==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 30-NOV-09 3KVM . COMPND 2 MOLECULE: DIHYDROOROTATE DEHYDROGENASE, MITOCHONDRIAL; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.MCLEAN,Y.ZHANG . 366 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15410.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 71.0 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 . 14 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 12.3 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 . 11 3.0 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 0 2 0 1 3 1 0 1 0 3 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 31 A A > 0 0 51 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -99.7 17.1 -4.1 -20.8 2 32 A T H > + 0 0 95 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.785 360.0 64.4 -58.9 -28.7 15.6 -5.7 -23.9 3 33 A G H > S+ 0 0 52 1,-0.2 4,-1.7 2,-0.2 3,-0.3 0.986 113.9 24.4 -61.7 -66.7 17.3 -3.1 -26.1 4 34 A D H > S+ 0 0 40 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.611 112.9 72.8 -80.2 -8.6 21.0 -3.9 -25.6 5 35 A E H X S+ 0 0 27 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.959 107.4 35.1 -58.9 -51.2 20.0 -7.4 -24.6 6 36 A R H X S+ 0 0 157 -4,-2.0 4,-3.1 -3,-0.3 5,-0.4 0.856 117.0 54.9 -71.0 -35.5 19.3 -8.0 -28.3 7 37 A F H X>S+ 0 0 107 -4,-1.7 5,-2.6 -5,-0.2 4,-1.8 0.910 112.7 41.8 -64.7 -42.1 22.1 -5.7 -29.3 8 38 A Y H <>S+ 0 0 39 -4,-2.7 5,-2.5 3,-0.2 -2,-0.2 0.899 120.4 43.5 -70.1 -39.9 24.6 -7.7 -27.3 9 39 A A H <5S+ 0 0 28 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.886 123.8 32.8 -74.9 -40.1 23.2 -11.0 -28.3 10 40 A E H <5S+ 0 0 91 -4,-3.1 -3,-0.2 -5,-0.1 -2,-0.2 0.789 137.4 3.1 -89.5 -29.6 22.7 -10.3 -32.0 11 41 A H T X5S+ 0 0 106 -4,-1.8 4,-1.6 -5,-0.4 -3,-0.2 0.759 120.0 49.8-125.9 -55.4 25.6 -8.0 -32.8 12 42 A L H > S+ 0 0 60 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.867 111.6 48.6 -57.7 -34.2 29.1 -12.4 -32.2 15 45 A T H X S+ 0 0 84 -4,-1.6 4,-1.3 2,-0.2 -2,-0.2 0.894 109.1 51.9 -72.7 -40.4 31.5 -9.7 -33.5 16 46 A L H X S+ 0 0 43 -4,-2.2 4,-2.2 1,-0.2 3,-0.4 0.925 111.2 48.0 -57.2 -45.4 33.7 -10.1 -30.4 17 47 A Q H < S+ 0 0 38 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.792 108.3 54.4 -71.1 -28.1 33.8 -13.8 -31.1 18 48 A G H < S+ 0 0 66 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.770 115.9 39.3 -71.7 -25.6 34.6 -13.3 -34.7 19 49 A L H < S+ 0 0 140 -4,-1.3 2,-0.4 -3,-0.4 -2,-0.2 0.774 117.9 42.0 -93.7 -30.2 37.6 -11.1 -33.8 20 50 A L S < S- 0 0 51 -4,-2.2 -1,-0.2 -5,-0.2 0, 0.0 -0.954 74.2-123.9-128.9 137.8 39.0 -12.9 -30.8 21 51 A D > - 0 0 82 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.262 46.1 -95.4 -66.0 164.4 39.7 -16.5 -29.8 22 52 A P H > S+ 0 0 26 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.891 122.1 44.6 -55.2 -48.8 38.0 -17.7 -26.6 23 53 A E H > S+ 0 0 7 81,-0.3 4,-2.3 1,-0.2 5,-0.1 0.884 114.1 49.8 -67.8 -36.5 41.0 -17.2 -24.2 24 54 A S H > S+ 0 0 37 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.904 111.8 48.7 -65.1 -41.4 41.8 -13.7 -25.7 25 55 A A H X S+ 0 0 10 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.910 110.0 52.4 -63.8 -42.5 38.1 -12.7 -25.3 26 56 A H H X S+ 0 0 28 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.920 110.4 47.8 -58.0 -47.6 38.1 -14.0 -21.7 27 57 A R H X S+ 0 0 115 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.923 113.1 47.1 -60.1 -47.9 41.2 -11.9 -20.9 28 58 A L H X S+ 0 0 54 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.898 110.6 52.7 -61.8 -42.2 39.7 -8.8 -22.5 29 59 A A H X S+ 0 0 31 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.895 107.7 50.8 -62.6 -41.6 36.4 -9.3 -20.7 30 60 A V H X S+ 0 0 15 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.906 111.6 49.6 -61.5 -40.0 38.2 -9.6 -17.4 31 61 A R H X S+ 0 0 131 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.952 112.7 45.4 -62.5 -50.5 40.0 -6.3 -18.2 32 62 A F H X>S+ 0 0 97 -4,-2.9 5,-2.2 1,-0.2 4,-0.6 0.890 112.8 51.3 -60.8 -41.0 36.8 -4.5 -19.2 33 63 A T H ><5S+ 0 0 5 -4,-2.6 3,-1.2 1,-0.2 -1,-0.2 0.918 107.0 52.3 -64.6 -43.0 34.9 -5.7 -16.1 34 64 A S H 3<5S+ 0 0 57 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.750 111.1 49.0 -67.3 -22.4 37.7 -4.6 -13.7 35 65 A L H 3<5S- 0 0 122 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.507 113.6-118.4 -92.1 -7.5 37.5 -1.2 -15.2 36 66 A G T <<5 + 0 0 16 -3,-1.2 2,-2.7 -4,-0.6 -3,-0.2 0.633 60.7 151.7 80.4 13.1 33.7 -1.0 -15.0 37 67 A L < + 0 0 94 -5,-2.2 -1,-0.2 -6,-0.2 -3,-0.1 -0.422 32.1 128.8 -77.8 69.3 33.3 -0.7 -18.7 38 68 A L - 0 0 31 -2,-2.7 3,-0.1 -3,-0.1 2,-0.0 -0.817 64.5 -97.3-120.5 160.3 29.9 -2.3 -18.6 39 69 A P - 0 0 24 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.332 60.6 -78.9 -65.7 158.5 26.4 -1.6 -20.0 40 70 A R - 0 0 201 1,-0.1 2,-0.9 2,-0.0 3,-0.1 -0.431 37.0-146.3 -60.0 132.6 24.0 0.0 -17.6 41 71 A A + 0 0 60 1,-0.2 -1,-0.1 39,-0.1 41,-0.0 -0.714 30.6 164.7-103.6 78.9 22.5 -2.5 -15.2 42 72 A R + 0 0 147 -2,-0.9 2,-0.2 2,-0.1 -1,-0.2 0.698 34.4 109.9 -75.0 -24.4 19.1 -1.0 -14.8 43 73 A F - 0 0 47 -3,-0.1 2,-0.5 1,-0.1 296,-0.0 -0.363 57.6-151.7 -58.7 122.3 17.3 -4.0 -13.2 44 74 A Q - 0 0 176 -2,-0.2 2,-0.2 294,-0.0 -1,-0.1 -0.871 19.2-120.3 -98.1 126.0 16.5 -3.2 -9.6 45 75 A D - 0 0 48 -2,-0.5 2,-0.2 2,-0.1 15,-0.1 -0.456 26.2-147.5 -69.2 128.0 16.4 -6.3 -7.4 46 76 A S > - 0 0 31 -2,-0.2 3,-1.9 1,-0.1 4,-0.3 -0.527 28.5-106.0 -89.5 163.0 13.0 -6.8 -5.7 47 77 A D G > S+ 0 0 147 1,-0.3 3,-1.3 2,-0.2 -1,-0.1 0.754 114.9 73.7 -58.8 -25.6 12.5 -8.3 -2.3 48 78 A M G 3 S+ 0 0 30 1,-0.3 308,-2.7 307,-0.1 309,-0.3 0.781 94.9 51.4 -56.1 -29.6 11.2 -11.5 -4.1 49 79 A L G < S+ 0 0 0 -3,-1.9 -1,-0.3 306,-0.2 -2,-0.2 0.548 83.5 111.8 -91.3 -8.5 14.7 -12.3 -5.1 50 80 A E < - 0 0 53 -3,-1.3 307,-0.5 -4,-0.3 2,-0.4 -0.440 43.9-175.4 -71.7 136.6 16.4 -12.1 -1.7 51 81 A V E -A 58 0A 2 7,-2.6 7,-3.4 -2,-0.2 2,-0.5 -0.988 15.9-155.0-130.1 141.2 17.6 -15.3 -0.2 52 82 A R E +A 57 0A 178 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.961 40.7 124.5-117.9 116.3 19.1 -15.9 3.2 53 83 A V E > +A 56 0A 20 3,-1.9 3,-2.3 -2,-0.5 -2,-0.1 -0.956 53.0 34.7-158.4 163.2 21.4 -18.9 3.4 54 84 A L T 3 S- 0 0 27 1,-0.3 167,-0.2 -2,-0.3 3,-0.1 0.701 129.5 -60.7 57.5 20.7 25.0 -19.9 4.4 55 85 A G T 3 S+ 0 0 75 1,-0.3 2,-0.3 166,-0.0 -1,-0.3 0.658 118.9 88.8 83.4 15.9 24.8 -17.3 7.2 56 86 A H E < S-A 53 0A 53 -3,-2.3 -3,-1.9 89,-0.0 2,-0.4 -0.945 74.0-116.9-142.5 161.8 24.3 -14.4 4.8 57 87 A K E -A 52 0A 64 85,-0.3 2,-0.5 -2,-0.3 -5,-0.2 -0.853 23.7-162.5 -95.4 134.2 21.8 -12.3 2.9 58 88 A F E -A 51 0A 1 -7,-3.4 -7,-2.6 -2,-0.4 88,-0.2 -0.987 11.0-153.0-116.8 123.1 21.9 -12.5 -0.9 59 89 A R S S+ 0 0 84 86,-2.8 -10,-0.2 -2,-0.5 -1,-0.1 0.787 84.7 5.8 -73.5 -25.9 20.0 -9.7 -2.6 60 90 A N S S- 0 0 1 85,-0.4 -1,-0.2 24,-0.1 -10,-0.1 -0.968 72.8-125.4-146.5 161.4 19.4 -11.9 -5.6 61 91 A P S S+ 0 0 0 0, 0.0 262,-3.1 0, 0.0 2,-0.8 0.289 77.0 101.9 -88.6 9.4 20.2 -15.6 -6.2 62 92 A V E +b 323 0B 0 20,-0.2 22,-2.5 260,-0.2 23,-0.6 -0.832 47.4 172.9-106.2 106.6 22.2 -15.2 -9.4 63 93 A G E -bc 324 85B 0 260,-3.0 262,-1.8 -2,-0.8 2,-0.5 -0.621 36.3-111.8-106.5 165.0 26.0 -15.5 -9.0 64 94 A I E -bc 325 86B 1 21,-1.5 23,-1.2 260,-0.2 262,-0.2 -0.859 41.9-125.6 -91.5 128.5 28.9 -15.6 -11.3 65 95 A A > - 0 0 4 260,-2.1 3,-0.9 -2,-0.5 4,-0.4 -0.290 30.3 -86.4 -73.6 157.6 30.5 -19.0 -11.2 66 96 A A T 3 S+ 0 0 11 1,-0.2 24,-0.2 22,-0.1 -1,-0.1 -0.205 104.7 52.2 -53.7 148.7 34.2 -19.7 -10.5 67 97 A G T 3 S+ 0 0 11 22,-2.2 3,-0.3 2,-0.2 -1,-0.2 0.220 88.8 76.6 108.8 -14.8 36.6 -19.6 -13.4 68 98 A F S < S+ 0 0 12 -3,-0.9 2,-0.9 19,-0.3 3,-0.2 0.907 107.3 28.3 -88.7 -55.5 35.8 -16.3 -14.9 69 99 A D S > S+ 0 0 1 18,-0.4 20,-1.5 -4,-0.4 3,-0.6 -0.738 77.0 165.6-101.0 81.1 37.6 -14.1 -12.4 70 100 A K T 3 S+ 0 0 18 -2,-0.9 -1,-0.2 -3,-0.3 20,-0.1 0.792 73.2 35.7 -68.3 -29.6 40.3 -16.7 -11.4 71 101 A H T 3 S- 0 0 19 -3,-0.2 -1,-0.2 18,-0.1 59,-0.1 0.224 111.6-104.2-116.2 11.8 42.6 -14.2 -9.6 72 102 A G S < S+ 0 0 4 -3,-0.6 3,-0.1 17,-0.1 -2,-0.1 0.860 78.2 129.4 73.9 37.7 40.2 -11.8 -8.0 73 103 A E S S+ 0 0 80 1,-0.1 4,-0.1 2,-0.1 -1,-0.1 0.546 71.5 33.6-100.7 -11.5 40.8 -8.9 -10.4 74 104 A A S > S+ 0 0 2 1,-0.1 4,-2.0 2,-0.1 5,-0.2 0.104 70.5 126.7-137.1 21.6 37.2 -7.9 -11.3 75 105 A V H > S+ 0 0 4 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.884 78.8 44.6 -57.7 -46.2 35.1 -8.5 -8.3 76 106 A D H > S+ 0 0 55 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.877 110.8 54.1 -69.9 -36.6 33.5 -5.0 -8.1 77 107 A G H > S+ 0 0 7 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.863 106.3 54.7 -62.1 -33.4 32.8 -4.9 -11.8 78 108 A L H <>S+ 0 0 1 -4,-2.0 5,-1.4 2,-0.2 4,-0.5 0.890 106.8 48.2 -71.3 -37.7 31.0 -8.2 -11.4 79 109 A Y H ><5S+ 0 0 22 -4,-1.7 3,-1.4 1,-0.2 -1,-0.2 0.896 109.0 55.4 -63.3 -37.9 28.7 -6.8 -8.7 80 110 A K H 3<5S+ 0 0 117 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.819 98.3 62.7 -62.9 -29.6 28.2 -3.8 -11.0 81 111 A M T 3<5S- 0 0 11 -4,-1.3 -1,-0.3 -5,-0.1 257,-0.2 0.679 125.3-103.4 -70.2 -18.3 27.1 -6.3 -13.7 82 112 A G T < 5 + 0 0 11 -3,-1.4 -20,-0.2 -4,-0.5 -3,-0.2 0.447 67.6 150.4 112.1 1.2 24.2 -7.2 -11.3 83 113 A F < - 0 0 2 -5,-1.4 -1,-0.3 1,-0.1 -20,-0.2 -0.427 42.8-143.8 -65.4 138.2 25.3 -10.6 -9.8 84 114 A G S S+ 0 0 0 -22,-2.5 -25,-0.4 1,-0.2 2,-0.3 0.641 83.6 8.2 -80.1 -15.2 24.0 -11.1 -6.3 85 115 A F E -c 63 0B 0 -23,-0.6 -21,-1.5 61,-0.2 2,-0.4 -0.973 69.3-140.8-159.7 158.6 27.2 -12.8 -5.3 86 116 A V E -cd 64 148B 0 61,-1.8 63,-3.5 -2,-0.3 2,-0.5 -0.972 6.5-165.3-127.5 133.8 30.7 -13.4 -6.8 87 117 A E E - d 0 149B 1 -23,-1.2 -18,-0.4 -2,-0.4 -19,-0.3 -0.977 11.0-167.6-118.4 122.9 32.9 -16.4 -6.7 88 118 A I E - d 0 150B 0 61,-2.5 63,-3.0 -2,-0.5 -18,-0.2 -0.655 32.8 -2.2-102.9 165.8 36.6 -16.1 -7.6 89 119 A G E - 0 0 0 -20,-1.5 -22,-2.2 1,-0.3 63,-0.1 -0.645 33.9-136.1 112.2-173.7 39.1 -18.9 -8.3 90 120 A S E - 0 0 5 61,-0.5 2,-0.4 -2,-0.2 -1,-0.3 0.400 54.4-176.4 -73.6 143.4 40.0 -21.5 -8.5 91 121 A V E - d 0 152B 1 60,-2.3 62,-3.3 -3,-0.2 30,-0.1 -0.928 10.2-154.8-109.7 132.5 43.2 -20.3 -6.7 92 122 A T - 0 0 0 -2,-0.4 32,-1.0 60,-0.2 62,-0.2 -0.701 26.7-113.6-103.6 157.8 46.1 -22.6 -6.1 93 123 A P S S+ 0 0 4 0, 0.0 31,-1.2 0, 0.0 32,-0.6 0.948 101.0 31.1 -58.5 -53.2 48.7 -22.2 -3.3 94 124 A K S S- 0 0 121 29,-0.2 29,-0.3 30,-0.1 -2,-0.1 -0.730 101.0 -93.7 -99.6 154.5 51.7 -21.4 -5.5 95 125 A P + 0 0 91 0, 0.0 2,-0.3 0, 0.0 27,-0.2 -0.342 50.3 172.5 -58.3 144.1 51.5 -19.6 -8.8 96 126 A Q B -J 121 0C 36 25,-2.1 25,-2.5 23,-0.1 27,-0.1 -0.981 35.4-133.9-155.2 158.6 51.2 -21.9 -11.9 97 127 A E - 0 0 175 -2,-0.3 23,-0.2 23,-0.2 22,-0.1 0.675 36.8-144.5 -88.0 -20.8 50.6 -21.5 -15.6 98 128 A G - 0 0 27 21,-0.3 20,-0.3 20,-0.2 -1,-0.2 -0.359 48.0 -21.8 79.6-168.7 48.1 -24.2 -16.3 99 129 A N S S- 0 0 44 18,-2.7 4,-0.1 17,-0.3 17,-0.0 -0.239 76.1 -91.0 -74.6 160.0 48.0 -26.1 -19.6 100 130 A P - 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.351 64.0 -66.9 -64.3 150.2 49.5 -25.1 -22.9 101 131 A R S S+ 0 0 131 2,-0.1 2,-0.1 -2,-0.0 16,-0.0 -0.505 107.5 56.0 -81.8 155.4 47.3 -23.1 -25.3 102 132 A P + 0 0 88 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.556 66.7 141.5 -74.3 150.2 45.0 -23.4 -27.0 103 133 A R + 0 0 15 1,-0.2 13,-3.1 -2,-0.1 2,-0.4 0.254 51.9 64.4-143.6 8.8 43.0 -24.5 -24.0 104 134 A V E -K 115 0D 19 11,-0.2 2,-0.4 12,-0.1 -81,-0.3 -0.998 59.4-176.3-137.2 137.3 39.5 -22.9 -24.5 105 135 A F E -K 114 0D 16 9,-2.8 9,-2.5 -2,-0.4 2,-0.3 -0.995 17.1-138.4-140.4 135.9 37.1 -23.8 -27.3 106 136 A R E -K 113 0D 39 -2,-0.4 161,-0.3 7,-0.2 7,-0.2 -0.738 7.9-169.7 -91.4 139.6 33.7 -22.5 -28.5 107 137 A L E >>> +K 112 0D 0 5,-2.7 5,-1.8 -2,-0.3 3,-1.6 -0.737 13.5 174.0-120.9 81.0 30.9 -24.8 -29.6 108 138 A P G >45S+ 0 0 71 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.848 74.9 57.2 -58.8 -37.9 28.5 -22.1 -31.1 109 139 A E G 345S+ 0 0 129 1,-0.3 -2,-0.0 -3,-0.1 -3,-0.0 0.699 116.3 36.7 -67.9 -18.0 26.1 -24.7 -32.5 110 140 A D G <45S- 0 0 17 -3,-1.6 -1,-0.3 2,-0.2 167,-0.2 0.373 104.2-124.2-112.2 -0.5 25.7 -26.2 -29.0 111 141 A Q T <<5S+ 0 0 64 -3,-0.9 166,-2.1 -4,-0.6 2,-0.3 0.952 73.7 124.4 46.2 54.4 25.9 -23.0 -27.0 112 142 A A E < -KL 107 276D 0 -5,-1.8 -5,-2.7 164,-0.2 2,-0.3 -0.903 51.2-149.9-138.5 159.8 28.7 -24.7 -25.1 113 143 A V E -KL 106 275D 17 162,-1.1 162,-2.7 -2,-0.3 2,-0.4 -0.974 3.1-157.6-128.5 147.7 32.3 -24.2 -24.2 114 144 A I E +KL 105 274D 0 -9,-2.5 -9,-2.8 -2,-0.3 2,-0.4 -0.998 20.6 176.0-119.2 130.0 35.1 -26.8 -23.6 115 145 A N E +KL 104 273D 33 158,-1.8 158,-2.6 -2,-0.4 -11,-0.2 -0.986 27.5 177.7-133.0 144.9 38.1 -25.7 -21.5 116 146 A R + 0 0 54 -13,-3.1 -17,-0.3 -2,-0.4 -12,-0.1 -0.346 27.3 148.8-133.3 53.9 41.2 -27.3 -20.2 117 147 A Y - 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0 0 42 16,-0.1 16,-0.2 1,-0.0 -2,-0.1 -0.473 68.7-145.4 -80.1 159.6 31.1 -36.5 -20.9 259 289 A R - 0 0 75 -2,-0.1 3,-0.1 10,-0.0 4,-0.1 -0.854 20.6-141.2-125.2 96.5 30.1 -35.6 -24.4 260 290 A P > - 0 0 44 0, 0.0 3,-1.2 0, 0.0 19,-0.0 -0.165 29.5 -96.3 -54.6 146.5 26.3 -35.9 -24.7 261 291 A A T 3 S+ 0 0 110 1,-0.2 0, 0.0 0, 0.0 0, 0.0 -0.362 107.4 42.6 -59.0 141.9 25.0 -37.3 -28.0 262 292 A G T 3 + 0 0 56 1,-0.3 -1,-0.2 -3,-0.1 2,-0.1 0.335 68.3 148.5 103.4 -8.4 24.0 -34.6 -30.4 263 293 A L < - 0 0 6 -3,-1.2 -1,-0.3 1,-0.1 -153,-0.1 -0.396 21.9-175.8 -59.1 134.2 26.8 -32.1 -30.0 264 294 A Q + 0 0 126 -157,-0.1 -1,-0.1 -2,-0.1 4,-0.1 0.661 39.7 115.7-107.1 -22.9 27.3 -30.4 -33.3 265 295 A G > - 0 0 2 -158,-0.2 3,-1.6 1,-0.2 4,-0.1 -0.173 67.5-131.4 -56.1 140.1 30.3 -28.2 -32.7 266 296 A A T 3 S+ 0 0 100 1,-0.3 3,-0.4 2,-0.1 -1,-0.2 0.784 107.3 53.4 -59.7 -27.0 33.4 -29.0 -34.8 267 297 A L T > S+ 0 0 67 -161,-0.3 3,-1.9 1,-0.2 -1,-0.3 0.133 70.2 117.3 -97.8 19.7 35.5 -28.9 -31.6 268 298 A R T < S+ 0 0 115 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.702 71.1 57.5 -65.0 -19.8 33.4 -31.4 -29.6 269 299 A S T 3 S+ 0 0 109 -3,-0.4 -1,-0.3 -4,-0.1 2,-0.1 0.347 76.3 119.9 -96.7 6.3 36.2 -33.9 -29.3 270 300 A E S < S- 0 0 57 -3,-1.9 2,-0.1 1,-0.1 -155,-0.1 -0.467 72.5-107.6 -64.0 140.3 38.7 -31.5 -27.6 271 301 A T S S+ 0 0 104 -2,-0.1 2,-0.3 -157,-0.1 -1,-0.1 -0.452 75.0 65.8 -67.3 142.3 39.8 -32.7 -24.2 272 302 A G S S- 0 0 7 -2,-0.1 2,-0.5 -15,-0.1 -156,-0.2 -0.860 86.1 -41.7 140.8-174.0 38.4 -30.8 -21.3 273 303 A G E -L 115 0D 0 -158,-2.6 -158,-1.8 -2,-0.3 2,-0.4 -0.789 48.5-139.9 -93.9 132.4 35.3 -29.9 -19.3 274 304 A L E +LM 114 256D 0 -18,-3.1 -18,-2.1 -2,-0.5 2,-0.2 -0.757 26.1 176.9 -91.8 133.5 32.1 -29.1 -21.3 275 305 A S E +L 113 0D 13 -162,-2.7 -162,-1.1 -2,-0.4 2,-0.2 -0.758 33.0 39.5-127.1 172.5 29.9 -26.3 -20.0 276 306 A G E >> S-L 112 0D 5 -2,-0.2 3,-1.9 -164,-0.2 4,-0.7 -0.522 105.9 -5.9 91.3-154.0 26.7 -24.5 -21.1 277 307 A K G >4 S+ 0 0 89 -166,-2.1 3,-1.2 1,-0.3 4,-0.5 0.825 126.0 56.2 -55.5 -44.4 23.5 -25.8 -22.6 278 308 A P G 34 S+ 0 0 36 0, 0.0 -1,-0.3 0, 0.0 4,-0.3 0.726 111.5 48.5 -61.6 -18.1 24.5 -29.5 -23.1 279 309 A L G <> S+ 0 0 5 -3,-1.9 4,-2.4 1,-0.1 5,-0.3 0.647 87.3 93.9 -89.1 -18.8 25.3 -29.5 -19.4 280 310 A R H S+ 0 0 83 -4,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.801 114.5 59.7 -77.1 -25.0 19.7 -30.8 -17.4 282 312 A L H > S+ 0 0 63 -4,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.937 110.3 44.8 -59.6 -45.4 22.5 -33.1 -16.3 283 313 A S H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.914 111.3 52.1 -63.5 -45.3 23.3 -30.5 -13.7 284 314 A T H X S+ 0 0 3 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.918 109.5 49.8 -60.4 -42.7 19.7 -30.0 -12.7 285 315 A Q H X S+ 0 0 108 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.848 108.7 52.4 -65.0 -34.6 19.3 -33.8 -12.2 286 316 A T H X S+ 0 0 2 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.875 109.5 49.8 -69.5 -36.1 22.4 -33.9 -10.0 287 317 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.931 109.4 51.6 -62.4 -46.9 20.9 -31.1 -7.9 288 318 A R H X S+ 0 0 72 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.923 113.4 45.2 -56.4 -45.7 17.7 -33.0 -7.6 289 319 A E H X S+ 0 0 65 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.924 113.8 46.3 -67.3 -47.3 19.5 -36.1 -6.5 290 320 A M H X S+ 0 0 0 -4,-2.6 4,-1.3 1,-0.2 6,-0.2 0.869 110.0 54.8 -66.3 -36.3 21.8 -34.4 -3.9 291 321 A Y H <>S+ 0 0 34 -4,-2.6 5,-2.9 -5,-0.2 6,-0.3 0.914 112.1 44.1 -61.0 -42.9 18.9 -32.4 -2.5 292 322 A A H ><5S+ 0 0 54 -4,-1.7 3,-1.4 -5,-0.2 -2,-0.2 0.912 110.9 53.1 -69.5 -43.1 17.1 -35.7 -1.8 293 323 A L H 3<5S+ 0 0 50 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.732 114.4 43.2 -64.7 -22.9 20.1 -37.5 -0.5 294 324 A T T ><5S- 0 0 0 -4,-1.3 3,-1.9 -5,-0.2 -1,-0.3 0.264 111.7-119.6-105.2 8.5 20.6 -34.6 2.0 295 325 A Q T < 5 - 0 0 92 -3,-1.4 -3,-0.2 1,-0.3 -4,-0.1 0.775 61.4 -71.4 60.8 28.2 16.9 -34.4 2.9 296 326 A G T 3 S- 0 0 22 1,-0.1 4,-2.0 32,-0.1 5,-0.2 -0.959 83.9-103.1-150.7 168.4 17.2 -17.8 -18.7 309 339 A G H > S+ 0 0 0 -2,-0.3 4,-2.9 30,-0.2 5,-0.2 0.877 121.4 54.4 -61.1 -37.5 14.8 -17.4 -15.8 310 340 A Q H > S+ 0 0 109 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.933 106.7 50.8 -62.9 -45.1 13.3 -20.8 -16.6 311 341 A D H > S+ 0 0 3 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.908 113.8 45.1 -56.0 -45.2 16.7 -22.4 -16.4 312 342 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 3,-0.2 0.938 112.5 49.8 -66.5 -47.6 17.3 -20.8 -13.0 313 343 A L H X S+ 0 0 5 -4,-2.9 4,-3.1 1,-0.2 5,-0.3 0.864 105.8 57.2 -62.6 -36.7 13.8 -21.6 -11.6 314 344 A E H X S+ 0 0 65 -4,-2.6 4,-1.3 -5,-0.2 -1,-0.2 0.900 109.8 44.7 -61.9 -38.8 14.2 -25.3 -12.7 315 345 A K H X>S+ 0 0 0 -4,-1.4 5,-2.8 -3,-0.2 4,-0.7 0.889 113.7 50.0 -71.5 -37.8 17.3 -25.6 -10.6 316 346 A I H ><5S+ 0 0 0 -4,-2.3 45,-2.7 3,-0.2 3,-1.3 0.955 112.0 46.7 -64.1 -49.6 15.8 -23.8 -7.7 317 347 A R H 3<5S+ 0 0 42 -4,-3.1 46,-2.0 1,-0.3 47,-0.5 0.812 108.7 57.7 -60.1 -29.9 12.7 -26.0 -7.8 318 348 A A H 3<5S- 0 0 0 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.665 138.4 -78.7 -75.5 -17.0 15.0 -29.0 -8.0 319 349 A G T <<5S+ 0 0 1 -3,-1.3 -19,-0.5 -4,-0.7 2,-0.3 0.387 84.2 136.1 137.1 -0.6 16.6 -27.9 -4.7 320 350 A A < - 0 0 0 -5,-2.8 -1,-0.3 1,-0.2 41,-0.2 -0.597 32.1-169.5 -77.6 131.4 19.0 -25.0 -5.4 321 351 A S S S+ 0 0 17 -21,-2.4 2,-0.3 -2,-0.3 -20,-0.2 0.726 81.4 12.9 -83.0 -26.7 18.9 -22.1 -2.9 322 352 A L E S- i 0 301B 2 -22,-1.5 -20,-3.2 -7,-0.1 2,-0.3 -0.952 72.0-150.1-140.9 158.6 21.2 -20.1 -5.3 323 353 A V E -bi 62 302B 0 -262,-3.1 -260,-3.0 -2,-0.3 2,-0.3 -0.919 4.1-160.1-127.7 160.5 22.3 -20.4 -8.9 324 354 A Q E -bi 63 303B 0 -22,-2.2 -20,-0.7 -2,-0.3 -18,-0.3 -0.945 4.0-168.4-129.3 157.7 25.4 -19.4 -10.9 325 355 A L E +b 64 0B 3 -262,-1.8 -260,-2.1 -2,-0.3 -18,-0.1 -0.951 20.6 151.5-136.6 161.9 26.1 -19.0 -14.6 326 356 A Y S >> S+ 0 0 56 -2,-0.3 3,-1.5 -20,-0.2 4,-0.9 0.236 72.0 52.1-147.1 -64.9 29.2 -18.5 -16.6 327 357 A T H >> S+ 0 0 14 1,-0.3 4,-1.0 2,-0.2 3,-1.0 0.853 103.5 60.5 -55.6 -39.4 29.0 -19.8 -20.2 328 358 A A H >> S+ 0 0 9 -22,-0.4 4,-2.6 1,-0.3 3,-0.5 0.854 99.6 58.6 -56.1 -34.4 25.8 -17.8 -20.9 329 359 A L H <> S+ 0 0 12 -3,-1.5 4,-1.7 1,-0.2 -1,-0.3 0.851 100.5 55.8 -62.8 -34.6 27.8 -14.7 -20.2 330 360 A T H << S+ 0 0 39 -3,-1.0 -1,-0.2 -4,-0.9 -2,-0.2 0.758 116.2 35.7 -72.7 -24.0 30.2 -15.5 -23.0 331 361 A F H << S+ 0 0 17 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.844 131.7 24.4 -94.3 -40.5 27.4 -15.8 -25.6 332 362 A W H < S- 0 0 73 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.583 96.9-142.2-108.1 -13.9 25.0 -13.1 -24.5 333 363 A G >< - 0 0 0 -4,-1.7 3,-2.4 -5,-0.4 4,-0.2 -0.087 50.7 -33.9 77.8-179.3 27.2 -10.7 -22.6 334 364 A P T >> S+ 0 0 27 0, 0.0 3,-1.7 0, 0.0 4,-0.6 0.740 125.0 70.5 -48.1 -34.1 26.5 -8.7 -19.4 335 365 A P H 3> S+ 0 0 14 0, 0.0 4,-1.9 0, 0.0 -2,-0.1 0.702 81.1 76.6 -60.2 -15.8 22.8 -8.1 -20.3 336 366 A V H <> S+ 0 0 2 -3,-2.4 4,-2.6 1,-0.2 5,-0.2 0.800 87.1 60.6 -68.1 -24.4 22.1 -11.8 -19.6 337 367 A V H <> S+ 0 0 0 -3,-1.7 4,-2.2 -4,-0.2 -1,-0.2 0.954 107.4 40.9 -69.2 -49.6 22.3 -11.2 -15.9 338 368 A G H X S+ 0 0 18 -4,-0.6 4,-2.7 -257,-0.2 5,-0.2 0.875 114.1 56.6 -63.5 -35.8 19.4 -8.7 -15.8 339 369 A K H X S+ 0 0 44 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.948 108.1 45.2 -59.3 -51.1 17.5 -10.9 -18.2 340 370 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.910 114.7 48.3 -61.2 -43.9 17.8 -14.0 -16.0 341 371 A K H X S+ 0 0 6 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.923 112.6 48.1 -63.6 -43.7 16.7 -12.0 -12.9 342 372 A R H X S+ 0 0 84 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.908 114.3 45.4 -65.5 -42.3 13.8 -10.4 -14.6 343 373 A E H X S+ 0 0 59 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.869 110.8 54.4 -69.1 -35.9 12.5 -13.7 -16.1 344 374 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.926 108.7 48.1 -63.3 -44.4 13.0 -15.4 -12.8 345 375 A E H X S+ 0 0 39 -4,-2.2 4,-2.0 2,-0.2 5,-0.2 0.916 112.1 49.3 -63.0 -43.7 10.8 -12.9 -11.0 346 376 A A H X S+ 0 0 46 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.913 112.2 47.9 -60.8 -44.6 8.1 -13.1 -13.6 347 377 A L H X S+ 0 0 31 -4,-2.5 4,-1.9 2,-0.2 6,-0.2 0.861 107.9 56.0 -66.4 -36.4 8.0 -16.9 -13.4 348 378 A L H <>S+ 0 0 0 -4,-2.2 5,-2.5 2,-0.2 4,-0.2 0.944 111.8 41.6 -60.8 -48.7 7.9 -16.8 -9.6 349 379 A K H ><5S+ 0 0 121 -4,-2.0 3,-1.8 1,-0.2 -2,-0.2 0.939 112.8 56.6 -59.7 -46.5 4.8 -14.6 -9.6 350 380 A E H 3<5S+ 0 0 146 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.814 109.9 43.1 -56.6 -36.5 3.4 -16.7 -12.5 351 381 A Q T 3<5S- 0 0 88 -4,-1.9 -1,-0.3 -3,-0.2 -2,-0.2 0.277 119.5-105.6-101.1 10.3 3.7 -19.9 -10.5 352 382 A G T < 5 + 0 0 68 -3,-1.8 2,-0.4 1,-0.3 -3,-0.2 0.655 67.6 146.6 83.0 16.6 2.3 -18.5 -7.3 353 383 A F < - 0 0 35 -5,-2.5 -1,-0.3 -6,-0.2 3,-0.1 -0.708 44.3-148.5 -86.2 135.8 5.5 -18.2 -5.3 354 384 A G S S- 0 0 59 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.807 77.4 -28.3 -70.1 -28.6 5.8 -15.3 -2.8 355 385 A G S >> S- 0 0 8 -7,-0.1 3,-0.7 1,-0.1 4,-0.7 -0.971 76.2 -76.1-169.4 178.3 9.6 -15.3 -3.4 356 386 A V H >> S+ 0 0 0 -308,-2.7 3,-1.5 -2,-0.3 4,-1.0 0.884 121.9 61.4 -51.4 -43.6 12.6 -17.4 -4.4 357 387 A T H >4 S+ 0 0 82 -307,-0.5 3,-0.6 -309,-0.3 -1,-0.2 0.859 99.7 54.1 -57.5 -38.3 12.7 -19.0 -0.9 358 388 A D H <4 S+ 0 0 89 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.714 107.4 52.5 -67.4 -21.4 9.3 -20.5 -1.3 359 389 A A H X< S+ 0 0 0 -3,-1.5 3,-2.3 -4,-0.7 4,-0.3 0.647 76.5 115.9 -92.6 -17.2 10.4 -22.2 -4.6 360 390 A I T << S- 0 0 22 -4,-1.0 -43,-0.2 -3,-0.6 -39,-0.1 -0.355 97.1 -6.2 -58.4 116.9 13.5 -23.9 -3.2 361 391 A G T > S+ 0 0 0 -45,-2.7 3,-2.0 -2,-0.2 4,-0.5 0.528 88.1 142.0 78.9 6.0 12.9 -27.6 -3.5 362 392 A A G X + 0 0 11 -3,-2.3 3,-0.9 1,-0.3 -44,-0.1 0.743 63.3 63.2 -57.7 -27.1 9.3 -27.2 -4.6 363 393 A D G > S+ 0 0 39 -46,-2.0 3,-0.9 -4,-0.3 -1,-0.3 0.809 98.5 56.3 -64.4 -29.8 9.5 -30.1 -7.1 364 394 A H G < S+ 0 0 69 -3,-2.0 -1,-0.2 -47,-0.5 -2,-0.2 0.609 102.3 56.2 -80.3 -11.2 10.1 -32.5 -4.2 365 395 A R G < 0 0 145 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.2 0.231 360.0 360.0-105.6 12.4 6.9 -31.5 -2.4 366 396 A R < 0 0 220 -3,-0.9 -3,-0.0 -4,-0.1 -4,-0.0 -0.602 360.0 360.0 -79.7 360.0 4.6 -32.3 -5.3