==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 06-OCT-05 2C3E . COMPND 2 MOLECULE: ADP/ATP TRANSLOCASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR H.NURY,C.DAHOUT-GONZALEZ,V.TREZEGUET,G.LAUQUIN,G.BRANDOLIN, . 293 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15993.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 229 78.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 14 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 58.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 0 0 0 0 2 1 0 0 0 1 2 0 0 0 0 0 0 0 1 1 0 0 0 2 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 S 0 0 127 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 156.5 43.2 1.9 34.3 2 2 A D + 0 0 163 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.126 360.0 21.6 167.9 -7.0 40.8 1.5 37.3 3 3 A Q S S+ 0 0 181 2,-0.0 2,-2.1 0, 0.0 0, 0.0 -0.020 78.9 153.0-164.4 28.3 41.4 4.9 39.0 4 4 A A S S- 0 0 61 1,-0.2 3,-0.1 3,-0.0 0, 0.0 -0.457 81.2 -75.4 -72.5 76.6 42.8 6.8 36.0 5 5 A L S >> S+ 0 0 159 -2,-2.1 2,-0.7 1,-0.2 4,-0.5 0.793 83.4 162.2 33.6 42.3 41.7 10.3 37.0 6 6 A S T 34 + 0 0 80 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 -0.825 47.9 53.5 -97.7 114.0 38.2 9.4 36.0 7 7 A F T 3> S+ 0 0 150 -2,-0.7 4,-0.7 -3,-0.1 -1,-0.2 -0.170 104.1 56.2 158.2 -36.0 35.5 11.7 37.5 8 8 A L H <> S+ 0 0 109 -3,-0.5 4,-2.2 2,-0.2 5,-0.1 0.679 89.9 63.5 -95.4 -23.5 36.9 14.9 36.2 9 9 A K H X S+ 0 0 150 -4,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.825 105.7 53.6 -69.9 -24.4 37.3 14.6 32.4 10 10 A D H > S+ 0 0 104 2,-0.2 4,-4.5 1,-0.2 5,-0.2 0.920 105.0 53.6 -67.9 -47.0 33.5 14.3 32.6 11 11 A F H X S+ 0 0 64 -4,-0.7 4,-1.7 2,-0.2 -2,-0.2 0.909 111.2 45.1 -53.0 -50.2 33.4 17.6 34.5 12 12 A L H X S+ 0 0 85 -4,-2.2 4,-2.7 2,-0.2 3,-0.3 0.962 117.3 44.1 -60.6 -52.5 35.4 19.3 31.8 13 13 A A H X S+ 0 0 48 -4,-2.5 4,-3.4 1,-0.2 5,-0.3 0.922 111.0 55.1 -58.3 -46.2 33.2 17.7 29.0 14 14 A G H X S+ 0 0 31 -4,-4.5 4,-1.5 1,-0.2 -1,-0.2 0.823 114.0 41.2 -56.9 -34.0 30.1 18.5 31.0 15 15 A G H X S+ 0 0 0 -4,-1.7 4,-2.3 -3,-0.3 -1,-0.2 0.797 112.8 52.5 -84.5 -32.1 31.1 22.1 31.1 16 16 A V H X S+ 0 0 69 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.912 111.8 47.5 -69.4 -40.0 32.3 22.3 27.6 17 17 A A H X S+ 0 0 16 -4,-3.4 4,-2.0 -5,-0.2 5,-0.3 0.940 110.6 52.0 -64.2 -46.3 29.0 20.8 26.4 18 18 A A H X S+ 0 0 15 -4,-1.5 4,-2.1 -5,-0.3 5,-0.2 0.913 107.3 52.8 -54.7 -46.3 27.1 23.3 28.6 19 19 A A H X S+ 0 0 24 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.910 108.9 50.8 -56.7 -44.6 29.1 26.2 27.1 20 20 A I H X S+ 0 0 73 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.908 111.0 43.8 -63.4 -48.6 28.2 25.1 23.6 21 21 A S H X S+ 0 0 11 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.907 115.0 49.9 -67.1 -39.6 24.4 24.8 24.0 22 22 A K H X S+ 0 0 67 -4,-2.1 4,-0.6 -5,-0.3 -2,-0.2 0.916 113.3 45.8 -63.7 -42.8 24.1 28.0 25.9 23 23 A T H < S+ 0 0 46 -4,-2.1 3,-0.4 -5,-0.2 -1,-0.2 0.857 109.2 56.0 -67.8 -37.9 26.1 29.9 23.3 24 24 A A H < S+ 0 0 50 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.959 118.7 32.0 -60.7 -49.6 24.2 28.4 20.4 25 25 A V H >X S+ 0 0 18 -4,-2.2 4,-2.5 1,-0.2 3,-0.6 0.387 88.2 104.3 -90.6 5.4 20.9 29.6 21.8 26 26 A A H 3X S+ 0 0 0 -4,-0.6 4,-1.5 -3,-0.4 -1,-0.2 0.824 76.5 59.1 -53.4 -35.3 22.3 32.8 23.4 27 27 A P H 3> S+ 0 0 29 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.900 112.2 36.5 -63.0 -42.8 20.7 34.8 20.6 28 28 A I H <> S+ 0 0 32 -3,-0.6 4,-2.4 2,-0.2 -2,-0.2 0.808 112.7 60.1 -79.2 -28.9 17.2 33.7 21.3 29 29 A E H X S+ 0 0 27 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.808 106.1 49.1 -66.1 -29.9 17.9 33.7 25.0 30 30 A R H X S+ 0 0 0 -4,-1.5 4,-2.7 -5,-0.2 -1,-0.2 0.837 108.7 51.0 -78.3 -34.1 18.6 37.4 24.6 31 31 A V H X S+ 0 0 0 -4,-1.1 4,-2.5 2,-0.2 5,-0.2 0.893 109.4 51.6 -69.5 -39.1 15.5 38.1 22.7 32 32 A K H X S+ 0 0 7 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.917 111.9 46.5 -63.4 -43.5 13.5 36.4 25.4 33 33 A L H X S+ 0 0 3 -4,-1.6 4,-3.0 2,-0.2 5,-0.3 0.959 110.9 51.5 -63.6 -50.7 15.1 38.5 28.1 34 34 A L H X S+ 0 0 1 -4,-2.7 4,-2.3 1,-0.3 5,-0.2 0.954 112.8 44.9 -49.7 -57.8 14.6 41.8 26.1 35 35 A L H < S+ 0 0 21 -4,-2.5 4,-0.3 1,-0.2 -1,-0.3 0.837 115.7 51.7 -54.0 -34.9 10.9 41.1 25.7 36 36 A Q H < S+ 0 0 0 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.881 126.1 17.3 -71.5 -44.1 10.8 40.1 29.3 37 37 A V H >< S+ 0 0 1 -4,-3.0 3,-1.4 -3,-0.1 -2,-0.2 0.359 93.3 98.1-117.9 9.6 12.4 43.1 30.9 38 38 A Q G >< S+ 0 0 16 -4,-2.3 3,-1.5 -5,-0.3 -3,-0.1 0.868 74.2 68.2 -65.4 -36.5 12.2 45.8 28.3 39 39 A H G 3 S+ 0 0 57 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.629 103.9 47.4 -57.1 -13.2 9.1 47.4 29.8 40 40 A A G < S+ 0 0 0 -3,-1.4 2,-0.3 209,-0.0 -1,-0.3 -0.246 88.0 122.2-123.2 44.4 11.4 48.3 32.8 41 41 A S < - 0 0 19 -3,-1.5 -3,-0.0 3,-0.3 102,-0.0 -0.834 54.7-151.4-113.2 147.8 14.4 49.8 31.0 42 42 A K S S+ 0 0 145 -2,-0.3 -1,-0.1 1,-0.1 -4,-0.0 0.800 101.6 41.6 -79.7 -31.2 15.9 53.3 31.2 43 43 A Q S S+ 0 0 46 1,-0.1 2,-0.7 2,-0.1 -1,-0.1 0.953 97.7 73.2 -81.9 -57.6 17.1 53.0 27.6 44 44 A I - 0 0 6 -6,-0.1 -3,-0.3 4,-0.1 -1,-0.1 -0.480 69.6-164.2 -65.9 110.1 14.2 51.5 25.8 45 45 A S >> - 0 0 48 -2,-0.7 3,-0.9 1,-0.1 4,-0.7 -0.092 41.3 -93.2 -76.8-172.7 11.6 54.2 25.5 46 46 A A T 34 S+ 0 0 74 1,-0.2 3,-0.3 2,-0.2 -1,-0.1 0.812 127.3 58.0 -74.6 -26.5 8.0 53.3 24.7 47 47 A E T 34 S+ 0 0 159 1,-0.2 -1,-0.2 3,-0.0 -2,-0.0 -0.067 107.4 45.6 -92.7 30.2 8.9 54.0 21.0 48 48 A K T <4 S+ 0 0 65 -3,-0.9 -1,-0.2 2,-0.1 -2,-0.2 0.358 78.0 121.0-142.1 -16.1 11.7 51.5 20.9 49 49 A Q < - 0 0 60 -4,-0.7 2,-0.1 -3,-0.3 -14,-0.0 -0.356 68.3-112.4 -59.5 128.4 10.1 48.5 22.7 50 50 A Y - 0 0 12 1,-0.1 -1,-0.1 -2,-0.1 3,-0.1 -0.327 8.1-138.8 -70.2 144.4 10.1 45.5 20.3 51 51 A K S S- 0 0 184 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.440 70.1 -58.5 -79.4 -4.5 7.0 44.0 18.8 52 52 A G S > S- 0 0 21 1,-0.2 4,-1.7 2,-0.0 -1,-0.1 -0.963 77.7 -46.3 153.7-166.8 8.1 40.4 19.3 53 53 A I H > S+ 0 0 42 -2,-0.3 4,-2.8 2,-0.2 5,-0.4 0.981 129.9 42.2 -61.3 -64.7 10.9 38.0 18.4 54 54 A I H > S+ 0 0 132 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.931 114.7 51.1 -49.4 -53.9 11.2 38.7 14.6 55 55 A D H > S+ 0 0 34 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.902 114.8 47.1 -49.3 -43.0 10.9 42.4 15.2 56 56 A C H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 3,-0.4 0.928 114.4 40.2 -66.1 -55.4 13.6 42.1 17.8 57 57 A V H < S+ 0 0 50 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.727 113.7 56.4 -70.8 -23.5 16.2 39.9 16.0 58 58 A V H < S+ 0 0 100 -4,-2.3 4,-0.3 -5,-0.4 -1,-0.2 0.746 117.3 35.8 -78.1 -22.6 15.6 41.9 12.8 59 59 A R H X S+ 0 0 58 -4,-0.7 4,-2.5 -3,-0.4 -2,-0.2 0.737 102.7 69.6-101.6 -29.8 16.5 45.1 14.7 60 60 A I H X>S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.9 0.935 96.3 52.0 -58.3 -51.0 19.2 44.0 17.1 61 61 A P H >5S+ 0 0 41 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.916 116.0 42.8 -53.0 -44.6 22.0 43.5 14.5 62 62 A K H 45S+ 0 0 189 -4,-0.3 -2,-0.2 2,-0.2 -3,-0.1 0.874 117.3 45.5 -69.2 -40.4 21.3 46.9 13.0 63 63 A E H <5S+ 0 0 28 -4,-2.5 -3,-0.2 1,-0.1 -1,-0.2 0.895 136.8 1.1 -71.5 -44.7 20.9 48.7 16.4 64 64 A Q H <5S- 0 0 22 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.1 0.460 111.1 -83.6-127.1 -4.6 24.0 47.3 18.3 65 65 A G ><< - 0 0 29 -4,-1.4 3,-1.8 -5,-0.9 4,-0.2 -0.007 39.1 -89.8 109.3 144.5 25.9 44.9 16.0 66 66 A F G > S+ 0 0 125 1,-0.3 3,-1.3 -5,-0.2 4,-0.2 0.830 123.2 59.6 -55.8 -37.4 25.5 41.2 15.1 67 67 A L G > S+ 0 0 137 1,-0.2 3,-1.7 2,-0.1 -1,-0.3 0.653 83.5 82.3 -68.8 -14.5 27.7 40.1 17.9 68 68 A S G X S+ 0 0 5 -3,-1.8 3,-2.2 1,-0.3 -1,-0.2 0.691 70.4 78.6 -65.6 -16.4 25.3 41.8 20.4 69 69 A F G < S+ 0 0 20 -3,-1.3 -1,-0.3 1,-0.3 -39,-0.2 0.872 95.2 50.6 -57.7 -31.9 23.1 38.6 20.2 70 70 A W G X S+ 0 0 86 -3,-1.7 3,-2.0 -4,-0.2 2,-0.6 0.230 79.0 141.0 -92.0 16.8 25.8 37.2 22.6 71 71 A R T < S+ 0 0 33 -3,-2.2 72,-0.1 1,-0.3 -3,-0.1 -0.448 77.5 8.3 -65.6 108.9 25.6 40.1 25.0 72 72 A G T >> S+ 0 0 10 -2,-0.6 3,-0.9 68,-0.1 4,-0.6 0.234 93.2 121.0 104.1 -8.8 25.9 38.7 28.5 73 73 A N H X> + 0 0 13 -3,-2.0 3,-2.2 1,-0.2 4,-1.1 0.865 53.4 75.9 -53.9 -45.6 26.7 35.2 27.3 74 74 A L H 3> S+ 0 0 94 -4,-0.4 4,-1.6 1,-0.3 3,-0.5 0.823 92.6 55.1 -35.2 -49.6 30.1 34.9 29.1 75 75 A A H <> S+ 0 0 2 -3,-0.9 4,-2.2 1,-0.2 -1,-0.3 0.864 101.0 59.5 -56.7 -37.7 28.4 34.4 32.4 76 76 A N H < S+ 0 0 61 -4,-1.6 3,-1.6 1,-0.2 -2,-0.2 0.984 97.2 68.0 -74.4 -65.6 31.3 30.4 33.5 79 79 A R H 3X S+ 0 0 71 -4,-2.2 4,-2.2 1,-0.3 5,-0.3 0.644 87.2 72.6 -26.4 -38.9 28.5 29.5 35.9 80 80 A Y H 3X S+ 0 0 38 -4,-0.6 4,-2.8 1,-0.2 -1,-0.3 0.909 97.6 42.5 -49.4 -57.0 28.7 25.8 35.0 81 81 A F H <> S+ 0 0 70 -3,-1.6 4,-2.0 -4,-0.4 -1,-0.2 0.924 115.5 45.6 -63.0 -49.8 31.9 24.9 36.8 82 82 A P H > S+ 0 0 50 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.894 115.3 49.3 -63.4 -36.4 31.3 26.9 40.0 83 83 A T H X S+ 0 0 16 -4,-2.2 4,-1.1 1,-0.2 3,-0.4 0.984 109.3 51.8 -63.0 -56.4 27.8 25.5 40.3 84 84 A Q H >X S+ 0 0 70 -4,-2.8 4,-1.9 -5,-0.3 3,-0.6 0.832 104.3 56.2 -48.2 -43.1 28.8 21.9 39.7 85 85 A A H 3X S+ 0 0 55 -4,-2.0 4,-1.1 1,-0.3 -1,-0.2 0.944 106.0 52.0 -56.1 -48.9 31.4 22.1 42.4 86 86 A L H 3X S+ 0 0 33 -4,-1.5 4,-1.5 -3,-0.4 5,-0.4 0.704 105.9 55.0 -61.8 -23.0 28.8 23.1 44.9 87 87 A N H S+ 0 0 37 -4,-1.1 4,-0.8 -3,-0.6 5,-0.6 0.928 101.7 53.9 -78.1 -44.4 26.5 20.1 43.9 88 88 A F H <5S+ 0 0 171 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.817 114.7 49.1 -55.9 -25.2 29.2 17.5 44.5 89 89 A A H <5S+ 0 0 46 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.826 130.5 2.7 -86.1 -34.6 29.2 19.2 47.9 90 90 A F H X5S+ 0 0 80 -4,-1.5 4,-2.3 -3,-0.2 5,-0.3 0.751 100.6 83.8-125.0 -36.5 25.5 19.5 48.9 91 91 A K H X5S+ 0 0 104 -4,-0.8 4,-2.0 -5,-0.4 -3,-0.1 0.851 100.4 43.6 -39.1 -52.9 22.9 17.9 46.5 92 92 A D H > S+ 0 0 111 -3,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.832 109.7 49.0 -56.9 -38.4 23.4 15.7 51.6 94 94 A Y H X S+ 0 0 47 -4,-2.3 4,-2.3 2,-0.2 5,-0.5 0.882 105.5 57.8 -71.7 -38.4 20.1 17.4 50.9 95 95 A K H X>S+ 0 0 89 -4,-2.0 4,-3.2 -5,-0.3 5,-0.6 0.922 112.1 40.7 -57.0 -45.5 18.6 14.3 49.4 96 96 A Q H <5S+ 0 0 101 -4,-2.0 -1,-0.2 3,-0.3 -2,-0.2 0.743 111.3 55.0 -78.3 -24.4 19.2 12.3 52.6 97 97 A I H <5S+ 0 0 111 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.910 128.8 17.3 -73.5 -40.2 18.2 15.0 55.0 98 98 A F H <5S+ 0 0 62 -4,-2.3 -2,-0.2 -5,-0.1 -3,-0.2 0.811 138.1 31.1-101.8 -36.8 14.9 15.3 53.2 99 99 A L T ><5S+ 0 0 20 -4,-3.2 3,-1.6 -5,-0.5 -3,-0.3 0.527 86.8 124.6 -99.8 -7.0 14.3 12.2 51.2 100 100 A G T 3 > - 0 0 86 -2,-0.4 3,-1.5 1,-0.1 4,-0.8 -0.825 8.9-145.7 -94.0 112.5 10.1 4.9 49.8 104 104 A R T 34 S+ 0 0 115 -2,-0.7 3,-0.3 1,-0.3 7,-0.1 0.762 97.0 50.0 -45.1 -33.8 8.7 6.7 46.7 105 105 A H T 34 S+ 0 0 179 1,-0.2 -1,-0.3 2,-0.1 3,-0.3 0.752 115.9 38.1 -82.6 -23.4 6.1 4.0 46.1 106 106 A K T <4 S+ 0 0 171 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.267 125.4 35.6-111.4 11.8 4.7 3.7 49.6 107 107 A Q X + 0 0 88 -4,-0.8 4,-1.2 -3,-0.3 -1,-0.2 -0.369 64.5 166.8-160.2 66.2 4.7 7.4 50.5 108 108 A F H > S+ 0 0 88 -3,-0.3 4,-1.5 1,-0.2 3,-0.3 0.912 78.2 38.8 -53.0 -54.9 3.9 9.5 47.3 109 109 A W H > S+ 0 0 191 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.833 112.7 53.8 -70.4 -34.6 3.3 12.9 49.0 110 110 A R H > S+ 0 0 109 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.729 113.0 47.8 -70.2 -20.3 6.0 12.7 51.6 111 111 A Y H X S+ 0 0 56 -4,-1.2 4,-1.7 -3,-0.3 -2,-0.2 0.761 108.8 53.2 -86.7 -32.5 8.3 12.0 48.7 112 112 A F H X S+ 0 0 40 -4,-1.5 4,-1.5 -5,-0.2 -2,-0.2 0.970 115.1 40.1 -66.3 -52.0 6.9 14.9 46.7 113 113 A A H >X S+ 0 0 53 -4,-2.6 4,-2.5 1,-0.2 3,-0.5 0.951 115.0 50.5 -61.2 -53.5 7.5 17.3 49.5 114 114 A G H 3X S+ 0 0 5 -4,-1.5 4,-2.7 1,-0.3 -1,-0.2 0.872 110.7 50.9 -54.6 -37.5 10.9 15.9 50.5 115 115 A N H 3X S+ 0 0 11 -4,-1.7 4,-2.3 2,-0.2 -1,-0.3 0.815 108.6 51.3 -71.4 -30.4 12.0 16.1 46.9 116 116 A L H X S+ 0 0 18 -4,-2.4 4,-2.1 2,-0.2 3,-2.0 0.952 114.2 51.8 -59.1 -54.3 24.2 27.2 44.6 127 127 A L H 3X S+ 0 0 13 -4,-3.0 4,-3.5 1,-0.3 -2,-0.2 0.956 95.9 70.1 -44.7 -59.4 22.4 30.4 43.8 128 128 A C H 3< S+ 0 0 59 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.716 114.2 27.4 -27.1 -38.5 23.8 31.9 47.0 129 129 A F H << S+ 0 0 135 -3,-2.0 -1,-0.2 -4,-0.6 -2,-0.2 0.885 130.2 31.5 -98.4 -51.6 27.2 31.8 45.2 130 130 A V H >X S+ 0 0 7 -4,-2.1 3,-2.0 1,-0.2 4,-1.2 0.554 86.4 103.0 -88.9 -7.1 26.7 32.1 41.4 131 131 A Y H >X S+ 0 0 0 -4,-3.5 4,-2.3 -5,-0.4 3,-0.8 0.887 74.0 62.8 -40.0 -52.4 23.6 34.2 41.6 132 132 A P H 3> S+ 0 0 19 0, 0.0 4,-3.1 0, 0.0 -1,-0.3 0.828 98.1 55.8 -44.1 -40.2 25.7 37.3 40.7 133 133 A L H <> S+ 0 0 23 -3,-2.0 4,-3.3 2,-0.2 5,-0.2 0.928 107.2 48.3 -60.9 -44.8 26.5 35.7 37.3 134 134 A D H < S+ 0 0 9 -4,-3.1 3,-1.6 1,-0.2 -2,-0.2 0.868 107.6 57.4 -58.9 -42.4 24.0 42.9 30.1 141 141 A A H 3< S+ 0 0 0 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.920 107.1 50.0 -57.2 -40.8 21.4 41.2 28.0 142 142 A A T 3< S+ 0 0 3 -4,-1.5 2,-1.8 -3,-0.2 -1,-0.3 0.517 80.6 111.0 -75.6 -4.6 19.1 44.1 28.7 143 143 A D < + 0 0 0 -3,-1.6 -1,-0.1 -4,-0.3 -3,-0.1 -0.543 38.8 171.7 -72.9 87.4 21.9 46.5 27.6 144 144 A V + 0 0 8 -2,-1.8 -1,-0.2 -110,-0.0 7,-0.1 0.325 35.0 129.1 -80.7 10.5 20.3 47.8 24.4 145 145 A G - 0 0 6 1,-0.1 6,-0.2 -81,-0.0 3,-0.1 -0.235 48.1-154.0 -66.2 154.3 23.1 50.3 24.2 146 146 A K + 0 0 126 1,-0.2 -1,-0.1 4,-0.1 2,-0.1 0.875 67.4 26.4 -91.9 -85.5 25.1 50.8 21.0 147 147 A G S > S- 0 0 30 1,-0.1 3,-3.7 4,-0.0 -1,-0.2 -0.415 91.6 -97.3 -81.2 158.3 28.6 52.2 21.6 148 148 A A T 3 S+ 0 0 86 1,-0.3 -1,-0.1 2,-0.2 3,-0.1 0.445 126.4 60.5 -53.4 4.3 30.7 51.8 24.7 149 149 A A T 3 S+ 0 0 91 1,-0.1 -1,-0.3 0, 0.0 -4,-0.0 0.570 105.6 42.3-106.1 -17.8 29.3 55.3 25.5 150 150 A Q S < S+ 0 0 113 -3,-3.7 2,-0.5 -7,-0.0 -2,-0.2 -0.079 96.1 106.8-117.4 28.6 25.7 54.3 25.5 151 151 A R - 0 0 55 -6,-0.2 3,-0.1 1,-0.1 -11,-0.0 -0.945 61.1-151.4-115.1 126.7 26.4 51.1 27.4 152 152 A E S S+ 0 0 35 -2,-0.5 2,-0.4 1,-0.2 -1,-0.1 0.895 87.4 17.1 -59.8 -43.5 25.4 50.6 31.1 153 153 A F - 0 0 7 -13,-0.1 -1,-0.2 -14,-0.1 3,-0.1 -0.998 61.1-145.0-136.4 139.3 28.3 48.1 31.6 154 154 A T S S- 0 0 104 -2,-0.4 2,-0.3 1,-0.1 3,-0.1 0.274 79.3 -46.1 -82.7 11.4 31.5 47.4 29.6 155 155 A G S > S- 0 0 20 1,-0.2 4,-3.2 2,-0.1 5,-0.2 -0.916 72.9 -59.5 151.4-177.7 31.2 43.7 30.6 156 156 A L H > S+ 0 0 18 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.966 127.3 47.9 -62.2 -55.6 30.6 41.1 33.2 157 157 A G H > S+ 0 0 47 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.883 117.7 42.2 -53.5 -45.1 33.6 42.1 35.4 158 158 A N H > S+ 0 0 50 2,-0.2 4,-4.0 1,-0.2 5,-0.2 0.969 110.6 55.6 -66.7 -54.9 32.5 45.8 35.2 159 159 A C H X S+ 0 0 0 -4,-3.2 4,-1.7 2,-0.2 5,-0.2 0.862 112.7 44.0 -44.8 -44.6 28.8 45.0 35.7 160 160 A I H X S+ 0 0 51 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.994 117.8 41.4 -64.8 -64.0 29.7 43.2 38.9 161 161 A T H X S+ 0 0 83 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.834 114.6 54.9 -53.4 -38.9 32.2 45.7 40.3 162 162 A K H < S+ 0 0 99 -4,-4.0 4,-0.4 2,-0.2 -1,-0.2 0.995 109.6 41.7 -60.1 -68.2 30.0 48.6 39.2 163 163 A I H >X S+ 0 0 4 -4,-1.7 4,-2.4 -5,-0.2 3,-0.7 0.816 115.5 53.5 -48.7 -38.3 26.7 47.6 40.9 164 164 A F H 3X S+ 0 0 104 -4,-2.0 4,-4.0 2,-0.3 3,-0.4 0.978 104.5 51.7 -61.1 -59.1 28.7 46.6 44.0 165 165 A K H 3< S+ 0 0 184 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.512 119.5 42.7 -57.1 -1.0 30.4 50.0 44.3 166 166 A S H <4 S- 0 0 49 -3,-0.7 -2,-0.3 -4,-0.4 -1,-0.3 0.693 140.2 -2.0-116.4 -32.2 26.8 51.2 44.1 167 167 A D H >X S- 0 0 60 -4,-2.4 4,-1.3 -3,-0.4 3,-0.9 0.125 85.7-134.8-149.1 20.2 24.9 48.8 46.4 168 168 A G H 3X S- 0 0 24 -4,-4.0 4,-0.9 1,-0.2 -1,-0.3 -0.253 71.0 -30.9 56.2-140.2 27.4 46.3 47.7 169 169 A L H 3> S+ 0 0 101 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.711 131.7 73.8 -82.7 -21.1 26.1 42.7 47.6 170 170 A R H <4 S+ 0 0 78 -3,-0.9 3,-0.4 2,-0.2 -2,-0.2 0.900 98.9 45.5 -59.9 -40.9 22.5 43.7 48.1 171 171 A G H >< S+ 0 0 2 -4,-1.3 3,-2.0 1,-0.2 70,-0.3 0.982 108.7 54.9 -65.5 -55.3 22.2 45.1 44.6 172 172 A L H 3< S+ 0 0 7 -4,-0.9 -1,-0.2 1,-0.3 -37,-0.2 0.640 110.0 49.6 -52.1 -18.4 23.9 42.1 43.0 173 173 A Y T >< S+ 0 0 60 -4,-1.0 3,-1.6 -3,-0.4 -1,-0.3 0.188 72.2 138.4-112.2 19.4 21.3 39.8 44.6 174 174 A Q T < S+ 0 0 55 -3,-2.0 64,-0.1 1,-0.2 63,-0.0 -0.414 70.1 29.2 -67.4 139.0 18.0 41.3 43.8 175 175 A G T 3> S+ 0 0 9 62,-0.1 4,-1.9 -2,-0.1 -1,-0.2 0.258 81.8 125.3 97.1 -9.3 15.3 38.8 42.8 176 176 A F H <> S+ 0 0 56 -3,-1.6 4,-1.5 2,-0.2 3,-0.5 0.921 70.4 47.0 -44.9 -63.5 16.9 36.1 45.0 177 177 A N H >> S+ 0 0 102 1,-0.2 3,-2.0 2,-0.2 4,-1.6 0.942 114.6 43.5 -45.4 -70.0 13.8 35.3 47.1 178 178 A V H 3> S+ 0 0 0 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.728 110.5 57.7 -53.1 -24.9 11.3 35.0 44.2 179 179 A S H 3X S+ 0 0 10 -4,-1.9 4,-1.7 -3,-0.5 -1,-0.3 0.803 106.7 48.9 -77.1 -25.3 13.8 33.0 42.2 180 180 A V H X S+ 0 0 43 -4,-2.3 4,-1.8 2,-0.2 3,-0.6 0.939 117.3 57.2 -78.9 -48.3 7.6 16.3 38.7 192 192 A G H 3X S+ 0 0 22 -4,-2.4 4,-1.6 -5,-0.4 3,-0.3 0.905 113.1 43.5 -47.4 -44.7 3.8 16.9 39.1 193 193 A V H 3X S+ 0 0 42 -4,-3.0 4,-1.3 1,-0.2 -1,-0.3 0.760 110.9 54.1 -73.6 -26.0 3.5 16.8 35.4 194 194 A Y H S+ 0 0 117 -3,-0.1 4,-0.7 0, 0.0 -1,-0.2 0.023 112.4 63.1 179.4 -30.8 12.7 6.8 21.9 210 210 A I H > S+ 0 0 98 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.772 100.9 54.5 -79.4 -28.5 12.6 10.0 20.0 211 211 A V H > S+ 0 0 84 1,-0.2 4,-1.2 -4,-0.2 -1,-0.2 0.816 103.9 57.5 -71.3 -30.4 9.0 10.4 21.0 212 212 A S H > S+ 0 0 51 -5,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.797 105.4 50.0 -68.0 -31.3 10.4 10.0 24.5 213 213 A W H >X S+ 0 0 81 -4,-0.7 4,-2.8 2,-0.2 3,-0.6 0.977 108.0 50.8 -71.1 -57.8 12.7 13.0 23.9 214 214 A M H 3X S+ 0 0 112 -4,-2.1 4,-1.9 1,-0.3 -2,-0.2 0.743 111.7 49.8 -51.9 -27.5 9.8 15.2 22.6 215 215 A I H 3X S+ 0 0 55 -4,-1.2 4,-2.9 2,-0.2 -1,-0.3 0.849 107.7 51.8 -82.1 -33.6 7.9 14.4 25.7 216 216 A A H X S+ 0 0 54 -4,-2.3 4,-2.0 -5,-0.2 3,-0.7 0.962 112.7 47.0 -64.4 -48.8 5.3 23.0 30.7 223 223 A A H 3X S+ 0 0 0 -4,-1.8 4,-1.2 1,-0.3 -1,-0.2 0.867 111.5 52.5 -58.0 -39.9 7.2 23.3 34.0 224 224 A G H 3< S+ 0 0 13 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.762 108.4 50.4 -70.0 -23.8 9.0 26.3 32.6 225 225 A L H X< S+ 0 0 63 -4,-1.3 3,-0.6 -3,-0.7 -2,-0.2 0.846 106.5 53.9 -80.8 -35.9 5.7 28.0 31.7 226 226 A V H 3< S+ 0 0 75 -4,-2.0 -2,-0.2 1,-0.2 4,-0.2 0.792 116.8 36.9 -68.2 -30.5 4.1 27.5 35.1 227 227 A S T 3X S+ 0 0 12 -4,-1.2 4,-1.1 -5,-0.2 3,-0.3 0.316 89.3 100.0-105.7 7.4 7.0 29.1 36.9 228 228 A Y H <> S+ 0 0 3 -3,-0.6 4,-2.8 1,-0.2 3,-0.4 0.880 73.3 60.0 -62.6 -43.2 7.7 31.8 34.3 229 229 A P H > S+ 0 0 16 0, 0.0 4,-2.2 0, 0.0 5,-0.3 0.924 104.5 52.7 -53.2 -38.7 5.9 34.6 36.1 230 230 A F H > S+ 0 0 42 -3,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.861 108.2 49.6 -63.5 -35.8 8.3 34.1 39.0 231 231 A D H X S+ 0 0 32 -4,-1.1 4,-2.6 -3,-0.4 -1,-0.2 0.915 108.5 55.6 -67.5 -42.0 11.2 34.4 36.5 232 232 A T H X S+ 0 0 0 -4,-2.8 4,-2.1 37,-0.3 -2,-0.2 0.920 111.1 40.1 -57.1 -50.1 9.6 37.6 35.2 233 233 A V H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.908 113.0 57.9 -68.8 -38.1 9.4 39.4 38.5 234 234 A R H X S+ 0 0 20 -4,-2.0 4,-1.4 -5,-0.3 3,-0.4 0.939 109.9 42.6 -52.7 -52.5 12.8 38.1 39.5 235 235 A R H X S+ 0 0 32 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.889 109.2 58.4 -61.5 -44.0 14.4 39.7 36.3 236 236 A R H < S+ 0 0 0 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.799 107.4 47.5 -57.5 -31.9 12.4 42.9 36.8 237 237 A M H >X S+ 0 0 5 -4,-1.7 3,-0.9 -3,-0.4 4,-0.8 0.821 106.0 57.2 -79.2 -34.7 14.0 43.3 40.3 238 238 A M H 3< S+ 0 0 0 -4,-1.4 3,-0.4 1,-0.3 -2,-0.2 0.894 97.7 64.7 -61.7 -38.6 17.5 42.6 39.0 239 239 A M T 3< S+ 0 0 0 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.774 95.1 60.6 -53.4 -31.2 17.0 45.5 36.6 240 240 A Q T X4 S+ 0 0 4 -3,-0.9 3,-2.7 -4,-0.4 -1,-0.2 0.895 71.0 108.2 -70.0 -46.4 16.8 47.9 39.6 241 241 A S T 3< S+ 0 0 4 -4,-0.8 -78,-0.1 -3,-0.4 -77,-0.1 -0.002 89.5 16.1 -37.6 128.2 20.2 47.5 41.3 242 242 A G T 3 S+ 0 0 21 -79,-0.2 2,-2.2 1,-0.1 -1,-0.3 -0.003 92.5 112.9 94.8 -29.5 22.4 50.6 40.7 243 243 A R < - 0 0 33 -3,-2.7 2,-0.6 -4,-0.1 5,-0.3 -0.479 57.0-162.2 -78.6 70.9 19.4 52.7 39.6 244 244 A K - 0 0 189 -2,-2.2 3,-0.1 3,-0.1 -3,-0.0 -0.421 48.5 -37.0 -61.8 103.5 19.5 55.0 42.6 245 245 A G S > S+ 0 0 44 -2,-0.6 3,-0.9 1,-0.2 2,-0.7 -0.004 109.9 48.5 75.1-179.6 16.2 56.8 42.9 246 246 A A T 3 S+ 0 0 109 1,-0.3 -1,-0.2 2,-0.1 -3,-0.0 -0.287 109.8 44.1 53.4 -96.3 13.7 58.2 40.4 247 247 A D T 3 S+ 0 0 89 -2,-0.7 -1,-0.3 -3,-0.1 -3,-0.1 0.673 75.5 131.5 -51.3 -22.8 13.2 55.4 37.8 248 248 A I < + 0 0 60 -3,-0.9 -2,-0.1 -5,-0.3 3,-0.1 -0.099 29.3 175.3 -38.3 97.8 12.9 52.8 40.6 249 249 A M + 0 0 56 1,-0.1 2,-0.3 -209,-0.1 -1,-0.2 0.677 65.4 34.4 -83.1 -21.4 9.7 51.2 39.3 250 250 A Y + 0 0 3 -14,-0.1 -1,-0.1 1,-0.1 3,-0.1 -0.985 48.2 177.1-137.8 147.5 9.9 48.6 42.0 251 251 A T S S+ 0 0 107 1,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.691 73.8 9.2-114.4 -40.6 11.1 48.4 45.6 252 252 A G S > S- 0 0 27 1,-0.1 4,-1.6 -78,-0.0 -1,-0.4 -0.912 78.1 -97.9-140.7 167.5 10.3 44.9 46.6 253 253 A T H >> S+ 0 0 33 -2,-0.3 4,-2.4 1,-0.2 3,-0.6 0.922 127.0 42.9 -46.8 -53.8 9.2 41.5 45.2 254 254 A V H 3> S+ 0 0 117 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.856 108.9 58.3 -62.8 -35.8 5.5 42.2 46.2 255 255 A D H 3> S+ 0 0 34 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.783 110.6 47.5 -62.8 -26.6 5.9 45.7 44.9 256 256 A C H X>S+ 0 0 60 -4,-2.2 4,-2.6 2,-0.2 5,-0.6 0.951 116.1 52.4 -50.5 -56.0 3.0 47.1 39.7 260 260 A I H 3X>S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.3 5,-1.2 0.943 108.5 45.7 -44.2 -77.0 3.1 44.5 36.9 261 261 A A H 3<5S+ 0 0 48 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.737 123.3 41.1 -41.3 -28.6 -0.4 43.1 37.2 262 262 A K H <<5S+ 0 0 127 -4,-1.5 -2,-0.2 -3,-0.6 -1,-0.2 0.946 127.8 23.7 -82.9 -74.9 -1.6 46.7 37.6 263 263 A D H <5S+ 0 0 106 -4,-2.6 -3,-0.2 1,-0.2 -2,-0.2 0.855 137.1 32.0 -60.6 -42.1 0.3 48.7 35.0 264 264 A E T < S+ 0 0 161 -3,-0.4 3,-4.5 -7,-0.1 -2,-0.1 0.591 74.9 97.0-122.6 -17.0 -0.0 38.6 31.3 268 268 A A G > S+ 0 0 5 -4,-0.5 3,-2.1 1,-0.3 -3,-0.1 0.848 79.4 73.1 -42.4 -30.3 3.0 40.9 31.3 269 269 A F G 3 S+ 0 0 17 -4,-0.3 -1,-0.3 1,-0.3 -37,-0.3 0.772 94.8 50.7 -56.1 -26.0 4.3 38.0 33.5 270 270 A F G X S+ 0 0 93 -3,-4.5 3,-1.6 2,-0.1 2,-1.0 0.015 71.8 136.7-102.7 26.4 4.6 35.9 30.3 271 271 A K T < S+ 0 0 65 -3,-2.1 -3,-0.0 1,-0.3 -4,-0.0 -0.650 84.1 11.3 -75.8 106.6 6.5 38.4 28.2 272 272 A G T 3> S+ 0 0 9 -2,-1.0 4,-2.4 -237,-0.1 -1,-0.3 0.387 88.7 126.7 106.8 1.4 9.1 36.2 26.6 273 273 A A T <4 S+ 0 0 9 -3,-1.6 4,-0.4 1,-0.2 -2,-0.1 0.862 76.1 43.8 -58.3 -41.1 7.5 32.9 27.6 274 274 A W T >> S+ 0 0 166 -4,-0.3 4,-2.0 2,-0.2 3,-1.0 0.887 112.4 52.1 -71.3 -43.4 7.3 31.5 24.0 275 275 A S H 3> S+ 0 0 2 1,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.860 108.0 53.4 -60.1 -36.7 10.8 32.7 23.2 276 276 A N H 3X S+ 0 0 25 -4,-2.4 4,-1.2 1,-0.2 -1,-0.3 0.651 104.7 54.6 -73.3 -16.8 11.9 30.9 26.4 277 277 A V H <> S+ 0 0 15 -3,-1.0 4,-2.2 -4,-0.4 -2,-0.2 0.852 110.2 46.0 -81.2 -42.2 10.2 27.7 25.2 278 278 A L H X S+ 0 0 68 -4,-2.0 4,-3.3 2,-0.2 5,-0.3 0.942 110.4 53.3 -64.4 -48.3 12.2 27.8 21.9 279 279 A R H X S+ 0 0 74 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.910 111.4 47.3 -54.2 -44.7 15.5 28.6 23.8 280 280 A G H X S+ 0 0 14 -4,-1.2 4,-2.1 2,-0.2 -1,-0.2 0.920 115.4 41.7 -65.9 -45.7 14.9 25.5 26.0 281 281 A M H X S+ 0 0 60 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.886 114.2 54.2 -69.4 -37.4 14.1 23.1 23.2 282 282 A G H X S+ 0 0 25 -4,-3.3 4,-2.0 -5,-0.2 -2,-0.2 0.897 109.2 48.1 -61.8 -41.8 16.9 24.5 21.1 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