==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 26-FEB-07 2OZL . COMPND 2 MOLECULE: PYRUVATE DEHYDROGENASE E1 COMPONENT ALPHA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.M.CISZAK,P.M.DOMINIAK,M.S.PATEL,L.G.KOROTCHKINA . 1384 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43052.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 981 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 130 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.1 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.1 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 . 98 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 151 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 437 31.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 30 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 7 8 2 0 2 2 0 8 4 6 0 4 2 0 0 0 0 0 0 0 2 0 2 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 10 2 8 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 PARALLEL BRIDGES PER LADDER . 4 4 5 3 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 ANTIPARALLEL BRIDGES PER LADDER . 8 0 0 0 2 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 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 0 A S 0 0 161 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -45.2 -19.9 -51.6 84.2 2 1 A F - 0 0 65 299,-0.1 299,-0.2 1,-0.1 2,-0.2 -0.439 360.0-117.1 -72.6 141.4 -18.1 -48.3 83.9 3 2 A A - 0 0 31 297,-2.5 3,-0.1 296,-0.2 -1,-0.1 -0.534 14.7-146.5 -72.9 143.2 -16.8 -46.6 87.0 4 3 A N S S- 0 0 123 1,-0.3 26,-2.4 -2,-0.2 27,-0.4 0.650 78.0 -0.4 -86.8 -14.7 -18.5 -43.2 87.5 5 4 A D E -A 29 0A 86 24,-0.3 2,-0.3 294,-0.1 -1,-0.3 -0.975 62.6-167.0-165.9 158.9 -15.4 -41.7 89.1 6 5 A A E -A 28 0A 18 22,-2.1 22,-2.8 -2,-0.3 2,-0.4 -0.988 21.1-120.2-152.3 155.3 -11.8 -42.6 90.0 7 6 A T E -A 27 0A 89 -2,-0.3 2,-0.3 20,-0.2 20,-0.2 -0.808 28.5-173.0-102.0 138.7 -8.9 -41.2 92.1 8 7 A F E -A 26 0A 27 18,-2.6 18,-2.0 -2,-0.4 2,-0.3 -0.947 21.5-125.1-131.9 153.3 -5.5 -40.4 90.6 9 8 A E E -A 25 0A 171 -2,-0.3 2,-0.3 16,-0.2 16,-0.2 -0.747 26.6-167.7 -95.1 141.6 -2.2 -39.3 91.9 10 9 A I - 0 0 12 14,-1.7 3,-0.1 -2,-0.3 -2,-0.0 -0.973 32.7 -89.2-131.4 145.5 -0.6 -36.1 90.5 11 10 A K - 0 0 131 -2,-0.3 216,-0.2 1,-0.1 2,-0.2 -0.216 45.8-113.5 -52.9 134.6 3.0 -34.8 90.9 12 11 A K - 0 0 147 12,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.509 34.7-119.3 -70.6 136.9 3.4 -32.5 93.9 13 12 A C - 0 0 9 9,-0.3 2,-0.3 -2,-0.2 213,-0.2 -0.542 18.2-118.6 -80.5 142.6 4.1 -28.9 92.9 14 13 A D E -B 225 0B 66 211,-1.0 211,-2.2 -2,-0.2 2,-0.3 -0.611 39.2-142.9 -75.3 140.3 7.4 -27.2 93.8 15 14 A L E -B 224 0B 51 -2,-0.3 2,-0.4 209,-0.2 209,-0.2 -0.830 21.2-165.3-116.2 150.1 6.5 -24.2 96.0 16 15 A H E S-B 223 0B 27 207,-2.5 207,-2.1 -2,-0.3 3,-0.1 -0.985 82.7 -17.2-130.3 116.5 7.7 -20.6 96.4 17 16 A R S S+ 0 0 159 -2,-0.4 2,-0.4 205,-0.2 -1,-0.1 0.855 106.4 118.5 55.8 40.8 6.6 -18.7 99.5 18 17 A L - 0 0 32 1,-0.1 -1,-0.2 205,-0.1 3,-0.1 -0.998 53.6-157.9-137.9 131.8 3.7 -21.1 100.1 19 18 A E S S+ 0 0 192 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.937 85.0 14.6 -71.4 -49.4 3.2 -23.3 103.2 20 19 A E - 0 0 163 3,-0.0 -1,-0.2 0, 0.0 0, 0.0 -0.949 69.9-163.4-128.9 149.4 0.9 -25.8 101.4 21 20 A G - 0 0 22 -2,-0.3 3,-0.1 1,-0.3 -6,-0.0 -0.358 44.4 -47.5-115.0-164.7 0.2 -26.4 97.7 22 21 A P S S- 0 0 13 0, 0.0 -1,-0.3 0, 0.0 -9,-0.3 -0.221 72.8 -88.3 -63.1 158.3 -2.4 -28.2 95.7 23 22 A P - 0 0 69 0, 0.0 -10,-0.1 0, 0.0 217,-0.1 -0.258 24.8-134.3 -65.7 158.4 -3.4 -31.7 96.8 24 23 A V S S+ 0 0 70 -3,-0.1 -14,-1.7 -12,-0.1 2,-0.3 0.181 88.3 50.8 -98.4 16.8 -1.4 -34.6 95.4 25 24 A T E +A 9 0A 67 -16,-0.2 2,-0.3 -14,-0.1 -16,-0.2 -0.987 64.0 175.0-149.8 146.8 -4.6 -36.6 94.7 26 25 A T E -A 8 0A 14 -18,-2.0 -18,-2.6 -2,-0.3 2,-0.4 -0.991 27.0-118.2-153.6 158.8 -7.8 -35.8 92.9 27 26 A V E -A 7 0A 69 -2,-0.3 2,-0.5 -20,-0.2 -20,-0.2 -0.861 20.8-167.5-104.7 132.9 -11.1 -37.3 91.7 28 27 A L E -A 6 0A 0 -22,-2.8 -22,-2.1 -2,-0.4 2,-0.2 -0.974 11.9-147.0-118.3 126.7 -12.1 -37.5 88.0 29 28 A T E > -A 5 0A 49 -2,-0.5 4,-2.4 -24,-0.2 -24,-0.3 -0.565 23.4-117.4 -89.0 159.4 -15.6 -38.3 87.0 30 29 A R H > S+ 0 0 57 -26,-2.4 4,-2.4 1,-0.2 5,-0.2 0.924 115.2 51.9 -60.0 -46.2 -16.5 -40.3 83.9 31 30 A E H > S+ 0 0 152 -27,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.900 112.2 44.7 -58.1 -45.4 -18.4 -37.3 82.5 32 31 A D H > S+ 0 0 34 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.885 112.0 52.9 -67.7 -39.3 -15.6 -34.9 83.0 33 32 A G H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.914 108.0 50.6 -62.2 -43.3 -13.0 -37.3 81.6 34 33 A L H X S+ 0 0 39 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.871 112.4 47.8 -62.1 -38.4 -15.0 -37.8 78.4 35 34 A K H X S+ 0 0 111 -4,-1.6 4,-2.6 -5,-0.2 -2,-0.2 0.948 112.5 46.9 -69.3 -49.0 -15.2 -34.0 78.0 36 35 A Y H X S+ 0 0 5 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.905 112.3 50.6 -60.3 -42.5 -11.5 -33.3 78.6 37 36 A Y H X S+ 0 0 6 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.956 112.5 46.0 -60.6 -49.6 -10.5 -36.1 76.3 38 37 A R H X S+ 0 0 81 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.891 113.3 50.8 -60.3 -41.4 -12.7 -34.8 73.5 39 38 A M H X S+ 0 0 32 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.932 112.5 43.8 -63.6 -48.5 -11.5 -31.2 74.0 40 39 A M H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.909 113.9 51.0 -64.6 -41.6 -7.8 -32.0 73.9 41 40 A Q H X S+ 0 0 22 -4,-2.5 4,-2.4 -5,-0.3 -1,-0.2 0.847 108.3 53.0 -64.1 -34.4 -8.3 -34.3 70.9 42 41 A T H X S+ 0 0 2 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.2 0.909 109.6 48.1 -67.1 -41.3 -10.2 -31.5 69.1 43 42 A V H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.918 111.3 51.7 -63.7 -42.8 -7.3 -29.1 69.8 44 43 A R H X S+ 0 0 23 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.935 112.4 43.2 -59.7 -50.2 -4.8 -31.7 68.5 45 44 A R H X S+ 0 0 56 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.849 111.3 56.0 -67.8 -32.4 -6.6 -32.4 65.2 46 45 A M H X S+ 0 0 0 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.928 109.6 45.8 -64.9 -43.0 -7.3 -28.7 64.7 47 46 A E H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.899 112.5 49.5 -67.3 -40.6 -3.6 -27.9 64.9 48 47 A L H X S+ 0 0 56 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.888 112.1 49.3 -65.6 -36.7 -2.6 -30.8 62.6 49 48 A K H X S+ 0 0 20 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.925 108.3 53.5 -66.4 -42.9 -5.2 -29.5 60.1 50 49 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.892 106.5 53.2 -57.3 -41.5 -3.8 -26.0 60.4 51 50 A D H X S+ 0 0 27 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.947 110.1 47.1 -58.2 -51.1 -0.3 -27.4 59.6 52 51 A Q H X S+ 0 0 83 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.920 111.9 49.8 -57.5 -48.1 -1.6 -29.0 56.4 53 52 A L H <>S+ 0 0 4 -4,-2.7 5,-2.4 1,-0.2 6,-0.8 0.861 107.9 54.4 -61.7 -36.8 -3.5 -25.9 55.3 54 53 A Y H ><5S+ 0 0 49 -4,-2.2 3,-2.2 1,-0.2 -1,-0.2 0.935 105.6 51.3 -64.2 -45.4 -0.5 -23.7 55.8 55 54 A K H 3<5S+ 0 0 149 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.818 107.1 55.1 -61.0 -29.1 1.7 -26.0 53.6 56 55 A Q T 3<5S- 0 0 106 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.370 117.1-119.2 -83.7 4.4 -1.1 -25.6 51.0 57 56 A K T < 5S+ 0 0 168 -3,-2.2 -3,-0.2 2,-0.2 -2,-0.1 0.621 83.9 119.8 67.3 15.3 -0.7 -21.8 51.3 58 57 A I S + 0 0 7 -2,-0.3 3,-2.3 -23,-0.1 193,-0.1 0.220 36.8 140.0-107.6 12.7 0.2 -25.6 70.3 67 66 A D T 3 S+ 0 0 1 1,-0.3 194,-1.9 2,-0.2 195,-0.4 -0.368 70.4 34.9 -61.0 132.8 0.1 -29.4 69.9 68 67 A G T 3 S+ 0 0 0 192,-0.2 191,-0.3 193,-0.1 3,-0.3 -0.043 108.3 71.7 111.1 -26.2 1.8 -31.1 72.8 69 68 A Q X> + 0 0 7 -3,-2.3 3,-1.6 1,-0.2 4,-0.9 0.143 57.9 116.0-105.3 17.9 0.6 -28.4 75.1 70 69 A E H 3> + 0 0 0 1,-0.3 4,-1.8 2,-0.2 5,-0.4 0.725 65.0 66.9 -62.2 -24.0 -3.1 -29.4 75.2 71 70 A A H 3> S+ 0 0 0 157,-0.3 4,-1.0 -3,-0.3 -1,-0.3 0.757 100.1 56.6 -68.1 -19.9 -3.1 -30.3 78.9 72 71 A C H <> S+ 0 0 0 -3,-1.6 4,-2.5 156,-0.2 5,-0.2 0.971 109.8 36.2 -76.2 -57.2 -2.5 -26.5 79.4 73 72 A C H X S+ 0 0 2 -4,-0.9 4,-1.7 2,-0.2 -2,-0.2 0.912 126.2 39.5 -66.2 -40.6 -5.5 -24.9 77.7 74 73 A V H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.906 117.3 49.3 -75.0 -40.4 -8.0 -27.7 78.6 75 74 A G H X S+ 0 0 0 -4,-1.0 4,-0.8 -5,-0.4 -2,-0.2 0.906 111.9 49.0 -63.5 -42.1 -6.6 -28.1 82.1 76 75 A L H >< S+ 0 0 0 -4,-2.5 3,-0.7 1,-0.2 4,-0.3 0.907 112.0 48.3 -64.1 -43.6 -6.8 -24.3 82.7 77 76 A E H >< S+ 0 0 33 -4,-1.7 3,-1.4 1,-0.2 -2,-0.2 0.897 106.2 57.8 -63.7 -40.2 -10.3 -24.2 81.4 78 77 A A H 3< S+ 0 0 18 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.712 106.3 50.7 -63.0 -21.4 -11.4 -27.1 83.6 79 78 A G T << S+ 0 0 8 -4,-0.8 -1,-0.3 -3,-0.7 2,-0.2 0.388 108.1 53.5-100.5 3.7 -10.2 -25.2 86.7 80 79 A I S < S- 0 0 14 -3,-1.4 159,-0.1 -4,-0.3 158,-0.0 -0.760 79.9-105.6-129.2 176.5 -12.0 -21.9 86.1 81 80 A N > - 0 0 76 -2,-0.2 3,-1.7 1,-0.1 -2,-0.1 -0.634 28.6-117.5-100.1 160.0 -15.6 -20.6 85.5 82 81 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 0.795 117.4 60.7 -66.9 -22.0 -16.9 -19.3 82.1 83 82 A T T 3 S+ 0 0 71 2,-0.1 2,-0.1 77,-0.0 48,-0.1 0.495 90.0 89.5 -81.4 -5.1 -17.3 -16.0 83.9 84 83 A D S < S- 0 0 0 -3,-1.7 2,-0.3 76,-0.1 78,-0.2 -0.387 76.1-120.1 -85.1 172.0 -13.6 -15.8 84.7 85 84 A H E -c 162 0B 16 76,-2.9 78,-2.6 -2,-0.1 2,-0.3 -0.831 24.7-177.5-119.9 154.8 -11.1 -14.1 82.3 86 85 A L E +cd 163 132B 0 45,-1.5 47,-2.0 -2,-0.3 2,-0.3 -0.999 5.0 176.3-151.0 145.4 -8.0 -15.2 80.3 87 86 A I E +c 164 0B 0 76,-2.0 78,-2.6 -2,-0.3 48,-0.2 -0.992 10.8 161.6-148.0 143.6 -5.4 -13.7 78.0 88 87 A T - 0 0 1 46,-2.5 48,-0.1 -2,-0.3 78,-0.1 -0.734 35.9 -88.6-145.0-166.7 -2.3 -15.1 76.3 89 88 A A - 0 0 13 -2,-0.2 47,-0.9 46,-0.2 -1,-0.3 0.357 65.2 -63.3 -88.0-137.5 0.2 -14.6 73.5 90 89 A Y S S+ 0 0 44 45,-0.3 2,-1.8 1,-0.2 -26,-0.4 0.596 113.2 80.7 -93.7 -15.6 0.0 -15.7 69.9 91 90 A R + 0 0 17 1,-0.2 4,-0.2 45,-0.1 -1,-0.2 -0.476 64.7 126.3 -88.9 65.3 0.1 -19.5 70.3 92 91 A A > + 0 0 3 -2,-1.8 4,-2.5 32,-0.3 5,-0.2 0.301 17.5 107.0-111.7 9.5 -3.6 -19.3 71.1 93 92 A H H > S+ 0 0 0 -29,-0.4 4,-1.5 -3,-0.2 5,-0.1 0.916 87.1 49.1 -55.1 -44.6 -5.7 -21.7 68.9 94 93 A G H > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 3,-0.3 0.930 111.7 47.5 -60.2 -47.9 -6.3 -24.0 71.8 95 94 A F H > S+ 0 0 6 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.869 105.8 58.7 -63.1 -37.2 -7.4 -21.3 74.1 96 95 A T H <>S+ 0 0 1 -4,-2.5 5,-2.0 1,-0.2 -1,-0.2 0.887 112.2 41.4 -60.5 -36.9 -9.7 -19.8 71.5 97 96 A F H ><5S+ 0 0 36 -4,-1.5 3,-1.6 -3,-0.3 -2,-0.2 0.919 112.9 50.5 -77.0 -45.2 -11.6 -23.1 71.4 98 97 A T H 3<5S+ 0 0 10 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.819 107.1 57.9 -63.4 -28.7 -11.6 -23.9 75.1 99 98 A R T 3<5S- 0 0 20 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.528 131.6 -83.3 -79.5 -7.1 -13.0 -20.4 75.7 100 99 A G T < 5S+ 0 0 61 -3,-1.6 -3,-0.2 1,-0.3 2,-0.2 0.358 83.5 124.9 129.7 -13.8 -16.0 -21.1 73.4 101 100 A L < - 0 0 23 -5,-2.0 -1,-0.3 1,-0.1 2,-0.1 -0.520 57.2-116.5 -81.5 149.3 -15.4 -20.5 69.7 102 101 A S > - 0 0 49 -2,-0.2 4,-1.8 1,-0.1 3,-0.2 -0.415 19.8-116.3 -81.1 159.8 -16.1 -23.3 67.2 103 102 A V H > S+ 0 0 3 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.856 116.2 61.2 -60.8 -33.0 -13.4 -24.9 65.1 104 103 A R H > S+ 0 0 99 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.907 105.6 42.8 -59.9 -47.4 -15.3 -23.5 62.1 105 104 A E H > S+ 0 0 74 -3,-0.2 12,-1.8 2,-0.2 4,-0.7 0.816 115.9 50.3 -70.8 -32.7 -14.8 -19.8 63.2 106 105 A I H >X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 3,-0.6 0.954 113.0 43.1 -71.1 -52.0 -11.2 -20.5 64.2 107 106 A L H 3X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.868 111.2 55.8 -63.3 -36.1 -10.2 -22.2 60.9 108 107 A A H 3<>S+ 0 0 0 -4,-1.9 5,-3.1 -5,-0.3 8,-0.5 0.750 107.5 50.2 -68.2 -23.4 -12.0 -19.6 58.8 109 108 A E H X<5S+ 0 0 0 -4,-0.7 3,-1.3 -3,-0.6 -1,-0.2 0.895 109.0 50.9 -79.5 -41.2 -10.0 -16.9 60.5 110 109 A L H 3<5S+ 0 0 0 -4,-2.0 -50,-0.6 1,-0.3 14,-0.2 0.865 112.2 47.1 -62.4 -35.5 -6.8 -18.7 59.8 111 110 A T T 3<5S- 0 0 10 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.426 115.8-119.7 -86.8 3.0 -7.8 -19.0 56.2 112 111 A G T < 5 + 0 0 2 -3,-1.3 -3,-0.2 1,-0.2 2,-0.2 0.895 58.8 148.9 63.1 47.3 -8.8 -15.3 56.1 113 112 A R > < - 0 0 45 -5,-3.1 3,-1.7 217,-0.2 217,-0.3 -0.635 61.1-106.2-110.4 168.0 -12.5 -15.6 55.3 114 113 A K T 3 S+ 0 0 100 215,-2.7 216,-0.1 1,-0.3 5,-0.1 0.817 117.1 57.4 -58.0 -36.1 -15.6 -13.6 56.0 115 114 A G T 3 S+ 0 0 22 214,-0.4 -1,-0.3 209,-0.1 -6,-0.2 0.426 80.4 121.7 -78.4 1.6 -16.9 -16.3 58.5 116 115 A G S X S- 0 0 6 -3,-1.7 3,-1.9 -8,-0.5 -10,-0.2 -0.257 79.2-112.8 -62.0 154.2 -13.7 -16.0 60.6 117 116 A C T 3 S+ 0 0 20 -12,-1.8 -1,-0.1 1,-0.3 -11,-0.1 0.737 123.1 34.6 -61.2 -21.5 -14.2 -15.0 64.2 118 117 A A T > S- 0 0 1 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-6.6 91.1 184 183 A A H <5S+ 0 0 21 -4,-2.1 3,-0.5 -5,-0.2 -1,-0.2 0.867 112.7 55.1 -75.8 -37.2 1.2 -7.4 94.5 185 184 A L H <5S+ 0 0 43 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.897 120.5 29.8 -61.8 -43.4 0.8 -3.8 95.6 186 185 A W T <5S- 0 0 42 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.288 104.9-124.5-102.1 10.0 -2.9 -3.7 94.9 187 186 A K T 5 - 0 0 124 -3,-0.5 63,-0.4 -4,-0.3 -3,-0.2 0.919 39.4-171.9 45.6 55.6 -3.6 -7.4 95.6 188 187 A L < - 0 0 0 -5,-2.2 2,-2.6 -6,-0.1 -1,-0.2 -0.552 33.2-118.9 -77.9 141.1 -5.1 -8.0 92.1 189 188 A P + 0 0 15 0, 0.0 -27,-1.9 0, 0.0 2,-0.5 -0.340 65.7 143.6 -77.2 60.1 -6.8 -11.4 91.5 190 189 A C E -f 162 0B 0 -2,-2.6 62,-1.5 -29,-0.2 2,-0.8 -0.896 41.3-157.2-108.8 127.8 -4.2 -12.1 88.7 191 190 A I E -fg 163 252B 1 -29,-2.8 -27,-3.1 -2,-0.5 2,-0.5 -0.875 12.1-155.0-104.8 103.2 -2.8 -15.5 88.0 192 191 A F E -fg 164 253B 0 60,-1.9 62,-2.4 -2,-0.8 2,-0.5 -0.664 14.1-168.2 -77.7 125.7 0.5 -15.1 86.2 193 192 A I E -fg 165 254B 0 -29,-3.4 -27,-2.4 -2,-0.5 2,-0.7 -0.960 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910,-0.0 5,-0.1 -0.871 68.0-135.5-105.8 116.7 17.0 -20.0 72.4 204 203 A S E >> -I 199 0C 18 -2,-0.6 4,-1.0 -5,-0.2 3,-0.7 -0.155 26.0-110.8 -61.1 159.6 16.9 -22.6 75.2 205 204 A V H >> S+ 0 0 11 -7,-1.6 4,-2.7 1,-0.2 3,-0.6 0.896 116.5 58.7 -61.5 -38.6 16.0 -21.4 78.7 206 205 A E H 34 S+ 0 0 123 1,-0.2 -1,-0.2 -8,-0.2 -7,-0.1 0.792 109.1 44.2 -62.9 -27.3 19.5 -22.0 80.0 207 206 A R H <4 S+ 0 0 74 -3,-0.7 -1,-0.2 1,-0.1 -2,-0.2 0.624 120.4 39.9 -92.0 -12.9 20.9 -19.6 77.4 208 207 A A H << S+ 0 0 8 -4,-1.0 2,-0.5 -3,-0.6 -2,-0.2 0.737 111.5 49.5-106.2 -28.5 18.3 -16.9 77.9 209 208 A A < - 0 0 2 -4,-2.7 -1,-0.2 -5,-0.2 3,-0.1 -0.956 58.6-152.0-122.1 127.8 17.7 -16.8 81.6 210 209 A A S S+ 0 0 42 -2,-0.5 2,-0.5 1,-0.2 -1,-0.1 0.867 98.9 34.7 -57.9 -36.6 20.3 -16.5 84.4 211 210 A S - 0 0 21 -3,-0.1 -1,-0.2 1,-0.1 6,-0.0 -0.987 67.3-167.0-121.8 125.6 17.8 -18.3 86.6 212 211 A T + 0 0 56 -2,-0.5 2,-1.4 1,-0.1 3,-0.2 0.226 61.6 103.7 -96.3 13.9 15.5 -21.0 85.0 213 212 A D > + 0 0 45 1,-0.2 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0.763 108.2 28.9 -82.7 -25.9 18.7 -26.6 64.8 273 272 A Y S S+ 0 0 44 1,-0.2 2,-0.3 818,-0.0 -1,-0.1 0.382 129.2 30.2-113.4 -1.2 18.6 -26.1 68.5 274 273 A R S S- 0 0 12 -70,-0.0 2,-0.2 4,-0.0 -1,-0.2 -0.983 81.1-107.1-154.5 155.1 17.2 -29.5 69.7 275 274 A T > - 0 0 75 -2,-0.3 4,-1.4 1,-0.1 3,-0.4 -0.534 19.5-127.5 -88.2 153.7 17.4 -33.1 68.5 276 275 A R H > S+ 0 0 185 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.823 111.4 60.1 -65.3 -30.6 14.6 -35.0 66.9 277 276 A E H > S+ 0 0 117 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.832 100.4 54.7 -67.5 -32.2 15.1 -37.7 69.5 278 277 A E H > S+ 0 0 38 -3,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.944 109.2 47.3 -65.5 -47.1 14.4 -35.3 72.2 279 278 A I H X S+ 0 0 16 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.930 113.9 45.8 -59.8 -49.4 11.0 -34.4 70.7 280 279 A Q H X S+ 0 0 101 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.822 108.3 57.0 -66.6 -31.3 9.9 -38.0 70.1 281 280 A E H X S+ 0 0 102 -4,-1.8 4,-1.3 2,-0.2 5,-0.2 0.914 107.8 48.0 -65.6 -41.4 11.0 -39.0 73.6 282 281 A V H X S+ 0 0 13 -4,-1.8 4,-3.4 2,-0.2 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313 A V H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.929 108.5 53.4 -66.0 -46.0 -13.7 -35.2 66.3 315 314 A R H X S+ 0 0 121 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.902 111.3 47.0 -57.0 -41.8 -11.9 -36.0 63.0 316 315 A K H X S+ 0 0 134 -4,-2.0 4,-2.9 2,-0.2 5,-0.3 0.882 108.8 54.0 -68.2 -38.5 -15.2 -35.4 61.1 317 316 A E H X S+ 0 0 81 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.928 111.0 47.4 -60.3 -43.8 -15.9 -32.2 63.0 318 317 A I H X S+ 0 0 2 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.937 113.0 47.6 -62.5 -48.7 -12.4 -30.9 61.9 319 318 A E H X S+ 0 0 81 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.901 112.0 48.8 -61.9 -41.5 -12.9 -32.0 58.3 320 319 A D H X S+ 0 0 72 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.861 113.6 48.9 -66.2 -33.9 -16.4 -30.4 58.1 321 320 A A H X S+ 0 0 2 -4,-1.9 4,-2.5 -5,-0.3 -2,-0.2 0.903 109.9 49.5 -71.4 -42.6 -14.9 -27.2 59.6 322 321 A A H X S+ 0 0 4 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.830 107.6 56.0 -66.0 -31.7 -11.9 -27.1 57.2 323 322 A Q H X S+ 0 0 124 -4,-1.8 4,-1.4 -5,-0.2 -1,-0.2 0.936 110.8 43.9 -64.9 -45.1 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23.8 22.9 76.3 816 121 C G S S- 0 0 1 -4,-0.2 3,-0.4 -149,-0.2 4,-0.3 0.828 80.7-166.1-100.9 -37.8 22.9 20.3 79.0 817 122 C G > - 0 0 0 1,-0.2 3,-0.7 -14,-0.2 -13,-0.2 -0.363 56.6 -28.1 82.6-164.5 22.0 22.0 82.3 818 123 C S T 3 S+ 0 0 4 -62,-0.4 -32,-0.3 -64,-0.2 -1,-0.2 0.848 135.7 46.7 -57.6 -43.1 21.6 20.3 85.7 819 124 C M T 3 S+ 0 0 8 -3,-0.4 10,-0.6 1,-0.2 2,-0.5 0.620 107.4 57.6 -80.3 -13.6 20.6 16.8 84.5 820 125 C H < + 0 0 0 -3,-0.7 2,-0.3 -4,-0.3 -1,-0.2 -0.826 61.4 135.1-127.5 96.5 23.3 16.4 81.8 821 126 C M - 0 0 3 -2,-0.5 2,-0.3 -3,-0.1 7,-0.2 -0.995 26.8-166.7-138.0 141.1 27.0 16.6 82.7 822 127 C Y + 0 0 12 -2,-0.3 2,-0.3 5,-0.1 5,-0.2 -0.938 10.6 165.8-132.0 153.0 29.9 14.4 81.7 823 128 C A B > -F 826 0J 19 3,-1.6 3,-2.6 -2,-0.3 2,-0.1 -0.885 55.0 -45.9-150.6 177.3 33.5 13.8 82.7 824 129 C K T 3 S- 0 0 153 1,-0.3 3,-0.1 -2,-0.3 -29,-0.1 -0.330 128.8 -10.4 -54.8 119.3 36.3 11.2 82.2 825 130 C N T 3 S+ 0 0 17 1,-0.2 -45,-1.9 -2,-0.1 2,-0.5 0.765 112.1 113.8 58.4 26.6 34.7 7.8 82.8 826 131 C F B < -eF 780 823J 1 -3,-2.6 -3,-1.6 -47,-0.2 -45,-0.2 -0.981 46.7-170.6-128.0 115.1 31.5 9.5 84.1 827 132 C Y - 0 0 13 -47,-2.3 -5,-0.1 -2,-0.5 -46,-0.1 -0.040 39.8-138.1-101.3 33.5 28.5 9.0 81.8 828 133 C G - 0 0 0 -7,-0.2 -46,-2.8 -48,-0.2 -1,-0.3 -0.234 22.9 -24.9 91.2 177.6 26.0 11.4 83.3 829 134 C G - 0 0 1 -10,-0.6 2,-0.4 -48,-0.2 -45,-0.3 -0.482 51.0-166.4 89.3 65.4 23.6 12.6 84.3 830 135 C N - 0 0 5 -47,-0.6 -46,-0.2 -2,-0.2 4,-0.1 -0.992 12.1-162.7-136.9 127.0 20.5 11.0 82.7 831 136 C G + 0 0 5 -2,-0.4 2,-0.8 -48,-0.2 -47,-0.1 0.551 67.5 84.7 -88.1 -9.6 17.0 12.3 82.9 832 137 C I S >> S- 0 0 3 321,-0.1 3,-1.7 317,-0.0 4,-0.5 -0.844 87.8-116.7 -97.5 110.9 14.9 9.3 81.9 833 138 C V T 34 S+ 0 0 33 -2,-0.8 -2,-0.1 1,-0.3 27,-0.1 -0.174 93.0 2.4 -49.3 121.7 14.3 7.2 85.0 834 139 C G T >4 S+ 0 0 0 -4,-0.1 3,-1.7 35,-0.1 -1,-0.3 0.037 98.3 106.3 91.5 -26.4 15.9 3.7 84.7 835 140 C A T <> S+ 0 0 2 -3,-1.7 4,-1.1 1,-0.3 -2,-0.1 0.809 71.9 62.1 -57.2 -32.5 17.5 4.3 81.3 836 141 C Q H 3X S+ 0 0 1 -4,-0.5 4,-2.2 1,-0.2 -1,-0.3 0.649 90.2 70.2 -70.6 -14.2 21.0 4.6 82.7 837 142 C V H <> S+ 0 0 0 -3,-1.7 4,-2.2 2,-0.2 5,-0.2 0.965 100.3 42.3 -71.1 -51.1 20.9 1.0 84.1 838 143 C P H > S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.903 114.5 55.2 -61.4 -34.6 21.1 -0.8 80.8 839 144 C L H X S+ 0 0 1 -4,-1.1 4,-2.1 1,-0.2 -2,-0.2 0.922 106.8 49.6 -60.6 -45.1 23.7 1.8 79.8 840 145 C G H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.890 108.9 51.3 -61.4 -40.9 25.8 0.9 82.8 841 146 C A H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.835 109.2 53.1 -65.8 -30.0 25.6 -2.8 82.0 842 147 C G H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.880 107.4 48.8 -71.4 -37.9 26.8 -1.9 78.5 843 148 C I H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.873 110.1 52.8 -68.0 -35.1 29.8 0.0 79.9 844 149 C A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.876 104.7 56.0 -65.9 -37.1 30.5 -3.1 82.0 845 150 C L H X S+ 0 0 12 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.914 106.9 49.4 -60.7 -43.2 30.3 -5.2 78.9 846 151 C A H X S+ 0 0 1 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.859 106.5 56.1 -65.0 -36.2 33.0 -3.0 77.3 847 152 C C H X>S+ 0 0 6 -4,-1.8 4,-1.3 2,-0.2 5,-0.8 0.946 111.5 42.5 -61.0 -46.9 35.2 -3.4 80.4 848 153 C K H <5S+ 0 0 114 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.893 113.2 54.3 -64.7 -40.3 35.1 -7.1 80.1 849 154 C Y H <5S+ 0 0 26 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.843 111.6 43.6 -62.6 -39.0 35.6 -6.9 76.3 850 155 C N H <5S- 0 0 75 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.674 96.3-143.6 -83.0 -19.7 38.8 -4.8 76.7 851 156 C G T <5 + 0 0 52 -4,-1.3 -3,-0.1 -5,-0.2 -4,-0.1 0.835 57.1 130.4 60.3 38.7 40.2 -6.9 79.5 852 157 C K S - g 0 889J 25 -2,-0.3 4,-1.2 27,-0.2 29,-0.2 -0.274 32.6-102.7 -85.6 173.2 17.1 5.5 92.9 862 167 C D T 4 S+ 0 0 3 27,-1.1 4,-0.2 1,-0.2 32,-0.1 0.838 123.2 52.6 -63.4 -33.1 14.5 3.6 94.9 863 168 C G T >4 S+ 0 0 8 30,-0.3 3,-1.2 1,-0.2 -442,-0.5 0.912 108.1 50.3 -68.7 -40.9 11.8 5.0 92.6 864 169 C A G >4 S+ 0 0 8 1,-0.2 3,-2.4 2,-0.1 -1,-0.2 0.727 89.0 85.0 -68.2 -21.7 13.7 3.8 89.6 865 170 C A G 3< S+ 0 0 2 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.683 83.3 58.9 -55.4 -20.3 14.0 0.3 91.1 866 171 C N G < S+ 0 0 2 -3,-1.2 2,-0.4 -4,-0.2 -1,-0.3 0.247 77.9 119.8 -95.0 13.0 10.5 -0.6 89.8 867 172 C Q X> - 0 0 2 -3,-2.4 3,-1.2 1,-0.1 4,-0.8 -0.638 63.3-139.1 -79.7 130.5 11.5 0.1 86.1 868 173 C G H >> S+ 0 0 2 -2,-0.4 4,-1.5 1,-0.2 3,-0.8 0.871 98.2 61.5 -57.6 -40.2 11.2 -3.0 83.9 869 174 C Q H 3> S+ 0 0 7 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.741 94.8 63.5 -62.2 -21.6 14.5 -2.4 82.0 870 175 C I H <> S+ 0 0 0 -3,-1.2 4,-1.8 -6,-0.2 -1,-0.3 0.914 104.6 46.0 -68.3 -39.3 16.4 -2.7 85.3 871 176 C F H S+ 0 0 0 -4,-2.3 5,-2.3 2,-0.2 4,-0.3 0.886 114.5 41.7 -64.5 -37.2 24.5 -9.0 83.5 878 183 C A H ><5S+ 0 0 27 -4,-2.1 3,-0.7 3,-0.2 -2,-0.2 0.896 112.1 55.3 -74.4 -42.3 24.2 -12.3 85.4 879 184 C L H 3<5S+ 0 0 43 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.895 120.3 30.5 -56.8 -43.8 24.0 -14.3 82.2 880 185 C W T 3<5S- 0 0 42 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.322 105.1-123.3-101.2 8.3 27.3 -12.8 80.9 881 186 C K T < 5 - 0 0 116 -3,-0.7 63,-0.4 -4,-0.3 -3,-0.2 0.921 40.3-171.2 48.9 53.8 29.0 -12.2 84.2 882 187 C L < - 0 0 0 -5,-2.3 2,-2.8 -6,-0.2 -1,-0.2 -0.527 32.1-119.8 -77.3 138.7 29.5 -8.5 83.6 883 188 C P + 0 0 13 0, 0.0 -27,-2.0 0, 0.0 2,-0.5 -0.365 64.9 142.8 -75.7 63.4 31.6 -6.5 86.1 884 189 C C E -g 856 0J 0 -2,-2.8 62,-1.6 -29,-0.2 2,-0.8 -0.922 42.4-156.9-112.8 126.7 28.7 -4.3 86.9 885 190 C I E -gh 857 946J 1 -29,-2.9 -27,-2.8 -2,-0.5 2,-0.4 -0.878 14.8-154.6-102.2 101.8 28.0 -3.0 90.4 886 191 C F E -gh 858 947J 0 60,-2.1 62,-3.0 -2,-0.8 2,-0.5 -0.663 14.0-167.3 -77.5 126.3 24.3 -2.2 90.4 887 192 C I E -gh 859 948J 0 -29,-3.1 -27,-2.5 -2,-0.4 2,-0.7 -0.955 13.6-162.8-125.7 119.0 23.7 0.5 93.1 888 193 C C E -gh 860 949J 0 60,-2.0 62,-2.5 -2,-0.5 2,-1.0 -0.871 10.3-153.1 -99.1 113.7 20.3 1.5 94.5 889 194 C E E -gh 861 950J 15 -29,-2.7 -27,-1.1 -2,-0.7 2,-0.9 -0.765 15.3-164.7 -85.3 104.3 20.4 4.9 96.2 890 195 C N E + h 0 951J 16 60,-2.9 62,-2.6 -2,-1.0 32,-0.1 -0.795 28.2 157.0 -97.7 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216 C R T << S+ 0 0 7 -3,-1.1 3,-0.2 -4,-0.6 -2,-0.1 0.730 74.3 72.4 -58.6 -21.2 15.2 -7.3 94.1 912 217 C G T > S- 0 0 1 -4,-0.4 2,-1.2 1,-0.2 3,-1.2 0.646 81.7-171.0 -68.3 -13.1 18.0 -8.7 91.8 913 218 C D T < S+ 0 0 22 -3,-2.7 -1,-0.2 1,-0.3 4,-0.1 -0.397 76.0 28.2 61.5 -90.7 16.8 -12.1 93.0 914 219 C F T 3 S+ 0 0 43 -2,-1.2 -1,-0.3 -3,-0.2 -2,-0.1 0.660 108.1 85.5 -74.8 -17.2 19.5 -14.3 91.5 915 220 C I S < S- 0 0 2 -3,-1.2 -3,-0.2 -5,-0.1 31,-0.1 -0.736 84.9-121.1 -87.6 129.3 22.1 -11.5 91.7 916 221 C P + 0 0 16 0, 0.0 31,-2.8 0, 0.0 2,-0.3 -0.260 38.9 173.5 -66.4 156.7 23.9 -11.3 95.1 917 222 C G E -Ci 710 947J 0 -207,-2.0 -207,-2.8 29,-0.2 2,-0.3 -0.968 23.1-149.4-157.2 171.8 23.6 -8.1 97.1 918 223 C L E -Ci 709 948J 0 29,-1.8 31,-3.0 -2,-0.3 2,-0.5 -0.992 16.8-132.3-148.2 148.9 24.3 -6.2 100.3 919 224 C R E -Ci 708 949J 45 -211,-1.9 -211,-1.2 -2,-0.3 2,-0.3 -0.917 29.0-167.7-107.4 126.7 22.7 -3.3 102.2 920 225 C V E - i 0 950J 3 29,-3.5 31,-2.4 -2,-0.5 2,-1.0 -0.824 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