==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 04-OCT-11 3U2O . COMPND 2 MOLECULE: DIHYDROOROTATE DEHYDROGENASE (QUINONE), MITOCHOND . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.LOZOYA,V.SEGARRA,M.ERRA,C.WENZKOWSKI,A.JESTEL,S.KRAPP,M.BL . 366 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15504.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 258 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 1 0.3 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 . 11 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 33.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 3.3 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 1 1 1 0 1 1 3 0 1 1 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 3 3 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 PARALLEL BRIDGES PER LADDER . 2 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 0 0 0 0 1 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 30 A M > 0 0 187 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -97.2 -5.8 13.5 -3.9 2 31 A A H > + 0 0 37 2,-0.2 4,-2.7 1,-0.2 5,-0.1 0.815 360.0 58.2 -68.7 -31.4 -4.5 16.5 -2.0 3 32 A T H > S+ 0 0 85 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.842 101.8 52.8 -65.7 -36.8 -2.0 16.8 -4.8 4 33 A G H > S+ 0 0 43 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.876 111.6 45.6 -64.7 -39.3 -4.9 17.1 -7.3 5 34 A D H X S+ 0 0 85 -4,-1.3 4,-2.5 2,-0.2 5,-0.3 0.948 111.4 52.7 -66.2 -48.6 -6.3 20.0 -5.2 6 35 A E H X S+ 0 0 25 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.882 112.1 46.2 -50.8 -44.0 -2.8 21.5 -5.0 7 36 A R H X>S+ 0 0 142 -4,-2.2 4,-2.7 2,-0.2 5,-0.5 0.852 109.0 54.1 -72.3 -37.3 -2.5 21.4 -8.8 8 37 A F H X>S+ 0 0 99 -4,-1.9 5,-2.7 2,-0.2 4,-2.3 0.952 115.7 38.3 -60.7 -49.4 -5.9 22.8 -9.4 9 38 A Y H <>S+ 0 0 28 -4,-2.5 5,-3.1 3,-0.2 -2,-0.2 0.950 119.9 46.8 -65.4 -48.6 -5.3 25.8 -7.3 10 39 A A H <5S+ 0 0 26 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.863 127.5 23.8 -63.9 -41.8 -1.7 26.2 -8.4 11 40 A E H <5S+ 0 0 88 -4,-2.7 -3,-0.2 -5,-0.2 -1,-0.2 0.698 136.9 15.4-101.1 -26.3 -2.3 25.8 -12.2 12 41 A H T X S+ 0 0 52 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.848 113.1 49.1 -59.1 -32.2 -3.6 32.0 -12.3 16 45 A T H X S+ 0 0 85 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.943 112.5 46.4 -71.3 -48.7 -7.2 32.7 -13.3 17 46 A L H X S+ 0 0 43 -4,-2.6 4,-2.2 1,-0.2 3,-0.3 0.913 111.5 51.8 -53.4 -46.0 -7.8 34.8 -10.2 18 47 A Q H < S+ 0 0 64 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.785 111.1 50.5 -68.6 -23.6 -4.5 36.6 -10.9 19 48 A G H < S+ 0 0 63 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.812 114.3 40.7 -77.5 -33.3 -5.7 37.3 -14.4 20 49 A L H < S+ 0 0 141 -4,-1.8 2,-0.3 -3,-0.3 -2,-0.2 0.798 116.9 39.4 -87.3 -32.5 -9.2 38.7 -13.5 21 50 A L S < S- 0 0 55 -4,-2.2 -1,-0.1 -5,-0.2 0, 0.0 -0.891 76.5-116.3-124.0 150.9 -8.3 40.9 -10.5 22 51 A D > - 0 0 78 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.365 46.5 -98.6 -73.1 161.3 -5.5 43.2 -9.4 23 52 A P H > S+ 0 0 28 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.892 122.2 47.0 -54.6 -44.6 -3.5 42.1 -6.3 24 53 A E H > S+ 0 0 10 81,-0.3 4,-2.7 2,-0.2 5,-0.2 0.901 111.4 49.8 -64.3 -40.7 -5.4 44.3 -3.9 25 54 A S H > S+ 0 0 48 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.915 111.0 51.3 -63.6 -40.4 -8.8 43.3 -5.2 26 55 A A H X S+ 0 0 12 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.889 109.4 50.3 -60.7 -42.6 -7.7 39.7 -4.9 27 56 A H H X S+ 0 0 21 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.942 111.7 47.6 -58.4 -50.2 -6.7 40.3 -1.3 28 57 A R H X S+ 0 0 166 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.893 112.7 48.4 -62.9 -41.5 -10.0 41.9 -0.4 29 58 A L H X S+ 0 0 92 -4,-2.4 4,-3.4 1,-0.2 5,-0.2 0.914 110.4 51.5 -63.5 -45.2 -12.0 39.1 -2.1 30 59 A A H X S+ 0 0 35 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.857 109.1 50.2 -59.3 -41.7 -9.9 36.4 -0.3 31 60 A V H X S+ 0 0 14 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.934 114.5 45.1 -63.3 -42.6 -10.6 38.1 3.1 32 61 A R H X S+ 0 0 162 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.970 116.1 44.7 -66.3 -50.7 -14.3 38.2 2.3 33 62 A F H <>S+ 0 0 95 -4,-3.4 5,-1.2 1,-0.2 4,-0.3 0.878 115.3 48.3 -60.5 -39.9 -14.4 34.6 1.0 34 63 A T H ><5S+ 0 0 20 -4,-2.4 3,-1.2 -5,-0.2 -1,-0.2 0.875 105.1 59.0 -71.5 -37.3 -12.4 33.3 3.9 35 64 A S H 3<5S+ 0 0 40 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.827 103.4 52.0 -63.0 -35.0 -14.5 35.1 6.5 36 65 A L T 3<5S- 0 0 94 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.565 102.8-135.2 -75.0 -12.1 -17.6 33.3 5.4 37 66 A G T < 5 + 0 0 17 -3,-1.2 -3,-0.2 -4,-0.3 -2,-0.1 0.789 51.5 151.6 64.9 27.4 -15.8 30.0 5.8 38 67 A L < + 0 0 109 -5,-1.2 -4,-0.1 2,-0.1 -1,-0.1 0.880 45.3 82.8 -63.8 -42.6 -17.2 28.9 2.4 39 68 A L S S- 0 0 44 -6,-0.3 3,-0.1 1,-0.1 42,-0.0 -0.340 91.9-109.6 -57.5 137.8 -14.3 26.6 1.6 40 69 A P - 0 0 98 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.274 46.0 -75.4 -70.5 163.4 -14.7 23.2 3.3 41 70 A R - 0 0 202 1,-0.1 41,-0.2 2,-0.1 2,-0.1 -0.261 53.1-100.8 -60.8 140.4 -12.5 22.1 6.2 42 71 A A - 0 0 44 39,-1.5 -1,-0.1 1,-0.1 41,-0.1 -0.373 25.6-143.7 -60.4 137.0 -9.0 21.0 5.4 43 72 A R + 0 0 208 -3,-0.1 -1,-0.1 -2,-0.1 -2,-0.1 0.860 67.8 103.2 -77.2 -40.3 -8.7 17.2 5.4 44 73 A F - 0 0 46 1,-0.1 2,-0.5 -42,-0.0 -2,-0.1 -0.205 62.9-146.8 -49.3 127.5 -5.2 16.9 6.9 45 74 A Q - 0 0 169 294,-0.0 2,-0.3 1,-0.0 -1,-0.1 -0.871 19.5-119.9-103.1 126.9 -5.3 15.9 10.6 46 75 A D - 0 0 43 -2,-0.5 2,-0.1 1,-0.1 15,-0.1 -0.511 26.2-141.0 -74.5 125.7 -2.6 17.4 12.7 47 76 A S > - 0 0 30 -2,-0.3 3,-1.6 1,-0.1 4,-0.2 -0.437 24.0-111.3 -77.7 160.4 -0.4 14.8 14.3 48 77 A D G > S+ 0 0 145 1,-0.3 3,-1.2 2,-0.2 -1,-0.1 0.716 113.6 72.8 -59.8 -25.5 0.9 15.1 17.9 49 78 A M G 3 S+ 0 0 28 1,-0.2 308,-3.0 307,-0.1 309,-0.3 0.696 94.4 54.0 -58.8 -26.2 4.4 15.6 16.3 50 79 A L G < S+ 0 0 0 -3,-1.6 -1,-0.2 306,-0.2 2,-0.2 0.497 81.3 111.5 -90.5 -6.8 3.4 19.0 15.2 51 80 A E < - 0 0 44 -3,-1.2 307,-0.4 -4,-0.2 2,-0.4 -0.516 45.6-171.6 -73.1 135.8 2.2 20.3 18.6 52 81 A V E -A 59 0A 2 7,-2.5 7,-2.9 -2,-0.2 2,-0.6 -0.986 15.5-154.5-127.8 139.6 4.3 23.0 20.1 53 82 A R E +A 58 0A 176 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.958 42.9 123.2-110.2 114.4 4.2 24.5 23.6 54 83 A V E > +A 57 0A 19 3,-2.4 3,-1.8 -2,-0.6 -2,-0.1 -0.969 52.5 33.7-161.4 159.7 5.5 28.1 23.7 55 84 A L T 3 S- 0 0 24 -2,-0.3 167,-0.3 1,-0.3 3,-0.1 0.688 129.6 -58.7 62.1 24.1 4.5 31.6 24.7 56 85 A G T 3 S+ 0 0 76 1,-0.3 2,-0.3 165,-0.1 -1,-0.3 0.568 120.5 86.9 82.2 13.6 2.3 30.3 27.5 57 86 A H E < S-A 54 0A 55 -3,-1.8 -3,-2.4 89,-0.0 2,-0.4 -0.934 74.5-116.8-145.1 161.8 0.3 28.2 25.1 58 87 A K E -A 53 0A 71 85,-0.3 2,-0.5 -2,-0.3 -5,-0.2 -0.816 23.4-163.6 -95.8 137.1 -0.2 25.0 23.1 59 88 A F E -A 52 0A 0 -7,-2.9 -7,-2.5 -2,-0.4 88,-0.2 -0.993 11.6-152.7-124.2 116.4 -0.2 25.3 19.3 60 89 A R S S+ 0 0 97 86,-3.1 -10,-0.2 -2,-0.5 87,-0.1 0.817 84.9 7.9 -69.7 -24.9 -1.6 22.3 17.7 61 90 A N S S- 0 0 0 85,-0.4 -1,-0.1 24,-0.1 -10,-0.1 -0.970 73.1-127.2-147.2 157.2 0.6 22.9 14.6 62 91 A P S S+ 0 0 0 0, 0.0 262,-3.4 0, 0.0 2,-0.7 0.275 76.6 101.2 -93.2 13.0 3.4 25.4 14.1 63 92 A V E +b 324 0B 0 20,-0.2 22,-2.7 260,-0.2 23,-0.6 -0.874 47.7 171.5-106.3 111.5 2.1 27.0 10.9 64 93 A G E -bc 325 86B 0 260,-2.8 262,-1.8 -2,-0.7 2,-0.6 -0.649 38.0-105.6-113.5 165.7 0.4 30.3 11.2 65 94 A I E -bc 326 87B 0 21,-1.5 23,-1.1 260,-0.2 262,-0.2 -0.844 42.9-125.7 -88.7 124.9 -1.0 33.0 9.0 66 95 A A > - 0 0 6 260,-2.5 3,-1.1 -2,-0.6 4,-0.4 -0.251 32.1 -87.2 -65.0 156.3 1.3 36.1 9.0 67 96 A A T 3 S+ 0 0 13 1,-0.2 24,-0.2 22,-0.1 -1,-0.1 -0.248 106.2 51.8 -57.2 146.6 0.2 39.6 9.8 68 97 A G T 3 S+ 0 0 11 22,-2.2 3,-0.5 20,-0.1 -1,-0.2 -0.072 87.9 76.6 113.4 -32.2 -1.1 41.5 6.8 69 98 A F S < S+ 0 0 15 -3,-1.1 2,-0.8 1,-0.3 3,-0.2 0.979 109.8 26.5 -70.5 -55.7 -3.7 39.1 5.3 70 99 A D S > S+ 0 0 1 -4,-0.4 20,-1.7 18,-0.4 3,-0.8 -0.669 72.6 162.0-106.4 79.4 -6.3 39.9 7.9 71 100 A K T 3 S+ 0 0 20 -2,-0.8 20,-0.2 -3,-0.5 -1,-0.2 0.798 76.5 38.7 -67.6 -28.0 -5.4 43.4 9.1 72 101 A H T 3 S- 0 0 23 -3,-0.2 -1,-0.2 18,-0.1 59,-0.1 0.186 110.2-108.2-114.3 11.6 -8.8 44.1 10.7 73 102 A G S < S+ 0 0 5 -3,-0.8 3,-0.1 1,-0.1 -2,-0.1 0.865 76.2 130.1 63.7 40.7 -9.7 40.7 12.3 74 103 A E S S+ 0 0 78 1,-0.1 4,-0.1 2,-0.1 -1,-0.1 0.619 70.5 35.3 -96.9 -13.6 -12.5 39.8 9.8 75 104 A A S > S+ 0 0 1 1,-0.1 4,-2.1 2,-0.1 5,-0.2 0.113 71.1 124.0-133.7 18.1 -11.5 36.2 8.8 76 105 A V H > S+ 0 0 3 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.902 79.5 44.3 -57.2 -47.9 -10.1 34.7 12.0 77 106 A D H > S+ 0 0 55 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.903 111.4 53.4 -65.9 -41.3 -12.4 31.7 12.1 78 107 A G H > S+ 0 0 5 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.847 106.9 54.1 -60.7 -33.9 -12.1 31.0 8.4 79 108 A L H <>S+ 0 0 1 -4,-2.1 5,-1.4 2,-0.2 4,-0.3 0.867 106.2 49.5 -72.4 -37.8 -8.4 30.9 8.8 80 109 A Y H ><5S+ 0 0 18 -4,-1.8 3,-1.7 1,-0.2 -2,-0.2 0.900 107.8 56.4 -60.7 -40.0 -8.5 28.3 11.5 81 110 A K H 3<5S+ 0 0 71 -4,-2.1 -39,-1.5 1,-0.3 -2,-0.2 0.821 98.9 60.5 -61.3 -31.6 -10.8 26.3 9.2 82 111 A M T 3<5S- 0 0 20 -4,-1.1 -1,-0.3 -41,-0.2 -2,-0.2 0.557 126.5-100.5 -72.1 -11.5 -8.0 26.4 6.5 83 112 A G T < 5 + 0 0 11 -3,-1.7 2,-0.2 1,-0.3 -20,-0.2 0.472 68.4 150.9 107.2 5.7 -5.7 24.6 9.0 84 113 A F < - 0 0 1 -5,-1.4 -1,-0.3 1,-0.1 -20,-0.2 -0.477 40.5-146.2 -68.4 138.0 -3.5 27.3 10.4 85 114 A G S S+ 0 0 0 -22,-2.7 -25,-0.4 1,-0.2 2,-0.3 0.641 81.8 9.3 -80.6 -18.3 -2.4 26.5 14.0 86 115 A F E -c 64 0B 0 -23,-0.6 -21,-1.5 61,-0.2 2,-0.4 -0.971 68.2-143.0-158.3 155.4 -2.5 30.1 14.9 87 116 A V E -cd 65 149B 0 61,-1.8 63,-2.9 -2,-0.3 2,-0.5 -0.978 6.8-165.2-125.0 133.1 -3.7 33.3 13.5 88 117 A E E - d 0 150B 0 -23,-1.1 -18,-0.4 -2,-0.4 2,-0.3 -0.993 11.3-165.9-116.7 123.4 -2.1 36.8 13.7 89 118 A I E - d 0 151B 0 61,-2.5 63,-2.9 -2,-0.5 -18,-0.2 -0.692 32.2 -8.1-102.9 163.2 -4.3 39.8 12.8 90 119 A G E - 0 0 0 -20,-1.7 -22,-2.2 1,-0.3 63,-0.1 -0.595 35.3-130.0 111.7-174.8 -3.1 43.3 12.1 91 120 A S E - 0 0 4 61,-0.5 2,-0.4 -24,-0.2 -1,-0.3 0.324 55.0-174.0 -74.4 142.7 -1.3 45.5 12.0 92 121 A V E - d 0 153B 1 60,-2.3 62,-3.0 -3,-0.2 30,-0.1 -0.918 8.5-156.8-108.2 131.8 -3.9 47.6 13.8 93 122 A T - 0 0 0 -2,-0.4 32,-1.2 60,-0.2 62,-0.2 -0.704 26.8-115.7-102.6 153.4 -3.4 51.4 14.4 94 123 A P S S+ 0 0 6 0, 0.0 31,-1.0 0, 0.0 32,-0.6 0.953 101.3 33.5 -53.4 -54.3 -5.1 53.3 17.2 95 124 A K S S- 0 0 137 29,-0.2 29,-0.3 30,-0.1 -2,-0.1 -0.714 101.3 -95.3-100.2 152.0 -7.2 55.5 14.9 96 125 A P - 0 0 90 0, 0.0 2,-0.3 0, 0.0 27,-0.2 -0.297 48.2-177.8 -56.3 145.4 -8.6 54.4 11.6 97 126 A Q B -J 122 0C 38 25,-2.6 25,-2.3 1,-0.1 27,-0.1 -0.996 33.4-137.4-151.2 155.2 -6.4 55.2 8.6 98 127 A E - 0 0 177 -2,-0.3 2,-0.2 23,-0.2 23,-0.2 0.859 37.9-147.5 -69.7 -43.4 -6.5 54.9 4.8 99 128 A G - 0 0 20 21,-0.2 20,-0.3 20,-0.2 -1,-0.2 -0.489 46.6 -25.0 86.8-169.4 -2.9 53.8 4.1 100 129 A N S S- 0 0 43 18,-2.8 4,-0.1 17,-0.3 17,-0.1 -0.270 76.7 -87.3 -74.0 159.7 -1.1 54.8 0.9 101 130 A P - 0 0 106 0, 0.0 -1,-0.1 0, 0.0 16,-0.1 -0.229 65.4 -69.8 -58.9 152.8 -2.7 55.7 -2.4 102 131 A R S S+ 0 0 161 2,-0.1 2,-0.1 1,-0.0 16,-0.0 -0.536 106.0 58.5 -84.2 155.2 -3.4 52.8 -4.8 103 132 A P + 0 0 85 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.579 66.6 142.4 -77.2 147.1 -1.9 50.9 -6.5 104 133 A R + 0 0 18 1,-0.2 13,-3.4 -2,-0.1 2,-0.4 0.325 49.2 63.4-141.0 9.0 -0.1 49.5 -3.5 105 134 A V E -K 116 0D 17 11,-0.2 2,-0.4 12,-0.1 -81,-0.3 -0.995 59.5-173.7-137.5 133.4 0.3 45.8 -3.9 106 135 A F E -K 115 0D 14 9,-3.1 9,-2.5 -2,-0.4 2,-0.3 -0.984 14.4-141.9-135.0 134.4 2.4 44.2 -6.8 107 136 A R E -K 114 0D 43 -2,-0.4 161,-0.3 7,-0.2 7,-0.2 -0.777 8.3-169.8 -96.2 143.9 2.9 40.6 -7.9 108 137 A L E >>> +K 113 0D 0 5,-2.9 5,-2.1 -2,-0.3 3,-1.3 -0.782 12.8 173.5-129.7 78.7 6.2 39.2 -9.2 109 138 A P G >45S+ 0 0 53 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.859 74.9 58.6 -64.2 -33.8 5.1 35.9 -10.5 110 139 A E G 345S+ 0 0 128 1,-0.2 -2,-0.0 -3,-0.1 -3,-0.0 0.689 116.7 35.3 -63.7 -21.8 8.5 35.1 -12.0 111 140 A D G <45S- 0 0 21 -3,-1.3 -1,-0.2 2,-0.2 167,-0.2 0.445 105.5-123.3-108.0 -5.7 10.0 35.4 -8.5 112 141 A Q T <<5S+ 0 0 68 -4,-1.0 166,-2.0 -3,-0.5 2,-0.3 0.953 74.1 124.3 53.4 51.8 7.1 34.0 -6.5 113 142 A A E < -KL 108 277D 0 -5,-2.1 -5,-2.9 164,-0.2 2,-0.3 -0.900 50.4-153.7-137.1 160.3 7.2 37.4 -4.7 114 143 A V E -KL 107 276D 14 162,-1.1 162,-2.9 -2,-0.3 2,-0.4 -0.966 5.2-155.3-130.5 147.8 5.0 40.3 -3.8 115 144 A I E -KL 106 275D 0 -9,-2.5 -9,-3.1 -2,-0.3 2,-0.4 -0.997 20.7-179.5-116.3 133.2 5.9 44.0 -3.1 116 145 A N E +KL 105 274D 33 158,-2.0 158,-2.6 -2,-0.4 -11,-0.2 -0.982 27.0 176.0-132.4 145.4 3.4 45.9 -1.0 117 146 A R + 0 0 52 -13,-3.4 -17,-0.3 -2,-0.4 -12,-0.1 -0.380 27.3 146.5-136.8 54.4 3.2 49.5 0.3 118 147 A Y - 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0 0 91 -3,-1.8 -3,-0.2 1,-0.3 -4,-0.1 0.752 61.6 -69.0 59.9 28.5 21.3 31.9 23.4 297 326 A G T 3 S- 0 0 23 1,-0.1 4,-2.0 32,-0.1 32,-0.1 -0.956 83.0 -99.8-153.0 168.9 7.0 24.1 1.8 310 339 A G H > S+ 0 0 0 -2,-0.3 4,-2.9 30,-0.2 5,-0.2 0.889 121.6 52.9 -57.5 -43.8 7.8 21.7 4.6 311 340 A Q H > S+ 0 0 108 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.908 107.4 51.9 -58.2 -45.8 11.5 22.0 3.9 312 341 A D H > S+ 0 0 3 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.919 112.2 46.4 -57.4 -45.7 11.2 25.8 4.1 313 342 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.938 112.9 48.0 -62.2 -52.5 9.4 25.5 7.5 314 343 A L H X S+ 0 0 4 -4,-2.9 4,-3.6 1,-0.2 5,-0.3 0.849 106.5 58.1 -59.2 -37.6 12.0 23.0 8.9 315 344 A E H X S+ 0 0 68 -4,-2.5 4,-1.7 -5,-0.2 -1,-0.2 0.937 110.2 43.4 -59.1 -41.0 14.9 25.1 7.8 316 345 A K H X>S+ 0 0 0 -4,-1.6 5,-2.4 2,-0.2 4,-0.8 0.908 115.0 49.5 -70.8 -41.9 13.5 28.0 9.9 317 346 A I H ><5S+ 0 0 0 -4,-2.5 45,-2.6 3,-0.2 3,-1.1 0.942 111.6 47.5 -60.4 -49.4 12.8 25.6 12.8 318 347 A R H 3<5S+ 0 0 65 -4,-3.6 46,-1.9 1,-0.3 47,-0.5 0.823 109.0 56.1 -64.5 -29.6 16.2 24.1 12.7 319 348 A A H 3<5S- 0 0 0 -4,-1.7 -1,-0.3 -5,-0.3 -27,-0.2 0.668 138.0 -77.4 -69.9 -22.6 17.6 27.7 12.5 320 349 A G T <<5S+ 0 0 1 -3,-1.1 -19,-0.5 -4,-0.8 -3,-0.2 0.368 83.8 135.2 144.5 -7.7 15.8 28.5 15.8 321 350 A A < - 0 0 0 -5,-2.4 -1,-0.3 1,-0.1 -19,-0.2 -0.501 32.9-167.9 -73.6 135.0 12.1 29.1 15.1 322 351 A S S S+ 0 0 16 -21,-3.2 2,-0.3 1,-0.2 -20,-0.2 0.741 81.3 12.7 -85.6 -30.1 9.5 27.6 17.5 323 352 A L E S- i 0 302B 1 -22,-1.5 -20,-3.1 -7,-0.1 2,-0.3 -0.942 71.3-147.5-139.8 163.3 6.7 28.5 15.1 324 353 A V E -bi 63 303B 0 -262,-3.4 -260,-2.8 -2,-0.3 2,-0.3 -0.930 6.8-164.1-132.0 154.4 6.5 29.6 11.5 325 354 A Q E -bi 64 304B 0 -22,-2.1 -20,-0.6 -2,-0.3 -18,-0.3 -0.917 4.2-172.7-127.7 162.3 4.1 31.8 9.5 326 355 A L E +b 65 0B 4 -262,-1.8 -260,-2.5 -2,-0.3 -18,-0.1 -0.967 20.6 152.5-144.3 160.8 3.4 32.4 5.8 327 356 A Y S > S+ 0 0 55 -2,-0.3 3,-2.7 -262,-0.2 4,-0.5 0.176 72.3 56.1-142.6 -66.8 1.3 34.7 3.7 328 357 A T T >> S+ 0 0 15 1,-0.3 3,-1.7 2,-0.2 4,-0.6 0.784 96.7 66.6 -50.6 -37.0 2.7 35.3 0.2 329 358 A A H >> S+ 0 0 9 -22,-0.4 4,-2.5 1,-0.3 3,-1.2 0.860 93.7 63.0 -53.5 -31.6 2.8 31.6 -0.7 330 359 A L H <> S+ 0 0 19 -3,-2.7 4,-1.4 1,-0.2 -1,-0.3 0.793 93.3 60.5 -63.4 -29.2 -1.0 31.7 -0.5 331 360 A T H <4 S+ 0 0 38 -3,-1.7 -1,-0.2 -4,-0.5 -2,-0.2 0.676 117.1 30.5 -76.1 -17.2 -1.2 34.1 -3.4 332 361 A F H << S+ 0 0 25 -3,-1.2 -2,-0.2 -4,-0.6 -1,-0.2 0.735 134.8 24.5-105.0 -33.6 0.5 31.6 -5.7 333 362 A W H < S- 0 0 74 -4,-2.5 -323,-0.2 1,-0.1 -3,-0.2 0.543 92.6-147.7-111.4 -15.9 -0.6 28.2 -4.3 334 363 A G >< - 0 0 1 -4,-1.4 3,-2.2 -5,-0.4 4,-0.2 -0.076 53.2 -33.7 68.7-175.4 -3.9 29.0 -2.5 335 364 A P T >> S+ 0 0 35 0, 0.0 3,-2.2 0, 0.0 4,-0.6 0.771 124.3 73.6 -47.5 -40.3 -5.2 27.3 0.6 336 365 A P H 3> S+ 0 0 18 0, 0.0 4,-2.1 0, 0.0 3,-0.2 0.772 81.0 75.7 -52.3 -21.1 -3.8 23.8 -0.3 337 366 A V H <> S+ 0 0 2 -3,-2.2 4,-2.7 1,-0.2 5,-0.2 0.831 86.7 61.5 -58.7 -28.3 -0.4 25.2 0.6 338 367 A V H <> S+ 0 0 0 -3,-2.2 4,-1.7 -4,-0.2 -1,-0.2 0.964 108.7 38.6 -67.8 -47.9 -1.3 25.0 4.3 339 368 A G H X S+ 0 0 17 -4,-0.6 4,-2.9 2,-0.2 5,-0.3 0.866 113.3 58.9 -67.6 -35.9 -1.8 21.2 4.4 340 369 A K H X S+ 0 0 22 -4,-2.1 4,-2.6 1,-0.2 5,-0.3 0.954 106.8 46.0 -56.0 -50.4 1.2 20.8 2.0 341 370 A V H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.888 115.0 47.2 -62.0 -40.7 3.5 22.5 4.4 342 371 A K H X S+ 0 0 3 -4,-1.7 4,-2.3 -5,-0.2 -1,-0.2 0.931 113.5 46.5 -70.2 -47.6 2.2 20.4 7.4 343 372 A R H X S+ 0 0 88 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.937 116.3 44.6 -56.4 -52.8 2.4 17.1 5.6 344 373 A E H X S+ 0 0 63 -4,-2.6 4,-2.5 -5,-0.3 -1,-0.2 0.867 112.0 53.1 -63.9 -37.6 5.9 17.7 4.2 345 374 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.930 109.7 47.7 -61.6 -48.6 7.1 19.0 7.6 346 375 A E H X S+ 0 0 39 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.925 113.1 48.5 -57.0 -48.4 5.9 15.9 9.4 347 376 A A H X S+ 0 0 48 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.922 112.5 48.3 -58.2 -46.2 7.5 13.6 6.8 348 377 A L H X S+ 0 0 30 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.847 108.4 54.4 -65.4 -35.6 10.8 15.5 7.0 349 378 A L H <>S+ 0 0 0 -4,-2.1 5,-3.0 2,-0.2 4,-0.3 0.920 111.9 43.5 -66.4 -44.0 10.8 15.4 10.7 350 379 A K H ><5S+ 0 0 120 -4,-2.0 3,-1.8 3,-0.2 -2,-0.2 0.957 112.7 53.6 -59.4 -52.8 10.4 11.6 10.7 351 380 A E H 3<5S+ 0 0 151 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.801 111.4 45.0 -52.6 -34.3 13.0 11.3 8.0 352 381 A Q T 3<5S- 0 0 83 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.354 118.9-107.2-100.2 7.1 15.6 13.3 10.0 353 382 A G T < 5 + 0 0 67 -3,-1.8 2,-0.5 -4,-0.3 -3,-0.2 0.761 68.0 143.8 81.1 26.7 14.9 11.5 13.2 354 383 A F < - 0 0 31 -5,-3.0 -1,-0.3 -6,-0.2 -2,-0.1 -0.846 46.1-147.8 -96.5 132.8 13.0 14.1 15.2 355 384 A G S S- 0 0 60 -2,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.861 78.1 -30.4 -62.5 -36.2 10.2 12.8 17.5 356 385 A G S >> S- 0 0 8 -7,-0.1 4,-0.9 -306,-0.1 3,-0.7 -0.958 77.7 -71.2-162.7-173.8 8.4 16.1 16.8 357 386 A V H >> S+ 0 0 0 -308,-3.0 4,-1.0 -2,-0.3 3,-0.9 0.862 121.3 62.0 -52.4 -43.0 8.8 19.8 16.0 358 387 A T H >4 S+ 0 0 82 -307,-0.4 3,-0.5 -309,-0.3 -1,-0.2 0.867 100.2 52.2 -58.6 -38.1 10.0 20.6 19.4 359 388 A D H <4 S+ 0 0 85 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.792 108.2 53.1 -68.1 -26.7 13.1 18.4 19.1 360 389 A A H X< S+ 0 0 0 -3,-0.9 3,-2.3 -4,-0.9 4,-0.3 0.690 78.5 114.6 -83.8 -17.8 14.0 20.2 15.8 361 390 A I T << S- 0 0 22 -4,-1.0 -43,-0.2 -3,-0.5 -44,-0.1 -0.371 97.2 -7.3 -62.4 119.7 13.9 23.7 17.2 362 391 A G T > S+ 0 0 0 -45,-2.6 3,-2.1 -2,-0.2 4,-0.4 0.454 89.4 140.8 77.1 3.7 17.4 25.1 17.1 363 392 A A G X + 0 0 14 -3,-2.3 3,-1.6 1,-0.3 -44,-0.1 0.766 62.2 63.9 -53.8 -32.0 18.9 21.8 15.9 364 393 A D G 3 S+ 0 0 63 -46,-1.9 -1,-0.3 -4,-0.3 -45,-0.1 0.791 100.0 54.6 -63.6 -26.8 21.4 23.4 13.4 365 394 A H G < 0 0 72 -3,-2.1 -1,-0.3 -47,-0.5 -2,-0.2 0.527 360.0 360.0 -82.1 -9.9 23.1 25.1 16.4 366 395 A R < 0 0 178 -3,-1.6 -2,-0.2 -4,-0.4 -3,-0.1 0.605 360.0 360.0-120.4 360.0 23.6 21.7 18.2