,-0.6 3,-2.5 -2,-0.3 4,-1.1 -0.819 85.6 -29.0-172.5-160.2 43.8 -7.4 12.2 21 25 A L H 3>>S+ 0 0 10 1,-0.3 4,-1.6 -2,-0.2 5,-1.1 0.765 122.3 68.6 -51.7 -28.5 44.3 -10.9 13.5 22 26 A G H 34>S+ 0 0 0 -4,-0.2 5,-2.0 3,-0.2 -1,-0.3 0.782 100.8 47.2 -62.3 -28.5 40.6 -10.9 14.4 23 27 A N H <45S+ 0 0 0 -3,-2.5 -1,-0.2 3,-0.2 -2,-0.2 0.889 120.3 32.5 -80.0 -43.5 39.7 -11.0 10.6 24 28 A F H <5S+ 0 0 0 -4,-1.1 -2,-0.2 3,-0.1 -3,-0.1 0.481 134.9 19.5 -97.7 -3.9 42.1 -13.7 9.4 25 29 A L T X5S+ 0 0 12 -4,-1.6 4,-1.4 -5,-0.2 -3,-0.2 0.631 124.4 39.3-126.8 -63.6 42.2 -15.9 12.5 26 30 A R H > S+ 0 0 1 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.913 114.9 46.8 -51.8 -43.6 37.2 -18.1 10.2 29 33 A V H X S+ 0 0 3 -4,-1.4 4,-2.8 2,-0.2 5,-0.3 0.939 112.8 47.5 -62.6 -50.7 37.1 -20.2 13.4 30 34 A Q H X S+ 0 0 34 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.920 115.1 45.3 -58.0 -47.0 34.0 -18.6 14.7 31 35 A A H <>S+ 0 0 0 -4,-3.0 5,-2.9 -5,-0.2 8,-0.3 0.867 114.2 49.8 -66.6 -37.3 32.1 -18.9 11.4 32 36 A A H ><5S+ 0 0 2 -4,-2.2 3,-1.2 -5,-0.3 -2,-0.2 0.929 111.8 46.2 -67.6 -46.9 33.3 -22.5 11.0 33 37 A E H 3<5S+ 0 0 67 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.811 112.3 53.5 -63.7 -30.9 32.3 -23.7 14.5 34 38 A N T 3<5S- 0 0 20 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.313 125.5 -92.9 -93.5 7.0 28.9 -22.0 14.1 35 39 A G T X 5 - 0 0 32 -3,-1.2 3,-1.4 -4,-0.2 2,-0.3 0.751 48.6-104.4 94.0 26.1 27.9 -23.6 10.9 36 40 A G T >>> S+ 0 0 3 186,-1.9 4,-1.1 189,-0.5 3,-0.9 0.830 117.4 66.6 -49.4 -37.8 26.1 -19.4 6.6 38 42 A A H <4 S+ 0 0 0 -3,-1.4 -1,-0.3 188,-0.4 -2,-0.2 0.815 101.3 49.5 -54.7 -32.4 24.1 -20.0 9.7 39 43 A F H <> S+ 0 0 0 -3,-1.9 4,-1.9 -8,-0.3 -1,-0.3 0.741 99.7 68.0 -78.6 -25.3 26.6 -17.8 11.6 40 44 A M H S+ 0 0 0 0, 0.0 4,-4.0 0, 0.0 5,-0.3 0.927 114.8 55.9 -52.5 -45.2 23.3 -13.1 13.3 43 47 A Y H X S+ 0 0 2 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.944 109.0 44.4 -50.3 -55.9 26.7 -11.7 12.4 44 48 A I H X S+ 0 0 80 -4,-3.6 4,-1.9 1,-0.2 -1,-0.2 0.932 115.5 48.2 -57.7 -46.5 25.2 -9.2 9.9 45 49 A I H X S+ 0 0 60 -4,-2.9 4,-3.0 -5,-0.3 5,-0.4 0.943 110.5 51.0 -59.4 -46.5 22.4 -8.3 12.4 46 50 A A H X>S+ 0 0 5 -4,-4.0 5,-1.9 1,-0.3 4,-1.2 0.839 108.9 53.3 -60.9 -31.5 25.0 -7.9 15.2 47 51 A F H <>S+ 0 0 32 -4,-2.3 5,-2.0 -5,-0.3 -1,-0.3 0.863 114.1 41.1 -69.4 -36.5 26.9 -5.6 12.8 48 52 A L H <5S+ 0 0 76 -4,-1.9 -2,-0.2 -3,-0.4 -3,-0.2 0.894 123.3 34.4 -79.8 -43.1 23.8 -3.5 12.2 49 53 A L H <5S+ 0 0 67 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.564 136.5 14.1 -92.3 -9.6 22.3 -3.2 15.7 50 54 A V T X5S+ 0 0 7 -4,-1.2 4,-2.3 -5,-0.4 5,-0.3 0.658 119.4 49.5-128.0 -63.6 25.6 -3.2 17.6 51 55 A G H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.914 117.2 46.2 -58.8 -44.3 25.9 2.4 16.6 54 58 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.843 110.5 54.6 -66.7 -34.2 28.7 1.6 19.1 55 59 A M H X S+ 0 0 4 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.961 111.3 43.9 -61.6 -51.6 31.3 2.6 16.5 56 60 A W H X S+ 0 0 9 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.909 112.9 52.7 -58.9 -44.2 29.6 6.0 16.0 57 61 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.905 110.6 46.9 -58.8 -43.5 29.2 6.4 19.8 58 62 A E H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.882 111.1 51.0 -69.2 -39.1 32.9 5.8 20.4 59 63 A W H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.939 112.8 47.6 -58.8 -47.0 34.0 8.2 17.7 60 64 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.940 113.4 45.3 -61.3 -51.6 31.7 10.8 19.2 61 65 A M H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 5,-0.3 0.916 114.0 52.1 -58.4 -43.3 32.9 10.3 22.8 62 66 A G H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.949 113.0 41.1 -58.5 -54.8 36.5 10.3 21.5 63 67 A R H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.895 114.1 55.0 -61.3 -41.1 36.3 13.5 19.6 64 68 A Y H X S+ 0 0 47 -4,-2.7 4,-0.7 -5,-0.3 -2,-0.2 0.927 113.5 39.6 -58.2 -49.3 34.3 15.1 22.4 65 69 A G H ><>S+ 0 0 0 -4,-2.7 5,-2.8 1,-0.2 3,-0.7 0.864 112.1 58.1 -69.0 -36.3 37.0 14.3 25.0 66 70 A G H ><5S+ 0 0 2 -4,-2.5 3,-1.7 -5,-0.3 -2,-0.2 0.871 96.4 61.6 -62.6 -39.1 39.8 15.1 22.6 67 71 A A H 3<5S+ 0 0 53 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.843 109.5 43.1 -54.7 -34.0 38.5 18.7 22.1 68 72 A Q T <<5S- 0 0 94 -4,-0.7 -1,-0.3 -3,-0.7 -2,-0.2 0.354 128.2 -97.7 -96.0 3.5 39.1 19.2 25.8 69 73 A G T < 5S+ 0 0 24 -3,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.721 87.2 116.9 90.6 23.9 42.4 17.4 25.8 70 74 A H < + 0 0 45 -5,-2.8 -2,-0.2 -8,-0.1 -1,-0.2 -0.968 28.4 168.7-130.6 119.0 41.3 14.0 27.0 71 75 A G + 0 0 0 -2,-0.4 2,-0.3 288,-0.3 190,-0.2 0.439 59.2 73.9-105.5 -1.8 41.7 10.8 24.9 72 76 A T S >> S- 0 0 1 287,-0.2 4,-2.3 -7,-0.1 3,-0.8 -0.844 79.6-119.7-121.5 154.1 40.9 8.2 27.6 73 77 A T H 3> S+ 0 0 3 -2,-0.3 4,-2.6 17,-0.2 5,-0.4 0.780 103.1 68.9 -61.1 -35.5 37.8 7.0 29.4 74 78 A P H 34 S+ 0 0 5 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.927 115.7 28.6 -51.2 -44.2 38.8 7.8 32.9 75 79 A A H <> S+ 0 0 13 -3,-0.8 4,-1.9 2,-0.2 3,-0.3 0.909 121.2 52.1 -79.1 -46.9 38.6 11.6 32.0 76 80 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.3 5,-0.3 0.909 105.9 53.2 -60.6 -47.6 35.9 11.4 29.3 77 81 A F H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.3 0.853 110.4 51.0 -53.1 -35.3 33.4 9.4 31.5 78 82 A Y H 4 S+ 0 0 48 -4,-0.5 -1,-0.2 -5,-0.4 -2,-0.2 0.852 107.8 50.9 -74.1 -35.6 33.9 12.2 34.0 79 83 A L H < S+ 0 0 20 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.880 116.4 41.5 -65.5 -38.7 33.2 14.9 31.4 80 84 A L H < S+ 0 0 11 -4,-2.5 2,-0.4 1,-0.3 -2,-0.2 0.837 133.3 17.1 -78.0 -35.1 30.0 13.1 30.4 81 85 A W S < S- 0 0 76 -4,-2.3 2,-1.0 -5,-0.3 -1,-0.3 -0.995 77.6-132.3-140.0 130.7 29.0 12.3 34.0 82 86 A R + 0 0 139 -2,-0.4 2,-0.3 -3,-0.2 -4,-0.1 -0.740 60.0 108.4 -91.8 106.0 30.4 13.9 37.1 83 87 A N > - 0 0 59 -2,-1.0 4,-0.6 1,-0.1 -2,-0.1 -0.972 67.8-130.3-163.1 159.8 31.3 11.1 39.5 84 88 A R H >> S+ 0 0 117 -2,-0.3 4,-2.4 2,-0.2 3,-0.6 0.837 113.4 57.2 -79.4 -38.5 34.3 9.3 41.0 85 89 A F H 3> S+ 0 0 108 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.757 98.3 61.1 -63.2 -25.9 32.7 6.0 40.1 86 90 A A H 3> S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.871 107.0 45.2 -67.2 -37.4 32.6 7.3 36.5 87 91 A K H < S+ 0 0 74 -4,-2.4 3,-0.6 1,-0.3 4,-0.3 0.917 112.5 44.9 -54.4 -45.7 36.7 4.1 38.3 89 93 A L H >< S+ 0 0 23 -4,-2.5 3,-1.6 1,-0.2 4,-0.3 0.864 106.2 62.4 -64.3 -35.8 34.6 2.6 35.5 90 94 A G H >< S+ 0 0 0 -4,-1.6 3,-1.7 1,-0.3 -17,-0.2 0.774 84.6 77.0 -59.8 -27.6 36.8 4.6 33.1 91 95 A V T XX S+ 0 0 0 -4,-1.4 4,-2.7 -3,-0.6 3,-1.6 0.788 82.6 66.6 -53.8 -29.2 39.7 2.6 34.3 92 96 A F H <> S+ 0 0 43 -3,-1.6 4,-2.4 -4,-0.3 -1,-0.3 0.801 86.7 67.4 -65.2 -28.9 38.5 -0.3 32.1 93 97 A G H <4 S+ 0 0 2 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.503 114.2 31.5 -69.5 -4.0 39.2 1.8 29.0 94 98 A L H <> S+ 0 0 1 -3,-1.6 4,-2.6 -4,-0.2 5,-0.2 0.682 117.4 52.0-111.1 -58.4 42.9 1.3 30.0 95 99 A W H X S+ 0 0 21 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.895 110.1 50.9 -46.6 -49.2 42.9 -2.1 31.7 96 100 A I H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.962 112.7 41.7 -60.2 -57.0 41.2 -3.8 28.7 97 101 A P H > S+ 0 0 2 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.853 117.1 50.8 -61.1 -33.8 43.4 -2.5 25.9 98 102 A L H X S+ 0 0 3 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.971 112.5 44.1 -65.6 -54.6 46.5 -3.1 28.1 99 103 A V H X S+ 0 0 0 -4,-2.9 4,-1.1 -5,-0.2 5,-0.2 0.928 116.9 45.9 -55.4 -50.1 45.6 -6.7 29.0 100 104 A V H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.3 3,-0.3 0.917 109.7 55.6 -60.6 -42.8 44.6 -7.5 25.4 101 105 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.3 5,-0.3 0.892 97.6 66.2 -55.6 -41.1 47.8 -5.9 24.2 102 106 A I H X S+ 0 0 0 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.907 116.3 22.1 -50.1 -55.7 49.8 -8.1 26.4 103 107 A Y H X S+ 0 0 3 -4,-1.1 4,-2.5 -3,-0.3 5,-0.2 0.837 119.1 62.8 -81.7 -34.8 49.0 -11.4 24.6 104 108 A Y H X S+ 0 0 4 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.926 102.7 48.7 -56.7 -49.6 48.0 -9.9 21.3 105 109 A V H X S+ 0 0 0 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.823 109.7 54.8 -61.5 -30.6 51.5 -8.4 20.7 106 110 A Y H X S+ 0 0 3 -4,-0.5 4,-1.9 -5,-0.3 -2,-0.2 0.944 107.8 46.7 -68.8 -48.4 52.9 -11.9 21.5 107 111 A I H X S+ 0 0 13 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.913 110.6 55.2 -56.3 -42.6 50.8 -13.6 18.9 108 112 A E H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.929 104.4 52.3 -54.8 -47.3 51.8 -10.9 16.6 109 113 A S H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.864 105.4 57.1 -59.3 -35.2 55.5 -11.8 17.3 110 114 A W H X S+ 0 0 11 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.975 105.6 48.4 -55.5 -56.0 54.5 -15.3 16.4 111 115 A T H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 232,-0.2 0.860 112.2 51.1 -55.2 -36.1 53.3 -14.2 13.0 112 116 A L H X S+ 0 0 20 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.956 109.9 47.1 -65.7 -51.6 56.6 -12.3 12.6 113 117 A G H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.912 114.1 48.2 -56.6 -46.2 58.8 -15.2 13.5 114 118 A F H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.910 108.8 54.3 -60.2 -43.4 56.9 -17.5 11.2 115 119 A A H X S+ 0 0 4 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.944 111.8 45.1 -55.6 -48.3 57.1 -14.9 8.4 116 120 A I H X S+ 0 0 62 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.952 113.8 47.0 -60.7 -53.3 60.9 -14.9 8.8 117 121 A K H X>S+ 0 0 43 -4,-2.8 5,-2.4 1,-0.2 4,-0.9 0.863 114.5 47.5 -60.9 -37.3 61.4 -18.6 9.0 118 122 A F H <5S+ 0 0 5 -4,-2.7 -1,-0.2 3,-0.2 218,-0.2 0.845 111.9 51.2 -72.2 -34.5 59.2 -19.2 6.0 119 123 A L H <5S+ 0 0 103 -4,-2.1 -2,-0.2 -5,-0.3 -3,-0.2 0.969 113.9 41.8 -63.1 -54.8 61.0 -16.5 4.0 120 124 A V H <5S- 0 0 102 -4,-2.9 -1,-0.2 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0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.934 112.3 45.1 -61.5 -48.3 28.4 -13.3 16.5 242 248 A V H X S+ 0 0 23 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.931 112.7 51.0 -62.5 -47.3 28.1 -10.4 18.9 243 249 A G H X S+ 0 0 5 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.911 111.1 48.8 -55.2 -44.7 31.5 -11.3 20.5 244 250 A Q H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.889 109.4 52.2 -64.2 -41.0 33.1 -11.4 17.1 245 251 A I H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 6,-0.3 0.934 111.8 46.7 -59.2 -47.1 31.5 -8.0 16.1 246 252 A F H <>S+ 0 0 0 -4,-2.7 5,-2.1 1,-0.2 4,-0.3 0.950 116.3 43.9 -58.5 -51.4 32.9 -6.5 19.3 247 253 A F H ><5S+ 0 0 11 -4,-2.7 3,-0.9 1,-0.2 -2,-0.2 0.913 114.7 46.6 -63.8 -45.9 36.4 -7.9 18.8 248 254 A T H 3<5S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.806 114.0 46.5 -72.7 -30.4 36.8 -7.2 15.1 249 255 A L T 3<5S- 0 0 0 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.394 108.9-121.4 -90.6 3.0 35.6 -3.6 15.2 250 256 A S T X 5 + 0 0 0 -3,-0.9 3,-0.8 -4,-0.3 6,-0.8 0.822 55.4 163.5 60.0 32.4 37.8 -2.9 18.3 251 257 A L T 3 < + 0 0 0 -5,-2.1 -1,-0.2 -6,-0.3 159,-0.1 -0.641 58.2 17.2 -84.8 138.5 34.7 -1.9 20.2 252 258 A G T 3 S+ 0 0 0 -2,-0.3 -1,-0.2 157,-0.1 157,-0.1 0.474 97.6 99.6 83.3 1.8 34.9 -1.8 24.0 253 259 A F S < S- 0 0 0 -3,-0.8 -2,-0.1 -7,-0.2 -153,-0.1 0.463 88.6-127.4 -95.1 -4.1 38.7 -1.6 23.9 254 260 A G S > S+ 0 0 2 -4,-0.2 4,-1.7 152,-0.1 5,-0.1 0.467 84.7 108.6 69.8 0.2 38.8 2.1 24.4 255 261 A A H > S+ 0 0 0 -5,-0.4 4,-2.8 2,-0.2 5,-0.3 0.942 72.3 49.6 -73.0 -50.5 41.0 2.2 21.3 256 262 A I H > S+ 0 0 2 -6,-0.8 4,-2.3 1,-0.2 -1,-0.2 0.911 111.2 51.7 -54.0 -45.9 38.5 3.7 18.9 257 263 A I H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.941 110.4 47.5 -56.2 -50.5 37.8 6.5 21.4 258 264 A T H < S+ 0 0 2 -4,-1.7 4,-0.4 1,-0.2 3,-0.4 0.920 112.3 48.4 -61.2 -46.9 41.5 7.3 21.8 259 265 A Y H >< S+ 0 0 1 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.891 111.5 52.6 -57.0 -39.0 42.1 7.4 18.1 260 266 A A H >< S+ 0 0 0 -4,-2.3 3,-2.1 -5,-0.3 -1,-0.2 0.770 92.5 71.6 -71.5 -26.7 39.0 9.6 17.8 261 267 A S T 3< S+ 0 0 0 -4,-1.6 -1,-0.3 -3,-0.4 -192,-0.2 0.686 93.9 57.8 -63.5 -15.9 40.3 12.1 20.4 262 268 A Y T < S+ 0 0 3 -3,-1.1 -258,-1.5 -4,-0.4 2,-0.5 0.397 82.9 101.9 -95.6 1.4 42.8 13.2 17.8 263 269 A V S < S- 0 0 2 -3,-2.1 -196,-0.1 -260,-0.2 -197,-0.1 -0.752 86.1-105.9 -83.3 129.0 40.1 14.1 15.3 264 270 A R > - 0 0 120 -2,-0.5 3,-1.3 -260,-0.2 -1,-0.1 -0.190 27.8-114.2 -56.4 145.8 39.5 17.8 15.2 265 271 A K T 3 S+ 0 0 114 1,-0.3 -1,-0.1 -4,-0.1 -198,-0.1 0.822 114.6 44.3 -51.2 -38.3 36.3 19.0 16.9 266 272 A D T 3 S+ 0 0 106 2,-0.1 -1,-0.3 167,-0.0 -2,-0.1 0.629 90.6 104.4 -86.6 -14.8 34.8 20.2 13.6 267 273 A Q S < S- 0 0 61 -3,-1.3 2,-0.3 1,-0.1 167,-0.1 -0.349 79.7 -99.3 -73.7 149.8 35.7 17.2 11.5 268 274 A D + 0 0 12 165,-0.2 4,-0.2 1,-0.1 166,-0.1 -0.494 36.2 173.9 -72.2 123.6 33.1 14.6 10.4 269 275 A I S > S+ 0 0 0 163,-0.4 4,-1.3 161,-0.3 5,-0.2 0.491 70.2 70.1 -99.8 -7.3 33.1 11.3 12.4 270 276 A V H > S+ 0 0 0 2,-0.2 4,-2.6 3,-0.2 5,-0.2 0.978 105.8 30.5 -74.8 -56.5 30.0 9.9 10.8 271 277 A L H > S+ 0 0 39 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.862 121.4 53.0 -74.4 -36.0 31.2 9.1 7.2 272 278 A S H > S+ 0 0 2 -4,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.941 112.4 44.9 -61.8 -48.5 34.7 8.3 8.4 273 279 A G H X S+ 0 0 0 -4,-1.3 4,-2.8 2,-0.2 5,-0.3 0.945 113.1 49.2 -61.6 -51.4 33.4 5.9 11.0 274 280 A L H X S+ 0 0 53 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.891 112.4 50.2 -54.2 -41.1 31.0 4.2 8.7 275 281 A T H X S+ 0 0 47 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.906 110.3 48.4 -66.9 -43.0 33.8 3.9 6.1 276 282 A A H X S+ 0 0 3 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.950 114.2 45.9 -61.3 -50.5 36.2 2.4 8.7 277 283 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.937 113.2 49.7 -57.6 -49.0 33.7 -0.2 9.9 278 284 A T H X S+ 0 0 48 -4,-2.6 4,-2.5 -5,-0.3 -1,-0.2 0.919 109.4 51.4 -57.4 -47.0 32.7 -1.0 6.3 279 285 A L H X S+ 0 0 39 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.919 109.8 51.3 -55.5 -44.9 36.3 -1.5 5.3 280 286 A N H X S+ 0 0 0 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.934 109.5 48.0 -58.6 -48.7 36.7 -3.8 8.3 281 287 A E H X>S+ 0 0 18 -4,-2.6 4,-2.6 1,-0.2 5,-0.6 0.887 111.1 51.6 -61.9 -39.4 33.7 -6.0 7.4 282 288 A K H X>S+ 0 0 112 -4,-2.5 5,-1.3 1,-0.2 4,-1.0 0.918 110.7 47.9 -60.6 -44.2 34.9 -6.2 3.8 283 289 A A H <>S+ 0 0 1 -4,-2.4 5,-2.5 -5,-0.2 -1,-0.2 0.773 117.9 45.0 -67.3 -24.9 38.3 -7.4 5.1 284 290 A E H <>S+ 0 0 0 -4,-1.6 5,-1.9 3,-0.2 -2,-0.2 0.970 122.4 25.0 -83.6 -64.1 36.6 -9.9 7.3 285 291 A V H <5S+ 0 0 19 -4,-2.6 -3,-0.2 3,-0.2 -2,-0.1 0.892 131.7 35.9 -74.7 -41.6 33.9 -11.6 5.4 286 292 A I T < > S+ 0 0 0 -3,-1.0 4,-1.4 -4,-0.5 5,-0.2 0.864 112.0 27.1-103.3 -73.3 41.3 -17.8 2.7 292 298 A S H X S+ 0 0 1 -4,-0.8 4,-2.7 2,-0.2 5,-0.2 0.954 123.0 44.1 -61.4 -57.2 41.6 -20.3 5.6 293 299 A I H > S+ 0 0 4 -5,-0.3 4,-3.0 1,-0.2 5,-0.3 0.933 112.6 49.0 -58.7 -53.2 38.3 -22.1 5.4 294 300 A P H > S+ 0 0 1 0, 0.0 4,-1.7 0, 0.0 -74,-0.3 0.832 114.4 48.1 -59.4 -31.4 38.1 -22.5 1.6 295 301 A A H X S+ 0 0 0 -4,-1.4 4,-2.6 2,-0.2 5,-0.3 0.942 111.7 47.7 -71.4 -50.1 41.6 -24.0 1.6 296 302 A A H X>S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.5 0.928 115.9 45.1 -54.8 -48.2 40.9 -26.3 4.5 297 303 A V H X5S+ 0 0 1 -4,-3.0 4,-1.7 3,-0.2 -1,-0.2 0.882 108.9 59.2 -63.1 -38.6 37.7 -27.5 2.8 298 304 A A H <5S+ 0 0 0 -4,-1.7 -86,-0.3 -5,-0.3 -84,-0.2 0.955 118.3 27.0 -55.1 -54.9 39.6 -27.7 -0.4 299 305 A F H <5S+ 0 0 36 -4,-2.6 -2,-0.2 1,-0.1 -3,-0.2 0.943 138.4 20.8 -76.6 -51.4 42.1 -30.3 0.9 300 306 A F H X5S- 0 0 29 -4,-2.7 4,-0.5 -5,-0.3 -3,-0.2 0.486 104.9-117.7 -99.9 -3.7 40.3 -32.1 3.7 301 307 A G H X< - 0 0 14 -4,-1.7 4,-1.9 -5,-0.5 -1,-0.2 -0.087 38.9 -67.2 83.8 168.7 36.7 -31.5 2.8 302 308 A V H > S+ 0 0 56 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.944 127.3 49.1 -61.3 -56.4 34.0 -29.6 4.8 303 309 A A H > S+ 0 0 78 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.929 115.2 44.4 -51.4 -53.3 33.5 -32.0 7.8 304 310 A N H X S+ 0 0 96 -4,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.863 111.5 54.3 -60.9 -37.9 37.3 -32.2 8.4 305 311 A A H X S+ 0 0 2 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.917 109.5 47.0 -62.5 -44.5 37.7 -28.5 8.0 306 312 A V H X S+ 0 0 31 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.906 111.1 52.3 -63.1 -43.0 35.0 -27.8 10.6 307 313 A A H X S+ 0 0 56 -4,-2.5 4,-1.5 -5,-0.2 -2,-0.2 0.923 110.3 48.0 -57.4 -46.3 36.7 -30.4 12.9 308 314 A I H X S+ 0 0 20 -4,-2.5 4,-0.9 2,-0.2 -2,-0.2 0.897 109.9 52.6 -62.0 -42.1 40.0 -28.6 12.5 309 315 A A H >< S+ 0 0 0 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.911 110.4 47.1 -60.5 -43.8 38.4 -25.2 13.2 310 316 A K H 3< S+ 0 0 116 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.773 98.5 73.3 -67.2 -26.3 36.9 -26.6 16.4 311 317 A A H 3< S- 0 0 71 -4,-1.5 2,-0.3 1,-0.2 -1,-0.2 0.849 116.7 -51.1 -58.1 -36.4 40.3 -28.0 17.3 312 318 A G S+ 0 0 47 -2,-0.3 4,-0.7 1,-0.2 3,-0.2 0.857 119.5 38.2 -78.2 -37.2 42.1 -20.9 17.0 314 320 A F H > S+ 0 0 49 1,-0.2 4,-2.3 2,-0.2 5,-0.4 0.564 101.3 76.1 -90.5 -10.0 45.8 -21.2 16.2 315 321 A N H >>S+ 0 0 27 2,-0.2 5,-2.9 1,-0.2 4,-0.6 0.864 99.3 41.9 -69.7 -36.7 45.4 -24.7 14.7 316 322 A L H <>S+ 0 0 4 -4,-0.6 5,-2.0 3,-0.2 -1,-0.2 0.908 123.4 36.9 -75.2 -44.4 43.9 -23.4 11.4 317 323 A G H <5S+ 0 0 1 -4,-0.7 -2,-0.2 3,-0.2 -3,-0.1 0.919 126.4 30.2 -76.8 -48.0 46.2 -20.5 11.0 318 324 A F H <5S+ 0 0 1 -4,-2.3 -3,-0.2 3,-0.1 -1,-0.1 0.559 134.8 17.0 -93.4 -9.0 49.6 -21.6 12.2 319 325 A I T X5S+ 0 0 3 -4,-0.6 4,-2.0 -5,-0.4 -3,-0.2 0.683 120.3 42.6-125.9 -66.3 49.3 -25.3 11.3 320 326 A T H > S+ 0 0 1 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.865 112.4 54.2 -63.4 -33.3 50.9 -23.8 6.0 323 329 A A H < S+ 0 0 0 -4,-2.0 4,-0.3 2,-0.2 -2,-0.2 0.869 109.5 48.0 -65.3 -37.6 50.7 -27.6 5.8 324 330 A I H >< S+ 0 0 2 -4,-2.1 3,-1.4 1,-0.2 -1,-0.2 0.924 111.3 49.9 -66.8 -45.4 48.2 -27.2 3.0 325 331 A F H >< S+ 0 0 1 -4,-2.6 3,-2.5 1,-0.3 -2,-0.2 0.866 99.4 66.0 -60.8 -37.2 50.5 -24.7 1.2 326 332 A S T 3< S+ 0 0 35 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.669 94.7 60.3 -61.4 -15.5 53.5 -27.0 1.6 327 333 A Q T < S+ 0 0 71 -3,-1.4 -1,-0.3 -4,-0.3 2,-0.3 0.382 98.7 72.2 -93.0 3.4 51.7 -29.4 -0.8 328 334 A T S X S- 0 0 24 -3,-2.5 3,-1.7 -4,-0.1 4,-0.2 -0.817 97.3 -85.9-118.7 157.8 51.7 -26.8 -3.6 329 335 A A T 3 S+ 0 0 98 -2,-0.3 -2,-0.1 1,-0.3 -1,-0.0 -0.423 117.1 5.9 -62.3 127.4 54.3 -25.4 -5.9 330 336 A G T 3> S+ 0 0 57 -2,-0.2 4,-1.5 -4,-0.1 -1,-0.3 0.816 86.9 148.0 66.7 31.2 56.0 -22.4 -4.1 331 337 A G H <> + 0 0 4 -3,-1.7 4,-2.4 1,-0.2 -5,-0.2 0.808 62.9 58.4 -68.5 -32.2 54.0 -23.2 -1.0 332 338 A T H > S+ 0 0 49 2,-0.2 4,-2.3 -4,-0.2 -1,-0.2 0.932 107.3 46.6 -62.4 -46.3 56.7 -22.0 1.4 333 339 A F H > S+ 0 0 120 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.862 110.4 54.3 -64.4 -36.1 56.7 -18.5 -0.2 334 340 A L H X S+ 0 0 11 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.925 106.9 50.5 -63.3 -45.7 52.9 -18.6 0.0 335 341 A G H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.920 108.3 54.0 -55.5 -45.3 53.1 -19.4 3.7 336 342 A F H X S+ 0 0 30 -4,-2.3 4,-2.2 -218,-0.2 -2,-0.2 0.933 107.6 49.0 -54.3 -50.4 55.5 -16.4 4.0 337 343 A L H X S+ 0 0 18 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.922 110.6 52.5 -56.0 -46.0 53.0 -14.1 2.4 338 344 A W H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.949 112.3 43.0 -53.1 -55.1 50.3 -15.4 4.7 339 345 A F H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -224,-0.3 0.775 111.9 54.5 -68.6 -26.7 52.3 -14.7 7.9 340 346 A F H X S+ 0 0 60 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.929 109.1 48.3 -70.2 -46.0 53.5 -11.3 6.6 341 347 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.964 111.8 49.6 -53.0 -55.3 49.8 -10.3 6.1 342 348 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.897 110.2 52.3 -51.5 -43.3 49.0 -11.6 9.6 343 349 A F H X S+ 0 0 10 -4,-2.0 4,-2.7 -232,-0.2 -1,-0.2 0.911 109.8 46.4 -64.0 -44.9 52.0 -9.6 10.9 344 350 A F H X S+ 0 0 28 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.932 114.5 47.0 -64.5 -45.2 50.9 -6.3 9.3 345 351 A A H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.943 113.9 49.6 -58.4 -47.3 47.3 -6.6 10.4 346 352 A G H X S+ 0 0 0 -4,-2.6 4,-2.7 -5,-0.3 3,-0.3 0.916 111.7 47.7 -57.1 -48.9 48.5 -7.5 13.9 347 353 A L H X S+ 0 0 1 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.944 107.7 54.2 -58.5 -52.6 50.9 -4.6 14.1 348 354 A T H X S+ 0 0 4 -4,-2.7 4,-0.5 1,-0.2 -1,-0.2 0.758 114.9 43.0 -57.7 -27.2 48.3 -2.1 12.9 349 355 A S H X S+ 0 0 0 -4,-1.4 4,-1.7 -3,-0.3 -1,-0.2 0.895 109.7 54.8 -80.1 -44.9 46.0 -3.3 15.7 350 356 A S H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.3 3,-0.4 0.911 105.0 52.0 -58.8 -48.1 48.6 -3.5 18.5 351 357 A I H X S+ 0 0 3 -4,-2.5 4,-1.9 1,-0.3 3,-0.3 0.917 109.1 54.0 -53.7 -41.0 49.8 0.1 18.1 352 358 A A H < S+ 0 0 0 -4,-0.5 -1,-0.3 -5,-0.3 -2,-0.2 0.846 108.5 47.4 -62.9 -36.3 46.1 1.0 18.4 353 359 A I H < S+ 0 0 2 -4,-1.7 4,-0.4 -3,-0.4 -1,-0.2 0.686 112.6 48.0 -84.2 -16.8 45.7 -0.9 21.7 354 360 A M H X S+ 0 0 4 -4,-1.8 4,-2.4 -3,-0.3 3,-0.4 0.736 95.9 76.1 -83.1 -28.1 48.8 0.6 23.3 355 361 A Q H X S+ 0 0 4 -4,-1.9 4,-2.8 -5,-0.3 5,-0.2 0.796 86.5 59.2 -55.5 -35.2 47.8 4.1 22.3 356 362 A P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.953 109.3 43.2 -60.6 -46.9 45.2 4.4 25.0 357 363 A M H > S+ 0 0 3 -3,-0.4 4,-2.5 -4,-0.4 3,-0.2 0.956 115.0 50.1 -60.7 -50.0 47.8 3.8 27.8 358 364 A I H X S+ 0 0 1 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.924 111.2 49.1 -52.3 -47.2 50.2 6.2 26.0 359 365 A A H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.4 0.798 108.6 52.5 -67.1 -32.7 47.5 8.9 25.7 360 366 A F H X>S+ 0 0 2 -4,-1.9 4,-1.9 -3,-0.2 5,-1.2 0.930 109.9 49.0 -66.2 -45.6 46.6 8.6 29.4 361 367 A L H <5S+ 0 0 10 -4,-2.5 6,-2.6 3,-0.2 4,-0.2 0.883 117.2 42.5 -60.0 -38.9 50.2 9.0 30.4 362 368 A E H <5S+ 0 0 35 -4,-2.1 4,-0.3 4,-0.2 -2,-0.2 0.951 123.2 33.6 -72.7 -51.9 50.4 12.1 28.1 363 369 A D H <5S+ 0 0 17 -4,-2.8 -3,-0.2 3,-0.1 -2,-0.2 0.958 129.9 27.7 -71.6 -54.9 47.1 13.8 28.9 364 370 A E T <5S+ 0 0 16 -4,-1.9 -3,-0.2 -5,-0.4 -2,-0.1 0.886 132.1 31.9 -82.1 -42.5 46.5 13.0 32.5 365 371 A L S - 0 0 59 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.345 32.1-110.4 -68.5 158.2 56.2 13.4 27.1 369 375 A R H > S+ 0 0 90 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.912 116.7 53.3 -58.2 -45.4 55.3 11.1 24.2 370 376 A K H > S+ 0 0 125 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.941 112.7 42.4 -54.8 -53.2 58.7 9.4 24.4 371 377 A H H > S+ 0 0 101 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.922 113.5 52.1 -62.1 -46.8 58.5 8.6 28.1 372 378 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.931 113.5 44.7 -54.8 -48.5 54.8 7.5 27.8 373 379 A V H X S+ 0 0 3 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.918 113.4 48.9 -63.9 -46.4 55.7 5.1 24.9 374 380 A L H X S+ 0 0 79 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.880 114.7 45.2 -64.0 -38.5 58.8 3.7 26.6 375 381 A W H X S+ 0 0 156 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.898 112.1 50.6 -72.4 -41.9 57.0 3.0 29.9 376 382 A T H X S+ 0 0 1 -4,-2.5 4,-2.8 -5,-0.3 5,-0.2 0.942 112.6 48.3 -57.3 -46.9 53.9 1.5 28.2 377 383 A A H X S+ 0 0 12 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.885 110.2 51.8 -60.8 -40.9 56.3 -0.7 26.2 378 384 A A H X S+ 0 0 43 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.942 111.8 45.9 -60.7 -48.9 58.1 -1.6 29.5 379 385 A I H X S+ 0 0 34 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.939 115.5 45.4 -60.1 -50.9 54.8 -2.6 31.2 380 386 A V H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.942 114.8 47.8 -58.8 -50.0 53.5 -4.6 28.3 381 387 A F H X S+ 0 0 48 -4,-2.7 4,-0.5 -5,-0.2 -2,-0.2 0.936 114.3 46.3 -57.8 -50.2 56.9 -6.4 27.7 382 388 A F H >< S+ 0 0 133 -4,-2.8 3,-1.7 -5,-0.2 4,-0.3 0.963 113.7 47.1 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0.930 75.7 54.6 -64.8 -46.3 47.2 -17.6 30.7 394 400 A L H X S+ 0 0 22 -4,-0.5 4,-2.8 -7,-0.3 5,-0.2 0.911 107.8 49.1 -52.8 -48.6 46.6 -16.2 27.2 395 401 A D H > S+ 0 0 96 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.884 110.2 51.5 -60.9 -40.5 43.1 -17.8 27.1 396 402 A E H X S+ 0 0 25 -4,-1.6 4,-2.7 2,-0.2 5,-0.3 0.937 112.8 44.3 -63.4 -48.7 42.2 -16.4 30.5 397 403 A M H X>S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.9 0.933 112.5 52.0 -60.3 -47.3 43.3 -12.8 29.5 398 404 A D H <5S+ 0 0 44 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.812 114.2 46.1 -60.1 -30.4 41.5 -13.1 26.2 399 405 A F H X>S+ 0 0 39 -4,-1.7 5,-2.2 -5,-0.2 4,-1.2 0.982 117.8 36.5 -75.3 -64.0 38.4 -14.2 28.1 400 406 A W H <>S+ 0 0 67 -4,-2.7 5,-1.6 3,-0.2 -2,-0.2 0.882 134.7 23.6 -58.8 -41.9 38.2 -11.7 30.9 401 407 A A T <>S+ 0 0 0 -4,-2.7 5,-0.9 -5,-0.3 -3,-0.2 0.947 128.6 36.7 -89.0 -63.2 39.5 -8.8 28.8 402 408 A G T 4S+ 0 0 48 -4,-2.5 5,-1.9 -5,-0.2 4,-1.1 0.893 114.0 46.1 -65.6 -40.8 24.7 3.9 29.0 416 422 A I H <>S+ 0 0 3 -4,-2.5 5,-2.6 3,-0.2 6,-0.2 0.917 120.9 36.9 -68.3 -43.9 26.9 6.8 30.2 417 423 A F H <5S+ 0 0 0 -4,-2.7 9,-0.2 -5,-0.2 -2,-0.2 0.940 126.5 31.5 -76.3 -49.4 26.8 8.6 26.8 418 424 A F H <5S+ 0 0 0 -4,-2.6 -3,-0.2 -5,-0.3 -1,-0.1 0.550 132.4 26.1 -92.7 -8.5 23.3 8.0 25.5 419 425 A W T <5S+ 0 0 122 -4,-1.1 4,-0.2 -5,-0.4 -3,-0.2 0.736 127.5 30.4-115.3 -64.4 21.4 7.9 28.9 420 426 A I T - 0 0 20 -6,-0.2 4,-1.1 3,-0.1 -3,-0.2 0.091 15.1-113.3 100.7 146.3 21.4 12.5 27.7 423 429 A A H > S+ 0 0 9 -4,-0.2 4,-2.5 2,-0.2 5,-0.1 0.873 111.3 46.4 -80.6 -40.4 20.1 11.1 24.4 424 430 A D H > S+ 0 0 114 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.907 113.8 47.6 -71.5 -43.0 19.5 14.3 22.5 425 431 A K H > S+ 0 0 128 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.891 114.1 49.2 -63.1 -39.8 22.8 15.9 23.4 426 432 A A H X S+ 0 0 0 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.942 111.6 47.9 -63.2 -49.7 24.5 12.7 22.5 427 433 A W H X S+ 0 0 51 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.929 113.1 47.8 -57.5 -48.8 22.8 12.4 19.2 428 434 A E H X S+ 0 0 57 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.867 110.7 52.4 -60.8 -37.9 23.5 16.1 18.4 429 435 A E H < S+ 0 0 27 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.861 111.3 47.3 -66.6 -36.0 27.2 15.5 19.4 430 436 A I H < S+ 0 0 0 -4,-2.2 -161,-0.3 1,-0.2 -2,-0.2 0.937 116.4 41.4 -69.8 -48.3 27.4 12.5 17.0 431 437 A N H >< S+ 0 0 14 -4,-2.7 3,-2.3 -5,-0.2 -2,-0.2 0.727 87.2 114.6 -74.8 -21.9 25.8 14.2 14.0 432 438 A R T 3< S+ 0 0 75 -4,-1.8 -163,-0.4 1,-0.3 -162,-0.1 -0.257 90.9 1.1 -56.0 127.6 27.6 17.5 14.5 433 439 A G T 3 S+ 0 0 41 1,-0.2 -1,-0.3 -165,-0.1 -165,-0.2 0.392 93.4 154.7 77.9 -3.4 30.0 18.2 11.6 434 440 A G < - 0 0 12 -3,-2.3 -1,-0.2 1,-0.2 -3,-0.1 -0.351 45.8-147.7 -64.1 128.6 29.0 15.0 9.9 435 441 A I S S+ 0 0 95 -2,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.886 94.9 16.6 -58.9 -39.2 29.4 15.0 6.1 436 442 A I S S- 0 0 68 -3,-0.0 2,-0.3 -5,-0.0 -165,-0.2 -0.885 89.8-119.2-126.4 163.6 26.4 12.7 6.2 437 443 A K - 0 0 122 -2,-0.3 3,-0.1 -167,-0.1 -6,-0.1 -0.812 26.1-105.8-109.5 146.6 23.9 12.2 9.0 438 444 A V - 0 0 8 -2,-0.3 5,-0.1 -11,-0.1 -7,-0.0 -0.456 46.8 -99.4 -66.2 132.2 23.0 9.1 10.9 439 445 A P > - 0 0 68 0, 0.0 3,-1.4 0, 0.0 4,-0.4 -0.259 30.8-121.9 -51.1 136.8 19.6 7.6 9.9 440 446 A R T >> S+ 0 0 73 1,-0.3 3,-1.9 2,-0.2 4,-0.7 0.829 107.0 67.4 -53.6 -38.4 16.9 8.6 12.4 441 447 A I H >> S+ 0 0 107 1,-0.3 3,-1.2 2,-0.2 4,-1.1 0.847 89.8 64.5 -53.6 -37.1 16.0 5.0 13.2 442 448 A Y H <> S+ 0 0 35 -3,-1.4 4,-3.0 1,-0.3 -1,-0.3 0.752 87.9 68.8 -61.2 -25.7 19.5 4.5 14.8 443 449 A Y H <> S+ 0 0 31 -3,-1.9 4,-1.6 -4,-0.4 -1,-0.3 0.916 105.6 41.5 -56.4 -41.5 18.6 7.0 17.5 444 450 A Y H S+ 0 0 129 -3,-1.2 5,-1.3 -4,-0.7 4,-1.2 0.714 112.5 55.7 -79.7 -20.8 16.1 4.5 18.7 445 451 A V H <>S+ 0 0 10 -4,-1.1 5,-3.0 3,-0.2 -2,-0.2 0.906 111.1 42.8 -74.5 -44.0 18.6 1.6 18.2 446 452 A M H <5S+ 0 0 0 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.884 118.1 44.7 -67.9 -41.4 21.2 3.3 20.4 447 453 A R H <5S+ 0 0 86 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.787 134.0 1.4 -79.0 -29.4 18.8 4.3 23.1 448 454 A Y T X5S+ 0 0 120 -4,-1.2 4,-1.8 -5,-0.1 5,-0.2 0.724 124.2 46.4-124.3 -63.3 16.8 1.1 23.5 449 455 A I H > S+ 0 0 4 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.880 114.1 50.5 -58.9 -38.9 21.7 -1.6 25.5 452 458 A A H X S+ 0 0 54 -4,-1.8 4,-2.8 2,-0.2 5,-0.2 0.947 110.9 48.1 -62.2 -50.7 18.9 -4.2 26.1 453 459 A F H X S+ 0 0 48 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.943 113.8 46.7 -54.1 -51.8 20.6 -6.7 23.8 454 460 A L H X S+ 0 0 1 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.897 111.5 51.6 -59.3 -42.5 23.9 -6.2 25.5 455 461 A A H X S+ 0 0 38 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.939 110.6 47.6 -61.1 -48.6 22.3 -6.5 29.0 456 462 A V H X S+ 0 0 92 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.948 111.7 51.4 -55.4 -50.9 20.6 -9.7 28.1 457 463 A L H X S+ 0 0 16 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.940 110.9 47.2 -51.2 -53.6 23.8 -11.1 26.7 458 464 A L H X S+ 0 0 30 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.878 109.9 53.8 -58.8 -41.4 25.7 -10.2 29.9 459 465 A V H X S+ 0 0 77 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.950 111.2 45.1 -58.2 -50.5 23.0 -11.7 32.1 460 466 A V H X S+ 0 0 46 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.961 113.8 49.5 -56.9 -53.9 23.2 -15.0 30.2 461 467 A W H X S+ 0 0 16 -4,-2.8 4,-2.8 1,-0.2 3,-0.3 0.944 112.3 46.7 -51.2 -56.7 27.0 -15.1 30.2 462 468 A A H X S+ 0 0 49 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.927 108.5 57.0 -52.4 -49.3 27.2 -14.4 34.0 463 469 A R H < S+ 0 0 179 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.894 114.3 38.6 -48.6 -45.8 24.5 -17.0 34.6 464 470 A E H X S+ 0 0 110 -4,-2.2 4,-0.6 -3,-0.3 -1,-0.2 0.885 121.0 41.9 -75.3 -40.5 26.7 -19.6 32.9 465 471 A Y H X S+ 0 0 70 -4,-2.8 4,-2.5 -5,-0.2 -2,-0.2 0.795 92.9 76.8 -82.1 -32.3 30.1 -18.5 34.1 466 472 A I H X S+ 0 0 116 -4,-2.8 4,-0.9 -5,-0.3 -1,-0.2 0.879 101.1 41.7 -51.4 -45.4 29.6 -17.7 37.8 467 473 A P H > S+ 0 0 63 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.904 114.7 52.2 -68.4 -38.3 29.5 -21.3 39.0 468 474 A K H < S+ 0 0 134 -4,-0.6 -2,-0.2 1,-0.2 -3,-0.1 0.851 99.3 63.5 -66.9 -37.8 32.4 -22.4 36.7 469 475 A I H < S+ 0 0 45 -4,-2.5 -1,-0.2 1,-0.2 -3,-0.1 0.939 100.9 48.7 -54.3 -54.6 34.8 -19.7 37.9 470 476 A M H < S+ 0 0 142 -4,-0.9 2,-0.9 1,-0.2 -1,-0.2 0.853 110.3 54.8 -60.5 -37.5 35.1 -20.8 41.5 471 477 A E S < S+ 0 0 150 -4,-1.0 2,-0.3 -3,-0.1 -1,-0.2 -0.824 70.8 126.2-101.3 99.8 35.7 -24.4 40.5 472 478 A E - 0 0 48 -2,-0.9 6,-0.1 1,-0.1 -3,-0.0 -0.949 44.5-153.7-147.2 130.6 38.7 -24.4 38.1 473 479 A T + 0 0 135 -2,-0.3 -1,-0.1 4,-0.0 2,-0.0 0.889 60.9 92.2 -80.1 -40.0 41.6 -26.7 38.9 474 480 A H > - 0 0 70 1,-0.1 4,-0.6 2,-0.0 3,-0.2 -0.271 56.3-155.0 -69.4 137.4 44.6 -25.0 37.3 475 481 A W H > S+ 0 0 129 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.737 87.8 73.0 -79.6 -24.9 46.8 -22.6 39.3 476 482 A T H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.885 97.0 50.0 -55.6 -40.3 48.0 -20.7 36.1 477 483 A V H > S+ 0 0 3 -3,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.857 109.3 50.2 -70.2 -35.8 44.6 -19.1 35.7 478 484 A W H X S+ 0 0 107 -4,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.873 110.7 50.5 -68.9 -37.0 44.5 -18.0 39.4 479 485 A I H X S+ 0 0 71 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.945 112.4 46.9 -61.5 -49.1 48.0 -16.5 38.9 480 486 A T H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.938 113.2 48.0 -58.3 -50.7 46.8 -14.7 35.7 481 487 A R H X S+ 0 0 26 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.946 111.8 50.3 -55.2 -52.2 43.6 -13.4 37.4 482 488 A F H X S+ 0 0 156 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.929 112.6 47.4 -51.2 -49.7 45.6 -12.2 40.4 483 489 A Y H X S+ 0 0 57 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.911 111.9 46.9 -63.6 -46.0 48.1 -10.4 38.2 484 490 A I H X S+ 0 0 7 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.858 110.1 53.9 -68.0 -33.7 45.5 -8.6 36.0 485 491 A I H X S+ 0 0 101 -4,-2.6 4,-2.5 -5,-0.3 -1,-0.2 0.922 107.2 53.2 -59.4 -43.4 43.6 -7.6 39.1 486 492 A G H X S+ 0 0 33 -4,-2.2 4,-2.5 -5,-0.3 -2,-0.2 0.903 106.2 51.9 -55.5 -43.9 46.9 -6.1 40.2 487 493 A L H X S+ 0 0 11 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.910 107.5 52.5 -59.8 -43.1 47.1 -4.2 36.9 488 494 A F H X S+ 0 0 44 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.932 109.9 47.8 -59.5 -46.7 43.6 -2.9 37.5 489 495 A L H X S+ 0 0 115 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.908 111.2 52.4 -58.9 -43.3 44.6 -1.6 41.0 490 496 A F H X S+ 0 0 78 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.942 110.8 45.5 -57.4 -51.6 47.8 -0.1 39.4 491 497 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.895 110.6 54.0 -62.0 -41.1 45.8 1.8 36.8 492 498 A T H X S+ 0 0 43 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.890 108.5 50.7 -58.5 -39.5 43.3 3.0 39.4 493 499 A F H X S+ 0 0 112 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.913 108.2 51.0 -65.2 -43.6 46.2 4.3 41.4 494 500 A L H X S+ 0 0 20 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.903 109.5 51.0 -59.9 -41.2 47.6 6.2 38.4 495 501 A V H X S+ 0 0 14 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.892 108.2 52.8 -62.5 -40.6 44.1 7.7 37.9 496 502 A F H X S+ 0 0 88 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.942 109.3 49.0 -56.6 -49.4 44.2 8.7 41.5 497 503 A L H X S+ 0 0 68 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.899 111.2 49.2 -58.9 -44.3 47.5 10.4 41.0 498 504 A A H X S+ 0 0 5 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.939 110.0 51.6 -59.6 -48.4 46.3 12.3 37.9 499 505 A E H X S+ 0 0 25 -4,-2.7 4,-1.4 1,-0.2 -2,-0.2 0.890 111.2 48.0 -55.6 -42.6 43.2 13.4 39.8 500 506 A R H < S+ 0 0 95 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.883 107.9 54.5 -67.3 -39.2 45.4 14.7 42.6 501 507 A R H < S+ 0 0 107 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.862 102.9 58.7 -61.9 -36.6 47.7 16.5 40.1 502 508 A R H < 0 0 150 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.953 360.0 360.0 -56.5 -52.9 44.6 18.3 38.7 503 509 A N < 0 0 148 -4,-1.4 -1,-0.3 0, 0.0 -2,-0.2 0.517 360.0 360.0 -58.2 360.0 43.8 19.8 42.1 504 ! 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 0.0 505 601 A L 0 0 0 0, 0.0 -485,-0.6 0, 0.0 -255,-0.1 0.000 360.0 360.0 360.0 360.0 41.3 -6.0 16.2