==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 31-AUG-05 2AW6 . COMPND 2 MOLECULE: PRGX; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR K.SHI,C.K.BROWN,Z.Y.GU,B.K.KOZLOWICZ,G.M.DUNNY, . 587 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25749.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 447 76.1 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 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 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 329 56.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.7 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 2 0 0 8 0 2 4 0 0 5 2 5 0 1 1 2 0 0 0 0 0 0 0 0 0 0 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 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 M 0 0 115 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 31.0 -30.1 50.0 -17.7 2 2 A F - 0 0 42 65,-0.0 2,-1.7 0, 0.0 3,-0.3 -0.961 360.0-123.9-130.7 142.0 -29.5 46.2 -17.3 3 3 A K > + 0 0 113 62,-0.6 4,-1.0 -2,-0.4 5,-0.0 -0.583 49.0 148.5 -84.2 79.3 -27.8 43.5 -19.3 4 4 A I H > S+ 0 0 5 -2,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.896 70.8 55.4 -74.5 -45.7 -30.8 41.1 -19.7 5 5 A G H > S+ 0 0 0 30,-0.3 4,-3.1 -3,-0.3 5,-0.2 0.915 104.5 53.7 -53.4 -46.4 -29.7 39.8 -23.1 6 6 A S H > S+ 0 0 39 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.897 110.2 47.6 -58.9 -39.5 -26.3 38.9 -21.7 7 7 A V H X S+ 0 0 3 -4,-1.0 4,-2.9 2,-0.2 -1,-0.2 0.884 110.8 50.9 -68.8 -39.4 -28.1 36.8 -19.0 8 8 A L H X S+ 0 0 0 -4,-2.7 4,-3.4 2,-0.2 -2,-0.2 0.950 113.0 46.4 -57.8 -49.1 -30.3 35.2 -21.6 9 9 A K H X S+ 0 0 89 -4,-3.1 4,-2.5 2,-0.2 5,-0.3 0.928 112.2 51.7 -55.5 -49.3 -27.2 34.4 -23.6 10 10 A Q H X S+ 0 0 97 -4,-2.7 4,-1.6 -5,-0.2 -2,-0.2 0.928 115.9 39.0 -53.3 -53.8 -25.5 33.1 -20.5 11 11 A I H X S+ 0 0 0 -4,-2.9 4,-1.6 2,-0.2 -2,-0.2 0.912 113.0 55.8 -65.9 -47.4 -28.4 30.8 -19.6 12 12 A R H <>S+ 0 0 26 -4,-3.4 5,-2.4 1,-0.2 3,-0.4 0.921 111.8 42.7 -51.4 -51.7 -29.1 29.7 -23.1 13 13 A Q H ><5S+ 0 0 99 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.835 110.2 57.1 -66.3 -35.1 -25.5 28.5 -23.6 14 14 A E H 3<5S+ 0 0 22 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.777 111.4 43.3 -66.9 -26.4 -25.5 26.9 -20.2 15 15 A L T 3<5S- 0 0 26 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.299 113.1-119.8-100.8 7.4 -28.5 24.8 -21.2 16 16 A N T < 5 + 0 0 119 -3,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.767 60.2 151.5 54.4 31.4 -27.0 24.0 -24.6 17 17 A Y < - 0 0 57 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.2 -0.687 42.5-126.3 -84.6 145.8 -30.0 25.7 -26.4 18 18 A H >> - 0 0 128 -2,-0.3 3,-0.9 1,-0.1 4,-0.7 -0.688 24.0-111.7 -89.7 145.0 -29.4 27.2 -29.9 19 19 A Q H >> S+ 0 0 41 -2,-0.3 4,-1.8 1,-0.2 3,-1.6 0.836 118.1 61.0 -39.9 -41.8 -30.4 30.8 -30.6 20 20 A I H 3> S+ 0 0 82 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.909 93.2 61.9 -57.3 -48.3 -33.1 29.5 -32.9 21 21 A D H <4 S+ 0 0 79 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.679 113.0 39.8 -46.7 -22.4 -34.8 27.6 -30.0 22 22 A L H << S+ 0 0 0 -3,-1.6 -2,-0.2 -4,-0.7 -1,-0.2 0.902 118.9 34.6 -98.7 -54.8 -35.3 31.1 -28.5 23 23 A Y H >X S+ 0 0 33 -4,-1.8 4,-2.9 3,-0.1 3,-2.1 0.769 84.8 112.3 -80.4 -27.0 -36.3 33.7 -31.1 24 24 A S T 3< S+ 0 0 51 -4,-2.0 4,-0.1 1,-0.3 -4,-0.0 -0.235 90.0 9.9 -57.7 125.0 -38.4 31.5 -33.4 25 25 A G T 34 S+ 0 0 81 2,-0.2 -1,-0.3 1,-0.0 3,-0.1 0.635 130.4 59.8 77.4 15.8 -42.1 32.5 -33.4 26 26 A I T <4 S- 0 0 33 -3,-2.1 2,-0.3 1,-0.5 -2,-0.2 0.514 113.0 -24.2-135.1 -48.1 -41.1 35.6 -31.4 27 27 A M S < S- 0 0 31 -4,-2.9 -1,-0.5 -5,-0.0 -2,-0.2 -0.935 71.9 -72.1-157.6 179.5 -38.7 37.7 -33.5 28 28 A S > - 0 0 56 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.393 40.3-118.2 -76.0 159.6 -36.0 37.7 -36.3 29 29 A K H > S+ 0 0 89 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.966 115.2 51.1 -58.6 -55.4 -32.6 36.2 -35.8 30 30 A S H > S+ 0 0 79 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.807 112.2 48.4 -57.1 -33.7 -30.8 39.5 -36.4 31 31 A V H > S+ 0 0 39 2,-0.2 4,-1.4 1,-0.2 3,-0.4 0.936 111.0 48.3 -70.7 -46.8 -33.1 41.1 -33.8 32 32 A Y H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.3 5,-0.2 0.857 106.8 57.4 -62.5 -35.3 -32.6 38.4 -31.2 33 33 A I H X S+ 0 0 72 -4,-2.8 4,-1.4 1,-0.2 -1,-0.3 0.859 105.8 51.8 -58.9 -36.4 -28.8 38.7 -31.8 34 34 A K H <>S+ 0 0 96 -4,-0.9 5,-2.8 -3,-0.4 6,-1.3 0.804 106.3 53.7 -71.5 -29.3 -29.3 42.4 -30.8 35 35 A V H ><5S+ 0 0 1 -4,-1.4 3,-1.4 2,-0.2 -30,-0.3 0.962 110.8 44.2 -68.9 -50.7 -31.1 41.4 -27.6 36 36 A E H 3<5S+ 0 0 11 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.783 112.2 54.1 -61.6 -28.4 -28.2 39.1 -26.5 37 37 A A T 3<5S- 0 0 69 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.632 110.4-131.2 -74.8 -13.9 -25.8 41.9 -27.5 38 38 A D T < 5S+ 0 0 59 -3,-1.4 -3,-0.2 -4,-0.4 -2,-0.1 0.881 77.0 115.3 57.3 43.5 -27.9 44.2 -25.3 39 39 A S < + 0 0 70 -5,-2.8 -4,-0.2 1,-0.2 -5,-0.1 0.686 69.3 52.0-104.9 -33.2 -28.2 46.8 -28.0 40 40 A R S S- 0 0 74 -6,-1.3 -1,-0.2 -9,-0.2 -2,-0.2 -0.927 90.9-123.6-103.4 125.9 -32.0 46.5 -28.4 41 41 A P - 0 0 70 0, 0.0 2,-0.3 0, 0.0 -6,-0.1 -0.415 26.5-127.8 -67.5 146.0 -34.1 46.8 -25.2 42 42 A I - 0 0 10 -7,-0.1 290,-2.5 -2,-0.1 291,-0.4 -0.710 13.1-125.1 -99.0 141.6 -36.4 43.8 -24.5 43 43 A S B > -A 331 0A 11 -2,-0.3 4,-2.7 288,-0.3 288,-0.3 -0.482 19.9-122.2 -79.0 156.0 -40.2 43.9 -23.8 44 44 A V H > S+ 0 0 2 286,-2.4 4,-2.7 2,-0.2 5,-0.2 0.940 116.8 53.0 -60.3 -47.0 -41.6 42.4 -20.6 45 45 A E H > S+ 0 0 69 285,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.924 110.7 47.3 -52.1 -49.2 -43.8 40.2 -22.9 46 46 A E H > S+ 0 0 25 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.935 111.6 48.7 -59.5 -51.4 -40.7 39.0 -24.8 47 47 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.871 109.5 53.7 -57.4 -40.3 -38.7 38.3 -21.6 48 48 A S H X S+ 0 0 14 -4,-2.7 4,-1.1 2,-0.2 -1,-0.2 0.896 109.5 48.3 -60.1 -42.3 -41.7 36.3 -20.2 49 49 A K H X S+ 0 0 65 -4,-2.0 4,-1.7 -5,-0.2 3,-0.2 0.888 111.5 49.0 -68.4 -40.0 -41.7 34.3 -23.4 50 50 A F H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 5,-0.2 0.871 104.9 59.4 -65.3 -38.5 -37.9 33.6 -23.2 51 51 A S H X>S+ 0 0 12 -4,-2.6 4,-1.9 1,-0.2 5,-0.7 0.824 106.7 48.2 -55.2 -36.5 -38.3 32.6 -19.6 52 52 A E H <5S+ 0 0 73 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.916 107.6 54.0 -72.5 -43.8 -40.7 29.9 -20.7 53 53 A R H <5S+ 0 0 85 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.863 116.8 37.5 -58.0 -39.1 -38.3 28.7 -23.5 54 54 A L H <5S- 0 0 0 -4,-2.0 341,-0.6 2,-0.2 -1,-0.2 0.847 99.8-130.6 -84.8 -36.9 -35.4 28.2 -21.1 55 55 A G T <5 + 0 0 2 -4,-1.9 2,-0.5 1,-0.3 -3,-0.2 0.623 65.6 126.6 91.7 14.9 -37.4 26.9 -18.1 56 56 A V S - 0 0 38 -2,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.015 25.4-132.7 -43.3 133.2 -37.9 31.6 -13.6 58 58 A F H > S+ 0 0 20 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.893 106.7 44.8 -55.6 -47.0 -38.8 35.1 -15.0 59 59 A F H > S+ 0 0 36 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.823 109.5 56.0 -71.6 -32.1 -37.9 36.9 -11.8 60 60 A E H > S+ 0 0 6 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.956 105.0 52.3 -62.7 -50.3 -34.7 35.0 -11.3 61 61 A I H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.901 109.7 51.1 -54.0 -39.9 -33.6 36.1 -14.8 62 62 A L H X>S+ 0 0 0 -4,-1.6 5,-1.6 2,-0.2 4,-0.9 0.934 108.8 49.5 -61.9 -47.6 -34.3 39.6 -13.6 63 63 A N H ><>S+ 0 0 14 -4,-2.5 3,-1.5 1,-0.2 5,-0.7 0.947 110.8 50.0 -53.8 -49.9 -32.3 39.3 -10.4 64 64 A R H 3<5S+ 0 0 32 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.832 106.1 57.1 -60.4 -31.4 -29.4 37.9 -12.4 65 65 A A H 3<5S- 0 0 2 -4,-1.6 -62,-0.6 -5,-0.3 -1,-0.3 0.671 132.5 -89.0 -73.2 -17.6 -29.7 40.8 -14.8 66 66 A G T <<5S+ 0 0 20 -3,-1.5 -3,-0.2 -4,-0.9 -2,-0.2 0.656 98.1 109.5 116.1 26.1 -29.3 43.2 -11.8 67 67 A M T < + 0 0 15 -5,-1.6 -4,-0.2 -8,-0.1 5,-0.1 0.620 63.2 79.7 -97.3 -16.1 -32.7 44.0 -10.2 68 68 A N S S+ 0 0 50 1,-0.1 3,-1.2 6,-0.1 6,-0.4 0.599 87.4 86.7-105.0 -19.4 -31.4 48.0 -4.5 71 71 A S T 3 + 0 0 67 1,-0.3 -1,-0.1 5,-0.2 -4,-0.0 0.342 59.7 102.3 -64.1 7.5 -28.7 50.3 -5.9 72 72 A V T 3 S+ 0 0 51 -3,-0.1 -1,-0.3 -5,-0.1 2,-0.3 0.803 90.0 12.5 -65.3 -31.5 -30.6 50.2 -9.2 73 73 A N S <> S- 0 0 39 -3,-1.2 4,-1.5 1,-0.1 3,-0.2 -0.864 88.3 -91.5-140.4 173.6 -32.0 53.7 -8.6 74 74 A E H > S+ 0 0 92 -2,-0.3 4,-2.0 1,-0.2 3,-0.3 0.917 117.0 57.2 -49.8 -54.0 -31.5 56.8 -6.3 75 75 A T H > S+ 0 0 9 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.855 104.7 49.7 -51.3 -49.6 -34.1 55.7 -3.8 76 76 A G H > S+ 0 0 7 -6,-0.4 4,-2.1 -3,-0.2 -5,-0.2 0.896 107.2 53.7 -59.0 -46.1 -32.5 52.3 -2.9 77 77 A K H >X S+ 0 0 113 -4,-1.5 4,-2.2 -7,-0.3 3,-0.5 0.958 110.4 49.1 -49.5 -53.0 -29.0 53.9 -2.4 78 78 A E H 3X S+ 0 0 25 -4,-2.0 4,-0.7 1,-0.3 -1,-0.2 0.807 109.1 52.1 -57.5 -37.2 -30.7 56.3 0.1 79 79 A K H 3< S+ 0 0 6 -4,-1.7 4,-0.4 1,-0.2 -1,-0.3 0.793 110.2 47.4 -72.7 -32.0 -32.4 53.4 1.8 80 80 A L H XX S+ 0 0 84 -4,-2.1 4,-0.9 -3,-0.5 3,-0.9 0.823 103.0 65.0 -73.8 -32.8 -29.1 51.5 2.3 81 81 A L H 3X S+ 0 0 52 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.765 85.9 73.4 -59.2 -29.3 -27.6 54.8 3.5 82 82 A I H 3X S+ 0 0 13 -4,-0.7 4,-2.8 1,-0.2 -1,-0.2 0.898 94.8 50.3 -51.6 -47.6 -30.0 54.6 6.5 83 83 A S H <> S+ 0 0 80 -3,-0.9 4,-2.2 -4,-0.4 5,-0.3 0.938 108.7 51.3 -59.1 -50.6 -27.9 51.7 8.1 84 84 A K H X S+ 0 0 132 -4,-0.9 4,-2.6 1,-0.2 -1,-0.2 0.930 115.0 43.1 -49.2 -52.6 -24.6 53.7 7.7 85 85 A I H < S+ 0 0 0 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.850 107.9 58.7 -66.5 -38.9 -26.2 56.7 9.4 86 86 A F H < S+ 0 0 95 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.936 116.9 33.6 -56.6 -47.1 -27.9 54.7 12.1 87 87 A T H < S+ 0 0 88 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.840 127.8 39.9 -77.7 -34.4 -24.5 53.3 13.2 88 88 A N >< + 0 0 77 -4,-2.6 3,-1.8 -5,-0.3 -1,-0.2 -0.631 68.5 172.3-118.4 74.7 -22.5 56.5 12.4 89 89 A P G > + 0 0 35 0, 0.0 3,-3.4 0, 0.0 4,-0.3 0.687 65.6 78.3 -59.3 -29.5 -24.8 59.4 13.5 90 90 A D G 3 S+ 0 0 152 1,-0.3 4,-0.3 2,-0.1 3,-0.1 0.693 90.1 60.4 -54.4 -18.9 -22.2 62.2 13.0 91 91 A L G <> S+ 0 0 77 -3,-1.8 4,-1.2 -6,-0.2 -1,-0.3 0.406 83.0 91.2 -87.7 -0.8 -23.2 61.8 9.3 92 92 A F H X> S+ 0 0 2 -3,-3.4 4,-2.6 -7,-0.2 3,-0.7 0.983 77.9 50.3 -57.2 -68.0 -26.8 62.7 10.1 93 93 A D H 3> S+ 0 0 96 -4,-0.3 4,-1.7 1,-0.3 -1,-0.2 0.831 109.5 50.2 -45.9 -51.5 -27.0 66.5 9.6 94 94 A K H 34 S+ 0 0 161 -4,-0.3 4,-0.4 1,-0.2 -1,-0.3 0.893 118.9 37.8 -56.4 -44.8 -25.3 66.6 6.2 95 95 A N H XX S+ 0 0 29 -4,-1.2 4,-2.1 -3,-0.7 3,-2.1 0.945 109.8 57.0 -74.9 -52.6 -27.7 63.9 4.8 96 96 A F H 3X S+ 0 0 19 -4,-2.6 4,-2.8 1,-0.3 -1,-0.2 0.796 102.0 60.8 -48.1 -34.3 -30.9 64.8 6.5 97 97 A Q H 3< S+ 0 0 135 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.778 109.3 41.1 -65.2 -29.2 -30.5 68.3 4.8 98 98 A R H <4 S+ 0 0 96 -3,-2.1 4,-0.4 -4,-0.4 -2,-0.2 0.829 120.9 42.1 -86.6 -36.9 -30.6 66.6 1.4 99 99 A I H >X S+ 0 0 1 -4,-2.1 3,-1.9 2,-0.1 4,-0.7 0.934 99.6 69.3 -74.5 -52.2 -33.4 64.2 2.2 100 100 A E G >< S+ 0 0 41 -4,-2.8 3,-1.1 1,-0.3 4,-0.2 0.804 100.5 45.7 -42.6 -53.4 -35.8 66.4 4.2 101 101 A P G 34 S+ 0 0 80 0, 0.0 3,-0.4 0, 0.0 -1,-0.3 0.741 111.9 52.5 -65.3 -22.2 -37.0 68.6 1.3 102 102 A K G X> S+ 0 0 88 -3,-1.9 3,-2.4 -4,-0.4 4,-0.5 0.518 78.1 106.2 -88.8 -5.1 -37.5 65.6 -1.1 103 103 A R T << S+ 0 0 29 -3,-1.1 -1,-0.2 -4,-0.7 7,-0.2 0.673 80.0 43.9 -53.2 -27.8 -39.7 63.8 1.4 104 104 A L T 34 S+ 0 0 58 -3,-0.4 -1,-0.3 -4,-0.2 3,-0.1 0.186 90.8 87.8-105.8 17.3 -43.0 64.4 -0.4 105 105 A T T <4 S+ 0 0 83 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.962 102.7 0.6 -78.4 -57.5 -41.8 63.6 -3.9 106 106 A S S >X S- 0 0 13 -4,-0.5 4,-1.9 1,-0.1 3,-0.7 -0.942 70.9-115.7-128.2 153.5 -42.3 59.9 -4.0 107 107 A L H 3> S+ 0 0 8 235,-0.6 4,-1.5 -2,-0.3 236,-0.1 0.781 118.6 63.1 -53.6 -27.2 -43.8 57.5 -1.3 108 108 A Q H 3> S+ 0 0 20 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.887 101.3 45.9 -66.1 -45.5 -40.3 56.1 -1.5 109 109 A Y H <> S+ 0 0 15 -3,-0.7 4,-2.8 1,-0.2 -2,-0.2 0.898 109.0 57.2 -65.0 -39.6 -38.6 59.3 -0.3 110 110 A F H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.855 103.3 52.6 -60.4 -38.8 -41.2 59.7 2.5 111 111 A S H X S+ 0 0 0 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.933 110.9 47.9 -60.0 -45.3 -40.3 56.2 3.9 112 112 A I H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.916 108.0 55.8 -60.8 -46.1 -36.6 57.3 4.0 113 113 A Y H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.938 106.2 49.1 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-4,-0.8 4,-0.6 -3,-0.4 -1,-0.2 0.798 110.8 47.3 -81.8 -31.6 -52.1 36.5 29.6 246 246 A L H < S+ 0 0 38 -4,-1.9 -2,-0.2 2,-0.1 -3,-0.1 0.815 120.3 37.0 -78.3 -30.4 -53.3 40.0 30.0 247 247 A T H < S+ 0 0 54 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.905 130.2 26.3 -90.8 -44.5 -56.9 39.2 29.3 248 248 A D H < S- 0 0 115 -4,-1.6 -3,-0.2 -5,-0.2 -2,-0.1 0.388 88.4-143.6-101.6 0.2 -57.4 35.8 30.9 249 249 A K < + 0 0 172 -4,-0.6 2,-0.4 1,-0.2 -4,-0.2 0.575 47.7 147.3 46.6 16.2 -54.7 36.2 33.5 250 250 A N >> - 0 0 67 -6,-0.6 3,-0.8 1,-0.1 4,-0.7 -0.682 47.1-142.1 -85.1 133.4 -53.8 32.5 33.2 251 251 A I H 3> S+ 0 0 101 -2,-0.4 4,-1.9 1,-0.2 5,-0.1 0.693 88.8 74.8 -73.4 -23.6 -50.1 31.9 33.7 252 252 A D H 3> S+ 0 0 103 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.888 94.0 53.7 -55.2 -43.7 -49.7 29.2 31.0 253 253 A S H <> S+ 0 0 2 -3,-0.8 4,-2.7 2,-0.2 -1,-0.2 0.897 104.3 54.8 -63.2 -40.6 -49.8 31.8 28.3 254 254 A Y H X S+ 0 0 66 -4,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.957 108.5 49.1 -53.6 -52.2 -47.0 33.8 29.9 255 255 A L H X S+ 0 0 85 -4,-1.9 4,-3.3 2,-0.2 -2,-0.2 0.883 109.0 52.2 -55.4 -44.2 -44.8 30.7 29.9 256 256 A N H X S+ 0 0 47 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.962 107.4 52.8 -55.3 -51.8 -45.6 30.0 26.2 257 257 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.890 112.5 45.2 -50.0 -44.5 -44.6 33.6 25.4 258 258 A V H X S+ 0 0 34 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.957 110.6 52.6 -65.3 -50.0 -41.3 33.0 27.2 259 259 A N H X S+ 0 0 50 -4,-3.3 4,-1.3 1,-0.2 -2,-0.2 0.812 109.5 50.5 -57.7 -33.9 -40.8 29.6 25.5 260 260 A I H X S+ 0 0 0 -4,-2.7 4,-0.9 2,-0.2 3,-0.3 0.945 110.3 48.6 -65.0 -51.4 -41.3 31.3 22.1 261 261 A I H >X S+ 0 0 4 -4,-2.0 3,-1.2 1,-0.2 4,-0.8 0.924 108.4 54.5 -56.6 -49.2 -38.8 34.0 22.9 262 262 A N H >X S+ 0 0 53 -4,-2.8 4,-2.2 1,-0.3 3,-1.1 0.870 96.4 65.5 -50.0 -42.1 -36.2 31.5 24.0 263 263 A I H 3X S+ 0 0 0 -4,-1.3 4,-1.2 1,-0.3 -1,-0.3 0.836 93.6 61.9 -57.2 -31.7 -36.6 29.6 20.7 264 264 A F H <<>S+ 0 0 2 -3,-1.2 5,-2.3 -4,-0.9 3,-0.3 0.896 106.7 44.2 -56.6 -44.9 -35.0 32.7 19.1 265 265 A K H X<5S+ 0 0 110 -3,-1.1 3,-2.6 -4,-0.8 -2,-0.2 0.951 108.8 56.6 -61.2 -51.8 -31.9 32.2 21.2 266 266 A I H 3<5S+ 0 0 47 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.702 110.1 46.1 -56.5 -22.9 -31.9 28.4 20.4 267 267 A I T 3<5S- 0 0 3 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.153 120.4-106.2-109.3 17.3 -31.8 29.2 16.7 268 268 A G T < 5S+ 0 0 53 -3,-2.6 2,-2.0 1,-0.2 3,-0.2 0.537 75.1 136.2 79.1 10.3 -29.1 31.9 16.9 269 269 A K >< + 0 0 52 -5,-2.3 4,-2.5 1,-0.2 3,-0.2 -0.442 29.7 166.1 -83.9 65.2 -31.1 35.1 16.5 270 270 A E H > + 0 0 85 -2,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.872 65.2 40.5 -54.2 -56.7 -29.0 36.5 19.3 271 271 A D H > S+ 0 0 94 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.817 114.6 52.7 -67.6 -32.2 -29.8 40.2 19.1 272 272 A I H > S+ 0 0 57 2,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.900 108.5 51.9 -68.7 -39.0 -33.5 39.7 18.3 273 273 A H H X S+ 0 0 19 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.903 110.0 48.8 -60.3 -45.0 -33.7 37.5 21.4 274 274 A R H X S+ 0 0 149 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.956 110.2 50.8 -57.3 -54.0 -32.1 40.2 23.5 275 275 A S H X S+ 0 0 55 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.820 112.3 48.0 -52.9 -36.2 -34.5 42.9 22.1 276 276 A L H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.896 107.3 53.8 -74.7 -41.3 -37.4 40.6 23.0 277 277 A V H X S+ 0 0 66 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.897 110.7 47.8 -61.6 -40.6 -36.3 39.9 26.5 278 278 A E H X S+ 0 0 124 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.922 112.2 50.0 -61.9 -46.0 -36.1 43.6 27.2 279 279 A E H X S+ 0 0 12 -4,-1.6 4,-3.0 -5,-0.2 -2,-0.2 0.850 108.5 51.6 -65.4 -36.7 -39.5 44.1 25.6 280 280 A L H X S+ 0 0 10 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.966 111.1 46.7 -66.0 -49.8 -41.1 41.4 27.8 281 281 A T H < S+ 0 0 100 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.941 113.8 50.9 -54.1 -45.8 -39.7 42.9 31.0 282 282 A K H >X S+ 0 0 95 -4,-2.7 4,-0.8 1,-0.2 3,-0.6 0.928 105.3 54.7 -55.8 -50.5 -40.9 46.2 29.7 283 283 A I H 3< S+ 0 0 5 -4,-3.0 2,-2.1 1,-0.3 -1,-0.2 0.901 95.9 67.7 -48.3 -47.3 -44.5 44.9 29.0 284 284 A S T 3< S+ 0 0 73 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.1 -0.085 119.4 16.4 -72.5 41.4 -44.7 43.6 32.7 285 285 A A T <4 S- 0 0 80 -2,-2.1 2,-0.3 -3,-0.6 -2,-0.2 -0.240 113.8 -57.7-165.5 -92.1 -44.8 47.3 33.8 286 286 A K < 0 0 162 -4,-0.8 -82,-0.1 1,-0.1 -83,-0.1 -0.960 360.0 360.0-158.2 172.1 -45.6 50.0 31.3 287 287 A E 0 0 104 -84,-0.3 -83,-0.1 -2,-0.3 -84,-0.1 0.064 360.0 360.0-169.0 360.0 -44.8 52.0 28.0 288 !* 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 0.0 289 1 B M 0 0 119 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 37.7 -49.9 39.1 -22.4 290 2 B F - 0 0 39 65,-0.0 2,-1.9 0, 0.0 3,-0.3 -0.970 360.0-124.6-129.3 140.7 -50.4 41.3 -19.3 291 3 B K > + 0 0 135 62,-0.5 4,-1.2 -2,-0.4 5,-0.1 -0.542 49.7 148.8 -85.3 77.1 -52.1 44.6 -18.9 292 4 B I H > + 0 0 5 -2,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.889 69.4 56.7 -76.7 -40.7 -49.1 46.5 -17.4 293 5 B G H > S+ 0 0 0 30,-0.3 4,-3.3 -3,-0.3 5,-0.2 0.910 103.9 53.3 -54.8 -47.4 -50.2 49.8 -18.9 294 6 B S H > S+ 0 0 43 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.907 110.1 48.1 -54.4 -45.0 -53.6 49.6 -17.2 295 7 B V H X S+ 0 0 6 -4,-1.2 4,-2.9 2,-0.2 5,-0.2 0.869 110.8 50.4 -64.6 -38.9 -51.8 49.1 -13.8 296 8 B L H X S+ 0 0 0 -4,-2.3 4,-3.3 2,-0.2 -2,-0.2 0.959 113.4 46.3 -61.0 -49.7 -49.5 52.0 -14.5 297 9 B K H X S+ 0 0 90 -4,-3.3 4,-2.5 1,-0.2 5,-0.2 0.910 112.5 51.1 -54.9 -47.3 -52.6 54.1 -15.3 298 10 B Q H X S+ 0 0 83 -4,-3.0 4,-1.5 1,-0.2 -2,-0.2 0.917 115.5 40.3 -59.4 -47.8 -54.3 52.7 -12.2 299 11 B I H X S+ 0 0 0 -4,-2.9 4,-1.6 2,-0.2 -2,-0.2 0.914 112.9 55.7 -68.6 -43.6 -51.4 53.6 -9.9 300 12 B R H ><>S+ 0 0 22 -4,-3.3 5,-2.3 1,-0.2 3,-0.6 0.939 111.8 42.2 -52.1 -54.8 -50.8 57.0 -11.7 301 13 B Q H ><5S+ 0 0 100 -4,-2.5 3,-0.8 1,-0.2 -1,-0.2 0.801 110.5 57.2 -64.9 -33.7 -54.3 58.1 -11.1 302 14 B E H 3<5S+ 0 0 19 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.769 112.0 42.1 -68.9 -26.0 -54.3 56.8 -7.5 303 15 B L T <<5S- 0 0 20 -4,-1.6 -1,-0.2 -3,-0.6 -2,-0.2 0.315 112.3-120.7-101.2 6.2 -51.3 59.0 -6.8 304 16 B N T < 5 + 0 0 117 -3,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.789 59.7 151.3 53.7 34.4 -52.7 62.0 -8.7 305 17 B Y < - 0 0 50 -5,-2.3 2,-0.3 -6,-0.2 -1,-0.2 -0.695 42.2-126.6 -86.8 146.7 -49.8 62.1 -11.1 306 18 B H >> - 0 0 124 -2,-0.3 3,-1.3 1,-0.1 4,-0.7 -0.721 24.4-109.4 -95.2 146.2 -50.4 63.5 -14.6 307 19 B Q H >> S+ 0 0 42 -2,-0.3 3,-2.0 1,-0.3 4,-1.8 0.845 119.0 62.2 -36.9 -46.2 -49.4 61.6 -17.7 308 20 B I H 3> S+ 0 0 92 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.884 93.7 60.7 -45.3 -53.4 -46.7 64.2 -18.2 309 21 B D H <4 S+ 0 0 75 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.689 113.1 39.1 -49.9 -24.3 -44.9 63.2 -15.0 310 22 B L H << S+ 0 0 0 -3,-2.0 -2,-0.2 -4,-0.7 -1,-0.2 0.908 118.7 35.9 -96.9 -54.4 -44.5 59.7 -16.4 311 23 B Y H >X S+ 0 0 34 -4,-1.8 4,-2.9 3,-0.1 3,-1.7 0.749 84.3 112.7 -80.0 -25.0 -43.6 59.9 -20.1 312 24 B S T 3< S+ 0 0 51 -4,-2.0 4,-0.1 -5,-0.3 -4,-0.0 -0.244 89.9 9.0 -57.0 126.7 -41.4 63.1 -20.1 313 25 B G T 34 S+ 0 0 82 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.690 130.9 59.9 73.4 21.0 -37.7 62.3 -20.9 314 26 B I T <4 S- 0 0 43 -3,-1.7 2,-0.3 1,-0.5 -2,-0.2 0.478 112.7 -20.5-139.6 -51.1 -38.7 58.7 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