==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 26-APR-12 4EWG . COMPND 2 MOLECULE: BETA-KETOACYL SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA PHYMATUM; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 817 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25400.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 569 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 55 6.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 104 12.7 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 2 0.2 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 . 52 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 216 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.4 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 4 2 2 0 2 2 2 0 0 2 4 4 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 5 2 1 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 PARALLEL BRIDGES PER LADDER . 4 4 2 0 0 0 0 8 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 . 4 0 0 0 0 0 0 0 0 2 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 0 137 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 60.2 4.2 39.5 89.8 2 1 A M - 0 0 103 1,-0.1 2,-0.2 179,-0.0 179,-0.2 -0.408 360.0-122.5 -73.3 141.6 5.0 36.7 87.3 3 2 A K - 0 0 102 177,-2.9 2,-0.2 176,-0.2 -1,-0.1 -0.545 18.4-124.2 -85.7 146.7 3.5 36.7 83.8 4 3 A R - 0 0 114 -2,-0.2 240,-2.0 175,-0.1 2,-0.4 -0.557 25.0-145.3 -83.8 157.2 1.4 33.9 82.4 5 4 A V E +AB 243 258A 1 253,-0.6 253,-2.4 238,-0.2 2,-0.3 -0.992 17.4 179.8-136.0 127.1 2.5 32.4 79.2 6 5 A V E -AB 242 257A 2 236,-2.7 236,-2.7 -2,-0.4 2,-0.6 -0.794 28.6-120.3-124.5 163.5 0.4 30.9 76.3 7 6 A I E +AB 241 256A 0 249,-2.6 248,-2.7 -2,-0.3 249,-0.8 -0.924 32.4 165.3-109.1 115.3 1.1 29.3 73.0 8 7 A T E + 0 0 3 232,-1.9 2,-0.3 -2,-0.6 245,-0.2 0.427 64.4 42.3-113.4 -2.7 -0.5 31.3 70.1 9 8 A G E +A 240 0A 0 231,-1.0 231,-3.0 80,-0.1 2,-0.3 -0.990 56.6 174.3-145.9 135.7 1.4 29.6 67.2 10 9 A M E +A 239 0A 11 -2,-0.3 2,-0.3 229,-0.2 229,-0.2 -0.996 17.9 132.1-139.6 139.7 2.4 26.0 66.3 11 10 A G E +A 238 0A 4 227,-1.7 227,-3.1 -2,-0.3 2,-0.3 -0.971 13.4 158.1-172.4 165.6 4.1 24.6 63.2 12 11 A G E -A 237 0A 0 -2,-0.3 2,-0.5 225,-0.3 225,-0.2 -0.988 40.1-102.7-179.1 179.3 6.8 22.4 61.9 13 12 A V E +A 236 0A 10 223,-2.1 223,-2.1 -2,-0.3 2,-0.3 -0.995 51.3 162.1-122.4 113.0 8.3 20.2 59.2 14 13 A T B > -K 17 0B 5 3,-0.6 3,-1.9 -2,-0.5 221,-0.1 -0.904 55.1-104.2-137.6 167.3 7.8 16.4 59.9 15 14 A A T 3 S+ 0 0 14 219,-0.4 3,-0.1 1,-0.3 220,-0.1 0.725 123.7 48.5 -63.6 -19.5 7.9 12.9 58.4 16 15 A L T 3 S- 0 0 23 1,-0.4 -1,-0.3 38,-0.1 10,-0.2 0.398 123.0 -98.7-101.2 -0.0 4.1 13.0 58.5 17 16 A G B < -K 14 0B 19 -3,-1.9 -3,-0.6 1,-0.1 -1,-0.4 -0.654 29.2 -87.0 118.8-172.7 3.7 16.5 57.0 18 17 A S S S+ 0 0 37 -2,-0.2 -6,-0.2 -5,-0.2 2,-0.1 0.767 95.2 75.4-104.9 -44.0 3.2 20.1 58.2 19 18 A R S > S- 0 0 154 1,-0.1 4,-2.1 -8,-0.1 5,-0.1 -0.474 75.8-134.0 -75.0 143.6 -0.5 20.6 58.5 20 19 A W H > S+ 0 0 18 2,-0.2 4,-3.8 1,-0.2 5,-0.2 0.902 105.0 57.1 -63.5 -40.3 -2.2 19.0 61.5 21 20 A D H > S+ 0 0 85 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.892 109.3 46.1 -58.7 -41.7 -5.1 17.6 59.5 22 21 A E H > S+ 0 0 100 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.906 115.3 47.0 -62.7 -44.6 -2.5 15.8 57.3 23 22 A I H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.928 109.2 53.4 -67.6 -45.2 -0.6 14.5 60.4 24 23 A E H X S+ 0 0 42 -4,-3.8 4,-3.2 1,-0.2 -1,-0.2 0.923 107.5 51.9 -53.1 -46.3 -3.8 13.4 62.1 25 24 A A H X S+ 0 0 58 -4,-1.8 4,-2.1 -5,-0.2 -1,-0.2 0.917 111.8 47.1 -60.4 -40.9 -4.8 11.3 59.1 26 25 A A H X>S+ 0 0 25 -4,-1.9 4,-0.7 2,-0.2 5,-0.6 0.956 111.4 49.2 -65.8 -50.7 -1.3 9.7 59.1 27 26 A L H ><5S+ 0 0 3 -4,-3.1 3,-1.8 1,-0.2 -2,-0.2 0.967 113.8 48.3 -50.6 -52.1 -1.5 9.0 62.9 28 27 A K H 3<5S+ 0 0 117 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.843 102.4 61.2 -57.4 -39.4 -4.9 7.5 62.3 29 28 A A H 3<5S- 0 0 83 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.575 99.8-140.0 -71.5 -8.3 -3.8 5.4 59.4 30 29 A G T <<5 + 0 0 38 -3,-1.8 2,-0.4 -4,-0.7 -3,-0.1 0.626 55.7 125.4 65.7 18.0 -1.3 3.6 61.8 31 30 A R < - 0 0 66 -5,-0.6 -1,-0.2 331,-0.1 -2,-0.1 -0.900 53.8-132.0-104.3 140.0 1.8 3.2 59.6 32 31 A N - 0 0 9 -2,-0.4 302,-0.2 185,-0.3 301,-0.2 -0.276 14.6-121.9 -79.7 173.5 5.0 4.6 60.8 33 32 A A + 0 0 8 300,-3.0 2,-0.2 19,-0.1 301,-0.1 0.054 66.8 129.9-103.4 24.9 7.4 6.7 58.7 34 33 A V + 0 0 2 182,-0.2 2,-0.3 18,-0.2 18,-0.2 -0.566 31.5 176.1 -83.8 139.2 10.3 4.3 59.0 35 34 A R E -L 51 0C 135 16,-3.3 16,-1.8 -2,-0.2 2,-0.2 -0.957 36.2-100.1-138.0 158.3 12.2 3.3 55.8 36 35 A R E -L 50 0C 54 -2,-0.3 14,-0.2 14,-0.2 178,-0.1 -0.504 31.6-148.8 -70.6 145.7 15.2 1.2 54.8 37 36 A M > + 0 0 29 12,-2.5 3,-1.8 -2,-0.2 4,-0.1 -0.687 22.8 171.8-120.9 78.1 18.2 3.5 54.1 38 37 A P G > S+ 0 0 102 0, 0.0 3,-2.0 0, 0.0 4,-0.2 0.796 72.4 71.8 -59.1 -28.6 20.3 1.8 51.4 39 38 A D G > S+ 0 0 129 1,-0.3 3,-1.9 2,-0.2 4,-0.2 0.756 81.4 73.6 -56.7 -26.7 22.5 4.9 51.1 40 39 A W G X S+ 0 0 13 -3,-1.8 3,-1.3 1,-0.3 -1,-0.3 0.522 70.6 84.0 -71.4 -3.9 24.1 4.1 54.4 41 40 A D G < S+ 0 0 122 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.682 77.8 72.9 -64.8 -19.2 26.0 1.2 52.8 42 41 A Y G < S+ 0 0 118 -3,-1.9 -1,-0.3 -4,-0.2 2,-0.2 0.841 84.3 82.1 -57.6 -34.0 28.4 4.1 52.0 43 42 A F S < S- 0 0 20 -3,-1.3 3,-0.5 -4,-0.2 493,-0.2 -0.514 78.4-136.1 -85.3 144.9 29.4 4.2 55.7 44 43 A E S S+ 0 0 117 491,-3.0 2,-0.2 1,-0.2 492,-0.1 0.966 88.8 16.8 -63.6 -55.7 32.0 1.7 57.1 45 44 A S S S+ 0 0 60 490,-0.3 2,-0.5 2,-0.0 -1,-0.2 -0.448 76.8 129.9-129.9 56.8 30.5 0.5 60.3 46 45 A L - 0 0 10 -3,-0.5 155,-0.0 -6,-0.2 -3,-0.0 -0.955 30.1-171.1-105.3 130.4 26.7 1.2 60.8 47 46 A H + 0 0 106 -2,-0.5 -1,-0.2 157,-0.0 166,-0.1 0.877 66.5 73.2 -82.4 -43.5 24.6 -1.8 61.8 48 47 A T - 0 0 1 1,-0.1 163,-0.1 152,-0.1 156,-0.0 -0.425 48.7-177.7 -73.4 147.3 21.3 -0.1 61.3 49 48 A R + 0 0 49 161,-0.2 -12,-2.5 -2,-0.1 2,-0.4 -0.106 55.2 104.6-122.6 30.4 19.8 0.5 57.9 50 49 A L E +L 36 0C 1 160,-0.3 182,-0.4 -14,-0.2 2,-0.3 -0.896 34.1 147.8-116.5 144.1 16.6 2.3 59.3 51 50 A A E -L 35 0C 0 -16,-1.8 -16,-3.3 -2,-0.4 182,-0.2 -0.955 41.7-131.3-156.7 167.2 15.6 5.9 59.5 52 51 A A B +m 233 0D 0 180,-2.1 182,-0.8 -2,-0.3 -18,-0.2 -0.710 41.6 179.8-119.5 73.8 12.4 8.1 59.4 53 52 A P - 0 0 33 0, 0.0 -2,-0.0 0, 0.0 141,-0.0 -0.216 38.9 -95.4 -72.0 163.0 13.4 10.8 56.9 54 53 A L - 0 0 12 1,-0.1 -39,-0.1 -38,-0.0 3,-0.1 -0.591 34.7-129.1 -64.5 136.7 11.3 13.7 55.7 55 54 A P S S- 0 0 115 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.794 79.1 -35.1 -64.4 -22.9 9.7 12.4 52.4 56 55 A G - 0 0 50 2,-0.0 2,-0.3 -3,-0.0 0, 0.0 -0.954 55.8-162.5-175.7 175.2 11.1 15.6 50.9 57 56 A F + 0 0 44 -2,-0.3 2,-0.4 -3,-0.1 20,-0.0 -0.795 6.0 179.8-168.8 131.3 11.7 19.2 51.5 58 57 A A - 0 0 85 -2,-0.3 3,-0.1 0, 0.0 -2,-0.0 -0.994 36.2-107.6-134.3 137.6 12.3 22.2 49.2 59 58 A Q - 0 0 96 -2,-0.4 -2,-0.0 1,-0.1 18,-0.0 -0.301 46.1 -95.9 -50.8 139.8 12.9 25.7 50.4 60 59 A P > - 0 0 25 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.354 32.5-124.7 -54.5 141.8 10.1 28.1 49.7 61 60 A A T 3 S+ 0 0 109 1,-0.3 -2,-0.1 -3,-0.1 0, 0.0 0.804 105.3 59.1 -62.2 -33.9 10.6 29.9 46.5 62 61 A D T 3 S+ 0 0 124 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.322 73.5 114.5 -86.0 7.8 10.3 33.4 48.0 63 62 A W S < S- 0 0 16 -3,-1.3 2,-0.3 1,-0.0 5,-0.0 -0.710 70.7-125.1 -75.3 123.6 13.3 32.9 50.5 64 63 A P >> - 0 0 73 0, 0.0 3,-2.2 0, 0.0 4,-1.4 -0.548 4.6-129.8 -77.7 135.1 15.9 35.4 49.4 65 64 A R H 3> S+ 0 0 218 -2,-0.3 4,-1.4 1,-0.3 3,-0.0 0.816 106.5 62.5 -41.4 -46.0 19.4 34.1 48.7 66 65 A K H 34 S+ 0 0 101 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.817 110.2 41.0 -58.7 -28.0 20.9 36.8 50.8 67 66 A K H <4 S+ 0 0 35 -3,-2.2 3,-0.5 1,-0.1 -1,-0.2 0.789 112.7 53.0 -91.6 -27.9 19.1 35.2 53.8 68 67 A T H >< S+ 0 0 24 -4,-1.4 3,-1.9 1,-0.2 -2,-0.2 0.573 81.2 87.5 -88.1 -9.3 19.6 31.5 53.0 69 68 A R T 3< S+ 0 0 42 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.1 0.815 88.9 52.6 -55.7 -33.3 23.5 31.4 52.5 70 69 A S T 3 S+ 0 0 14 -3,-0.5 2,-0.5 -4,-0.2 -1,-0.3 0.326 95.7 92.6 -90.9 8.4 23.9 30.8 56.2 71 70 A M < - 0 0 11 -3,-1.9 2,-0.2 4,-0.1 67,-0.1 -0.905 44.8-178.0-114.2 123.9 21.6 27.8 56.3 72 71 A G > - 0 0 5 -2,-0.5 4,-2.2 66,-0.2 3,-0.3 -0.354 59.1 -77.0 -89.7-170.2 22.2 24.0 56.0 73 72 A R H > S+ 0 0 85 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.879 129.0 53.8 -60.9 -45.8 19.2 21.7 56.2 74 73 A V H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.885 112.1 45.3 -60.1 -39.7 18.6 21.8 59.9 75 74 A S H > S+ 0 0 0 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.882 111.5 53.4 -71.8 -36.4 18.5 25.6 59.9 76 75 A M H X S+ 0 0 19 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.925 110.5 47.0 -61.9 -42.1 16.2 25.5 56.9 77 76 A Y H X S+ 0 0 0 -4,-3.2 4,-2.8 2,-0.2 5,-0.2 0.943 112.8 50.2 -59.9 -46.2 13.9 23.1 58.7 78 77 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.919 112.6 45.7 -60.6 -47.5 14.0 25.4 61.8 79 78 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.920 113.1 49.4 -64.9 -40.3 13.2 28.5 59.7 80 79 A R H X S+ 0 0 77 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.921 111.6 49.5 -66.2 -44.1 10.4 26.8 57.9 81 80 A A H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 157,-0.3 0.902 113.1 46.6 -53.8 -45.9 8.9 25.6 61.2 82 81 A S H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.865 109.3 54.4 -73.8 -36.0 9.1 29.0 62.7 83 82 A E H X S+ 0 0 41 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.890 110.0 47.0 -59.1 -44.9 7.6 30.6 59.5 84 83 A L H X S+ 0 0 45 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.930 113.4 48.8 -63.9 -43.3 4.6 28.2 59.8 85 84 A A H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.883 110.2 50.7 -67.4 -41.9 4.2 29.0 63.5 86 85 A L H X>S+ 0 0 4 -4,-2.7 5,-2.5 2,-0.2 4,-0.5 0.905 111.1 48.0 -60.5 -43.0 4.4 32.7 63.0 87 86 A A H ><5S+ 0 0 55 -4,-2.0 3,-1.8 1,-0.2 5,-0.3 0.961 111.6 50.5 -60.8 -47.7 1.7 32.6 60.3 88 87 A D H 3<5S+ 0 0 78 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.851 108.1 53.3 -61.6 -33.5 -0.4 30.5 62.5 89 88 A A H 3<5S- 0 0 7 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.520 119.9-109.9 -79.5 -5.6 0.1 33.0 65.4 90 89 A G T <<5S+ 0 0 50 -3,-1.8 -3,-0.2 -4,-0.5 -2,-0.1 0.601 87.9 114.9 90.7 13.1 -1.1 35.9 63.1 91 90 A F > < + 0 0 10 -5,-2.5 3,-2.3 -6,-0.2 -4,-0.2 0.422 30.9 129.3 -99.7 1.3 2.4 37.6 62.7 92 91 A A T 3 S+ 0 0 75 -6,-0.5 3,-0.1 1,-0.3 -8,-0.0 -0.299 88.4 3.6 -50.4 135.5 2.9 37.0 58.9 93 92 A G T 3 S+ 0 0 85 1,-0.2 2,-0.8 2,-0.1 -1,-0.3 0.526 100.6 126.8 63.5 4.9 3.9 40.4 57.4 94 93 A D X - 0 0 60 -3,-2.3 3,-0.7 1,-0.1 -1,-0.2 -0.846 35.8-178.6 -99.1 107.3 3.8 42.0 60.9 95 94 A E G > + 0 0 164 -2,-0.8 3,-2.0 1,-0.2 -1,-0.1 0.577 63.8 86.4 -86.9 -11.8 7.2 43.7 61.4 96 95 A S G > S+ 0 0 45 1,-0.3 3,-1.7 2,-0.2 5,-0.4 0.769 75.6 72.7 -61.2 -21.4 6.6 44.9 65.0 97 96 A I G < >S+ 0 0 3 -3,-0.7 5,-0.8 1,-0.3 3,-0.5 0.745 89.6 62.8 -63.6 -20.3 7.9 41.5 66.2 98 97 A S G < 5S+ 0 0 17 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.447 74.7 92.5 -82.5 0.4 11.3 42.7 65.2 99 98 A D T < 5S- 0 0 95 -3,-1.7 -1,-0.2 -4,-0.1 -2,-0.1 0.259 113.6 -87.5 -85.8 12.5 11.4 45.6 67.6 100 99 A G T 5S+ 0 0 27 -3,-0.5 57,-0.2 2,-0.2 -2,-0.1 0.261 107.1 102.8 103.5 -7.1 13.2 43.6 70.4 101 100 A R T 5S+ 0 0 74 -5,-0.4 85,-2.2 83,-0.1 84,-1.6 0.654 74.4 59.6 -82.4 -22.5 10.0 42.3 72.0 102 101 A M E < +c 186 0A 0 -5,-0.8 54,-1.3 83,-0.2 53,-0.4 -0.954 64.6 177.5-113.7 134.2 10.4 38.8 70.5 103 102 A G E -c 187 0A 0 83,-1.9 85,-2.4 -2,-0.4 2,-0.4 -0.492 21.5-118.2-121.1-173.5 13.4 36.5 71.1 104 103 A V E -cd 188 158A 0 53,-2.4 55,-3.0 83,-0.2 2,-0.5 -0.992 17.3-176.8-139.0 128.1 14.4 33.0 70.1 105 104 A A E +cd 189 159A 0 83,-3.2 85,-1.8 -2,-0.4 2,-0.3 -0.997 33.3 134.4-119.7 126.0 15.2 29.8 71.9 106 105 A Y E +cd 190 160A 0 53,-1.5 55,-2.3 -2,-0.5 2,-0.3 -0.984 18.9 163.7-164.6 154.2 16.3 26.9 69.8 107 106 A G E -c 191 0A 0 83,-0.7 85,-1.7 -2,-0.3 2,-0.3 -0.981 14.0-157.4-165.3 179.3 18.8 24.1 69.3 108 107 A S - 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0 0 65 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.838 51.2-177.8 57.6 34.0 15.4 40.5 61.9 154 153 A L < - 0 0 0 -5,-2.8 -56,-0.2 -6,-0.2 -1,-0.2 -0.315 22.1-169.0 -74.0 149.7 14.5 39.8 65.5 155 154 A K + 0 0 50 -53,-0.4 519,-1.3 -58,-0.4 -52,-0.1 0.188 50.5 102.8-128.1 15.2 16.3 41.8 68.2 156 155 A G S S- 0 0 1 -54,-1.3 -53,-0.2 517,-0.2 -55,-0.1 -0.124 83.0 -61.3 -86.6-173.0 15.3 39.9 71.4 157 156 A R - 0 0 6 -57,-0.2 -53,-2.4 515,-0.2 2,-0.6 -0.433 42.4-139.4 -76.5 144.3 17.5 37.6 73.4 158 157 A I E -d 104 0A 1 -55,-0.2 -53,-0.2 515,-0.2 -12,-0.1 -0.944 13.9-168.8-103.2 120.1 18.8 34.4 71.9 159 158 A V E -d 105 0A 4 -55,-3.0 -53,-1.5 -2,-0.6 2,-0.4 -0.901 12.3-152.4-108.2 99.9 18.6 31.4 74.2 160 159 A P E +d 106 0A 2 0, 0.0 -53,-0.2 0, 0.0 411,-0.1 -0.607 18.1 176.8 -77.6 120.9 20.7 28.6 72.6 161 160 A T + 0 0 0 -55,-2.3 2,-1.3 -2,-0.4 10,-0.2 -0.387 16.1 153.4-119.3 52.3 19.3 25.3 73.8 162 161 A S + 0 0 2 407,-0.6 409,-0.1 -56,-0.2 3,-0.1 -0.693 15.4 137.7 -83.2 94.9 21.4 22.9 71.8 163 162 A S > - 0 0 0 -2,-1.3 3,-2.3 1,-0.5 -54,-0.2 -0.318 62.7-116.6-136.6 48.5 21.3 19.9 74.2 164 163 A A G > S+ 0 0 2 -56,-0.5 3,-1.8 1,-0.3 -1,-0.5 -0.295 95.7 4.5 50.8-124.8 20.8 17.0 71.8 165 164 A C G 3 S+ 0 0 5 1,-0.3 177,-0.5 2,-0.1 4,-0.3 0.647 133.0 56.3 -60.0 -24.3 17.5 15.3 72.5 166 165 A A G <> S+ 0 0 0 -3,-2.3 4,-2.6 1,-0.2 5,-0.3 0.319 78.4 101.8 -89.8 7.9 16.5 17.9 75.1 167 166 A S H <> S+ 0 0 0 -3,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.919 83.4 39.9 -64.1 -47.3 16.9 20.9 72.7 168 167 A G H > S+ 0 0 0 171,-0.8 4,-2.0 170,-0.3 -1,-0.2 0.847 117.7 46.9 -74.5 -36.2 13.3 21.5 71.9 169 168 A S H > S+ 0 0 0 -4,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.870 112.7 48.6 -76.6 -40.0 11.9 21.0 75.4 170 169 A Q H X S+ 0 0 0 -4,-2.6 4,-3.2 2,-0.2 5,-0.4 0.874 109.7 55.1 -63.7 -34.4 14.6 23.2 77.0 171 170 A A H X S+ 0 0 0 -4,-1.8 4,-2.5 -5,-0.3 5,-0.3 0.968 111.9 42.5 -60.3 -49.4 13.8 25.8 74.3 172 171 A I H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.951 118.8 45.3 -63.4 -47.2 10.1 25.7 75.3 173 172 A G H X S+ 0 0 0 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.910 116.8 41.3 -64.2 -49.8 10.9 25.7 79.0 174 173 A Y H X S+ 0 0 8 -4,-3.2 4,-2.1 2,-0.2 -1,-0.2 0.885 114.5 52.2 -72.2 -33.9 13.5 28.3 79.1 175 174 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.4 5,-0.2 0.940 109.3 53.3 -61.5 -43.0 11.6 30.6 76.6 176 175 A Y H X S+ 0 0 26 -4,-2.6 4,-2.7 -5,-0.3 -2,-0.2 0.907 108.9 46.5 -56.6 -45.8 8.6 30.1 79.0 177 176 A E H X S+ 0 0 9 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.871 108.1 56.9 -70.2 -34.7 10.6 31.3 82.0 178 177 A N H <>S+ 0 0 12 -4,-2.1 5,-2.4 2,-0.2 6,-0.8 0.924 113.0 40.6 -60.1 -42.1 11.9 34.3 80.0 179 178 A I H ><5S+ 0 0 1 -4,-2.2 3,-1.7 2,-0.2 -176,-0.2 0.946 114.4 51.8 -72.1 -46.2 8.4 35.5 79.3 180 179 A A H 3<5S+ 0 0 7 -4,-2.7 -177,-2.9 1,-0.3 -1,-0.2 0.869 110.1 50.2 -53.1 -40.3 7.1 34.6 82.8 181 180 A M T 3<5S- 0 0 36 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.472 117.4-114.9 -82.8 -4.3 10.0 36.6 84.2 182 181 A G T < 5S+ 0 0 47 -3,-1.7 -3,-0.2 2,-0.3 -2,-0.1 0.585 80.9 120.4 84.6 13.1 9.2 39.6 81.9 183 182 A K S - 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0 0 0 -5,-2.5 -56,-0.2 -6,-0.2 -1,-0.2 -0.347 21.9-167.0 -72.4 151.5 25.6 17.5 89.9 564 154 B K + 0 0 54 -53,-0.4 -299,-1.4 -58,-0.3 -52,-0.1 0.161 49.8 104.2-129.2 15.4 21.9 17.1 89.4 565 155 B G S S- 0 0 0 -54,-1.2 -53,-0.2 -301,-0.2 -55,-0.1 -0.117 81.8 -59.5 -85.1-169.7 20.7 20.6 88.7 566 156 B R - 0 0 7 -57,-0.2 -53,-2.3 -303,-0.2 2,-0.5 -0.439 41.9-140.6 -76.7 144.5 19.7 22.2 85.5 567 157 B I E -u 513 0I 2 -55,-0.2 -53,-0.2 -303,-0.2 -12,-0.1 -0.942 12.8-167.1-103.8 121.5 22.1 22.4 82.6 568 158 B V E -u 514 0I 5 -55,-2.8 2,-1.7 -2,-0.5 -53,-1.4 -0.928 11.9-152.5-110.9 100.5 21.8 25.7 80.7 569 159 B P + 0 0 1 0, 0.0 2,-2.3 0, 0.0 -407,-0.6 -0.460 18.7 176.3 -87.7 79.1 23.8 25.1 77.4 570 160 B T + 0 0 1 -2,-1.7 2,-1.3 -55,-0.2 10,-0.2 -0.259 15.0 154.1 -81.6 56.7 25.0 28.6 76.4 571 161 B S + 0 0 2 -2,-2.3 -429,-0.1 -56,-0.2 3,-0.1 -0.681 14.3 139.2 -86.8 93.5 27.1 27.7 73.3 572 162 B S > - 0 0 0 -2,-1.3 3,-2.3 1,-0.5 -54,-0.2 -0.334 63.6-113.4-133.0 48.9 26.9 31.0 71.5 573 163 B A G > S+ 0 0 4 -56,-0.5 3,-2.0 1,-0.3 -1,-0.5 -0.290 96.6 0.0 48.6-125.9 30.4 31.4 70.1 574 164 B C G 3 S+ 0 0 6 1,-0.3 177,-0.4 2,-0.1 4,-0.3 0.618 132.9 60.4 -66.9 -14.4 32.0 34.5 71.9 575 165 B A G <> S+ 0 0 0 -3,-2.3 4,-2.7 1,-0.2 5,-0.3 0.359 77.3 100.3 -88.1 6.1 28.8 35.1 73.9 576 166 B S H <> S+ 0 0 0 -3,-2.0 4,-1.9 1,-0.2 23,-0.2 0.911 83.9 38.4 -64.0 -48.1 29.1 31.7 75.6 577 167 B G H > S+ 0 0 0 171,-0.9 4,-1.9 170,-0.3 -1,-0.2 0.838 117.6 48.5 -73.9 -37.0 30.7 32.7 78.9 578 168 B S H > S+ 0 0 0 -4,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.877 112.5 47.8 -74.3 -39.1 28.7 35.9 79.3 579 169 B Q H X S+ 0 0 0 -4,-2.7 4,-3.3 2,-0.2 5,-0.5 0.888 109.4 56.0 -63.9 -36.7 25.4 34.2 78.6 580 170 B A H X S+ 0 0 0 -4,-1.9 4,-2.3 -5,-0.3 5,-0.3 0.964 112.1 41.8 -56.1 -50.7 26.4 31.5 81.0 581 171 B I H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.957 118.6 45.4 -63.5 -49.6 26.9 34.0 83.7 582 172 B G H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.910 116.8 41.5 -61.9 -48.5 23.8 36.0 82.9 583 173 B Y H X S+ 0 0 7 -4,-3.3 4,-2.2 2,-0.2 -1,-0.2 0.878 114.8 52.0 -72.2 -35.0 21.4 33.2 82.5 584 174 B A H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.5 -2,-0.2 0.933 109.0 53.1 -60.0 -45.5 22.8 31.4 85.6 585 175 B Y H X S+ 0 0 24 -4,-2.7 4,-2.8 -5,-0.3 -2,-0.2 0.907 109.8 46.3 -55.2 -45.0 22.3 34.7 87.4 586 176 B E H X S+ 0 0 8 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.868 107.7 57.1 -70.3 -34.7 18.6 34.8 86.3 587 177 B N H <>S+ 0 0 11 -4,-2.2 5,-2.4 2,-0.2 6,-0.8 0.913 113.2 40.1 -59.5 -41.8 18.1 31.1 87.3 588 178 B I H ><5S+ 0 0 1 -4,-2.1 3,-1.9 3,-0.2 -176,-0.3 0.951 113.5 54.0 -73.3 -46.6 19.3 31.9 90.9 589 179 B A H 3<5S+ 0 0 10 -4,-2.8 -177,-2.9 1,-0.3 -2,-0.2 0.874 110.3 46.8 -54.0 -40.1 17.5 35.2 91.1 590 180 B M T 3<5S- 0 0 37 -4,-2.2 -1,-0.3 -179,-0.2 -2,-0.2 0.416 119.3-110.2 -89.6 3.9 14.2 33.6 90.1 591 181 B G T < 5S+ 0 0 51 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.1 0.625 82.2 119.6 85.7 16.2 14.7 30.7 92.6 592 182 B K S - 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