==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-NOV-05 2EZU . COMPND 2 MOLECULE: PYRUVATE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS PLANTARUM; . AUTHOR G.WILLE,D.MEYER,A.STEINMETZ,E.HINZE,R.GOLBIK,K.TITTMANN . 1170 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45245.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 805 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 159 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 1.4 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 . 2 0.2 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 . 68 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 148 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 364 31.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 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 3 0 3 4 1 9 4 11 0 2 1 3 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 7 11 2 2 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 . 4 0 2 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 . 2 0 0 0 6 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 9 A T 0 0 147 0, 0.0 170,-2.4 0, 0.0 171,-0.4 0.000 360.0 360.0 360.0 -47.0 61.7 106.0 29.1 2 10 A N E -A 170 0A 88 168,-0.3 2,-0.3 169,-0.2 166,-0.1 -0.881 360.0-167.5-122.8 159.9 62.4 104.5 25.6 3 11 A I E -A 169 0A 37 166,-2.5 166,-3.0 -2,-0.3 2,-0.3 -0.991 33.9-104.9-140.5 147.1 64.6 101.8 24.1 4 12 A L E >> -A 168 0A 64 -2,-0.3 4,-2.1 164,-0.2 3,-0.7 -0.572 31.1-127.9 -68.3 131.5 65.6 101.0 20.5 5 13 A A H 3> S+ 0 0 0 162,-2.9 4,-2.4 159,-0.4 161,-0.2 0.844 110.6 56.2 -48.7 -38.2 63.6 98.0 19.4 6 14 A G H 3> S+ 0 0 1 159,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.877 105.5 51.4 -65.4 -37.3 66.9 96.3 18.3 7 15 A A H <> S+ 0 0 28 -3,-0.7 4,-2.3 158,-0.4 -2,-0.2 0.927 109.5 49.3 -62.6 -47.2 68.3 96.8 21.8 8 16 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.904 108.6 54.2 -57.2 -43.2 65.2 95.1 23.3 9 17 A V H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.906 108.5 47.7 -58.2 -44.6 65.6 92.2 20.9 10 18 A I H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.909 108.9 54.8 -66.3 -37.6 69.3 91.6 22.0 11 19 A K H X S+ 0 0 60 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.839 104.9 54.0 -61.0 -35.6 68.1 91.8 25.6 12 20 A V H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.934 109.0 48.4 -61.0 -45.5 65.5 89.0 24.8 13 21 A L H <>S+ 0 0 0 -4,-1.9 5,-2.2 1,-0.2 -2,-0.2 0.915 112.6 48.5 -61.2 -43.3 68.4 86.8 23.4 14 22 A E H ><5S+ 0 0 32 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.886 107.7 54.3 -63.0 -40.1 70.5 87.6 26.5 15 23 A A H 3<5S+ 0 0 56 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.851 105.8 54.2 -63.8 -32.9 67.5 86.7 28.8 16 24 A W T 3<5S- 0 0 16 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.419 121.0-110.0 -83.5 4.5 67.3 83.3 27.0 17 25 A G T < 5 + 0 0 36 -3,-1.6 2,-0.5 1,-0.3 -3,-0.2 0.695 55.1 166.9 80.1 18.1 70.9 82.6 27.8 18 26 A V < + 0 0 9 -5,-2.2 -1,-0.3 1,-0.2 3,-0.1 -0.572 9.3 177.4 -67.0 115.5 72.3 83.0 24.2 19 27 A D + 0 0 83 -2,-0.5 25,-2.7 1,-0.3 2,-0.3 0.862 62.3 8.1 -83.0 -47.1 76.1 83.2 24.6 20 28 A H E -b 44 0B 10 23,-0.2 50,-0.4 38,-0.0 2,-0.3 -0.949 58.0-174.9-140.4 158.8 77.0 83.3 20.9 21 29 A L E -b 45 0B 1 23,-1.9 25,-3.6 -2,-0.3 2,-0.3 -0.984 14.3-135.9-154.6 159.3 75.5 83.7 17.4 22 30 A Y E +bc 46 71B 0 48,-1.9 50,-1.6 -2,-0.3 2,-0.3 -0.857 36.0 96.5-125.2 146.7 76.6 83.6 13.8 23 31 A G E -b 47 0B 0 23,-1.6 25,-1.3 -2,-0.3 50,-0.2 -0.981 54.0 -92.9 167.3-166.3 76.2 85.4 10.5 24 32 A I - 0 0 38 48,-0.4 50,-0.4 -2,-0.3 25,-0.1 -0.995 40.3-122.8-136.3 131.1 77.4 88.0 7.9 25 33 A P + 0 0 57 0, 0.0 2,-0.3 0, 0.0 49,-0.2 -0.192 31.6 168.4 -73.9 170.4 76.1 91.6 8.0 26 34 A G > - 0 0 19 47,-0.1 3,-2.2 1,-0.1 4,-0.5 -0.931 52.1 -93.5-168.1 162.1 74.4 93.5 5.1 27 35 A G G > S+ 0 0 58 1,-0.3 3,-1.1 -2,-0.3 4,-0.3 0.885 124.3 57.4 -49.2 -40.4 72.5 96.8 4.7 28 36 A S G 3 S+ 0 0 17 1,-0.2 74,-1.3 2,-0.1 -1,-0.3 0.543 116.3 33.5 -72.7 -9.6 69.3 95.0 5.4 29 37 A I G <> S+ 0 0 4 -3,-2.2 4,-2.0 72,-0.2 3,-0.4 0.194 83.8 108.1-127.9 16.8 70.5 93.7 8.8 30 38 A N H <> S+ 0 0 71 -3,-1.1 4,-2.1 -4,-0.5 -2,-0.1 0.722 74.0 59.1 -72.4 -21.5 72.7 96.6 9.9 31 39 A S H > S+ 0 0 3 -4,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.844 108.2 45.3 -78.1 -30.0 70.2 97.8 12.6 32 40 A I H > S+ 0 0 3 -3,-0.4 4,-2.8 2,-0.2 -2,-0.2 0.889 113.0 52.5 -68.1 -41.0 70.4 94.4 14.4 33 41 A M H X S+ 0 0 26 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.909 106.5 53.0 -58.3 -43.9 74.2 94.6 13.9 34 42 A D H X S+ 0 0 88 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.917 111.2 45.6 -60.3 -46.0 74.1 98.1 15.5 35 43 A A H X S+ 0 0 12 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.898 112.5 51.2 -62.6 -44.2 72.3 96.6 18.6 36 44 A L H < S+ 0 0 7 -4,-2.8 3,-0.4 1,-0.2 -2,-0.2 0.866 105.2 57.6 -55.9 -42.3 74.7 93.7 18.6 37 45 A S H >< S+ 0 0 49 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.894 105.6 48.4 -59.1 -44.5 77.7 96.1 18.6 38 46 A A H 3< S+ 0 0 82 -4,-1.5 3,-0.3 1,-0.2 -1,-0.2 0.758 113.9 49.4 -64.4 -23.5 76.5 97.9 21.8 39 47 A E T >X S+ 0 0 31 -4,-0.9 4,-2.2 -3,-0.4 3,-1.6 0.117 70.1 119.5-107.4 17.0 76.0 94.5 23.5 40 48 A R T <4 S+ 0 0 162 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.682 70.9 58.9 -66.0 -18.4 79.4 93.0 22.7 41 49 A D T 34 S+ 0 0 154 -3,-0.3 -1,-0.3 1,-0.1 3,-0.1 0.707 117.4 31.3 -78.3 -21.0 80.4 92.6 26.4 42 50 A R T <4 S+ 0 0 155 -3,-1.6 2,-0.3 1,-0.3 -2,-0.2 0.669 124.9 32.9-110.1 -26.6 77.3 90.4 27.1 43 51 A I S < S- 0 0 2 -4,-2.2 2,-0.6 -7,-0.2 -1,-0.3 -0.999 74.9-136.0-137.6 139.7 76.6 88.5 23.8 44 52 A H E -b 20 0B 74 -25,-2.7 -23,-1.9 -2,-0.3 2,-0.4 -0.843 8.6-153.9-113.7 109.7 79.2 87.3 21.3 45 53 A Y E -b 21 0B 58 -2,-0.6 2,-0.6 -25,-0.2 -23,-0.2 -0.646 6.3-157.5 -82.8 128.2 78.8 87.7 17.6 46 54 A I E -b 22 0B 8 -25,-3.6 -23,-1.6 -2,-0.4 2,-0.6 -0.940 7.7-149.5-108.4 109.5 80.7 85.2 15.4 47 55 A Q E -b 23 0B 57 -2,-0.6 -23,-0.2 -25,-0.2 2,-0.1 -0.707 18.0-167.5 -82.2 116.8 81.4 86.4 11.9 48 56 A V - 0 0 0 -25,-1.3 3,-0.1 -2,-0.6 400,-0.0 -0.447 26.6-129.2 -96.7 172.2 81.5 83.5 9.5 49 57 A R S S+ 0 0 112 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.558 96.2 25.6 -99.9 -12.4 82.7 83.5 5.8 50 58 A H S >> S- 0 0 36 395,-0.1 3,-1.3 1,-0.1 4,-1.0 -0.961 76.9-131.6-149.5 132.9 79.6 81.8 4.4 51 59 A E H 3> S+ 0 0 17 -2,-0.3 4,-2.0 1,-0.3 5,-0.2 0.754 102.8 65.9 -62.9 -23.4 76.1 82.0 6.0 52 60 A E H 3> S+ 0 0 30 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.867 99.3 53.7 -64.0 -33.1 75.5 78.2 5.7 53 61 A V H <> S+ 0 0 0 -3,-1.3 4,-2.7 2,-0.2 -1,-0.2 0.869 106.9 52.1 -67.8 -36.5 78.3 77.7 8.2 54 62 A G H X S+ 0 0 0 -4,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.920 112.7 43.5 -59.9 -47.3 76.6 80.0 10.5 55 63 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.888 115.0 49.6 -67.4 -41.6 73.3 78.1 10.2 56 64 A M H X S+ 0 0 2 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.902 111.5 48.2 -62.9 -44.5 75.2 74.7 10.5 57 65 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.894 108.8 54.6 -64.7 -38.1 77.1 75.9 13.6 58 66 A A H X S+ 0 0 0 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.923 109.9 47.2 -60.4 -44.2 73.8 77.2 15.2 59 67 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.924 111.8 50.1 -58.6 -45.6 72.3 73.6 14.7 60 68 A A H X S+ 0 0 4 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.868 103.9 58.7 -64.6 -41.2 75.4 72.0 16.2 61 69 A D H X S+ 0 0 7 -4,-2.6 4,-2.8 2,-0.2 6,-0.5 0.923 111.4 42.8 -46.2 -52.3 75.3 74.3 19.3 62 70 A A H X S+ 0 0 4 -4,-1.5 4,-1.9 1,-0.2 -2,-0.2 0.875 110.9 53.7 -68.8 -42.5 71.8 73.0 19.9 63 71 A K H < S+ 0 0 31 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.861 117.6 39.8 -54.5 -39.5 72.8 69.3 19.2 64 72 A L H < S+ 0 0 5 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.916 134.0 13.3 -80.7 -47.4 75.6 69.8 21.8 65 73 A T H < S- 0 0 59 -4,-2.8 -3,-0.2 2,-0.2 -2,-0.2 0.591 87.9-122.8-108.7 -17.6 74.1 71.8 24.6 66 74 A G S < S+ 0 0 44 -4,-1.9 2,-0.3 -5,-0.4 -4,-0.2 0.406 71.6 129.9 78.2 -0.1 70.3 71.7 24.0 67 75 A K S S- 0 0 75 -6,-0.5 -1,-0.3 1,-0.1 -2,-0.2 -0.682 72.4 -96.3 -90.1 136.3 70.4 75.5 24.0 68 76 A I - 0 0 4 -2,-0.3 28,-0.2 -52,-0.2 2,-0.2 -0.239 39.5-135.0 -50.2 130.4 68.7 77.2 21.0 69 77 A G E - d 0 96B 1 26,-2.4 28,-3.1 -10,-0.1 2,-0.4 -0.629 17.4-151.6 -85.9 156.2 71.3 78.1 18.3 70 78 A V E + d 0 97B 1 -50,-0.4 -48,-1.9 -2,-0.2 2,-0.3 -0.989 23.5 154.2-135.6 127.9 71.1 81.5 16.7 71 79 A C E -cd 22 98B 0 26,-2.3 28,-2.1 -2,-0.4 2,-0.3 -0.915 15.1-166.0-143.1 167.5 72.2 82.6 13.2 72 80 A F E - d 0 99B 0 -50,-1.6 -48,-0.4 -2,-0.3 2,-0.3 -0.978 6.6-167.9-151.7 163.2 71.3 85.3 10.7 73 81 A G E - d 0 100B 0 26,-1.8 28,-2.8 -2,-0.3 6,-0.2 -0.978 29.9-107.8-149.0 147.9 71.7 86.3 7.0 74 82 A S > - 0 0 13 -50,-0.4 5,-1.9 -2,-0.3 4,-0.3 -0.174 59.7 -62.6 -68.2 168.8 71.0 89.6 5.1 75 83 A A T > 5S- 0 0 2 3,-0.2 3,-0.8 2,-0.1 -1,-0.2 -0.129 106.4 -8.0 -54.9 145.9 68.1 89.9 2.7 76 84 A G T >>5S+ 0 0 3 25,-0.3 4,-1.9 1,-0.2 3,-0.5 -0.545 138.2 21.5 73.4-118.9 68.0 87.7 -0.3 77 85 A P H 3>5S+ 0 0 66 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.665 118.4 61.1 -60.7 -25.5 71.2 85.7 -0.8 78 86 A G H <45S+ 0 0 1 -3,-0.8 4,-0.3 -4,-0.3 -3,-0.2 0.961 112.1 38.5 -65.2 -49.0 72.4 86.0 2.9 79 87 A G H X4< S+ 0 0 63 -4,-1.9 3,-0.9 1,-0.3 4,-0.2 0.778 99.9 63.6 -63.7 -24.9 69.0 81.6 1.3 81 89 A H T 3< S+ 0 0 77 -4,-1.2 3,-0.4 1,-0.2 -1,-0.3 0.690 92.9 65.2 -67.7 -19.6 72.6 80.6 2.1 82 90 A L T X> S+ 0 0 0 -3,-2.1 4,-1.9 -4,-0.3 3,-1.2 0.724 75.4 95.2 -71.2 -22.6 71.3 79.4 5.6 83 91 A M H <> S+ 0 0 32 -3,-0.9 4,-3.0 -4,-0.4 5,-0.3 0.769 76.3 53.0 -49.0 -47.0 69.2 76.7 4.1 84 92 A N H 3> S+ 0 0 69 -3,-0.4 4,-1.2 1,-0.2 -1,-0.3 0.877 115.5 42.0 -62.8 -34.4 71.5 73.7 4.4 85 93 A G H <> S+ 0 0 0 -3,-1.2 4,-1.9 -4,-0.3 -1,-0.2 0.827 114.6 50.8 -75.8 -35.2 72.0 74.3 8.1 86 94 A L H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.908 111.0 48.0 -69.1 -41.3 68.3 75.1 8.7 87 95 A Y H X S+ 0 0 41 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.868 109.2 55.4 -64.1 -35.2 67.2 71.9 7.0 88 96 A D H X S+ 0 0 0 -4,-1.2 4,-2.3 -5,-0.3 -2,-0.2 0.930 108.5 48.0 -60.4 -43.6 69.8 70.1 9.1 89 97 A A H <>S+ 0 0 0 -4,-1.9 5,-2.2 2,-0.2 -2,-0.2 0.864 112.4 48.3 -66.8 -37.5 68.1 71.6 12.2 90 98 A R H ><5S+ 0 0 85 -4,-2.1 3,-1.1 3,-0.2 -2,-0.2 0.957 115.2 43.1 -67.2 -52.6 64.6 70.6 11.1 91 99 A E H 3<5S+ 0 0 57 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.821 118.3 44.3 -65.3 -34.5 65.6 67.0 10.3 92 100 A D T 3<5S- 0 0 10 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.309 109.1-129.9 -91.4 7.2 67.7 66.6 13.4 93 101 A H T < 5 + 0 0 106 -3,-1.1 -3,-0.2 1,-0.2 61,-0.2 0.878 54.7 143.2 49.1 57.1 64.9 68.2 15.4 94 102 A V < - 0 0 15 -5,-2.2 2,-0.4 -6,-0.1 -1,-0.2 -0.941 55.5-102.4-124.5 146.0 67.0 70.8 17.3 95 103 A P + 0 0 1 0, 0.0 -26,-2.4 0, 0.0 2,-0.4 -0.546 45.6 167.6 -73.2 123.3 65.9 74.5 18.2 96 104 A V E -de 69 155B 1 58,-1.7 60,-2.4 -2,-0.4 2,-0.5 -0.999 23.8-153.2-134.2 134.7 67.4 77.1 15.9 97 105 A L E -de 70 156B 0 -28,-3.1 -26,-2.3 -2,-0.4 2,-0.5 -0.950 15.0-170.8-102.8 127.4 66.4 80.8 15.6 98 106 A A E -de 71 157B 0 58,-2.7 60,-2.1 -2,-0.5 2,-0.5 -0.979 6.4-159.7-119.1 123.2 67.2 82.4 12.2 99 107 A L E -de 72 158B 1 -28,-2.1 -26,-1.8 -2,-0.5 2,-0.5 -0.877 8.4-159.0-103.2 133.6 66.9 86.1 11.7 100 108 A I E -de 73 159B 0 58,-2.8 60,-3.1 -2,-0.5 -26,-0.2 -0.945 15.1-125.9-115.0 126.5 66.6 87.2 8.1 101 109 A G E - e 0 160B 0 -28,-2.8 -25,-0.3 -2,-0.5 2,-0.3 -0.283 30.0-178.0 -59.6 152.1 67.3 90.8 6.9 102 110 A Q E - e 0 161B 3 -74,-1.3 60,-2.3 58,-1.2 3,-0.1 -0.978 32.3 -99.7-150.4 144.8 64.6 92.7 5.0 103 111 A F - 0 0 78 -2,-0.3 5,-0.1 58,-0.2 -75,-0.0 -0.236 61.0 -79.1 -51.6 151.0 64.4 96.2 3.3 104 112 A G >> - 0 0 7 57,-0.2 3,-2.0 1,-0.1 4,-1.5 -0.123 41.8-107.6 -55.1 154.8 62.6 98.8 5.4 105 113 A T T 34 S+ 0 0 61 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 0.729 118.8 61.9 -60.9 -25.2 58.8 98.8 5.5 106 114 A T T 34 S+ 0 0 131 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.683 113.1 36.5 -76.1 -17.0 58.8 102.0 3.3 107 115 A G T X4 S+ 0 0 6 -3,-2.0 3,-1.7 2,-0.0 5,-0.3 0.603 86.9 115.3-109.4 -16.1 60.5 100.0 0.5 108 116 A M T 3< S+ 0 0 37 -4,-1.5 9,-0.1 1,-0.3 -4,-0.0 -0.248 84.7 15.0 -55.0 137.8 59.0 96.6 0.8 109 117 A N T 3 S+ 0 0 123 1,-0.1 -1,-0.3 3,-0.1 -4,-0.0 0.609 96.4 104.6 68.8 11.2 56.9 95.5 -2.2 110 118 A M S < S- 0 0 132 -3,-1.7 -2,-0.1 6,-0.0 -1,-0.1 0.484 91.0-120.8 -90.5 -4.8 58.4 98.3 -4.3 111 119 A D + 0 0 144 -4,-0.2 2,-0.1 1,-0.1 -3,-0.1 0.971 58.5 157.3 55.4 57.8 60.6 95.8 -6.2 112 120 A T > - 0 0 57 -5,-0.3 3,-1.9 1,-0.2 -1,-0.1 -0.326 49.4 -42.3 -98.3-172.7 63.8 97.5 -5.1 113 121 A F T 3 S- 0 0 159 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 -0.285 123.7 -14.2 -61.9 130.9 67.3 96.1 -4.8 114 122 A Q T 3 S+ 0 0 79 1,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.753 105.5 136.8 45.5 28.7 67.6 92.6 -3.2 115 123 A E < + 0 0 13 -3,-1.9 2,-0.3 -13,-0.1 -1,-0.2 -0.910 17.7 132.6-110.6 131.0 64.0 93.1 -2.1 116 124 A M - 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0 0 75 -4,-2.4 4,-0.1 -5,-0.4 0, 0.0 -0.472 45.7-163.8 -83.0 138.5 33.9 103.7 10.2 1067 489 B Q S S+ 0 0 181 -2,-0.2 -1,-0.1 2,-0.1 2,-0.1 0.856 75.5 54.5 -80.2 -36.0 33.6 107.4 9.2 1068 490 B N S S- 0 0 124 1,-0.2 3,-0.1 3,-0.0 -2,-0.1 -0.213 101.7 -62.2 -97.1 179.6 31.2 106.8 6.2 1069 491 B D - 0 0 148 1,-0.1 -1,-0.2 -2,-0.1 -2,-0.1 -0.162 65.0 -79.7 -62.3 157.3 27.8 105.0 6.0 1070 492 B F - 0 0 80 -4,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.219 53.5-171.0 -44.5 137.7 27.2 101.3 6.7 1071 493 B I - 0 0 124 -3,-0.1 -9,-0.1 -12,-0.0 -1,-0.0 -0.978 56.9 -4.8-144.6 129.2 28.2 99.2 3.8 1072 494 B G S S+ 0 0 59 -2,-0.3 3,-0.1 2,-0.2 -13,-0.1 0.588 105.8 91.7 76.0 8.0 27.7 95.4 3.1 1073 495 B V S S+ 0 0 3 1,-0.1 -18,-2.2 -19,-0.1 2,-0.4 0.518 74.2 59.2-118.6 -11.6 26.1 94.7 6.5 1074 496 B E B +J 1054 0L 114 -20,-0.2 2,-0.3 -15,-0.1 -20,-0.2 -0.982 69.4 155.8-118.9 133.3 22.4 95.2 5.8 1075 497 B F - 0 0 67 -22,-2.2 2,-0.1 -2,-0.4 -2,-0.0 -0.864 40.4 -61.7-148.0 176.7 20.8 93.0 3.2 1076 498 B N - 0 0 148 -2,-0.3 -23,-0.1 1,-0.1 -1,-0.0 -0.344 56.4 -98.3 -69.0 146.7 17.6 91.4 1.8 1077 499 B D - 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0 0 7 -5,-2.5 -1,-0.3 -8,-0.1 -2,-0.2 -0.963 58.3-113.5-117.6 132.7 12.5 69.8 6.5 1090 512 B Q E +i 1116 0K 112 25,-0.7 27,-1.9 -2,-0.4 2,-0.3 -0.424 48.3 171.5 -63.3 141.1 9.7 70.9 8.8 1091 513 B A E -i 1117 0K 32 25,-0.2 2,-0.3 -2,-0.1 27,-0.2 -0.984 27.2-157.1-154.6 157.5 10.0 74.5 9.8 1092 514 B F E -i 1118 0K 35 25,-2.4 27,-3.3 -2,-0.3 2,-0.4 -0.968 8.4-152.3-133.4 153.4 8.5 77.6 11.4 1093 515 B R E -i 1119 0K 78 -2,-0.3 2,-0.3 25,-0.2 27,-0.2 -0.997 19.1-179.2-123.1 132.0 9.0 81.3 11.1 1094 516 B V E +i 1120 0K 3 25,-2.6 27,-3.0 -2,-0.4 3,-0.1 -0.970 22.5 167.3-129.8 147.2 8.3 83.7 14.0 1095 517 B N + 0 0 88 -2,-0.3 -146,-1.7 25,-0.2 2,-0.4 0.356 63.0 68.0-132.6 2.5 8.5 87.4 14.5 1096 518 B K B > S-D 948 0J 81 -148,-0.2 3,-1.9 1,-0.1 4,-0.4 -0.973 73.8-129.9-128.5 139.3 6.7 88.1 17.9 1097 519 B I G > S+ 0 0 4 -150,-2.6 3,-1.8 -2,-0.4 -151,-0.1 0.879 107.2 60.9 -50.5 -41.9 7.7 87.1 21.4 1098 520 B E G 3 S+ 0 0 69 -151,-0.3 4,-0.3 1,-0.3 -1,-0.3 0.632 95.7 62.1 -68.6 -12.7 4.3 85.6 22.1 1099 521 B Q G <> S+ 0 0 63 -3,-1.9 4,-1.5 1,-0.1 -1,-0.3 0.640 84.7 81.8 -81.3 -15.8 4.7 83.1 19.3 1100 522 B L H <> S+ 0 0 0 -3,-1.8 4,-2.9 -4,-0.4 5,-0.4 0.888 79.6 56.6 -64.1 -49.4 7.7 81.4 20.9 1101 523 B P H > S+ 0 0 73 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.918 113.1 39.0 -56.1 -45.8 6.3 78.9 23.5 1102 524 B D H > S+ 0 0 109 -4,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.896 116.8 49.3 -74.1 -38.8 4.1 76.9 21.0 1103 525 B V H X S+ 0 0 16 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.954 113.4 46.5 -62.3 -49.8 6.6 76.9 18.1 1104 526 B F H X S+ 0 0 3 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.874 110.9 53.3 -63.9 -36.5 9.5 75.7 20.4 1105 527 B E H X S+ 0 0 107 -4,-2.1 4,-1.7 -5,-0.4 -1,-0.2 0.920 110.5 47.2 -60.7 -44.3 7.2 73.1 21.9 1106 528 B Q H X S+ 0 0 83 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.902 112.4 49.8 -59.5 -42.7 6.3 71.8 18.4 1107 529 B A H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.905 106.3 55.1 -67.1 -44.3 10.0 71.8 17.5 1108 530 B K H < S+ 0 0 54 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.914 113.2 43.4 -49.8 -47.7 11.0 69.9 20.6 1109 531 B A H >< S+ 0 0 59 -4,-1.7 3,-1.9 1,-0.2 4,-0.2 0.928 112.1 51.0 -70.0 -47.2 8.5 67.1 19.6 1110 532 B I H >X S+ 0 0 29 -4,-2.6 3,-2.3 1,-0.3 4,-2.0 0.913 102.8 61.4 -55.1 -44.6 9.4 67.0 15.9 1111 533 B A T 3< S+ 0 0 13 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.383 80.7 82.7 -71.5 5.1 13.1 66.7 16.8 1112 534 B Q T <4 S+ 0 0 103 -3,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.727 120.3 0.4 -68.4 -22.4 12.3 63.4 18.6 1113 535 B H T <4 S+ 0 0 146 -3,-2.3 -2,-0.2 1,-0.4 -3,-0.1 0.536 130.8 29.7-138.7 -21.2 12.5 61.9 15.0 1114 536 B E S < S- 0 0 75 -4,-2.0 -1,-0.4 -70,-0.1 -75,-0.1 -0.976 80.9 -92.2-147.7 154.1 13.4 64.4 12.4 1115 537 B P - 0 0 5 0, 0.0 -25,-0.7 0, 0.0 2,-0.3 -0.289 41.6-169.0 -65.9 155.6 15.3 67.7 11.9 1116 538 B V E -hi10461090K 0 -71,-2.6 -69,-3.1 -27,-0.1 2,-0.4 -0.983 9.7-149.5-143.4 152.7 13.4 71.0 12.4 1117 539 B L E -hi10471091K 2 -27,-1.9 -25,-2.4 -2,-0.3 2,-0.5 -0.991 5.3-167.5-129.5 137.8 14.1 74.6 11.7 1118 540 B I E -hi10481092K 0 -71,-2.7 -69,-2.6 -2,-0.4 2,-0.8 -0.985 9.5-158.3-118.3 118.8 12.8 77.8 13.4 1119 541 B D E -hi10491093K 0 -27,-3.3 -25,-2.6 -2,-0.5 2,-0.8 -0.866 11.2-162.2 -96.7 104.9 13.5 81.1 11.6 1120 542 B A E -hi10501094K 0 -71,-3.0 -69,-2.4 -2,-0.8 2,-0.8 -0.804 8.0-151.6 -93.3 106.8 13.4 83.8 14.2 1121 543 B V E -h 1051 0K 43 -27,-3.0 -172,-0.3 -2,-0.8 2,-0.2 -0.668 29.5-176.5 -75.1 106.8 12.9 87.3 12.7 1122 544 B I - 0 0 23 -71,-2.1 -172,-0.2 -2,-0.8 -173,-0.1 -0.664 24.3 -98.7-108.3 166.4 14.6 89.4 15.3 1123 545 B T - 0 0 40 -174,-1.7 -172,-0.2 -2,-0.2 -1,-0.1 -0.190 28.0-116.7 -72.6 168.2 15.1 93.2 15.8 1124 546 B G + 0 0 39 -174,-0.1 -1,-0.1 2,-0.1 2,-0.1 0.117 62.3 143.1 -91.2 19.6 18.3 95.1 14.9 1125 547 B D - 0 0 79 1,-0.1 27,-0.0 27,-0.0 26,-0.0 -0.366 53.4-123.6 -55.9 129.6 19.0 96.2 18.5 1126 548 B R - 0 0 11 25,-0.1 2,-0.1 -2,-0.1 -1,-0.1 -0.643 26.8-123.1 -72.7 128.2 22.7 96.2 19.3 1127 549 B P - 0 0 6 0, 0.0 25,-0.1 0, 0.0 -1,-0.0 -0.473 44.8 -78.8 -70.0 148.9 23.4 93.9 22.3 1128 550 B L - 0 0 0 24,-0.2 2,-1.0 1,-0.1 5,-0.1 -0.206 44.8-130.1 -47.7 124.1 25.1 95.6 25.3 1129 551 B P > - 0 0 4 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.697 18.5-168.3 -82.5 106.0 28.8 96.0 24.6 1130 552 B A T 3 S+ 0 0 2 -2,-1.0 3,-0.5 -288,-0.4 -289,-0.1 0.736 88.3 57.0 -65.6 -21.1 30.6 94.7 27.6 1131 553 B E T 3 S+ 0 0 65 1,-0.2 -1,-0.3 -289,-0.1 -289,-0.1 0.443 109.7 45.2 -86.1 -3.1 33.9 96.2 26.3 1132 554 B K S < S+ 0 0 57 -3,-1.9 -1,-0.2 2,-0.0 2,-0.2 -0.343 77.3 169.8-135.3 53.1 32.3 99.8 26.1 1133 555 B L - 0 0 30 -3,-0.5 2,-0.3 -5,-0.1 3,-0.1 -0.472 15.4-174.6 -68.1 133.8 30.5 100.1 29.5 1134 556 B R + 0 0 101 -2,-0.2 15,-0.3 11,-0.1 14,-0.1 -0.751 51.4 101.1-127.3 82.6 29.2 103.6 30.3 1135 557 B L + 0 0 14 -2,-0.3 2,-0.7 1,-0.1 -1,-0.1 0.483 51.8 90.9-135.9 -18.2 27.8 103.2 33.9 1136 558 B D >> - 0 0 10 -3,-0.1 4,-2.5 1,-0.1 3,-1.9 -0.831 56.8-155.0-101.6 111.1 30.5 104.6 36.2 1137 559 B S T 34 S+ 0 0 107 -2,-0.7 -1,-0.1 1,-0.3 5,-0.1 0.680 96.5 54.9 -45.6 -32.9 30.2 108.4 37.2 1138 560 B A T 34 S+ 0 0 94 1,-0.1 -1,-0.3 3,-0.1 3,-0.1 0.667 118.0 32.9 -82.8 -17.5 33.9 108.5 37.9 1139 561 B M T <4 S+ 0 0 131 -3,-1.9 2,-0.3 1,-0.2 -2,-0.2 0.651 120.1 37.9-111.0 -23.0 34.9 107.2 34.4 1140 562 B S S < S- 0 0 23 -4,-2.5 -1,-0.2 2,-0.0 2,-0.1 -0.926 81.5-100.4-133.5 158.1 32.2 108.5 32.1 1141 563 B S > - 0 0 58 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.406 33.1-118.3 -72.6 152.4 30.1 111.7 31.6 1142 564 B A H > S+ 0 0 79 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.827 116.5 53.6 -58.8 -35.8 26.5 111.7 32.8 1143 565 B A H > S+ 0 0 74 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.911 107.5 50.5 -64.9 -44.9 25.3 112.2 29.2 1144 566 B D H > S+ 0 0 84 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.873 111.9 48.3 -58.5 -42.4 27.3 109.2 28.1 1145 567 B I H X S+ 0 0 12 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.909 109.9 49.7 -65.5 -47.8 25.7 107.1 30.9 1146 568 B E H X S+ 0 0 122 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.920 112.1 49.4 -62.7 -38.7 22.2 108.2 30.2 1147 569 B A H X S+ 0 0 61 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.913 113.1 46.2 -61.9 -45.8 22.6 107.4 26.5 1148 570 B F H X S+ 0 0 11 -4,-1.9 4,-2.4 2,-0.2 6,-0.4 0.941 111.8 51.0 -64.0 -47.2 24.1 103.9 27.2 1149 571 B K H <>S+ 0 0 36 -4,-2.9 5,-1.7 -15,-0.3 6,-0.5 0.894 113.4 46.7 -57.9 -41.4 21.3 103.1 29.7 1150 572 B Q H ><5S+ 0 0 136 -4,-2.0 3,-1.1 -5,-0.2 -2,-0.2 0.956 114.0 44.8 -64.8 -52.4 18.7 104.1 27.2 1151 573 B R H 3<5S+ 0 0 113 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.887 120.7 38.3 -63.2 -36.2 20.1 102.2 24.2 1152 574 B Y T 3<5S- 0 0 12 -4,-2.4 -1,-0.2 -5,-0.2 -24,-0.2 0.216 104.6-117.2-107.8 17.7 20.8 99.0 26.1 1153 575 B E T < 5S+ 0 0 58 -3,-1.1 3,-0.3 -4,-0.3 -3,-0.2 0.837 72.7 139.1 51.0 39.7 17.7 98.9 28.4 1154 576 B A > < + 0 0 0 -5,-1.7 3,-1.6 -6,-0.4 -4,-0.2 -0.001 10.0 124.1-108.0 20.8 20.4 99.1 31.1 1155 577 B Q T 3 S+ 0 0 86 -6,-0.5 -1,-0.2 1,-0.3 -6,-0.1 0.833 78.7 45.7 -53.6 -37.4 18.7 101.6 33.6 1156 578 B D T 3 S+ 0 0 136 -3,-0.3 2,-0.3 -7,-0.1 -1,-0.3 0.380 87.5 108.6 -92.1 4.2 19.0 99.1 36.5 1157 579 B L < - 0 0 1 -3,-1.6 -223,-0.1 -221,-0.1 -227,-0.0 -0.663 52.6-159.6 -79.7 136.1 22.7 98.1 35.9 1158 580 B Q - 0 0 67 -2,-0.3 -22,-0.1 -228,-0.1 2,-0.1 -0.911 20.8-113.6-112.0 145.9 25.2 99.4 38.4 1159 581 B P >> - 0 0 8 0, 0.0 3,-1.4 0, 0.0 4,-0.8 -0.368 31.9-110.4 -72.3 154.1 28.9 99.6 37.7 1160 582 B L H >> S+ 0 0 5 1,-0.2 4,-2.4 2,-0.2 3,-1.1 0.879 114.0 69.7 -52.3 -40.5 31.2 97.3 39.8 1161 583 B S H 3> S+ 0 0 6 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.802 90.9 61.1 -49.9 -33.5 32.5 100.4 41.8 1162 584 B T H <> S+ 0 0 45 -3,-1.4 4,-2.1 2,-0.2 -1,-0.3 0.921 110.0 40.2 -60.0 -44.7 29.1 100.8 43.4 1163 585 B Y H S+ 0 0 0 -4,-2.4 5,-3.1 1,-0.2 3,-0.3 0.959 112.5 42.5 -54.3 -52.0 33.1 97.9 45.7 1165 587 B K H ><5S+ 0 0 137 -4,-3.0 3,-1.8 3,-0.2 -2,-0.2 0.895 108.2 61.4 -59.1 -42.5 32.2 101.0 47.7 1166 588 B Q H 3<5S+ 0 0 121 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.887 110.6 38.3 -52.8 -44.9 29.2 99.2 49.3 1167 589 B F T 3<5S- 0 0 65 -4,-2.0 -1,-0.3 -3,-0.3 -2,-0.2 0.195 127.4 -96.4 -95.8 14.1 31.5 96.6 50.9 1168 590 B G T < 5S+ 0 0 68 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.751 80.2 124.2 83.4 30.6 34.2 99.2 51.7 1169 591 B L < - 0 0 46 -5,-3.1 -1,-0.2 -6,-0.2 2,-0.2 -0.841 42.5-146.8-116.4 156.1 36.7 99.0 48.9 1170 592 B D 0 0 130 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.582 360.0 360.0-108.8 178.9 38.2 101.4 46.3 1171 593 B D 0 0 96 -2,-0.2 -1,-0.1 -10,-0.0 -317,-0.1 -0.073 360.0 360.0 -91.1 360.0 39.4 101.2 42.6