==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 20-NOV-08 3FBZ . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ACIDIANUS FILAMENTOUS VIRUS 1; . AUTHOR A.GOULET,D.PRANGISHVILI,H.VAN TILBEURGH,V.CAMPANACCI, . 492 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24081.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 397 80.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.6 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 335 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.2 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 1 1 0 0 0 0 0 0 0 0 0 0 4 0 3 0 1 4 0 0 0 0 0 0 0 0 4 RESIDUES PER ALPHA HELIX . 4 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 15 A R >> 0 0 186 0, 0.0 3,-1.8 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0 -63.0 8.5 92.1 88.6 2 16 A Y H 3> + 0 0 118 1,-0.3 4,-0.6 2,-0.2 3,-0.1 0.660 360.0 68.6 -53.9 -18.8 12.0 90.5 88.6 3 17 A K H 3> S+ 0 0 119 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.704 80.4 75.3 -75.2 -27.0 9.9 87.3 88.3 4 18 A T H X4 S+ 0 0 54 -3,-1.8 3,-0.9 1,-0.2 4,-0.3 0.944 101.1 37.2 -58.3 -54.0 8.7 88.1 84.8 5 19 A K H >< S+ 0 0 12 -4,-0.5 3,-1.5 1,-0.2 4,-0.4 0.764 100.4 76.4 -72.1 -22.8 11.9 87.2 83.0 6 20 A L H >< S+ 0 0 25 -4,-0.6 3,-1.0 1,-0.3 4,-0.4 0.751 82.4 68.6 -62.6 -20.3 12.7 84.2 85.3 7 21 A Y G X< S+ 0 0 127 -3,-0.9 3,-1.4 -4,-0.7 4,-0.5 0.814 86.3 68.8 -65.9 -31.7 10.1 82.1 83.5 8 22 A L G < S+ 0 0 15 -3,-1.5 -1,-0.2 -4,-0.3 4,-0.2 0.654 87.0 67.2 -64.9 -19.2 12.3 82.1 80.4 9 23 A W G X S+ 0 0 3 -3,-1.0 3,-0.6 -4,-0.4 -1,-0.3 0.786 89.3 68.5 -64.7 -32.2 14.9 79.9 82.1 10 24 A R T < S+ 0 0 86 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.2 0.867 112.5 19.9 -62.9 -48.2 12.5 77.0 82.3 11 25 A N T 3 S+ 0 0 92 -4,-0.5 -1,-0.2 -3,-0.2 -2,-0.1 0.147 85.9 144.1-112.4 19.3 12.2 76.0 78.6 12 26 A L < - 0 0 8 -3,-0.6 375,-2.1 -4,-0.2 2,-0.1 -0.375 43.6-133.1 -68.2 130.3 15.4 77.6 77.2 13 27 A G B +a 387 0A 13 373,-0.3 2,-0.3 301,-0.1 375,-0.2 -0.384 34.8 154.3 -75.2 157.6 17.1 75.6 74.5 14 28 A G - 0 0 0 373,-0.9 372,-0.3 372,-0.1 371,-0.3 -0.968 37.6 -40.9-165.2-169.5 20.8 74.9 74.3 15 29 A L B -b 385 0B 20 369,-1.6 371,-0.6 -2,-0.3 270,-0.0 -0.181 44.3-132.0 -62.8 147.5 23.8 72.9 73.2 16 30 A I - 0 0 23 265,-0.2 -1,-0.1 369,-0.2 269,-0.1 -0.910 29.8-111.4-100.6 126.3 23.9 69.1 73.3 17 31 A P > - 0 0 31 0, 0.0 4,-2.0 0, 0.0 3,-0.2 -0.336 20.6-134.8 -54.3 130.3 27.0 67.5 75.0 18 32 A E H > S+ 0 0 112 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.915 102.4 55.1 -55.8 -48.0 29.2 65.8 72.3 19 33 A D H > S+ 0 0 51 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.873 109.4 47.1 -58.0 -38.0 29.7 62.7 74.5 20 34 A X H > S+ 0 0 38 2,-0.2 4,-1.3 -3,-0.2 -1,-0.2 0.886 113.2 48.7 -69.0 -38.2 25.9 62.2 74.9 21 35 A A H X S+ 0 0 8 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.899 110.6 50.5 -66.3 -41.7 25.4 62.7 71.1 22 36 A I H X S+ 0 0 52 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.844 104.3 59.4 -65.1 -35.5 28.2 60.2 70.3 23 37 A S H X S+ 0 0 56 -4,-1.7 4,-1.4 -5,-0.3 -1,-0.2 0.902 104.5 50.4 -57.5 -40.1 26.6 57.7 72.6 24 38 A V H X S+ 0 0 33 -4,-1.3 4,-1.4 2,-0.2 3,-0.3 0.948 113.7 43.1 -65.2 -48.2 23.5 57.9 70.5 25 39 A T H X S+ 0 0 13 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.846 109.4 57.2 -69.2 -35.4 25.3 57.3 67.2 26 40 A E H X S+ 0 0 126 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.823 104.5 52.6 -62.6 -31.7 27.5 54.6 68.6 27 41 A S H X S+ 0 0 45 -4,-1.4 4,-1.7 -3,-0.3 -2,-0.2 0.891 108.9 49.7 -73.1 -35.3 24.4 52.6 69.6 28 42 A I H X S+ 0 0 16 -4,-1.4 4,-2.0 2,-0.2 5,-0.3 0.945 110.7 50.1 -61.6 -51.7 23.1 52.9 66.0 29 43 A T H X S+ 0 0 36 -4,-2.5 4,-1.8 1,-0.2 5,-0.2 0.941 110.8 49.4 -49.8 -49.5 26.5 51.7 64.7 30 44 A A H X S+ 0 0 55 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.840 107.6 57.8 -58.9 -35.0 26.3 48.7 67.2 31 45 A D H X S+ 0 0 70 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.896 109.2 39.9 -64.7 -48.7 22.7 48.0 65.9 32 46 A W H X S+ 0 0 22 -4,-2.0 4,-2.6 2,-0.2 233,-0.2 0.791 115.4 52.6 -75.4 -27.1 23.6 47.5 62.2 33 47 A K H X S+ 0 0 101 -4,-1.8 4,-2.4 -5,-0.3 -2,-0.2 0.904 111.1 45.6 -71.1 -43.6 26.8 45.6 63.0 34 48 A Q H X S+ 0 0 110 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.883 114.2 51.4 -66.0 -36.4 24.9 43.2 65.3 35 49 A Y H X S+ 0 0 23 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.947 111.8 45.3 -61.4 -53.0 22.3 43.0 62.5 36 50 A N H X S+ 0 0 14 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.856 111.9 51.5 -61.1 -38.8 24.8 42.2 59.8 37 51 A D H X S+ 0 0 86 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.907 112.1 46.5 -66.2 -42.0 26.7 39.6 62.0 38 52 A X H X S+ 0 0 36 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.870 113.7 49.6 -62.7 -41.0 23.4 37.8 62.7 39 53 A X H X S+ 0 0 22 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.910 110.2 48.8 -69.2 -44.8 22.4 37.9 59.0 40 54 A S H X S+ 0 0 26 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.888 111.8 50.4 -61.6 -40.2 25.8 36.6 57.8 41 55 A K H X S+ 0 0 105 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.963 112.8 45.1 -61.9 -52.6 25.6 33.7 60.4 42 56 A V H X S+ 0 0 4 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.890 117.6 45.6 -56.4 -44.8 22.0 32.7 59.3 43 57 A R H X S+ 0 0 7 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.947 115.4 45.0 -64.0 -51.2 23.0 33.0 55.6 44 58 A N H X S+ 0 0 41 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.848 114.5 47.5 -65.5 -38.6 26.3 31.0 56.0 45 59 A E H X S+ 0 0 73 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.847 111.7 50.4 -72.2 -34.8 24.9 28.2 58.2 46 60 A T H X S+ 0 0 1 -4,-1.6 4,-2.5 -5,-0.3 -2,-0.2 0.943 108.4 52.9 -66.6 -47.5 21.9 27.8 55.8 47 61 A L H X S+ 0 0 14 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.856 108.8 50.6 -52.6 -40.0 24.3 27.6 52.9 48 62 A D H X S+ 0 0 89 -4,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.918 109.5 49.8 -67.1 -46.6 26.2 24.8 54.7 49 63 A I H X S+ 0 0 25 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.911 112.3 48.6 -54.7 -44.7 23.1 22.8 55.4 50 64 A L H <>S+ 0 0 0 -4,-2.5 5,-2.2 2,-0.2 -2,-0.2 0.895 111.2 48.7 -66.5 -43.5 22.1 23.1 51.7 51 65 A K H ><5S+ 0 0 141 -4,-2.3 3,-1.4 1,-0.2 -1,-0.2 0.935 111.6 50.6 -56.0 -52.3 25.5 22.0 50.5 52 66 A T H 3<5S+ 0 0 109 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.858 112.2 46.9 -53.3 -42.5 25.4 19.0 52.9 53 67 A N T 3<5S- 0 0 72 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.350 107.6-124.9 -90.2 6.9 21.9 18.0 51.7 54 68 A K T < 5 - 0 0 192 -3,-1.4 -3,-0.2 -4,-0.2 2,-0.2 0.874 41.7-174.3 52.5 42.2 22.9 18.3 48.0 55 69 A V < - 0 0 21 -5,-2.2 -1,-0.2 -6,-0.1 5,-0.1 -0.454 29.1-104.4 -66.9 136.5 20.0 20.7 47.4 56 70 A A > - 0 0 45 -2,-0.2 3,-1.8 1,-0.1 4,-0.3 -0.372 23.8-124.6 -63.9 142.1 19.3 21.8 43.8 57 71 A T G > S+ 0 0 32 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.753 109.0 63.5 -63.6 -26.2 20.4 25.4 43.1 58 72 A E G 3 S+ 0 0 64 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.707 101.8 52.3 -67.5 -22.5 16.9 26.3 41.9 59 73 A D G <> S+ 0 0 47 -3,-1.8 4,-1.9 1,-0.2 3,-0.3 0.460 81.7 92.6 -95.2 -2.7 15.6 25.7 45.4 60 74 A Y H <> S+ 0 0 10 -3,-0.9 4,-2.5 -4,-0.3 5,-0.3 0.891 82.5 54.2 -58.4 -43.3 18.2 27.9 47.2 61 75 A I H > S+ 0 0 6 -4,-0.4 4,-2.4 -3,-0.2 -1,-0.2 0.861 107.8 51.9 -59.7 -38.2 15.9 31.0 47.1 62 76 A G H > S+ 0 0 0 -3,-0.3 4,-2.0 -4,-0.2 -1,-0.2 0.931 113.8 41.0 -62.5 -51.7 13.2 28.9 48.9 63 77 A Y H X S+ 0 0 10 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.834 115.9 49.7 -68.6 -36.0 15.4 27.7 51.7 64 78 A I H X S+ 0 0 2 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.920 111.1 49.4 -67.0 -46.3 17.1 31.1 52.2 65 79 A A H X S+ 0 0 9 -4,-2.4 4,-2.5 -5,-0.3 -2,-0.2 0.876 111.2 51.3 -60.1 -40.5 13.8 32.9 52.3 66 80 A F H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.939 108.8 49.3 -59.4 -51.3 12.6 30.3 54.9 67 81 A A H X S+ 0 0 1 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.896 114.0 47.3 -56.7 -43.0 15.6 30.8 57.1 68 82 A E H X S+ 0 0 23 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.923 111.9 47.1 -66.5 -48.3 15.1 34.6 56.9 69 83 A E H X S+ 0 0 55 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.872 114.8 49.0 -63.4 -35.8 11.4 34.5 57.7 70 84 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.946 110.3 50.0 -65.6 -48.0 12.1 32.1 60.6 71 85 A A H X S+ 0 0 8 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.857 111.1 50.5 -56.6 -40.0 14.9 34.4 61.9 72 86 A H H X S+ 0 0 50 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.926 111.2 46.5 -64.9 -46.9 12.6 37.4 61.8 73 87 A Q H X S+ 0 0 40 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.859 112.0 52.3 -64.1 -35.3 9.7 35.6 63.7 74 88 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.895 107.1 52.0 -68.3 -40.5 12.3 34.4 66.3 75 89 A W H X S+ 0 0 50 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.919 110.7 48.9 -58.2 -45.0 13.6 37.9 66.8 76 90 A K H X>S+ 0 0 86 -4,-2.1 4,-2.5 2,-0.2 5,-0.7 0.868 111.1 50.0 -61.1 -39.8 9.9 39.0 67.4 77 91 A N H X5S+ 0 0 24 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.943 107.5 53.3 -64.9 -48.5 9.4 36.1 69.8 78 92 A K H <5S+ 0 0 96 -4,-2.7 -2,-0.2 1,-0.1 -1,-0.2 0.870 121.7 31.7 -50.5 -43.2 12.6 37.0 71.8 79 93 A N H <5S+ 0 0 103 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.2 0.969 129.3 27.5 -82.3 -61.1 11.3 40.6 72.2 80 94 A S H <5S+ 0 0 106 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.1 0.817 100.4 88.1 -77.9 -34.5 7.5 40.6 72.4 81 95 A S << - 0 0 31 -4,-1.3 4,-0.1 -5,-0.7 -4,-0.0 -0.470 58.7-154.8 -79.0 134.1 6.8 37.2 73.8 82 96 A P S S+ 0 0 136 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.648 104.8 30.9 -69.8 -19.8 6.6 36.4 77.6 83 97 A D S >> S+ 0 0 81 -6,-0.1 4,-1.3 1,-0.1 3,-0.9 -0.648 70.7 172.8-137.8 79.6 7.5 32.9 76.5 84 98 A P H 3> S+ 0 0 35 0, 0.0 4,-1.6 0, 0.0 -6,-0.1 0.799 75.7 64.5 -55.0 -33.5 9.7 33.1 73.3 85 99 A N H 3> S+ 0 0 113 1,-0.2 4,-1.0 2,-0.2 5,-0.1 0.828 103.1 45.3 -62.0 -38.5 10.4 29.3 73.5 86 100 A T H <> S+ 0 0 94 -3,-0.9 4,-1.4 2,-0.2 -1,-0.2 0.879 112.7 50.4 -72.4 -39.5 6.7 28.3 72.9 87 101 A A H X S+ 0 0 23 -4,-1.3 4,-2.1 1,-0.2 -2,-0.2 0.766 104.5 59.6 -72.6 -27.8 6.2 30.8 70.1 88 102 A N H X S+ 0 0 3 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.858 105.6 46.4 -66.2 -41.6 9.4 29.5 68.3 89 103 A E H X S+ 0 0 91 -4,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.830 113.4 50.0 -70.8 -34.1 8.0 26.0 68.0 90 104 A A H X S+ 0 0 60 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.851 110.1 50.2 -70.7 -37.8 4.7 27.4 66.7 91 105 A S H X S+ 0 0 9 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.891 108.9 53.2 -63.0 -44.7 6.6 29.6 64.2 92 106 A K H X S+ 0 0 31 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.962 111.1 45.2 -50.1 -58.8 8.5 26.5 63.1 93 107 A T H X S+ 0 0 90 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.901 115.4 48.1 -53.4 -49.2 5.2 24.6 62.5 94 108 A D H X S+ 0 0 93 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.921 117.3 39.7 -59.4 -50.8 3.6 27.6 60.7 95 109 A L H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.841 113.0 53.5 -75.1 -34.7 6.6 28.3 58.4 96 110 A E H X S+ 0 0 22 -4,-2.9 4,-1.9 -5,-0.3 5,-0.3 0.869 110.7 48.8 -65.2 -38.1 7.4 24.6 57.7 97 111 A S H X S+ 0 0 58 -4,-1.9 4,-2.8 -5,-0.3 5,-0.4 0.944 113.9 46.9 -60.7 -50.8 3.7 24.1 56.6 98 112 A K H X>S+ 0 0 72 -4,-2.0 4,-2.8 1,-0.2 5,-0.6 0.935 115.5 43.3 -57.7 -50.7 3.9 27.2 54.4 99 113 A Y H X5S+ 0 0 5 -4,-2.8 6,-2.1 3,-0.2 4,-0.5 0.801 118.9 41.5 -77.8 -28.1 7.2 26.3 52.7 100 114 A S H X5S+ 0 0 30 -4,-1.9 4,-1.0 4,-0.3 -1,-0.2 0.913 121.8 41.5 -79.2 -44.2 6.5 22.6 52.1 101 115 A D H <5S+ 0 0 115 -4,-2.8 -2,-0.2 -5,-0.3 -3,-0.2 0.947 129.0 27.2 -60.9 -55.6 2.8 23.2 51.0 102 116 A V H <5S+ 0 0 77 -4,-2.8 -3,-0.2 -5,-0.4 -2,-0.1 0.866 137.1 25.0 -81.2 -39.3 3.5 26.3 48.9 103 117 A Y H < - 0 0 82 1,-0.1 4,-2.1 -2,-0.1 3,-0.4 -0.697 21.6-150.1 -84.8 122.1 11.9 19.3 52.2 107 121 A V H > S+ 0 0 52 -2,-0.5 4,-2.4 1,-0.2 5,-0.1 0.782 94.8 57.1 -67.3 -31.6 11.0 19.4 55.9 108 122 A T H > S+ 0 0 94 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.884 109.6 46.9 -68.5 -36.1 14.0 17.5 57.2 109 123 A V H > S+ 0 0 3 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.892 111.4 51.6 -66.3 -41.4 16.2 20.2 55.5 110 124 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.873 106.3 54.5 -61.8 -38.8 13.9 22.9 57.1 111 125 A D H X S+ 0 0 51 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.903 106.8 51.4 -58.6 -45.0 14.4 21.2 60.5 112 126 A A H X S+ 0 0 31 -4,-1.6 4,-1.2 1,-0.2 3,-0.3 0.965 110.3 48.1 -57.1 -52.5 18.2 21.5 60.1 113 127 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 3,-0.4 0.870 108.5 56.0 -53.5 -42.9 17.9 25.2 59.3 114 128 A Y H X S+ 0 0 10 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.896 104.9 50.5 -57.7 -47.4 15.7 25.7 62.3 115 129 A N H < S+ 0 0 110 -4,-1.9 -1,-0.2 -3,-0.3 -2,-0.2 0.710 115.2 44.3 -67.0 -25.6 18.3 24.2 64.7 116 130 A A H X S+ 0 0 15 -4,-1.2 4,-1.1 -3,-0.4 -2,-0.2 0.885 113.3 48.8 -79.3 -46.0 20.9 26.6 63.3 117 131 A V H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 5,-0.2 0.861 103.0 62.2 -68.0 -36.1 18.8 29.7 63.2 118 132 A I H X S+ 0 0 32 -4,-2.2 4,-3.1 1,-0.2 5,-0.3 0.939 105.1 41.8 -60.4 -56.1 17.5 29.4 66.8 119 133 A P H > S+ 0 0 79 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.810 112.2 58.0 -63.7 -28.5 20.8 29.7 68.7 120 134 A I H < S+ 0 0 16 -4,-1.1 -2,-0.2 2,-0.2 -3,-0.1 0.908 116.7 32.3 -62.9 -43.5 21.9 32.5 66.3 121 135 A I H < S+ 0 0 7 -4,-2.0 -3,-0.2 -3,-0.3 -1,-0.2 0.838 122.8 46.3 -85.7 -35.4 18.9 34.7 67.2 122 136 A X H < 0 0 58 -4,-3.1 -2,-0.2 -5,-0.2 -1,-0.1 0.858 360.0 360.0 -75.8 -36.6 18.4 33.6 70.8 123 137 A G < 0 0 83 -4,-1.9 -3,-0.1 -5,-0.3 -5,-0.0 0.536 360.0 360.0 -94.6 360.0 22.1 33.9 71.8 124 !* 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 0.0 125 15 B R > 0 0 177 0, 0.0 3,-1.4 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0 -18.0 30.8 24.6 37.7 126 16 B Y T 3> + 0 0 147 1,-0.3 4,-0.6 2,-0.2 3,-0.1 0.788 360.0 58.9 -59.4 -29.2 27.5 24.8 39.6 127 17 B K H 3> S+ 0 0 127 1,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.667 85.0 81.3 -79.0 -15.0 29.3 26.0 42.8 128 18 B T H X4 S+ 0 0 51 -3,-1.4 3,-1.3 1,-0.2 4,-0.3 0.980 97.0 38.4 -54.7 -60.9 30.7 29.1 41.1 129 19 B K H >4 S+ 0 0 13 -4,-0.5 3,-1.4 1,-0.3 4,-0.2 0.741 101.3 75.6 -61.3 -28.3 27.5 31.3 41.4 130 20 B L H >< S+ 0 0 24 -4,-0.6 3,-1.5 1,-0.3 4,-0.4 0.747 80.5 68.3 -61.1 -26.8 26.6 29.9 44.8 131 21 B Y G XX S+ 0 0 129 -3,-1.3 3,-1.6 -4,-0.8 4,-0.5 0.837 88.1 69.3 -56.9 -30.9 29.3 32.1 46.5 132 22 B L G <4 S+ 0 0 17 -3,-1.4 4,-0.2 -4,-0.3 -1,-0.2 0.649 86.1 67.0 -67.7 -13.7 27.2 35.1 45.5 133 23 B W G <4 S+ 0 0 5 -3,-1.5 3,-0.5 -4,-0.2 -1,-0.3 0.745 88.9 69.1 -72.5 -27.0 24.5 34.1 48.1 134 24 B R T <4 S+ 0 0 87 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.2 0.917 111.7 20.7 -63.1 -50.6 26.9 34.7 51.0 135 25 B N S < S+ 0 0 93 -4,-0.5 -1,-0.2 -3,-0.1 -2,-0.1 0.130 84.4 144.1-111.3 17.9 27.2 38.5 50.9 136 26 B L - 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0 0 0 -371,-0.6 -373,-0.3 -372,-0.3 2,-0.2 -0.988 43.6 -26.1 166.3-166.5 19.2 73.2 77.4 387 29 D L B -a 13 0A 25 -375,-2.1 -373,-0.9 -2,-0.3 -227,-0.1 -0.467 50.1-130.5 -74.8 138.4 16.1 71.7 75.9 388 30 D I - 0 0 23 -232,-0.2 2,-0.2 -2,-0.2 -1,-0.1 -0.782 32.6-113.5 -80.3 127.0 16.2 70.1 72.5 389 31 D P > - 0 0 29 0, 0.0 4,-2.0 0, 0.0 3,-0.2 -0.472 20.5-136.5 -62.4 131.9 13.3 71.5 70.4 390 32 D E H > S+ 0 0 120 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.887 100.3 52.2 -60.6 -46.2 10.9 68.7 69.7 391 33 D D H > S+ 0 0 50 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.876 109.8 49.3 -61.0 -36.4 10.3 69.5 66.0 392 34 D X H > S+ 0 0 31 -3,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.892 112.6 48.5 -69.7 -37.8 14.1 69.5 65.3 393 35 D A H >X S+ 0 0 10 -4,-2.0 4,-1.9 2,-0.2 3,-0.5 0.954 112.8 46.9 -60.6 -51.6 14.4 66.1 67.1 394 36 D I H 3X S+ 0 0 62 -4,-3.0 4,-3.2 1,-0.2 5,-0.2 0.899 105.4 61.1 -61.6 -41.0 11.5 64.6 65.1 395 37 D S H 3X S+ 0 0 34 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.867 105.1 48.1 -50.2 -42.3 13.0 66.0 61.9 396 38 D V H S+ 0 0 0 -4,-2.5 5,-2.4 2,-0.2 -2,-0.2 0.856 112.0 48.8 -66.4 -37.5 15.1 37.7 33.4 423 65 D K H ><5S+ 0 0 168 -4,-1.9 3,-1.1 1,-0.2 -2,-0.2 0.906 111.3 49.8 -69.2 -45.4 11.6 36.5 32.6 424 66 D T H 3<5S+ 0 0 115 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.893 113.0 46.9 -56.4 -42.0 11.6 38.2 29.2 425 67 D N T 3<5S- 0 0 75 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.332 107.0-123.2 -89.2 7.0 15.0 36.6 28.4 426 68 D K T < 5 - 0 0 196 -3,-1.1 -3,-0.2 1,-0.2 -4,-0.1 0.841 42.5-174.2 53.2 38.6 14.0 33.1 29.5 427 69 D V < - 0 0 21 -5,-2.4 -1,-0.2 -6,-0.1 5,-0.1 -0.395 29.4-107.4 -65.3 134.5 16.9 33.0 31.9 428 70 D A > - 0 0 47 1,-0.1 3,-1.5 -2,-0.1 4,-0.3 -0.351 23.0-125.3 -59.4 144.7 17.5 29.7 33.7 429 71 D T G > S+ 0 0 56 1,-0.3 3,-0.7 2,-0.2 4,-0.4 0.692 108.9 67.6 -71.0 -19.5 16.5 29.9 37.4 430 72 D E G 3 S+ 0 0 65 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.684 100.1 51.6 -66.4 -24.0 19.9 28.6 38.4 431 73 D D G <> S+ 0 0 41 -3,-1.5 4,-1.9 1,-0.1 3,-0.3 0.469 79.8 93.2 -95.0 -7.3 21.3 32.0 37.1 432 74 D Y H <> S+ 0 0 11 -3,-0.7 4,-2.6 -4,-0.3 5,-0.3 0.886 83.4 55.1 -57.8 -43.5 18.9 34.3 39.1 433 75 D I H > S+ 0 0 5 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.892 107.3 51.4 -54.8 -44.6 21.5 34.7 41.9 434 76 D G H > S+ 0 0 0 -3,-0.3 4,-1.9 -4,-0.2 -2,-0.2 0.931 115.0 40.0 -56.3 -50.4 24.1 35.8 39.4 435 77 D Y H X S+ 0 0 8 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.816 117.2 48.7 -73.6 -30.4 21.9 38.5 37.8 436 78 D I H X S+ 0 0 1 -4,-2.6 4,-2.3 -5,-0.2 5,-0.2 0.877 111.1 50.7 -76.0 -38.1 20.4 39.7 41.1 437 79 D A H X S+ 0 0 5 -4,-2.2 4,-2.4 -5,-0.3 5,-0.2 0.908 112.8 47.1 -61.6 -43.2 23.9 39.8 42.6 438 80 D F H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.927 110.9 50.8 -62.9 -47.9 25.0 41.9 39.6 439 81 D A H X S+ 0 0 1 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.879 115.3 42.7 -60.5 -42.4 21.9 44.2 39.8 440 82 D E H X S+ 0 0 19 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.891 113.8 48.6 -73.1 -43.7 22.5 44.9 43.5 441 83 D E H X S+ 0 0 58 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.882 115.1 47.6 -63.2 -38.6 26.3 45.3 43.4 442 84 D L H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.945 110.8 49.7 -67.7 -49.6 25.8 47.7 40.5 443 85 D A H X S+ 0 0 13 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.904 110.1 52.9 -53.1 -43.2 23.1 49.6 42.3 444 86 D H H X S+ 0 0 56 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.909 111.4 44.7 -61.0 -42.0 25.4 49.9 45.3 445 87 D Q H X S+ 0 0 58 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.862 111.8 51.7 -72.2 -38.8 28.3 51.3 43.1 446 88 D V H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.856 107.7 53.9 -60.6 -38.4 25.9 53.7 41.3 447 89 D W H X S+ 0 0 40 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.956 110.3 47.1 -60.9 -48.5 24.7 54.9 44.8 448 90 D K H X>S+ 0 0 114 -4,-2.0 4,-2.3 1,-0.2 5,-0.8 0.861 110.2 52.1 -58.4 -42.6 28.4 55.6 45.7 449 91 D N H X5S+ 0 0 18 -4,-2.2 4,-0.7 1,-0.2 -1,-0.2 0.859 111.3 47.3 -63.1 -37.3 29.1 57.4 42.5 450 92 D K H <5S+ 0 0 100 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.874 116.5 43.5 -69.4 -39.3 26.1 59.7 43.1 451 93 D N H <5S+ 0 0 100 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.849 134.4 8.9 -75.8 -42.9 27.0 60.4 46.7 452 94 D S H <5S+ 0 0 89 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.1 0.700 97.0 100.0-116.6 -32.7 30.8 61.0 46.4 453 95 D S << - 0 0 32 -5,-0.8 4,-0.1 -4,-0.7 -4,-0.0 -0.442 54.8-153.4 -69.7 132.0 31.8 61.2 42.7 454 96 D P S S+ 0 0 139 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.592 101.9 32.1 -73.8 -11.1 32.2 64.7 41.3 455 97 D D S > S+ 0 0 80 -6,-0.1 4,-1.4 1,-0.1 3,-0.1 -0.735 74.2 174.0-146.3 81.4 31.3 63.1 37.9 456 98 D P H > S+ 0 0 34 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.842 73.8 58.5 -62.5 -37.2 28.9 60.3 38.7 457 99 D N H > S+ 0 0 99 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.875 105.8 47.2 -67.2 -39.4 28.1 59.4 35.0 458 100 D T H > S+ 0 0 88 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.919 113.6 50.0 -62.6 -43.5 31.8 58.7 34.1 459 101 D A H X S+ 0 0 20 -4,-1.4 4,-2.1 1,-0.2 -2,-0.2 0.767 105.7 56.9 -64.5 -30.4 32.0 56.5 37.3 460 102 D N H X S+ 0 0 2 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.890 106.8 48.1 -68.4 -40.5 28.8 54.7 36.4 461 103 D E H X S+ 0 0 87 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.791 110.9 51.3 -67.1 -34.4 30.3 53.6 33.0 462 104 D A H X S+ 0 0 61 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.893 111.0 47.9 -68.2 -42.0 33.5 52.5 34.8 463 105 D S H X S+ 0 0 11 -4,-2.1 4,-3.0 2,-0.2 5,-0.4 0.885 111.0 52.4 -61.9 -42.6 31.3 50.5 37.2 464 106 D K H X S+ 0 0 38 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.919 111.2 45.7 -58.1 -50.0 29.5 49.1 34.2 465 107 D T H X S+ 0 0 97 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.951 117.1 43.8 -61.2 -50.5 32.7 48.0 32.5 466 108 D D H X S+ 0 0 94 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.948 118.3 41.0 -61.1 -54.5 34.1 46.5 35.7 467 109 D L H X S+ 0 0 1 -4,-3.0 4,-2.9 1,-0.2 5,-0.2 0.839 112.2 56.2 -69.5 -34.2 31.1 44.6 36.9 468 110 D E H X S+ 0 0 18 -4,-2.2 4,-1.8 -5,-0.4 5,-0.3 0.865 108.8 46.4 -64.8 -35.0 30.1 43.5 33.4 469 111 D S H X S+ 0 0 57 -4,-1.8 4,-1.9 -5,-0.2 5,-0.5 0.845 113.7 50.6 -75.7 -32.1 33.5 41.8 32.9 470 112 D K H X>S+ 0 0 62 -4,-1.9 4,-2.2 -5,-0.2 5,-1.1 0.964 114.4 41.6 -60.9 -54.5 33.2 40.2 36.4 471 113 D Y H <5S+ 0 0 3 -4,-2.9 6,-2.5 3,-0.2 -2,-0.2 0.822 122.5 38.9 -74.7 -28.8 29.7 38.8 35.8 472 114 D S H X5S+ 0 0 24 -4,-1.8 4,-1.0 4,-0.2 -3,-0.2 0.934 125.3 34.8 -77.9 -50.6 30.4 37.6 32.3 473 115 D D H <5S+ 0 0 131 -4,-1.9 -3,-0.2 -5,-0.3 -2,-0.2 0.870 131.0 28.8 -76.4 -39.6 34.0 36.3 32.7 474 116 D V T <5S+ 0 0 85 -4,-2.2 -3,-0.2 -5,-0.5 -1,-0.1 0.880 134.4 29.4 -87.2 -41.8 33.8 35.0 36.2 475 117 D Y T 4 - 0 0 76 1,-0.1 4,-2.0 2,-0.0 3,-0.5 -0.648 22.3-153.0 -85.9 118.6 25.1 37.1 29.4 479 121 D V H > S+ 0 0 57 -2,-0.5 4,-2.2 1,-0.2 5,-0.2 0.828 94.6 56.9 -59.8 -33.5 26.4 40.6 28.5 480 122 D T H > S+ 0 0 92 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.886 109.2 46.0 -69.9 -34.7 23.2 41.6 26.6 481 123 D V H > S+ 0 0 2 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.865 111.2 52.1 -69.6 -39.1 21.1 40.8 29.7 482 124 D L H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.852 107.1 53.4 -68.2 -35.7 23.5 42.7 32.0 483 125 D D H X S+ 0 0 51 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.917 108.6 49.5 -57.7 -48.9 23.3 45.8 29.7 484 126 D A H X S+ 0 0 33 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.924 112.1 47.7 -59.5 -45.9 19.5 45.8 29.9 485 127 D I H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.925 110.7 52.2 -57.7 -47.9 19.8 45.5 33.8 486 128 D Y H X S+ 0 0 11 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.933 109.2 49.6 -53.6 -50.0 22.3 48.4 33.7 487 129 D N H < S+ 0 0 110 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.834 114.8 45.0 -58.4 -36.2 19.8 50.5 31.6 488 130 D A H X S+ 0 0 18 -4,-1.9 4,-0.8 -5,-0.2 -2,-0.2 0.892 113.8 47.8 -72.3 -44.9 17.1 49.7 34.2 489 131 D V H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 5,-0.3 0.850 98.8 65.3 -69.0 -40.7 19.1 50.3 37.4 490 132 D I H X S+ 0 0 30 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.926 102.9 45.6 -54.1 -53.9 20.7 53.7 36.6 491 133 D P H > S+ 0 0 84 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.844 111.1 55.4 -57.8 -37.1 17.5 55.8 36.5 492 134 D I H < S+ 0 0 27 -4,-0.8 -2,-0.2 2,-0.2 -3,-0.1 0.956 117.4 32.5 -59.4 -54.5 16.3 54.1 39.7 493 135 D I H < S+ 0 0 9 -4,-2.0 -1,-0.2 1,-0.2 -3,-0.1 0.890 119.5 52.0 -73.3 -39.4 19.3 55.0 41.8 494 136 D X H < 0 0 66 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.709 360.0 360.0 -75.5 -21.4 20.1 58.3 40.0 495 137 D G < 0 0 85 -4,-1.5 -3,-0.0 -5,-0.2 0, 0.0 -0.386 360.0 360.0-111.1 360.0 16.5 59.8 40.4