==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 25-SEP-07 2VCN . COMPND 2 MOLECULE: ASCORBATE PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GLYCINE MAX; . AUTHOR C.L.METCALFE,I.K.MACDONALD,K.A.BROWN,E.L.RAVEN,P.C.E.MOODY . 248 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10986.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 7 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 39.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.2 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 1 1 0 0 4 0 1 0 1 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 1 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 2 A G 0 0 108 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 2.8 36.1 39.3 15.9 2 3 A K - 0 0 63 2,-0.0 2,-0.4 1,-0.0 246,-0.2 -0.671 360.0-176.1 -96.3 138.4 37.4 42.4 17.5 3 4 A S - 0 0 86 244,-2.4 244,-0.0 -2,-0.3 -1,-0.0 -0.887 23.6-149.6-126.8 101.7 41.0 43.6 17.8 4 5 A Y - 0 0 72 -2,-0.4 113,-0.1 1,-0.1 2,-0.0 -0.416 15.3-117.0 -80.3 141.9 41.0 46.8 19.8 5 6 A P - 0 0 58 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.331 26.0-106.4 -74.4 157.2 43.7 49.4 19.2 6 7 A T - 0 0 142 111,-0.1 2,-0.3 -2,-0.0 111,-0.0 -0.657 36.6-174.0 -75.4 133.7 46.3 50.6 21.6 7 8 A V - 0 0 44 -2,-0.4 5,-0.0 1,-0.1 0, 0.0 -0.926 30.1 -95.7-123.2 154.1 45.7 54.0 23.1 8 9 A S > - 0 0 66 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.168 30.9-110.0 -61.6 161.8 48.1 55.9 25.4 9 10 A A H > S+ 0 0 90 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.882 122.0 54.4 -56.1 -42.8 47.9 56.0 29.2 10 11 A D H > S+ 0 0 129 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.878 106.4 51.5 -61.4 -39.9 46.8 59.6 28.9 11 12 A Y H 4 S+ 0 0 31 2,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.952 111.0 47.7 -60.1 -48.7 44.0 58.6 26.5 12 13 A Q H < S+ 0 0 35 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.892 109.8 52.0 -60.6 -38.8 42.8 56.0 29.0 13 14 A K H < 0 0 48 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.894 360.0 360.0 -64.9 -37.2 42.9 58.4 31.9 14 15 A A < 0 0 17 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.881 360.0 360.0 -67.3 360.0 40.8 60.8 29.9 15 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 16 17 A E > 0 0 136 0, 0.0 4,-1.4 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 -36.2 37.9 57.3 32.9 17 18 A K H > + 0 0 31 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.898 360.0 50.4 -71.5 -40.7 37.6 60.9 33.9 18 19 A A H > S+ 0 0 0 -4,-2.9 4,-2.9 2,-0.2 5,-0.2 0.877 106.2 56.8 -63.1 -37.7 35.2 61.7 31.1 19 20 A K H > S+ 0 0 11 -5,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.932 109.5 45.5 -58.4 -45.9 33.0 58.7 32.1 20 21 A K H X S+ 0 0 122 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.933 113.7 47.9 -64.3 -46.5 32.7 60.1 35.7 21 22 A K H X S+ 0 0 30 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.887 109.7 53.3 -63.3 -40.6 31.9 63.6 34.4 22 23 A L H X S+ 0 0 0 -4,-2.9 4,-2.9 2,-0.2 5,-0.4 0.875 104.8 56.5 -60.1 -36.6 29.3 62.3 32.0 23 24 A R H X S+ 0 0 97 -4,-1.9 4,-2.5 -5,-0.2 5,-0.3 0.975 112.2 40.0 -59.2 -54.3 27.6 60.4 34.8 24 25 A G H X S+ 0 0 46 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.920 118.8 47.0 -63.4 -40.3 27.1 63.6 36.8 25 26 A F H X S+ 0 0 41 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.934 114.4 44.8 -68.0 -49.5 26.2 65.7 33.8 26 27 A I H X>S+ 0 0 1 -4,-2.9 4,-1.4 2,-0.2 5,-1.3 0.901 115.2 48.4 -65.6 -39.6 23.8 63.3 32.3 27 28 A A H <5S+ 0 0 55 -4,-2.5 3,-0.3 -5,-0.4 -2,-0.2 0.947 115.0 45.2 -63.8 -47.7 22.0 62.6 35.6 28 29 A E H <5S+ 0 0 127 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.896 115.7 45.4 -64.1 -41.6 21.7 66.3 36.5 29 30 A K H <5S- 0 0 77 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.669 99.4-134.3 -78.3 -19.0 20.5 67.3 33.0 30 31 A R T <5 + 0 0 179 -4,-1.4 -3,-0.2 -3,-0.3 4,-0.1 0.816 67.5 125.9 70.9 32.4 18.0 64.4 32.8 31 32 A C >< + 0 0 12 -5,-1.3 4,-2.2 -6,-0.2 5,-0.2 0.181 18.4 118.5-113.8 18.9 19.1 63.8 29.3 32 33 A A H > S+ 0 0 3 -6,-0.5 4,-2.6 1,-0.2 5,-0.2 0.914 78.0 49.3 -53.0 -49.0 20.1 60.1 29.4 33 34 A P H > S+ 0 0 24 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.930 110.7 49.4 -60.9 -41.7 17.5 59.1 26.8 34 35 A L H > S+ 0 0 25 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.888 111.6 50.1 -60.9 -39.3 18.6 61.8 24.3 35 36 A M H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.872 109.3 51.0 -66.6 -37.0 22.2 60.7 24.8 36 37 A L H X S+ 0 0 16 -4,-2.6 4,-2.6 -5,-0.2 5,-0.2 0.943 111.2 48.5 -64.9 -45.9 21.4 57.1 24.1 37 38 A R H X S+ 0 0 65 -4,-2.7 4,-2.9 -5,-0.2 5,-0.2 0.907 110.2 51.9 -58.8 -43.3 19.6 58.1 21.0 38 39 A L H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.945 111.6 46.4 -56.4 -47.9 22.6 60.3 20.0 39 40 A A H X S+ 0 0 1 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.898 115.1 46.7 -63.4 -42.0 25.0 57.3 20.4 40 41 A A H X S+ 0 0 31 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.912 111.0 49.7 -71.4 -40.6 22.7 54.9 18.6 41 42 A H H < S+ 0 0 37 -4,-2.9 4,-0.3 2,-0.2 -1,-0.2 0.824 110.2 53.7 -64.7 -30.2 22.1 57.3 15.6 42 43 A S H < S+ 0 0 2 -4,-1.8 3,-0.4 -5,-0.2 14,-0.3 0.933 118.6 34.1 -64.3 -45.1 25.8 57.8 15.4 43 44 A A H >< S+ 0 0 0 -4,-1.9 3,-1.6 1,-0.2 -2,-0.2 0.821 103.0 71.4 -82.1 -36.9 26.4 54.0 15.2 44 45 A G T 3< S+ 0 0 5 -4,-3.0 -1,-0.2 1,-0.3 -3,-0.1 0.456 80.3 75.1 -71.9 -2.9 23.4 52.8 13.2 45 46 A T T 3 + 0 0 5 -3,-0.4 -1,-0.3 -4,-0.3 2,-0.2 0.426 68.0 124.9 -84.7 1.6 24.4 54.2 9.9 46 47 A F < - 0 0 3 -3,-1.6 2,-0.5 7,-0.2 7,-0.2 -0.407 43.4-164.9 -66.8 131.4 27.0 51.5 9.5 47 48 A D B >> -A 52 0A 37 5,-2.6 4,-1.7 -2,-0.2 5,-1.1 -0.973 5.6-160.8-115.7 115.5 26.8 49.5 6.3 48 49 A K T 45S+ 0 0 93 99,-3.2 -1,-0.1 -2,-0.5 99,-0.1 0.810 85.9 58.7 -66.1 -34.1 28.9 46.3 6.5 49 50 A G T 45S+ 0 0 68 97,-0.3 -1,-0.2 1,-0.2 98,-0.1 0.847 122.8 22.7 -65.4 -37.1 29.1 45.7 2.7 50 51 A T T 45S- 0 0 85 -3,-0.4 -2,-0.2 2,-0.1 -1,-0.2 0.524 97.8-130.4-106.9 -9.8 30.8 49.0 2.0 51 52 A K T <5 + 0 0 144 -4,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.872 61.5 137.3 56.6 42.1 32.3 49.6 5.5 52 53 A T B < +A 47 0A 53 -5,-1.1 -5,-2.6 -7,-0.1 -1,-0.2 -0.787 44.8 14.7-114.2 160.7 30.8 53.2 5.5 53 54 A G + 0 0 16 -2,-0.3 -7,-0.2 70,-0.3 -10,-0.1 -0.255 68.6 120.8 71.1-164.8 29.0 55.1 8.3 54 55 A G S S- 0 0 0 -12,-0.3 2,-2.3 -13,-0.2 4,-0.4 -0.387 76.1 -28.7 97.0-179.2 29.1 54.0 11.9 55 56 A P S S+ 0 0 0 0, 0.0 -12,-0.2 0, 0.0 42,-0.1 -0.396 84.2 124.4 -76.5 67.8 30.3 55.5 15.2 56 57 A F S S- 0 0 7 -2,-2.3 65,-2.3 -14,-0.3 37,-0.2 -0.062 85.3 -94.8-125.6 32.0 33.0 57.8 13.9 57 58 A G S > S+ 0 0 1 35,-0.2 3,-1.2 63,-0.2 4,-0.2 0.418 87.9 122.5 83.4 -1.4 32.1 61.2 15.2 58 59 A T G > + 0 0 4 -4,-0.4 3,-1.8 1,-0.3 6,-0.4 0.663 51.1 81.6 -75.4 -14.8 30.2 62.3 12.1 59 60 A I G 3 S+ 0 0 0 1,-0.3 -1,-0.3 5,-0.1 18,-0.1 0.730 84.8 61.4 -65.7 -21.0 26.9 63.1 13.8 60 61 A K G < S+ 0 0 49 -3,-1.2 -1,-0.3 4,-0.1 -2,-0.2 0.647 80.3 105.3 -76.6 -16.9 28.2 66.5 14.9 61 62 A H S X> S- 0 0 39 -3,-1.8 4,-2.6 -4,-0.2 3,-0.6 -0.440 78.6-129.9 -65.2 134.4 28.6 67.5 11.3 62 63 A P H 3> S+ 0 0 111 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.858 107.4 58.4 -52.6 -36.8 25.9 70.0 10.2 63 64 A A H 34 S+ 0 0 63 2,-0.2 4,-0.3 1,-0.2 -4,-0.1 0.857 111.0 40.2 -63.7 -39.5 25.1 67.8 7.1 64 65 A E H X4 S+ 0 0 0 -3,-0.6 3,-1.4 -6,-0.4 6,-0.2 0.873 111.8 55.2 -77.0 -38.8 24.4 64.7 9.3 65 66 A L H 3< S+ 0 0 35 -4,-2.6 9,-0.2 1,-0.3 -2,-0.2 0.810 100.6 63.8 -60.8 -26.5 22.5 66.7 11.9 66 67 A A T 3< S+ 0 0 75 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.652 74.4 112.0 -73.2 -18.7 20.3 67.9 9.0 67 68 A H S X S- 0 0 23 -3,-1.4 3,-1.6 -4,-0.3 -3,-0.0 -0.344 74.8-130.5 -55.5 133.6 19.1 64.4 8.3 68 69 A S G > S+ 0 0 93 1,-0.3 3,-1.8 2,-0.2 -1,-0.1 0.878 107.4 60.5 -59.9 -38.0 15.4 64.3 9.2 69 70 A A G 3 S+ 0 0 45 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.746 101.4 57.0 -55.5 -24.8 15.8 61.2 11.3 70 71 A N G X S+ 0 0 1 -3,-1.6 3,-2.4 -6,-0.2 4,-0.4 0.230 72.8 145.8 -95.9 13.3 18.3 63.2 13.4 71 72 A N T < S+ 0 0 72 -3,-1.8 101,-0.1 1,-0.3 -5,-0.1 -0.314 73.1 15.8 -55.4 125.5 15.8 66.0 14.4 72 73 A G T >> S+ 0 0 2 -7,-0.1 3,-0.9 99,-0.1 4,-0.8 0.170 94.2 104.3 94.7 -15.3 16.6 67.1 17.9 73 74 A L H <> + 0 0 0 -3,-2.4 4,-2.4 1,-0.3 5,-0.2 0.728 66.8 72.7 -73.0 -16.5 20.1 65.6 18.1 74 75 A D H 3> S+ 0 0 81 -4,-0.4 4,-2.5 1,-0.2 -1,-0.3 0.874 93.0 56.6 -60.5 -35.4 21.5 69.0 17.6 75 76 A I H <> S+ 0 0 44 -3,-0.9 4,-2.6 2,-0.2 -1,-0.2 0.928 107.1 48.0 -55.6 -50.7 20.4 69.6 21.2 76 77 A A H X S+ 0 0 0 -4,-0.8 4,-1.7 2,-0.2 -2,-0.2 0.909 111.2 49.2 -58.6 -49.2 22.4 66.6 22.4 77 78 A V H X S+ 0 0 17 -4,-2.4 4,-1.1 1,-0.2 3,-0.2 0.933 113.1 47.9 -57.9 -46.8 25.6 67.7 20.5 78 79 A R H >< S+ 0 0 149 -4,-2.5 3,-0.6 1,-0.2 -2,-0.2 0.912 109.0 53.4 -61.7 -42.3 25.3 71.2 22.0 79 80 A L H 3< S+ 0 0 52 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.835 112.9 44.2 -61.5 -35.5 24.8 69.9 25.5 80 81 A L H 3X S+ 0 0 0 -4,-1.7 4,-2.8 -3,-0.2 -1,-0.2 0.648 90.2 86.3 -84.7 -15.5 27.9 67.8 25.3 81 82 A E H S+ 0 0 90 0, 0.0 4,-0.6 0, 0.0 -1,-0.2 0.927 115.6 44.1 -60.9 -42.2 31.4 72.0 26.9 83 84 A L H >4 S+ 0 0 23 -4,-0.4 3,-1.3 1,-0.2 4,-0.3 0.901 110.7 54.4 -65.1 -41.6 32.2 68.7 28.5 84 85 A K H >< S+ 0 0 8 -4,-2.8 3,-2.2 1,-0.3 6,-0.2 0.892 100.6 61.0 -60.1 -38.6 33.9 67.4 25.3 85 86 A A H 3< S+ 0 0 70 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.719 95.4 61.7 -63.3 -21.5 36.1 70.5 25.3 86 87 A E T << S+ 0 0 133 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.591 107.8 45.7 -74.8 -12.2 37.5 69.4 28.8 87 88 A F X + 0 0 35 -3,-2.2 3,-1.4 -4,-0.3 -1,-0.2 -0.556 63.4 160.1-131.6 65.3 38.8 66.2 27.0 88 89 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.799 71.4 64.2 -60.9 -28.2 40.5 67.4 23.9 89 90 A I T 3 S+ 0 0 82 -3,-0.1 2,-0.2 -79,-0.1 -78,-0.1 0.785 87.8 86.1 -65.7 -26.2 42.5 64.1 23.6 90 91 A L S < S- 0 0 14 -3,-1.4 2,-0.1 -6,-0.2 -3,-0.1 -0.494 81.8-120.5 -79.5 143.8 39.3 62.0 23.1 91 92 A S > - 0 0 12 27,-0.2 4,-2.4 -2,-0.2 5,-0.1 -0.442 17.5-126.0 -71.3 149.2 37.8 61.5 19.7 92 93 A Y H > S+ 0 0 50 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.889 113.0 61.4 -57.1 -37.8 34.2 62.7 19.3 93 94 A A H > S+ 0 0 2 1,-0.2 4,-1.5 -37,-0.2 -36,-0.2 0.921 109.7 38.0 -55.7 -53.4 33.5 59.2 18.1 94 95 A D H > S+ 0 0 4 24,-0.5 4,-2.9 2,-0.2 -1,-0.2 0.894 113.8 56.7 -62.0 -43.7 34.6 57.7 21.5 95 96 A F H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.909 108.0 45.9 -58.9 -44.4 33.0 60.5 23.5 96 97 A Y H X S+ 0 0 2 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.874 113.9 48.1 -69.4 -38.0 29.5 60.0 22.0 97 98 A Q H X S+ 0 0 1 -4,-1.5 4,-2.2 -5,-0.3 -2,-0.2 0.909 111.2 51.7 -68.1 -37.0 29.7 56.2 22.5 98 99 A L H X S+ 0 0 20 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.904 106.8 53.5 -62.8 -43.9 30.9 56.7 26.0 99 100 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.912 108.5 50.5 -53.7 -44.1 27.9 59.1 26.6 100 101 A G H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.885 110.6 48.2 -60.4 -45.2 25.6 56.3 25.3 101 102 A V H X S+ 0 0 13 -4,-2.2 4,-2.2 1,-0.2 11,-0.3 0.928 113.7 46.8 -59.6 -45.8 27.1 53.7 27.7 102 103 A V H X S+ 0 0 5 -4,-2.7 4,-3.1 2,-0.2 5,-0.2 0.871 105.5 59.8 -67.0 -37.6 26.9 56.1 30.6 103 104 A A H X S+ 0 0 0 -4,-2.5 4,-0.6 1,-0.2 -1,-0.2 0.908 109.3 44.1 -55.2 -41.9 23.2 57.0 29.7 104 105 A V H ><>S+ 0 0 0 -4,-1.6 5,-2.8 1,-0.2 3,-0.6 0.917 115.6 48.5 -69.3 -45.3 22.3 53.3 30.2 105 106 A E H ><5S+ 0 0 46 -4,-2.2 3,-1.8 1,-0.2 -2,-0.2 0.936 108.5 50.1 -62.3 -46.7 24.3 53.0 33.3 106 107 A V H 3<5S+ 0 0 55 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.528 106.8 55.6 -78.0 -4.6 23.0 56.1 35.1 107 108 A T T <<5S- 0 0 11 -3,-0.6 78,-2.9 -4,-0.6 -1,-0.3 0.336 129.4 -95.1-100.8 3.9 19.4 55.1 34.5 108 109 A G T < 5S+ 0 0 50 -3,-1.8 -3,-0.2 76,-0.2 -2,-0.2 0.591 80.7 135.6 96.1 12.3 20.1 51.7 36.2 109 110 A G < - 0 0 11 -5,-2.8 -1,-0.2 1,-0.2 77,-0.0 -0.085 61.1 -65.0 -80.5-175.9 20.9 49.6 33.1 110 111 A P - 0 0 15 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 -0.245 51.3-104.9 -67.4 160.0 23.6 47.1 32.5 111 112 A E - 0 0 156 -3,-0.1 -9,-0.1 -6,-0.1 -10,-0.0 -0.803 37.4-152.7 -86.3 104.6 27.3 48.1 32.4 112 113 A V - 0 0 7 -2,-0.9 124,-0.1 -11,-0.3 -7,-0.1 -0.681 21.4-114.2 -82.6 122.7 28.1 48.0 28.7 113 114 A P - 0 0 60 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.295 33.0-157.2 -58.4 143.9 31.8 47.3 28.0 114 115 A F - 0 0 58 -13,-0.0 125,-0.0 -3,-0.0 129,-0.0 -0.989 13.0-173.7-130.1 130.4 33.6 50.2 26.4 115 116 A H - 0 0 60 -2,-0.4 3,-0.2 -21,-0.0 2,-0.1 -0.990 18.9-139.1-122.8 127.8 36.8 50.1 24.4 116 117 A P + 0 0 38 0, 0.0 -104,-0.0 0, 0.0 -26,-0.0 -0.334 62.0 81.3 -79.3 165.4 38.5 53.3 23.2 117 118 A G + 0 0 15 1,-0.3 2,-0.2 -113,-0.1 130,-0.1 0.447 41.0 145.1 124.4 3.8 40.1 54.1 19.9 118 119 A R - 0 0 3 -3,-0.2 -24,-0.5 -27,-0.1 -1,-0.3 -0.503 41.7-136.2 -67.4 142.6 37.5 55.1 17.4 119 120 A E - 0 0 152 -2,-0.2 2,-0.6 -26,-0.1 -1,-0.1 -0.674 16.0-111.8 -99.6 148.6 38.8 57.7 15.0 120 121 A D - 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0 0 20 -4,-1.1 4,-2.6 1,-0.1 0, 0.0 -0.611 69.8-136.1 -77.4 133.2 7.3 38.0 14.2 214 215 A P T 4 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.826 103.7 35.4 -56.9 -33.1 8.0 34.3 14.8 215 216 A V T > S+ 0 0 71 2,-0.1 4,-0.8 1,-0.1 -5,-0.1 0.880 119.8 47.3 -88.2 -40.6 11.7 35.0 15.9 216 217 A F H >> S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 3,-0.5 0.888 102.1 63.4 -71.5 -36.8 11.2 38.3 17.6 217 218 A R H 3X S+ 0 0 89 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.917 98.0 52.4 -61.7 -46.7 8.2 37.3 19.8 218 219 A P H 3> S+ 0 0 74 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.862 110.4 51.5 -54.0 -31.9 9.9 34.6 21.9 219 220 A L H S+ 0 0 66 -2,-0.4 4,-3.1 1,-0.2 5,-0.2 0.833 87.1 58.3 -60.2 -35.5 15.0 41.2 33.2 228 229 A D H > S+ 0 0 125 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.905 106.6 48.3 -60.4 -43.9 18.5 39.7 33.9 229 230 A A H > S+ 0 0 18 2,-0.2 4,-2.4 -7,-0.2 5,-0.2 0.901 111.9 50.2 -61.2 -43.9 18.3 38.0 30.5 230 231 A F H X S+ 0 0 0 -4,-2.0 4,-3.1 -7,-0.2 5,-0.2 0.947 109.6 50.2 -56.2 -50.4 17.3 41.3 28.9 231 232 A F H X S+ 0 0 36 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.876 112.0 48.3 -58.3 -40.6 20.2 43.1 30.6 232 233 A A H X S+ 0 0 58 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.946 116.3 41.0 -66.2 -47.3 22.7 40.5 29.4 233 234 A D H X S+ 0 0 18 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.853 114.8 53.0 -71.3 -36.9 21.4 40.5 25.8 234 235 A Y H X S+ 0 0 4 -4,-3.1 4,-3.3 -5,-0.2 5,-0.3 0.936 108.7 49.2 -59.1 -48.9 21.1 44.3 25.8 235 236 A A H X S+ 0 0 15 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.905 112.3 49.1 -61.4 -41.3 24.7 44.8 27.0 236 237 A E H X S+ 0 0 93 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.947 115.2 43.2 -59.8 -48.1 25.9 42.4 24.3 237 238 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.889 112.5 51.0 -68.1 -42.5 23.9 44.2 21.6 238 239 A H H X S+ 0 0 3 -4,-3.3 4,-3.1 2,-0.2 -1,-0.2 0.921 110.2 51.0 -62.3 -43.9 24.7 47.8 22.7 239 240 A Q H X S+ 0 0 38 -4,-2.1 4,-0.9 -5,-0.3 -2,-0.2 0.959 112.5 46.3 -57.3 -50.0 28.4 46.9 22.7 240 241 A K H >< S+ 0 0 65 -4,-2.2 3,-0.9 1,-0.2 4,-0.3 0.922 113.2 48.9 -57.5 -48.6 28.2 45.5 19.2 241 242 A L H >< S+ 0 0 13 -4,-2.9 3,-1.5 1,-0.2 -1,-0.2 0.940 110.2 51.2 -53.6 -49.5 26.2 48.5 18.0 242 243 A S H 3< S+ 0 0 0 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.636 113.8 45.9 -66.0 -16.0 28.8 50.9 19.6 243 244 A E T X< S+ 0 0 5 -4,-0.9 3,-2.5 -3,-0.9 -1,-0.3 0.232 74.8 142.8-113.1 9.7 31.6 49.1 17.8 244 245 A L T < S+ 0 0 9 -3,-1.5 5,-0.1 -4,-0.3 3,-0.1 -0.310 83.1 1.0 -56.0 126.2 30.2 48.7 14.3 245 246 A G T 3 S+ 0 0 20 1,-0.2 2,-0.5 -97,-0.1 4,-0.4 0.470 110.9 115.8 76.6 1.0 33.1 49.1 11.8 246 247 A F S < S- 0 0 8 -3,-2.5 -1,-0.2 2,-0.3 -128,-0.1 -0.902 85.0 -6.6-112.8 129.6 35.5 49.6 14.7 247 248 A A S S- 0 0 17 -2,-0.5 -244,-2.4 -245,-0.1 -1,-0.2 0.765 145.9 -18.2 61.6 29.9 38.3 47.2 15.5 248 249 A D 0 0 110 -3,-0.2 -2,-0.3 -246,-0.2 -3,-0.1 0.717 360.0 360.0 95.1 92.7 36.9 45.0 12.7 249 250 A A 0 0 54 -4,-0.4 -1,-0.2 -5,-0.1 -2,-0.1 -0.934 360.0 360.0-145.3 360.0 33.3 45.2 11.3