==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-MAR-01 1IA7 . COMPND 2 MOLECULE: CELLULASE CEL9M; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM CELLULOLYTICUM; . AUTHOR G.PARSIEGLA,A.BELAICH,J.P.BELAICH,R.HASER . 431 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15563.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 301 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 28 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 173 40.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 0 1 0 0 1 1 0 1 0 0 2 2 2 2 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 5 2 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 ANTIPARALLEL 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 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 A 0 0 79 0, 0.0 342,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 144.3 -9.9 40.0 56.9 2 2 A G + 0 0 80 1,-0.1 2,-0.3 2,-0.0 0, 0.0 0.892 360.0 31.3 -62.9 -40.1 -9.6 41.8 60.2 3 3 A T - 0 0 125 2,-0.0 2,-0.4 0, 0.0 -1,-0.1 -0.913 70.0-163.8-121.2 148.4 -8.3 38.6 61.9 4 4 A H - 0 0 35 -2,-0.3 2,-1.5 -3,-0.0 3,-0.2 -0.989 23.3-130.9-132.7 140.0 -6.1 35.8 60.4 5 5 A D > + 0 0 77 -2,-0.4 4,-1.5 1,-0.2 5,-0.1 -0.621 37.8 161.9 -88.6 78.4 -5.4 32.3 61.8 6 6 A Y H > + 0 0 9 -2,-1.5 4,-2.4 425,-0.2 -1,-0.2 0.822 69.3 63.9 -66.3 -30.6 -1.6 32.4 61.5 7 7 A S H > S+ 0 0 48 -3,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.929 105.1 42.1 -58.8 -50.4 -1.4 29.5 63.9 8 8 A T H > S+ 0 0 52 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.872 112.3 54.6 -66.9 -38.1 -3.2 27.0 61.6 9 9 A A H X S+ 0 0 0 -4,-1.5 4,-2.9 2,-0.2 -1,-0.2 0.915 107.9 50.5 -61.8 -42.2 -1.4 28.3 58.5 10 10 A L H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 5,-0.2 0.949 109.3 50.7 -60.4 -48.2 1.9 27.6 60.3 11 11 A K H X S+ 0 0 107 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.931 114.0 44.6 -54.5 -48.7 0.8 24.1 61.2 12 12 A D H X S+ 0 0 16 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.898 107.8 56.8 -64.2 -43.6 -0.2 23.4 57.6 13 13 A S H < S+ 0 0 0 -4,-2.9 4,-0.4 1,-0.2 -1,-0.2 0.835 111.8 43.8 -58.8 -33.0 2.9 24.9 56.1 14 14 A I H >< S+ 0 0 0 -4,-1.8 3,-1.2 -3,-0.2 4,-0.3 0.902 109.0 56.8 -77.9 -41.9 5.0 22.5 58.1 15 15 A I H >< S+ 0 0 21 -4,-2.2 3,-2.0 1,-0.2 4,-0.5 0.827 90.2 75.6 -57.4 -34.2 2.7 19.5 57.4 16 16 A F G >< S+ 0 0 0 -4,-2.0 3,-1.9 1,-0.3 4,-0.4 0.838 81.6 68.1 -47.6 -40.0 3.3 20.0 53.6 17 17 A F G X> S+ 0 0 0 -3,-1.2 3,-1.5 -4,-0.4 4,-0.5 0.798 85.5 69.3 -55.6 -28.5 6.7 18.5 53.8 18 18 A D G X4 S+ 0 0 0 -3,-2.0 3,-0.9 -4,-0.3 -1,-0.3 0.843 90.5 63.6 -57.9 -33.2 5.2 15.1 54.6 19 19 A A G <4 S+ 0 0 0 -3,-1.9 -1,-0.3 -4,-0.5 -2,-0.2 0.743 107.6 40.2 -65.1 -23.5 3.9 15.0 51.0 20 20 A N G <4 S+ 0 0 0 -3,-1.5 35,-3.0 -4,-0.4 -1,-0.2 0.375 79.6 132.9-108.0 3.8 7.5 15.0 49.6 21 21 A K B << -A 54 0A 7 -3,-0.9 2,-0.3 -4,-0.5 33,-0.2 -0.281 39.3-159.0 -57.7 139.0 9.3 12.7 51.9 22 22 A C + 0 0 0 31,-2.3 3,-0.2 15,-0.1 17,-0.1 -0.892 39.9 41.9-122.0 150.3 11.3 10.1 50.1 23 23 A G B > S-B 38 0B 0 15,-0.9 3,-1.6 -2,-0.3 15,-1.0 -0.403 97.4 -53.1 110.3 174.3 12.7 6.7 51.2 24 24 A P T 3 S+ 0 0 70 0, 0.0 3,-0.3 0, 0.0 13,-0.2 0.703 133.8 47.1 -63.5 -20.2 11.6 3.6 53.1 25 25 A Q T > S+ 0 0 100 -3,-0.2 3,-1.7 1,-0.2 -2,-0.1 0.297 76.6 110.5-104.3 9.0 10.5 5.7 56.1 26 26 A A T < S+ 0 0 0 -3,-1.6 -5,-0.2 1,-0.3 -1,-0.2 0.833 80.2 47.6 -52.0 -36.7 8.6 8.2 54.1 27 27 A G T > S+ 0 0 35 -3,-0.3 3,-1.5 -4,-0.2 2,-0.3 0.558 83.0 114.4 -84.5 -7.7 5.3 7.0 55.5 28 28 A E T < S- 0 0 112 -3,-1.7 3,-0.1 1,-0.3 -3,-0.1 -0.483 98.4 -11.6 -68.5 123.1 6.4 6.9 59.1 29 29 A N T 3 S+ 0 0 111 -2,-0.3 2,-0.4 1,-0.2 -1,-0.3 0.866 98.3 154.7 53.5 38.5 4.5 9.5 61.2 30 30 A N < - 0 0 24 -3,-1.5 -1,-0.2 1,-0.1 5,-0.1 -0.836 42.8-150.6 -99.2 132.0 3.2 10.9 57.9 31 31 A V S S+ 0 0 76 -2,-0.4 2,-0.7 -16,-0.2 -1,-0.1 0.671 79.8 79.8 -75.0 -16.8 -0.2 12.8 58.1 32 32 A F > - 0 0 13 1,-0.1 3,-1.5 354,-0.0 -2,-0.1 -0.826 62.6-163.6 -95.6 114.8 -1.0 11.8 54.5 33 33 A D T 3 S+ 0 0 152 -2,-0.7 -1,-0.1 1,-0.3 -2,-0.0 0.680 87.1 67.8 -69.5 -14.7 -2.3 8.3 54.2 34 34 A W T 3 S+ 0 0 43 -3,-0.0 2,-0.4 2,-0.0 -1,-0.3 0.364 85.5 84.9 -86.2 5.7 -1.6 8.4 50.5 35 35 A R < + 0 0 12 -3,-1.5 2,-0.2 -8,-0.1 -5,-0.1 -0.903 52.3 154.8-110.5 138.0 2.2 8.5 50.9 36 36 A G - 0 0 22 -2,-0.4 -13,-0.1 -15,-0.1 -11,-0.1 -0.801 48.4 -42.2-144.3-174.4 4.3 5.4 51.4 37 37 A A + 0 0 52 -2,-0.2 2,-0.3 -13,-0.2 -1,-0.1 -0.233 62.2 170.3 -56.3 140.4 7.8 4.1 50.9 38 38 A C B +B 23 0B 3 -15,-1.0 -15,-0.9 1,-0.1 95,-0.2 -0.987 49.8 12.3-152.8 158.3 9.6 5.1 47.7 39 39 A H > + 0 0 16 93,-0.6 3,-1.3 -2,-0.3 13,-0.2 0.864 68.7 170.3 39.2 51.5 12.9 5.1 45.8 40 40 A T T 3 + 0 0 74 1,-0.2 -1,-0.2 -17,-0.2 11,-0.1 0.424 65.6 51.3 -73.2 -1.0 14.2 2.7 48.5 41 41 A T T > S+ 0 0 76 96,-0.2 3,-2.3 9,-0.1 4,-0.3 0.160 72.1 151.1-121.6 18.8 17.4 1.8 46.8 42 42 A D T < + 0 0 3 -3,-1.3 8,-2.3 1,-0.3 9,-0.3 -0.231 69.9 22.0 -51.4 131.6 18.7 5.3 46.1 43 43 A G T >>>S+ 0 0 0 96,-0.5 3,-2.1 6,-0.2 5,-1.9 0.235 83.4 117.4 93.9 -14.3 22.5 5.3 46.0 44 44 A S T <45 + 0 0 65 -3,-2.3 3,-0.5 1,-0.3 -2,-0.1 0.797 67.2 67.2 -57.1 -29.1 22.9 1.6 45.3 45 45 A D T 345S+ 0 0 74 94,-0.4 -1,-0.3 -4,-0.3 -3,-0.1 0.747 113.2 31.1 -64.8 -21.9 24.6 2.5 42.0 46 46 A V T <45S- 0 0 56 -3,-2.1 -1,-0.2 2,-0.3 -2,-0.2 0.369 114.9-110.0-116.1 2.4 27.5 3.9 44.0 47 47 A G T <5S+ 0 0 67 -4,-0.7 2,-0.4 -3,-0.5 -3,-0.2 0.796 81.2 113.2 75.4 29.1 27.3 1.6 47.0 48 48 A V S -C 118 0C 2 -2,-0.8 4,-1.9 55,-0.2 55,-0.2 -0.769 13.0-143.4 -88.1 122.3 18.4 18.4 43.9 64 64 A G H > S+ 0 0 8 53,-1.1 4,-2.5 -2,-0.5 5,-0.2 0.830 89.9 49.8 -52.9 -48.8 21.2 19.4 46.2 65 65 A L H > S+ 0 0 6 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.963 116.9 38.7 -62.6 -54.0 21.0 23.2 46.2 66 66 A P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.845 114.6 56.5 -67.3 -27.6 17.3 23.6 46.9 67 67 A Q H X S+ 0 0 2 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.946 112.5 40.8 -66.0 -46.3 17.4 20.7 49.3 68 68 A G H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 5,-0.2 0.933 113.8 52.4 -66.7 -46.5 20.1 22.4 51.4 69 69 A Y H X S+ 0 0 2 -4,-2.6 4,-2.6 -5,-0.2 5,-0.2 0.920 109.3 50.3 -55.1 -47.0 18.5 25.8 51.2 70 70 A S H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.893 110.3 48.3 -61.3 -42.9 15.2 24.5 52.3 71 71 A A H X S+ 0 0 2 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.872 112.7 50.0 -66.0 -36.6 16.6 22.8 55.4 72 72 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.916 111.4 46.5 -68.3 -44.4 18.6 25.9 56.3 73 73 A I H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.870 113.1 49.4 -67.7 -36.7 15.6 28.2 56.1 74 74 A L H X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.918 112.2 49.0 -67.1 -41.5 13.4 25.9 58.1 75 75 A G H X S+ 0 0 1 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.898 109.8 51.6 -63.1 -38.8 16.2 25.6 60.7 76 76 A W H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.886 105.6 56.6 -64.4 -39.9 16.5 29.4 60.7 77 77 A S H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.932 110.1 42.8 -57.3 -50.6 12.7 29.7 61.3 78 78 A L H < S+ 0 0 3 -4,-1.8 4,-0.3 1,-0.2 -1,-0.2 0.863 113.6 53.3 -66.0 -36.2 12.8 27.6 64.4 79 79 A Y H < S+ 0 0 85 -4,-1.9 3,-0.4 -5,-0.2 -2,-0.2 0.905 116.9 35.1 -66.2 -44.2 15.9 29.3 65.7 80 80 A E H < S+ 0 0 22 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.798 130.7 29.1 -82.5 -32.1 14.6 32.8 65.5 81 81 A F S >X S+ 0 0 3 -4,-2.2 3,-1.3 -5,-0.3 4,-1.0 -0.186 70.4 142.7-124.5 42.5 10.9 32.3 66.4 82 82 A K H >> S+ 0 0 107 -3,-0.4 4,-2.5 -4,-0.3 3,-0.6 0.852 71.2 57.9 -48.9 -44.6 11.0 29.2 68.7 83 83 A E H 3> S+ 0 0 153 1,-0.3 4,-2.6 2,-0.2 -1,-0.3 0.827 98.9 60.0 -59.3 -33.2 8.3 30.5 70.9 84 84 A S H <> S+ 0 0 6 -3,-1.3 4,-0.8 1,-0.2 -1,-0.3 0.883 110.1 42.2 -63.3 -37.2 5.9 30.7 67.9 85 85 A F H <<>S+ 0 0 0 -4,-1.0 5,-2.6 -3,-0.6 6,-1.0 0.901 114.9 49.8 -75.8 -42.5 6.4 26.9 67.4 86 86 A D H ><5S+ 0 0 79 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.961 110.8 47.5 -60.1 -54.7 6.2 26.1 71.1 87 87 A A H 3<5S+ 0 0 88 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.739 115.0 46.1 -61.3 -25.9 3.0 28.0 71.9 88 88 A T T 3<5S- 0 0 35 -4,-0.8 -1,-0.3 -5,-0.3 -2,-0.2 0.395 111.5-117.2 -98.8 2.8 1.2 26.6 68.8 89 89 A G T < 5S+ 0 0 65 -3,-1.5 4,-0.2 -4,-0.4 -3,-0.2 0.839 83.0 113.8 67.1 35.4 2.2 23.0 69.5 90 90 A N >< + 0 0 9 -5,-2.6 4,-2.7 -6,-0.1 5,-0.2 0.433 41.5 93.6-114.2 -3.5 4.2 22.6 66.3 91 91 A T H > S+ 0 0 18 -6,-1.0 4,-2.8 1,-0.2 5,-0.2 0.912 85.3 51.8 -57.9 -44.7 7.8 22.3 67.6 92 92 A T H > S+ 0 0 100 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.959 113.9 41.7 -57.3 -55.4 7.6 18.5 67.7 93 93 A K H > S+ 0 0 35 -4,-0.2 4,-2.5 2,-0.2 3,-0.3 0.937 114.1 52.9 -58.5 -48.7 6.5 18.1 64.1 94 94 A M H X S+ 0 0 1 -4,-2.7 4,-2.5 1,-0.3 -1,-0.2 0.938 108.3 49.9 -52.5 -50.7 8.9 20.9 62.9 95 95 A L H X S+ 0 0 18 -4,-2.8 4,-2.3 1,-0.2 -1,-0.3 0.833 109.7 53.1 -58.9 -32.4 11.9 19.1 64.5 96 96 A Q H X S+ 0 0 75 -4,-1.7 4,-1.8 -3,-0.3 -1,-0.2 0.918 108.1 48.3 -70.6 -41.4 10.8 15.9 62.8 97 97 A Q H X S+ 0 0 0 -4,-2.5 4,-1.1 1,-0.2 -2,-0.2 0.922 113.4 49.4 -63.5 -41.4 10.7 17.6 59.4 98 98 A L H >X S+ 0 0 5 -4,-2.5 4,-2.6 1,-0.2 3,-0.6 0.924 109.0 50.2 -63.0 -46.7 14.2 19.0 60.1 99 99 A K H 3X S+ 0 0 51 -4,-2.3 4,-3.1 1,-0.3 5,-0.3 0.847 103.2 60.0 -64.0 -31.5 15.7 15.7 61.2 100 100 A Y H 3X S+ 0 0 28 -4,-1.8 -47,-0.9 2,-0.2 4,-0.9 0.855 110.1 44.9 -63.6 -31.8 14.4 14.0 58.1 101 101 A F H < S+ 0 0 43 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.915 109.8 49.5 -64.6 -42.1 24.6 12.7 57.1 107 107 A K H 3< S+ 0 0 61 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.800 107.2 56.3 -66.3 -27.6 24.1 9.6 55.0 108 108 A S T 3< S+ 0 0 0 -4,-1.6 8,-2.0 1,-0.2 -1,-0.3 0.455 97.5 67.9 -83.3 -0.6 25.3 11.5 51.9 109 109 A H < + 0 0 20 -3,-1.4 -1,-0.2 -4,-0.2 6,-0.1 -0.602 57.2 161.5-119.1 67.7 28.5 12.3 53.8 110 110 A P S S+ 0 0 69 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.749 70.3 11.9 -59.6 -29.2 30.2 8.9 54.0 111 111 A N S > S- 0 0 75 3,-0.5 3,-1.6 -3,-0.1 0, 0.0 -0.928 91.3 -91.7-144.1 168.1 33.6 10.4 54.7 112 112 A S T 3 S+ 0 0 62 -2,-0.3 78,-0.2 1,-0.3 -3,-0.0 0.678 120.8 37.4 -56.9 -22.6 35.1 13.8 55.6 113 113 A T T 3 S+ 0 0 62 76,-0.1 2,-0.4 77,-0.0 -1,-0.3 0.144 102.3 80.5-119.7 23.2 35.7 14.9 52.0 114 114 A T < + 0 0 17 -3,-1.6 -3,-0.5 32,-0.1 2,-0.3 -0.988 41.6 169.4-134.0 137.5 32.7 13.5 50.1 115 115 A F E - D 0 145C 5 30,-2.2 30,-3.1 -2,-0.4 2,-0.3 -0.851 18.4-154.9-149.1 110.4 29.1 14.6 49.6 116 116 A Y E + D 0 144C 27 -8,-2.0 28,-0.3 -2,-0.3 3,-0.1 -0.665 20.0 170.4 -80.6 136.0 26.6 13.2 47.2 117 117 A Y E + 0 0 3 26,-1.9 -53,-1.1 -2,-0.3 2,-0.3 0.393 50.8 53.3-133.5 5.3 24.0 15.9 46.4 118 118 A Q E -CD 63 143C 1 25,-1.0 25,-0.9 -55,-0.2 2,-0.5 -0.934 48.2-177.9-146.0 122.6 21.7 14.8 43.5 119 119 A V E +C 62 0C 0 -57,-1.4 -57,-2.3 -2,-0.3 22,-0.2 -0.982 61.1 20.4-118.2 118.3 19.7 11.6 43.2 120 120 A G S S- 0 0 0 20,-3.0 2,-0.5 -2,-0.5 22,-0.2 -0.231 78.8 -99.4 109.4 160.5 17.9 11.2 39.9 121 121 A E > - 0 0 50 1,-0.1 4,-2.6 -2,-0.1 5,-0.2 -0.974 25.9-146.8-121.5 113.9 18.1 12.7 36.4 122 122 A G H > S+ 0 0 0 -2,-0.5 4,-2.1 1,-0.2 -1,-0.1 0.828 91.3 52.1 -47.0 -49.2 15.6 15.6 35.9 123 123 A N H 4 S+ 0 0 94 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.947 116.6 38.2 -58.7 -51.8 14.9 15.1 32.2 124 124 A A H >4 S+ 0 0 55 1,-0.2 3,-1.2 2,-0.2 4,-0.3 0.894 113.5 56.6 -66.6 -40.5 14.1 11.4 32.4 125 125 A D H >< S+ 0 0 11 -4,-2.6 3,-1.3 1,-0.3 -1,-0.2 0.875 103.7 54.9 -58.6 -38.4 12.2 11.8 35.8 126 126 A H T 3< S+ 0 0 56 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.630 94.2 66.6 -73.0 -13.5 9.9 14.4 34.2 127 127 A T T < S+ 0 0 106 -3,-1.2 2,-0.4 -4,-0.5 -1,-0.3 0.515 93.8 79.8 -82.9 -4.3 8.9 12.0 31.4 128 128 A Y < - 0 0 59 -3,-1.3 2,-0.4 -4,-0.3 7,-0.0 -0.837 56.5-178.0-105.7 140.2 7.2 10.0 34.2 129 129 A W + 0 0 13 -2,-0.4 243,-0.6 2,-0.0 2,-0.3 -0.872 41.5 74.6-141.3 106.5 3.9 10.7 35.8 130 130 A G S S- 0 0 5 -2,-0.4 240,-0.1 241,-0.2 239,-0.1 -0.958 84.2 -35.9 178.3-170.5 2.6 8.6 38.6 131 131 A A > - 0 0 27 -2,-0.3 3,-1.5 1,-0.1 4,-0.4 -0.438 45.5-133.4 -71.7 140.6 3.0 7.8 42.3 132 132 A P G > S+ 0 0 1 0, 0.0 3,-0.9 0, 0.0 -93,-0.6 0.834 106.7 64.1 -63.8 -26.5 6.6 7.9 43.6 133 133 A E G 3 S+ 0 0 58 1,-0.2 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-25,-1.0 -0.952 56.5 172.6-128.4 145.8 26.4 14.5 41.2 144 144 A K E -D 116 0C 80 -2,-0.4 2,-0.4 -28,-0.3 -28,-0.3 -0.997 23.2-136.7-147.0 140.5 28.9 14.3 44.0 145 145 A A E +D 115 0C 0 -30,-3.1 -30,-2.2 -2,-0.3 46,-0.0 -0.849 38.6 142.5-101.6 135.5 31.2 16.9 45.6 146 146 A D B > -E 149 0D 32 3,-1.5 3,-2.1 -2,-0.4 -32,-0.1 -0.910 67.5 -67.8-155.1 178.4 34.8 16.0 46.4 147 147 A P T 3 S+ 0 0 91 0, 0.0 -33,-0.1 0, 0.0 -2,-0.0 0.743 134.6 38.6 -48.4 -26.5 38.3 17.5 46.3 148 148 A S T 3 S+ 0 0 101 1,-0.2 -3,-0.0 2,-0.0 0, 0.0 0.443 112.5 59.4-105.7 -0.9 38.3 17.6 42.5 149 149 A S B < S-E 146 0D 34 -3,-2.1 -3,-1.5 45,-0.0 -1,-0.2 -0.890 76.8-147.0-132.7 103.5 34.6 18.6 42.0 150 150 A P + 0 0 38 0, 0.0 49,-0.1 0, 0.0 45,-0.1 -0.278 32.9 155.0 -69.9 151.6 33.4 21.9 43.5 151 151 A A > + 0 0 0 43,-0.6 4,-3.1 47,-0.2 5,-0.3 -0.126 12.7 157.7-168.3 46.4 29.9 22.6 44.9 152 152 A S H > S+ 0 0 0 44,-2.3 4,-2.0 42,-0.3 45,-0.2 0.807 74.1 48.7 -50.2 -40.9 30.6 25.5 47.4 153 153 A D H > S+ 0 0 0 43,-0.4 4,-2.3 2,-0.2 5,-0.2 0.955 115.1 42.8 -69.2 -48.5 27.0 26.8 47.4 154 154 A I H > S+ 0 0 3 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.947 115.7 49.4 -61.5 -48.4 25.4 23.4 47.9 155 155 A L H X S+ 0 0 4 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.896 112.2 49.3 -58.4 -40.6 27.9 22.4 50.5 156 156 A S H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.3 -1,-0.2 0.901 110.0 47.7 -69.1 -42.6 27.5 25.7 52.4 157 157 A E H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.911 114.4 47.8 -65.1 -39.3 23.7 25.6 52.5 158 158 A T H X S+ 0 0 1 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.911 111.3 52.0 -65.3 -41.2 23.8 22.0 53.7 159 159 A S H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.935 108.9 49.6 -59.4 -48.4 26.4 23.1 56.3 160 160 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.903 109.1 52.5 -57.5 -44.1 24.2 25.9 57.5 161 161 A A H X S+ 0 0 5 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.861 110.8 47.9 -60.6 -37.8 21.2 23.5 57.9 162 162 A L H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.841 111.4 48.9 -73.8 -35.4 23.3 21.1 59.9 163 163 A T H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.940 109.9 51.7 -69.3 -45.7 24.7 23.9 62.2 164 164 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.857 107.7 53.4 -59.5 -33.2 21.2 25.2 62.8 165 165 A M H X S+ 0 0 3 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.895 106.0 52.5 -68.9 -38.2 20.1 21.7 63.7 166 166 A Y H X S+ 0 0 45 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.951 112.9 45.5 -59.5 -46.3 22.9 21.5 66.3 167 167 A L H < S+ 0 0 29 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.851 119.6 40.0 -65.0 -36.8 21.6 24.8 67.7 168 168 A N H < S+ 0 0 28 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.659 124.2 37.4 -87.7 -16.3 18.0 23.7 67.7 169 169 A Y H >X S+ 0 0 34 -4,-2.3 3,-2.5 -5,-0.2 4,-2.4 0.604 82.8 93.6-113.0 -12.9 18.6 20.1 68.8 170 170 A K T 3< S+ 0 0 79 -4,-2.0 4,-0.3 1,-0.3 -1,-0.1 0.668 87.0 54.5 -58.3 -18.3 21.4 20.1 71.4 171 171 A N T 34 S+ 0 0 149 2,-0.2 -1,-0.3 -4,-0.1 -2,-0.1 0.406 116.6 38.1 -94.1 2.1 18.9 20.3 74.3 172 172 A I T <4 S+ 0 0 101 -3,-2.5 2,-0.3 1,-0.1 -2,-0.2 0.748 139.0 0.4-113.0 -54.1 17.1 17.2 73.0 173 173 A D X - 0 0 69 -4,-2.4 4,-2.5 1,-0.1 -2,-0.2 -0.765 63.9-179.0-141.6 87.7 19.8 14.9 71.8 174 174 A S H > S+ 0 0 79 -4,-0.3 4,-1.9 -2,-0.3 5,-0.1 0.779 82.1 56.3 -60.3 -30.7 23.2 16.5 72.2 175 175 A A H > S+ 0 0 58 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.958 111.0 42.1 -67.5 -50.2 25.0 13.5 70.7 176 176 A Y H > S+ 0 0 12 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.907 111.8 57.0 -61.8 -41.9 23.0 13.8 67.4 177 177 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.897 107.3 47.8 -56.9 -41.7 23.4 17.6 67.5 178 178 A T H X S+ 0 0 62 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.809 105.2 58.3 -71.6 -28.9 27.2 17.3 67.6 179 179 A K H X S+ 0 0 100 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.903 108.6 47.7 -65.3 -37.0 27.1 14.8 64.7 180 180 A C H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.933 111.9 48.1 -66.9 -47.0 25.4 17.5 62.8 181 181 A L H X S+ 0 0 11 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.902 110.1 52.2 -62.2 -41.2 27.9 20.2 63.8 182 182 A N H X S+ 0 0 78 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.927 112.8 44.9 -60.8 -44.0 30.9 17.9 63.0 183 183 A A H X S+ 0 0 6 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.895 110.6 54.8 -65.6 -40.5 29.4 17.3 59.5 184 184 A A H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.898 107.0 50.9 -59.7 -42.0 28.7 21.0 59.1 185 185 A K H X S+ 0 0 76 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.929 112.9 45.7 -62.4 -44.7 32.3 21.9 59.8 186 186 A E H X S+ 0 0 73 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.884 110.7 50.5 -67.8 -41.6 33.5 19.4 57.2 187 187 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.882 111.2 50.4 -64.5 -37.7 31.1 20.4 54.5 188 188 A Y H X S+ 0 0 5 -4,-1.9 4,-2.0 -5,-0.2 5,-0.2 0.927 108.6 52.2 -64.2 -45.7 32.1 24.0 55.0 189 189 A A H X S+ 0 0 42 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.915 109.3 49.8 -57.1 -45.1 35.8 23.1 54.8 190 190 A M H X S+ 0 0 24 -4,-2.3 4,-1.8 1,-0.2 3,-0.3 0.927 108.7 53.9 -59.2 -45.8 35.2 21.3 51.5 191 191 A G H < S+ 0 0 0 -4,-2.2 5,-0.2 1,-0.2 -1,-0.2 0.835 112.3 40.6 -60.1 -38.4 33.3 24.3 50.1 192 192 A K H < S+ 0 0 88 -4,-2.0 3,-0.3 1,-0.1 -1,-0.2 0.666 109.0 63.2 -86.1 -14.4 36.1 26.8 50.8 193 193 A A H < S+ 0 0 82 -4,-1.4 2,-0.5 1,-0.3 -2,-0.2 0.948 117.8 21.0 -71.7 -51.6 38.8 24.4 49.7 194 194 A N S < S- 0 0 53 -4,-1.8 -43,-0.6 -45,-0.1 2,-0.5 -0.933 87.4-152.2-121.2 102.5 37.6 24.0 46.0 195 195 A Q + 0 0 75 -2,-0.5 2,-0.2 -3,-0.3 -3,-0.1 -0.662 42.4 99.7 -87.7 123.9 35.5 27.0 45.1 196 196 A G - 0 0 14 -2,-0.5 -44,-2.3 -5,-0.2 -43,-0.4 -0.847 69.6 -86.1 172.7 152.0 32.8 26.8 42.5 197 197 A V - 0 0 51 -2,-0.2 12,-0.1 -46,-0.2 -45,-0.0 -0.411 46.2-118.5 -72.7 149.8 29.0 26.3 42.2 198 198 A G - 0 0 7 -47,-0.2 8,-0.4 1,-0.1 2,-0.3 -0.174 33.1 -91.1 -78.3 178.8 27.7 22.8 42.2 199 199 A N + 0 0 76 -49,-0.1 -135,-0.2 1,-0.1 -134,-0.2 -0.734 44.2 158.0 -97.2 141.8 25.8 21.1 39.4 200 200 A G >> - 0 0 8 1,-0.4 4,-2.6 -2,-0.3 3,-0.6 0.047 45.8-127.0-147.5 26.3 22.0 21.1 39.0 201 201 A Q T 34 - 0 0 40 1,-0.2 -1,-0.4 2,-0.2 3,-0.0 -0.160 63.8 -44.6 55.1-152.4 21.5 20.5 35.3 202 202 A S T 34 S+ 0 0 72 1,-0.2 3,-0.4 2,-0.1 -1,-0.2 0.631 136.5 67.6 -84.2 -11.7 19.3 23.0 33.5 203 203 A F T <4 S+ 0 0 60 -3,-0.6 2,-0.3 1,-0.2 -2,-0.2 0.879 112.6 21.9 -75.6 -42.4 16.8 22.9 36.4 204 204 A Y S < S+ 0 0 29 -4,-2.6 2,-0.8 -3,-0.0 -1,-0.2 -0.658 73.6 176.5-130.5 77.2 18.9 24.5 39.1 205 205 A Q - 0 0 131 -3,-0.4 2,-0.2 -2,-0.3 -6,-0.1 -0.741 19.5-150.7 -84.9 111.8 21.6 26.6 37.4 206 206 A A + 0 0 21 -2,-0.8 -9,-0.1 -8,-0.4 3,-0.1 -0.488 22.9 179.1 -84.1 153.3 23.6 28.3 40.1 207 207 A T + 0 0 110 50,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.411 63.1 37.1-130.8 -5.5 25.4 31.6 39.7 208 208 A S + 0 0 15 49,-0.2 -1,-0.2 1,-0.1 32,-0.0 -0.999 33.2 163.6-153.5 147.9 26.9 32.4 43.1 209 209 A F S > S+ 0 0 42 -2,-0.3 4,-2.6 27,-0.1 5,-0.2 0.506 70.7 79.2-135.0 -19.3 28.6 30.7 46.1 210 210 A G H > S+ 0 0 3 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.875 95.1 54.5 -59.7 -35.7 30.3 33.5 48.0 211 211 A D H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.920 110.1 45.9 -62.8 -43.3 26.9 34.3 49.4 212 212 A D H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.895 109.5 52.5 -68.9 -42.8 26.5 30.8 50.7 213 213 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.928 111.4 47.7 -59.2 -46.2 30.0 30.4 52.2 214 214 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.932 112.1 50.1 -60.2 -47.2 29.5 33.6 54.2 215 215 A W H X S+ 0 0 0 -4,-2.0 4,-1.3 1,-0.2 3,-0.2 0.943 112.0 46.3 -56.0 -53.1 26.0 32.5 55.4 216 216 A A H X S+ 0 0 0 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.879 110.3 55.4 -59.5 -39.0 27.3 29.0 56.5 217 217 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.872 101.3 56.4 -64.4 -37.9 30.3 30.7 58.2 218 218 A T H X S+ 0 0 0 -4,-1.9 4,-2.0 -3,-0.2 -1,-0.2 0.881 108.2 48.1 -64.2 -36.0 28.1 33.0 60.4 219 219 A W H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.879 107.6 54.4 -70.7 -37.7 26.2 30.0 61.8 220 220 A L H X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 6,-0.4 0.846 108.7 50.5 -64.4 -31.8 29.4 28.2 62.6 221 221 A Y H X S+ 0 0 60 -4,-1.7 4,-3.4 2,-0.2 -2,-0.2 0.944 108.1 51.6 -69.9 -46.8 30.5 31.3 64.5 222 222 A T H < S+ 0 0 38 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.893 116.3 41.6 -55.7 -40.3 27.2 31.3 66.5 223 223 A A H < S+ 0 0 19 -4,-2.3 -1,-0.2 1,-0.1 -2,-0.2 0.858 130.5 22.7 -77.4 -36.4 27.7 27.7 67.4 224 224 A T H < S- 0 0 44 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.702 84.8-136.4-105.0 -24.6 31.5 27.7 68.2 225 225 A N < + 0 0 121 -4,-3.4 2,-0.9 -5,-0.3 -4,-0.1 0.671 55.2 143.8 72.1 17.4 32.3 31.3 69.0 226 226 A D > - 0 0 70 -6,-0.4 3,-1.8 -5,-0.2 4,-0.3 -0.805 40.5-158.4 -90.9 105.2 35.4 30.9 66.9 227 227 A S T >> S+ 0 0 73 -2,-0.9 4,-1.5 1,-0.3 3,-0.5 0.549 79.6 83.7 -63.6 -7.7 35.8 34.3 65.2 228 228 A T H 3> S+ 0 0 75 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.809 84.8 60.7 -65.2 -27.5 37.9 32.9 62.4 229 229 A Y H <> S+ 0 0 34 -3,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.846 102.8 49.7 -66.5 -34.2 34.6 32.0 60.8 230 230 A I H <> S+ 0 0 14 -3,-0.5 4,-2.3 -4,-0.3 -1,-0.2 0.840 106.0 55.7 -74.0 -32.2 33.7 35.6 60.6 231 231 A T H X S+ 0 0 98 -4,-1.5 4,-1.1 2,-0.2 -2,-0.2 0.925 111.4 45.1 -64.4 -41.2 37.0 36.5 59.1 232 232 A D H >X S+ 0 0 45 -4,-1.9 4,-2.6 1,-0.2 3,-0.8 0.962 110.8 54.6 -62.4 -53.4 36.2 34.0 56.4 233 233 A A H 3X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.3 -2,-0.2 0.861 104.1 52.3 -49.3 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254 A M S S+ 0 0 0 -2,-0.3 2,-0.3 55,-0.2 5,-0.2 -0.435 72.1 136.4 -62.8 127.0 16.5 35.3 49.6 255 255 A C B > -F 258 0E 4 3,-1.6 3,-0.5 -2,-0.2 160,-0.0 -0.962 69.5 -79.6-162.5 170.8 16.2 32.1 47.4 256 256 A W T 3 S+ 0 0 38 -2,-0.3 3,-0.1 1,-0.2 -187,-0.1 0.762 129.3 34.9 -50.7 -30.7 18.1 28.9 46.7 257 257 A D T 3 S+ 0 0 25 1,-0.2 2,-0.5 -51,-0.1 -50,-0.3 0.676 117.6 52.2 -99.0 -20.2 20.6 30.7 44.4 258 258 A D B < +F 255 0E 16 -3,-0.5 -3,-1.6 -5,-0.2 -1,-0.2 -0.892 44.8 152.4-127.9 106.9 20.9 34.0 46.2 259 259 A M > + 0 0 0 -2,-0.5 4,-2.0 -5,-0.2 5,-0.2 0.064 40.0 113.1-116.1 24.1 21.7 34.3 49.9 260 260 A Y H > S+ 0 0 55 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.826 77.4 49.6 -65.7 -33.0 23.4 37.7 49.9 261 261 A V H > S+ 0 0 6 2,-0.2 4,-2.6 -3,-0.2 -1,-0.2 0.950 112.4 43.9 -74.7 -48.8 20.7 39.4 52.0 262 262 A P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.920 115.4 50.6 -61.3 -39.5 20.4 36.8 54.8 263 263 A A H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.898 111.3 48.2 -62.5 -41.2 24.2 36.6 54.9 264 264 A A H X S+ 0 0 1 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.881 108.3 55.4 -66.9 -39.2 24.4 40.4 55.1 265 265 A L H X S+ 0 0 4 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.943 110.3 43.8 -59.4 -49.2 21.8 40.5 57.9 266 266 A R H X S+ 0 0 11 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.887 112.6 52.0 -65.4 -38.7 23.7 38.1 60.1 267 267 A L H X>S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 5,-0.6 0.837 106.4 55.1 -66.8 -30.9 27.0 39.9 59.5 268 268 A A H X5S+ 0 0 14 -4,-2.0 4,-1.7 3,-0.2 -1,-0.2 0.936 112.4 42.7 -65.5 -44.6 25.3 43.2 60.4 269 269 A Q H <5S+ 0 0 71 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.906 120.8 41.2 -66.2 -44.3 24.3 41.7 63.8 270 270 A I H <5S+ 0 0 47 -4,-2.7 -2,-0.2 -5,-0.1 -3,-0.2 0.820 131.1 21.7 -75.9 -36.1 27.6 40.0 64.4 271 271 A T H <5S- 0 0 44 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.653 83.8-143.2-106.8 -22.9 30.0 42.7 63.2 272 272 A G << + 0 0 37 -4,-1.7 -4,-0.2 -5,-0.6 -3,-0.1 0.504 44.2 158.2 70.8 4.2 27.9 45.8 63.5 273 273 A K >> - 0 0 97 -6,-0.5 4,-1.4 1,-0.1 3,-0.5 -0.294 47.3-135.5 -66.3 143.8 29.6 47.2 60.3 274 274 A Q H 3> S+ 0 0 101 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.827 99.7 68.0 -66.2 -34.7 27.9 49.8 58.2 275 275 A I H 3> S+ 0 0 53 1,-0.2 4,-1.5 2,-0.2 -27,-0.3 0.888 107.0 40.7 -54.1 -39.6 28.7 48.1 54.9 276 276 A Y H <> S+ 0 0 6 -3,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.849 112.3 53.3 -78.7 -36.0 26.3 45.3 55.9 277 277 A K H X S+ 0 0 87 -4,-1.4 4,-2.4 1,-0.2 -2,-0.2 0.865 109.3 51.6 -65.9 -35.0 23.6 47.6 57.3 278 278 A D H X S+ 0 0 79 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.915 108.2 50.7 -66.8 -43.2 23.7 49.5 54.0 279 279 A A H X S+ 0 0 11 -4,-1.5 4,-2.1 -5,-0.2 -29,-0.2 0.954 113.3 44.9 -59.2 -50.5 23.2 46.2 52.0 280 280 A I H X S+ 0 0 3 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.917 113.8 49.5 -60.1 -45.4 20.2 45.2 54.1 281 281 A E H X S+ 0 0 83 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.869 108.4 53.8 -64.1 -36.6 18.7 48.7 54.0 282 282 A F H X S+ 0 0 52 -4,-2.5 4,-3.0 2,-0.2 -1,-0.2 0.955 109.9 46.6 -62.6 -49.6 19.1 48.9 50.2 283 283 A N H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.883 114.5 47.2 -60.3 -40.2 17.3 45.6 49.6 284 284 A F H X S+ 0 0 7 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.933 114.4 46.5 -67.3 -45.9 14.5 46.7 52.0 285 285 A N H X S+ 0 0 87 -4,-2.8 4,-1.4 1,-0.2 5,-0.4 0.884 110.2 54.8 -62.8 -38.9 14.2 50.1 50.4 286 286 A Y H X>S+ 0 0 49 -4,-3.0 4,-2.4 1,-0.2 5,-1.3 0.920 109.4 46.2 -60.6 -46.2 14.3 48.5 46.9 287 287 A W H <5S+ 0 0 1 -4,-2.0 -1,-0.2 3,-0.2 -2,-0.2 0.823 105.4 62.9 -67.6 -30.0 11.3 46.2 47.8 288 288 A K H <5S- 0 0 64 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.899 130.7 -6.5 -63.1 -41.1 9.4 49.1 49.3 289 289 A T H <5S+ 0 0 109 -4,-1.4 -2,-0.2 -3,-0.2 -3,-0.2 0.596 128.3 56.8-132.5 -15.5 9.1 51.1 46.1 290 290 A Q T <5S+ 0 0 123 -4,-2.4 2,-0.3 -5,-0.4 -3,-0.2 0.755 85.4 84.4 -92.4 -28.8 11.1 49.6 43.2 291 291 A V S - 0 0 7 4,-2.6 3,-2.4 -2,-0.5 102,-0.1 -0.244 32.0-102.3 -70.2 164.0 -0.0 44.3 41.5 295 295 A P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 101,-0.1 0.864 124.4 59.3 -55.6 -32.3 -3.4 46.1 41.8 296 296 A G T 3 S- 0 0 24 2,-0.1 100,-0.1 1,-0.1 -2,-0.0 0.475 123.2-103.2 -76.4 -2.6 -4.1 43.6 44.5 297 297 A G S < S+ 0 0 31 -3,-2.4 2,-0.4 1,-0.3 42,-0.1 0.505 72.6 140.0 96.3 4.0 -1.2 44.6 46.6 298 298 A L - 0 0 0 41,-0.1 -4,-2.6 97,-0.1 2,-0.7 -0.678 54.6-126.5 -86.5 133.8 1.2 41.7 45.9 299 299 A K E -G 293 0F 22 -2,-0.4 2,-0.8 -6,-0.2 -6,-0.2 -0.708 28.0-157.2 -77.8 116.0 5.0 42.5 45.5 300 300 A W E +G 292 0F 38 -8,-3.6 -8,-0.5 -2,-0.7 3,-0.1 -0.828 25.0 165.1-103.4 99.6 5.7 40.9 42.1 301 301 A L - 0 0 25 -2,-0.8 2,-0.3 5,-0.3 -1,-0.2 0.918 66.8 -24.4 -79.1 -46.0 9.4 40.1 41.7 302 302 A S - 0 0 30 2,-0.1 -1,-0.2 1,-0.0 7,-0.1 -0.927 64.7 -97.3-156.3 177.3 9.2 37.7 38.7 303 303 A N S S+ 0 0 70 -2,-0.3 2,-0.5 -3,-0.1 3,-0.5 0.771 96.4 70.0 -78.6 -28.0 6.8 35.4 36.9 304 304 A W S S- 0 0 101 1,-0.2 104,-0.1 2,-0.1 103,-0.1 -0.816 118.7 -11.3 -98.9 125.8 7.9 32.0 38.3 305 305 A G S > S+ 0 0 0 102,-0.8 4,-1.4 -2,-0.5 -1,-0.2 0.932 76.9 169.2 56.4 48.6 7.1 31.2 41.9 306 306 A V H > S+ 0 0 1 -3,-0.5 4,-1.7 101,-0.3 -5,-0.3 0.846 72.2 50.1 -61.6 -36.5 6.1 34.8 42.6 307 307 A L H > S+ 0 0 0 84,-2.1 4,-2.5 83,-0.2 5,-0.3 0.843 102.5 61.2 -72.1 -33.1 4.6 34.1 46.1 308 308 A R H > S+ 0 0 13 83,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.902 107.5 46.6 -58.1 -40.4 7.7 32.1 47.1 309 309 A Y H X S+ 0 0 22 -4,-1.4 4,-2.4 2,-0.2 5,-0.3 0.918 110.5 50.3 -69.3 -44.6 9.6 35.4 46.6 310 310 A A H X S+ 0 0 0 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.887 113.5 46.1 -61.5 -40.0 7.2 37.6 48.5 311 311 A A H X S+ 0 0 1 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.870 111.4 52.0 -70.0 -39.2 7.2 35.2 51.5 312 312 A A H X S+ 0 0 1 -4,-1.8 4,-1.7 -5,-0.3 -2,-0.2 0.925 111.4 45.2 -64.8 -46.9 11.0 34.9 51.5 313 313 A E H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.916 112.7 52.8 -63.7 -41.7 11.6 38.7 51.5 314 314 A S H X S+ 0 0 0 -4,-1.8 4,-1.9 -5,-0.3 -1,-0.2 0.859 106.0 53.0 -62.4 -37.0 8.9 39.1 54.2 315 315 A M H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.902 107.3 51.4 -64.9 -42.4 10.5 36.5 56.5 316 316 A V H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.941 109.7 50.5 -59.7 -47.2 13.9 38.3 56.3 317 317 A M H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.882 109.1 50.9 -59.5 -40.3 12.2 41.6 57.3 318 318 A L H X S+ 0 0 0 -4,-1.9 4,-0.7 2,-0.2 -1,-0.2 0.874 109.2 49.6 -67.8 -36.2 10.5 39.9 60.3 319 319 A V H >< S+ 0 0 2 -4,-2.1 3,-1.2 1,-0.2 4,-0.5 0.942 112.0 50.5 -64.4 -45.1 13.7 38.4 61.6 320 320 A Y H >X S+ 0 0 41 -4,-2.4 4,-1.7 1,-0.2 3,-1.0 0.872 103.1 60.2 -57.9 -41.9 15.2 41.9 61.2 321 321 A C H 3< S+ 0 0 1 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.656 84.0 79.5 -64.2 -18.9 12.4 43.5 63.1 322 322 A K T << S+ 0 0 74 -3,-1.2 -1,-0.2 -4,-0.7 -2,-0.2 0.897 115.5 15.6 -57.2 -41.3 13.1 41.5 66.3 323 323 A Q T <4 S+ 0 0 132 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.615 133.9 48.5-105.8 -18.5 15.9 43.9 67.2 324 324 A N S < S- 0 0 71 -4,-1.7 2,-0.7 -5,-0.2 -1,-0.2 -0.757 77.5-152.8-125.8 83.4 15.0 46.7 64.9 325 325 A P + 0 0 114 0, 0.0 2,-0.6 0, 0.0 -4,-0.1 -0.398 23.1 171.0 -59.6 104.4 11.3 47.5 65.2 326 326 A D >> - 0 0 48 -2,-0.7 4,-2.0 -9,-0.1 3,-0.9 -0.894 20.4-166.7-122.2 100.9 10.4 49.0 61.8 327 327 A Q H 3> S+ 0 0 118 -2,-0.6 4,-2.5 1,-0.3 5,-0.2 0.801 88.8 59.0 -56.0 -33.0 6.6 49.5 61.3 328 328 A S H 3> S+ 0 0 47 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.882 109.9 44.4 -65.4 -34.7 7.0 50.0 57.5 329 329 A L H <> S+ 0 0 1 -3,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.848 111.5 51.9 -77.0 -35.6 8.5 46.5 57.3 330 330 A L H X S+ 0 0 17 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.896 111.4 48.5 -67.5 -38.3 5.9 45.0 59.6 331 331 A D H X S+ 0 0 65 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.916 112.5 46.7 -67.4 -44.5 3.2 46.4 57.5 332 332 A L H X S+ 0 0 17 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.921 114.0 48.2 -64.4 -43.7 4.7 45.2 54.2 333 333 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.915 111.2 50.1 -62.5 -44.5 5.3 41.7 55.5 334 334 A K H X S+ 0 0 58 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.876 108.4 52.9 -63.4 -38.5 1.8 41.4 56.9 335 335 A K H X S+ 0 0 128 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.886 110.1 47.4 -65.3 -38.7 0.2 42.5 53.6 336 336 A Q H X S+ 0 0 3 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.914 114.3 46.7 -69.1 -41.9 2.1 39.8 51.7 337 337 A V H X S+ 0 0 2 -4,-2.2 4,-2.3 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