==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 22-AUG-05 2AS2 . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE, MITOCHONDRIAL; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR R.BRENK,S.W.VETTER,S.E.BOYCE,D.B.GOODIN,B.K.SHOICHET . 291 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12316.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 64.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 5.2 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 . 2 0.7 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 . 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 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 15.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 35.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 0 0 0 3 1 0 1 1 1 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 PARALLEL BRIDGES PER LADDER . 2 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 4 A L 0 0 125 0, 0.0 2,-0.5 0, 0.0 269,-0.0 0.000 360.0 360.0 360.0 112.8 11.3 -3.4 14.6 2 5 A V - 0 0 101 2,-0.0 2,-0.6 269,-0.0 269,-0.1 -0.935 360.0-168.0-120.4 130.4 9.4 -5.8 16.9 3 6 A H E -a 271 0A 28 267,-0.7 269,-3.3 -2,-0.5 2,-0.5 -0.932 12.3-161.1-113.5 105.8 5.8 -5.4 18.2 4 7 A V E -a 272 0A 72 -2,-0.6 269,-0.2 267,-0.2 2,-0.1 -0.743 21.8-119.5 -95.2 126.8 4.9 -7.8 20.9 5 8 A A - 0 0 10 267,-2.7 2,-0.4 -2,-0.5 122,-0.2 -0.390 29.8-170.9 -59.2 131.1 1.3 -8.4 21.7 6 9 A S - 0 0 75 120,-2.6 120,-0.2 -2,-0.1 3,-0.1 -0.965 21.8-126.7-130.2 111.9 0.4 -7.4 25.3 7 10 A V - 0 0 54 -2,-0.4 3,-0.2 118,-0.1 121,-0.0 -0.345 35.2 -98.7 -61.6 134.6 -3.0 -8.4 26.5 8 11 A E > - 0 0 18 1,-0.2 3,-2.5 2,-0.1 -1,-0.1 -0.277 65.2 -78.1 -51.8 134.5 -5.0 -5.5 28.0 9 12 A K T 3 S- 0 0 147 1,-0.3 -1,-0.2 89,-0.1 89,-0.0 -0.136 106.9 -11.5 -58.6 122.5 -4.5 -5.9 31.7 10 13 A G T 3 S+ 0 0 75 1,-0.2 -1,-0.3 -3,-0.2 2,-0.1 0.396 98.9 139.2 78.1 1.3 -6.6 -8.7 33.3 11 14 A R < + 0 0 84 -3,-2.5 -1,-0.2 3,-0.1 2,-0.2 -0.466 23.2 170.7 -86.1 152.4 -8.8 -9.1 30.2 12 15 A S >> - 0 0 64 -2,-0.1 4,-1.6 -5,-0.0 3,-1.0 -0.736 52.0 -66.0-142.4-172.9 -10.0 -12.4 28.8 13 16 A Y H 3> S+ 0 0 83 1,-0.3 4,-2.6 -2,-0.2 5,-0.2 0.859 125.5 56.3 -49.3 -45.9 -12.4 -13.8 26.2 14 17 A E H 3> S+ 0 0 60 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.860 104.4 53.4 -57.6 -39.7 -15.6 -12.6 28.0 15 18 A D H <> S+ 0 0 33 -3,-1.0 4,-1.4 1,-0.2 -1,-0.2 0.937 112.2 43.8 -61.2 -45.5 -14.3 -9.0 27.9 16 19 A F H X S+ 0 0 0 -4,-1.6 4,-3.0 1,-0.2 -2,-0.2 0.848 108.2 57.5 -73.9 -29.8 -13.8 -9.0 24.2 17 20 A Q H X S+ 0 0 14 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.861 104.7 54.5 -64.2 -32.6 -17.1 -10.9 23.5 18 21 A K H X S+ 0 0 84 -4,-1.7 4,-2.1 -5,-0.2 -2,-0.2 0.905 109.4 45.7 -65.5 -40.0 -18.7 -7.9 25.3 19 22 A V H X S+ 0 0 0 -4,-1.4 4,-2.4 1,-0.2 -2,-0.2 0.934 112.4 51.3 -68.7 -46.9 -17.0 -5.5 22.9 20 23 A Y H X S+ 0 0 0 -4,-3.0 4,-3.0 1,-0.2 -1,-0.2 0.904 110.5 49.6 -46.6 -54.5 -18.0 -7.7 20.0 21 24 A N H X S+ 0 0 23 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.893 108.7 51.4 -62.9 -38.1 -21.6 -7.7 21.2 22 25 A A H X S+ 0 0 14 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.923 113.3 45.3 -63.5 -43.0 -21.6 -3.8 21.6 23 26 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.933 114.9 48.7 -59.9 -47.4 -20.3 -3.4 18.0 24 27 A A H X S+ 0 0 1 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.890 110.5 49.3 -65.2 -39.6 -22.8 -6.0 16.7 25 28 A L H X S+ 0 0 79 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.895 112.0 48.9 -69.3 -36.3 -25.8 -4.5 18.5 26 29 A K H X S+ 0 0 54 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.852 107.5 55.8 -70.0 -35.5 -24.9 -1.0 17.1 27 30 A L H < S+ 0 0 23 -4,-2.3 12,-0.3 1,-0.2 -2,-0.2 0.895 111.5 44.3 -58.0 -40.7 -24.6 -2.6 13.6 28 31 A R H < S+ 0 0 129 -4,-1.8 3,-0.3 -5,-0.2 -2,-0.2 0.911 117.4 44.6 -69.2 -42.9 -28.1 -3.8 14.0 29 32 A E H < S+ 0 0 85 -4,-2.3 2,-1.5 1,-0.2 3,-0.2 0.883 106.4 56.1 -73.0 -42.5 -29.4 -0.5 15.4 30 33 A D >< + 0 0 48 -4,-2.9 3,-0.7 1,-0.2 9,-0.3 -0.415 67.8 143.3 -89.1 60.6 -27.8 2.0 13.0 31 34 A D T 3 + 0 0 91 -2,-1.5 -1,-0.2 -3,-0.3 7,-0.1 0.571 50.9 71.5 -83.6 -7.6 -29.3 0.3 9.9 32 35 A E T 3> + 0 0 52 -3,-0.2 4,-2.1 5,-0.1 3,-0.4 0.705 66.6 122.5 -80.0 -22.0 -30.0 3.4 7.8 33 36 A Y H <>>S+ 0 0 44 -3,-0.7 5,-2.7 1,-0.2 4,-0.8 -0.073 79.1 4.5 -52.4 137.6 -26.4 4.3 7.0 34 37 A D H >45S- 0 0 37 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.935 139.3 -46.0 54.8 56.8 -25.4 4.5 3.3 35 38 A N H 345S- 0 0 148 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.877 113.6 -49.3 52.4 49.9 -28.9 4.0 2.0 36 39 A Y H 3<5S+ 0 0 157 -4,-2.1 -1,-0.3 -6,-0.1 -3,-0.2 0.500 109.6 116.9 66.4 17.8 -29.6 1.0 4.3 37 40 A I T <<5 - 0 0 18 -3,-1.4 3,-0.3 -4,-0.8 -3,-0.2 0.863 67.2-147.5 -67.9 -38.7 -26.4 -0.9 3.6 38 41 A G < - 0 0 8 -5,-2.7 4,-0.4 1,-0.2 -7,-0.1 -0.258 27.6 -70.4 88.1 172.2 -25.4 -0.4 7.2 39 42 A Y S > S+ 0 0 43 -9,-0.3 4,-2.0 -12,-0.3 5,-0.2 0.434 102.2 97.4 -88.2 0.4 -22.0 0.0 8.7 40 43 A G H > S+ 0 0 5 -3,-0.3 4,-1.9 1,-0.2 3,-0.3 0.957 84.6 44.1 -56.6 -57.4 -20.8 -3.5 8.1 41 44 A P H > S+ 0 0 15 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.921 111.9 51.6 -56.0 -47.2 -18.8 -2.9 4.8 42 45 A V H > S+ 0 0 16 -4,-0.4 4,-2.3 1,-0.2 -2,-0.2 0.867 108.7 52.8 -64.0 -31.5 -17.1 0.3 6.0 43 46 A L H X S+ 0 0 1 -4,-2.0 4,-2.3 -3,-0.3 -1,-0.2 0.870 108.8 49.5 -68.1 -34.6 -15.9 -1.5 9.1 44 47 A V H X S+ 0 0 8 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.927 112.0 47.7 -67.6 -42.8 -14.4 -4.2 7.0 45 48 A R H X S+ 0 0 71 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.896 110.1 53.3 -65.8 -36.5 -12.7 -1.7 4.8 46 49 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.3 0.953 108.4 49.1 -61.9 -46.5 -11.4 0.2 7.9 47 50 A A H X S+ 0 0 0 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.903 113.7 47.5 -61.5 -37.4 -9.9 -3.0 9.4 48 51 A W H X S+ 0 0 44 -4,-2.1 4,-2.7 1,-0.2 3,-0.5 0.937 112.0 48.4 -68.8 -45.3 -8.2 -3.7 6.0 49 52 A H H < S+ 0 0 15 -4,-3.0 4,-0.4 1,-0.2 -2,-0.2 0.829 109.2 51.5 -67.6 -31.5 -6.8 -0.1 5.7 50 53 A I H < S+ 0 0 5 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.772 120.2 37.4 -75.0 -19.4 -5.4 0.1 9.2 51 54 A S H >< S+ 0 0 0 -4,-0.9 3,-1.5 -3,-0.5 -2,-0.2 0.766 103.4 69.8 -94.2 -31.6 -3.6 -3.3 8.4 52 55 A G T 3< S+ 0 0 0 -4,-2.7 -3,-0.1 1,-0.3 -2,-0.1 0.463 80.9 74.8 -77.0 -0.9 -2.7 -2.7 4.8 53 56 A T T 3 S+ 0 0 4 -4,-0.4 -1,-0.3 -5,-0.1 -2,-0.1 0.502 72.6 120.4 -79.5 -5.8 -0.1 -0.1 5.6 54 57 A W < - 0 0 25 -3,-1.5 2,-0.5 7,-0.2 7,-0.2 -0.280 48.2-160.5 -62.3 145.8 2.2 -2.8 6.7 55 58 A D B >>> -B 60 0B 31 5,-2.1 4,-2.2 1,-0.1 3,-1.1 -0.957 7.9-156.6-125.3 114.5 5.6 -3.3 5.1 56 59 A K T 345S+ 0 0 88 101,-2.3 -1,-0.1 -2,-0.5 102,-0.1 0.747 87.3 68.1 -60.3 -24.1 7.1 -6.8 5.6 57 60 A H T 345S+ 0 0 140 100,-0.2 -1,-0.2 1,-0.2 -3,-0.0 0.854 124.2 3.6 -68.9 -32.9 10.6 -5.4 5.0 58 61 A D T <45S- 0 0 76 -3,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.405 94.5-116.7-134.9 5.5 10.9 -3.2 8.1 59 62 A N T <5 + 0 0 20 -4,-2.2 2,-0.2 1,-0.2 -3,-0.2 0.753 63.1 147.3 59.7 31.7 7.7 -3.9 10.0 60 63 A T B < +B 55 0B 35 -5,-0.7 -5,-2.1 -7,-0.1 -1,-0.2 -0.569 52.5 13.5 -87.7 161.2 6.5 -0.4 9.7 61 64 A G S S+ 0 0 13 73,-0.5 -7,-0.2 -7,-0.2 4,-0.2 -0.267 74.3 123.8 70.8-162.5 2.7 0.2 9.4 62 65 A G S S- 0 0 5 1,-0.2 3,-0.4 -13,-0.2 5,-0.4 -0.078 75.4 -72.5 91.0 166.1 0.3 -2.6 10.3 63 66 A S S > S+ 0 0 2 206,-0.5 3,-1.2 203,-0.3 -1,-0.2 0.700 105.3 86.9 -69.1 -22.0 -2.6 -2.8 12.7 64 67 A Y T 3 S+ 0 0 22 205,-0.4 38,-0.4 1,-0.3 -1,-0.2 0.859 87.3 44.7 -51.8 -49.7 -0.6 -3.0 15.9 65 68 A G T 3 S- 0 0 6 -3,-0.4 65,-2.0 -4,-0.2 -1,-0.3 0.541 92.0-133.9 -84.1 -6.5 -0.1 0.7 16.8 66 69 A G X + 0 0 3 -3,-1.2 3,-1.7 -4,-0.2 -2,-0.1 0.825 47.5 156.6 68.0 27.6 -3.6 2.0 16.1 67 70 A T G > + 0 0 7 -5,-0.4 3,-2.3 1,-0.3 6,-0.4 0.588 48.8 86.3 -78.4 -8.7 -2.1 4.9 14.2 68 71 A Y G 3 S+ 0 0 1 1,-0.3 -1,-0.3 5,-0.2 6,-0.2 0.769 78.0 71.0 -55.4 -26.4 -5.2 5.6 12.2 69 72 A R G < S+ 0 0 75 -3,-1.7 2,-0.3 4,-0.1 -1,-0.3 0.617 84.9 86.5 -67.1 -9.4 -6.3 7.7 15.1 70 73 A F S X> S- 0 0 33 -3,-2.3 4,-2.7 1,-0.1 3,-0.9 -0.772 87.8-118.9 -97.6 142.0 -3.5 10.3 14.1 71 74 A K H 3> S+ 0 0 55 -2,-0.3 4,-2.5 1,-0.3 -1,-0.1 0.768 106.9 59.4 -49.5 -40.4 -4.2 13.0 11.5 72 75 A K H 34 S+ 0 0 83 1,-0.2 -1,-0.3 2,-0.2 -4,-0.1 0.940 117.0 31.4 -65.0 -39.6 -1.7 12.0 9.0 73 76 A E H X4 S+ 0 0 2 -3,-0.9 3,-1.7 -6,-0.4 -2,-0.2 0.882 116.2 56.9 -80.8 -40.7 -3.2 8.6 8.5 74 77 A F H 3< S+ 0 0 53 -4,-2.7 -2,-0.2 -7,-0.3 -1,-0.2 0.870 111.9 45.5 -54.9 -34.2 -6.9 9.6 9.2 75 78 A N T 3< S+ 0 0 102 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.313 78.5 131.3 -98.3 11.1 -6.5 12.1 6.4 76 79 A D X - 0 0 8 -3,-1.7 3,-2.5 1,-0.2 4,-0.2 -0.453 62.8-131.7 -56.0 128.0 -4.8 9.8 3.8 77 80 A P G > S+ 0 0 95 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.845 108.1 61.7 -49.4 -36.4 -6.7 10.2 0.5 78 81 A S G 3 S+ 0 0 37 1,-0.3 -2,-0.1 63,-0.0 -3,-0.0 0.672 101.7 53.3 -64.4 -16.8 -6.9 6.4 0.3 79 82 A N G X S+ 0 0 0 -3,-2.5 3,-2.3 -6,-0.2 4,-0.4 0.216 74.4 140.0-102.8 11.7 -8.9 6.4 3.6 80 83 A A T < S+ 0 0 25 -3,-1.6 101,-0.1 1,-0.3 -5,-0.1 -0.382 72.2 23.0 -61.4 131.7 -11.6 8.9 2.5 81 84 A G T > S+ 0 0 4 99,-0.1 3,-1.8 -2,-0.0 4,-0.5 -0.041 93.9 98.5 102.5 -30.1 -14.9 7.7 3.8 82 85 A L T X> + 0 0 0 -3,-2.3 4,-2.2 1,-0.3 3,-0.8 0.713 61.9 82.3 -71.4 -14.1 -13.5 5.6 6.7 83 86 A Q H 3> S+ 0 0 63 -4,-0.4 4,-2.6 1,-0.2 -1,-0.3 0.823 85.5 60.8 -51.6 -33.4 -14.2 8.5 9.1 84 87 A N H <> S+ 0 0 67 -3,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.879 104.4 47.3 -65.0 -35.3 -17.7 7.0 9.2 85 88 A G H <> S+ 0 0 0 -3,-0.8 4,-2.0 -4,-0.5 -2,-0.2 0.904 111.2 50.4 -68.8 -41.5 -16.3 3.8 10.6 86 89 A F H X S+ 0 0 53 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.923 110.0 50.1 -62.9 -41.7 -14.3 5.6 13.1 87 90 A K H < S+ 0 0 74 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.890 107.3 54.7 -65.7 -35.8 -17.2 7.6 14.3 88 91 A F H < S+ 0 0 4 -4,-1.7 4,-0.5 1,-0.2 -1,-0.2 0.899 111.3 45.4 -57.7 -46.6 -19.3 4.4 14.6 89 92 A L H X S+ 0 0 2 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.668 91.2 85.2 -78.4 -12.4 -16.6 2.9 16.8 90 93 A E H X S+ 0 0 53 -4,-1.3 4,-2.6 -3,-0.3 -1,-0.2 0.939 90.5 45.7 -56.8 -51.7 -16.2 6.0 19.0 91 94 A P H > S+ 0 0 64 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.834 111.8 55.1 -62.2 -25.9 -19.1 5.3 21.5 92 95 A I H > S+ 0 0 6 -4,-0.5 4,-2.1 2,-0.2 -2,-0.2 0.946 108.4 46.5 -68.8 -44.7 -17.8 1.7 21.6 93 96 A H H < S+ 0 0 47 -4,-2.7 6,-0.2 1,-0.2 -1,-0.2 0.886 109.7 55.5 -61.3 -39.0 -14.3 2.9 22.6 94 97 A K H < S+ 0 0 79 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.875 110.8 44.1 -64.0 -36.1 -16.0 5.2 25.2 95 98 A E H < S+ 0 0 128 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.845 126.7 31.8 -75.5 -32.5 -17.8 2.3 26.8 96 99 A F >< + 0 0 19 -4,-2.1 3,-1.9 -5,-0.1 -1,-0.3 -0.618 69.5 162.8-122.8 68.5 -14.7 0.1 26.7 97 100 A P T 3 + 0 0 97 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.649 66.3 71.0 -68.8 -9.9 -11.9 2.5 27.1 98 101 A W T 3 S+ 0 0 56 -3,-0.1 2,-0.3 2,-0.1 -89,-0.1 0.610 76.5 95.0 -80.5 -16.9 -9.4 -0.3 28.1 99 102 A I S < S- 0 0 4 -3,-1.9 -3,-0.1 -6,-0.2 2,-0.0 -0.558 80.1-117.5 -79.4 142.9 -9.3 -1.7 24.6 100 103 A S > - 0 0 13 -2,-0.3 4,-2.6 27,-0.2 5,-0.2 -0.332 21.3-117.1 -70.4 158.8 -6.4 -0.6 22.4 101 104 A S H > S+ 0 0 7 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.930 115.3 49.7 -65.8 -45.7 -7.2 1.3 19.1 102 105 A G H > S+ 0 0 0 -38,-0.4 4,-2.5 1,-0.2 5,-0.3 0.904 111.1 49.5 -57.9 -42.8 -5.7 -1.4 16.9 103 106 A D H > S+ 0 0 0 24,-0.2 4,-2.7 -39,-0.2 -2,-0.2 0.936 113.2 47.8 -62.2 -44.1 -7.7 -4.1 18.8 104 107 A L H X S+ 0 0 1 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.937 113.4 45.1 -63.7 -46.4 -10.9 -2.1 18.3 105 108 A F H X S+ 0 0 2 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.936 117.4 44.3 -67.1 -41.1 -10.4 -1.3 14.6 106 109 A S H X S+ 0 0 0 -4,-2.5 4,-1.9 -5,-0.2 3,-0.4 0.918 113.5 50.7 -69.5 -38.3 -9.5 -4.9 13.8 107 110 A L H X S+ 0 0 0 -4,-2.7 4,-3.1 -5,-0.3 5,-0.2 0.860 103.3 60.7 -65.4 -32.5 -12.3 -6.4 16.0 108 111 A G H X S+ 0 0 1 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.902 106.3 46.5 -61.1 -39.3 -14.7 -4.1 14.2 109 112 A G H X S+ 0 0 0 -4,-1.3 4,-2.3 -3,-0.4 -2,-0.2 0.912 113.0 48.4 -72.6 -40.9 -13.9 -5.8 10.9 110 113 A V H X S+ 0 0 1 -4,-1.9 4,-2.5 1,-0.2 5,-0.3 0.924 112.8 49.0 -57.9 -47.7 -14.2 -9.3 12.4 111 114 A T H X S+ 0 0 0 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.923 110.9 50.0 -60.1 -46.5 -17.5 -8.4 14.0 112 115 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 6,-0.2 0.930 110.7 48.8 -60.3 -47.2 -18.8 -7.0 10.7 113 116 A V H <>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 82,-0.3 0.953 116.0 42.7 -56.2 -51.2 -17.9 -10.0 8.7 114 117 A Q H ><5S+ 0 0 4 -4,-2.5 3,-1.6 1,-0.2 -1,-0.2 0.903 113.4 50.7 -66.7 -37.8 -19.4 -12.5 11.2 115 118 A E H 3<5S+ 0 0 47 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.823 104.1 59.4 -71.6 -27.5 -22.6 -10.4 11.7 116 119 A M T 3<5S- 0 0 15 -4,-2.1 79,-2.9 -5,-0.2 -1,-0.3 0.188 128.4-100.6 -82.9 18.9 -23.0 -10.2 7.9 117 120 A Q T < 5S+ 0 0 131 -3,-1.6 -3,-0.2 77,-0.2 -2,-0.2 0.700 79.6 138.8 74.0 23.5 -23.2 -14.1 8.0 118 121 A G < - 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0 0 17 -2,-0.4 4,-2.7 -10,-0.2 3,-0.4 -0.384 33.9-107.9 -63.1 156.0 -12.7 -1.8 -10.3 230 233 A P H > S+ 0 0 24 0, 0.0 4,-1.6 0, 0.0 -85,-0.2 0.912 124.6 52.0 -52.0 -40.8 -10.0 -2.3 -12.9 231 234 A T H 4 S+ 0 0 12 -87,-1.5 4,-0.4 2,-0.2 -86,-0.1 0.843 109.0 50.3 -68.5 -30.9 -8.0 -4.2 -10.2 232 235 A D H >4 S+ 0 0 5 -3,-0.4 3,-1.7 -88,-0.2 4,-0.2 0.944 111.0 47.9 -64.0 -51.1 -11.1 -6.4 -9.5 233 236 A Y H >X S+ 0 0 43 -4,-2.7 3,-2.1 1,-0.3 4,-0.7 0.795 97.3 71.3 -61.6 -26.6 -11.5 -7.2 -13.2 234 237 A S H >X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.3 3,-0.5 0.770 83.2 73.0 -62.3 -21.2 -7.8 -8.0 -13.5 235 238 A L H <4 S+ 0 0 0 -3,-1.7 10,-0.3 -4,-0.4 -1,-0.3 0.664 103.8 38.0 -68.7 -18.7 -8.6 -11.1 -11.4 236 239 A I H <4 S+ 0 0 35 -3,-2.1 -1,-0.3 -4,-0.2 -2,-0.2 0.471 111.4 59.6-107.2 -2.0 -10.3 -12.6 -14.6 237 240 A Q H << S+ 0 0 117 -4,-0.7 -2,-0.2 -3,-0.5 -3,-0.1 0.764 95.4 68.5 -88.1 -30.4 -7.7 -11.2 -17.0 238 241 A D S X S- 0 0 21 -4,-1.8 4,-2.5 1,-0.1 5,-0.2 -0.777 79.7-142.2 -90.0 128.8 -4.7 -13.0 -15.4 239 242 A P H > S+ 0 0 97 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.827 98.7 50.5 -68.0 -28.5 -4.9 -16.8 -15.9 240 243 A K H > S+ 0 0 121 2,-0.2 4,-0.9 1,-0.2 5,-0.1 0.937 114.5 43.2 -72.0 -43.7 -3.6 -17.6 -12.4 241 244 A Y H >> S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 3,-0.7 0.902 109.4 59.7 -65.5 -37.4 -6.1 -15.4 -10.7 242 245 A L H 3X S+ 0 0 42 -4,-2.5 4,-2.5 1,-0.3 5,-0.2 0.895 101.1 52.8 -61.7 -39.4 -8.9 -16.6 -13.0 243 246 A S H 3X S+ 0 0 71 -4,-1.6 4,-1.3 1,-0.2 -1,-0.3 0.806 111.4 46.8 -68.6 -24.6 -8.5 -20.2 -11.9 244 247 A I H < S+ 0 0 64 -4,-1.3 3,-0.5 1,-0.2 4,-0.3 0.951 112.5 41.8 -59.7 -48.4 -12.7 -22.1 -7.6 248 251 A Y H >< S+ 0 0 1 -4,-2.6 3,-0.8 1,-0.2 7,-0.2 0.864 109.9 57.8 -73.9 -30.6 -14.3 -19.7 -5.1 249 252 A A H 3< S+ 0 0 9 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.767 114.6 40.1 -63.1 -24.4 -17.3 -19.1 -7.5 250 253 A N T << S+ 0 0 138 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.309 117.6 46.0-108.2 6.4 -17.9 -22.9 -7.3 251 254 A D <> + 0 0 76 -3,-0.8 4,-2.1 -4,-0.3 -1,-0.2 -0.634 53.3 179.7-154.2 87.7 -17.2 -23.6 -3.6 252 255 A Q H > S+ 0 0 124 1,-0.2 4,-2.5 -2,-0.2 5,-0.2 0.867 86.6 51.4 -54.7 -44.0 -18.7 -21.2 -1.0 253 256 A D H > S+ 0 0 109 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.922 108.1 50.7 -64.8 -43.8 -17.2 -23.1 2.0 254 257 A K H > S+ 0 0 68 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.922 110.9 49.6 -62.7 -41.1 -13.6 -23.1 0.5 255 258 A F H X S+ 0 0 0 -4,-2.1 4,-3.1 -7,-0.2 5,-0.3 0.956 110.7 50.3 -60.6 -46.0 -13.9 -19.3 -0.0 256 259 A F H X S+ 0 0 45 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.927 113.4 44.7 -61.4 -44.6 -15.1 -18.8 3.5 257 260 A K H X S+ 0 0 78 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.937 116.3 45.3 -68.8 -39.4 -12.3 -20.8 5.0 258 261 A D H X S+ 0 0 26 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.892 113.5 50.3 -69.8 -38.2 -9.6 -19.2 2.8 259 262 A F H X S+ 0 0 0 -4,-3.1 4,-3.0 -5,-0.3 5,-0.3 0.902 108.4 52.9 -60.2 -48.2 -11.0 -15.7 3.5 260 263 A S H X S+ 0 0 15 -4,-2.3 4,-2.3 -5,-0.3 5,-0.2 0.943 112.3 44.5 -57.4 -45.8 -11.0 -16.3 7.2 261 264 A K H X S+ 0 0 104 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.930 116.3 45.4 -63.1 -45.0 -7.3 -17.4 7.2 262 265 A A H X S+ 0 0 1 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.877 113.4 49.5 -69.4 -37.8 -6.2 -14.5 4.9 263 266 A F H X S+ 0 0 4 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.912 111.2 48.2 -70.2 -41.8 -8.1 -11.9 6.8 264 267 A E H X S+ 0 0 30 -4,-2.3 4,-1.5 -5,-0.3 -2,-0.2 0.956 113.2 49.9 -58.3 -44.7 -6.8 -13.0 10.2 265 268 A K H >X S+ 0 0 53 -4,-2.3 4,-1.5 -5,-0.2 3,-0.6 0.944 109.7 50.6 -59.8 -45.1 -3.3 -13.0 8.7 266 269 A L H >< S+ 0 0 2 -4,-2.6 3,-0.5 1,-0.3 -203,-0.3 0.926 112.2 46.8 -55.7 -47.7 -3.8 -9.5 7.3 267 270 A L H 3< S+ 0 0 2 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.670 117.4 43.6 -71.0 -18.7 -5.0 -8.2 10.7 268 271 A E H X< S+ 0 0 32 -4,-1.5 3,-2.2 -3,-0.6 -1,-0.2 0.480 78.9 127.2-105.6 -6.3 -2.1 -9.9 12.5 269 272 A N T << S+ 0 0 18 -4,-1.5 -206,-0.5 -3,-0.5 -205,-0.4 -0.246 77.1 21.3 -55.6 132.9 0.8 -9.0 10.1 270 273 A G T 3 S+ 0 0 15 1,-0.2 -267,-0.7 -208,-0.1 2,-0.5 0.236 97.4 115.2 97.9 -13.4 3.6 -7.3 12.1 271 274 A I E < -a 3 0A 18 -3,-2.2 2,-0.6 -269,-0.1 -1,-0.2 -0.797 51.9-153.1-100.1 130.3 2.6 -8.7 15.5 272 275 A T E -a 4 0A 70 -269,-3.3 -267,-2.7 -2,-0.5 -3,-0.0 -0.867 13.1-155.6 -96.4 122.1 4.7 -11.1 17.5 273 276 A F - 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