==== 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 17-AUG-05 2AQD . 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) . 12386.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 63.2 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 . 16 5.5 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 . 10 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 14.4 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 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 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 0 108 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 99.2 11.3 -3.6 14.8 2 5 A V - 0 0 104 2,-0.0 2,-0.7 269,-0.0 269,-0.1 -0.925 360.0-165.4-115.5 128.6 9.4 -6.0 17.0 3 6 A H E -a 271 0A 37 267,-0.6 269,-3.2 -2,-0.5 2,-0.5 -0.915 12.9-160.6-111.8 105.8 5.8 -5.5 18.2 4 7 A V E -a 272 0A 70 -2,-0.7 269,-0.2 267,-0.2 2,-0.1 -0.742 21.0-119.8 -93.1 127.1 4.9 -7.9 21.0 5 8 A A - 0 0 10 267,-2.8 2,-0.5 -2,-0.5 122,-0.2 -0.411 29.8-169.8 -62.3 131.9 1.3 -8.5 21.8 6 9 A S - 0 0 74 120,-2.5 120,-0.2 -2,-0.1 3,-0.1 -0.969 21.2-126.8-131.3 110.8 0.4 -7.5 25.3 7 10 A V - 0 0 55 -2,-0.5 3,-0.2 118,-0.1 121,-0.0 -0.333 34.8-101.5 -59.2 130.7 -3.0 -8.5 26.6 8 11 A E > - 0 0 19 1,-0.2 3,-2.5 2,-0.1 -1,-0.1 -0.303 64.5 -76.9 -52.3 133.9 -5.0 -5.6 28.0 9 12 A K T 3 S- 0 0 149 1,-0.3 -1,-0.2 89,-0.1 89,-0.0 -0.086 106.6 -12.7 -57.0 121.8 -4.6 -5.9 31.8 10 13 A G T 3 S+ 0 0 76 1,-0.2 -1,-0.3 -3,-0.2 2,-0.1 0.434 98.9 139.3 78.3 3.1 -6.7 -8.7 33.3 11 14 A R < + 0 0 82 -3,-2.5 -1,-0.2 3,-0.1 2,-0.2 -0.438 23.5 171.3 -86.9 151.0 -8.9 -9.1 30.2 12 15 A S >> - 0 0 66 -2,-0.1 4,-1.5 -5,-0.0 3,-1.0 -0.776 51.4 -66.3-141.8-173.0 -10.1 -12.4 28.8 13 16 A Y H 3> S+ 0 0 83 1,-0.3 4,-2.6 -2,-0.2 3,-0.3 0.882 125.8 55.5 -49.1 -46.3 -12.4 -13.9 26.2 14 17 A E H 3> S+ 0 0 55 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.854 103.9 54.3 -62.0 -36.1 -15.6 -12.6 27.9 15 18 A D H <> S+ 0 0 33 -3,-1.0 4,-1.4 1,-0.2 -1,-0.2 0.933 112.2 43.6 -61.0 -44.3 -14.4 -9.0 27.9 16 19 A F H X S+ 0 0 0 -4,-1.5 4,-2.8 -3,-0.3 -2,-0.2 0.842 107.9 58.2 -74.2 -31.3 -13.8 -9.1 24.2 17 20 A Q H X S+ 0 0 12 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.863 104.7 53.6 -62.1 -33.7 -17.1 -10.9 23.5 18 21 A K H X S+ 0 0 105 -4,-1.7 4,-2.0 -5,-0.2 -2,-0.2 0.899 109.1 47.0 -67.1 -38.8 -18.8 -7.9 25.2 19 22 A V H X S+ 0 0 0 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.940 112.3 50.5 -66.1 -46.6 -17.0 -5.5 22.9 20 23 A Y H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 -1,-0.2 0.889 110.0 51.1 -47.2 -56.6 -18.0 -7.7 19.9 21 24 A N H X S+ 0 0 22 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.881 108.2 50.6 -59.4 -39.1 -21.6 -7.7 21.1 22 25 A A H X S+ 0 0 14 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.914 113.0 46.6 -64.8 -41.3 -21.7 -3.9 21.5 23 26 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.949 114.3 48.0 -60.9 -46.8 -20.4 -3.5 17.9 24 27 A A H X S+ 0 0 1 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.871 110.7 50.2 -64.8 -40.3 -22.8 -6.1 16.6 25 28 A L H X S+ 0 0 78 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.899 111.7 48.2 -66.5 -37.2 -25.8 -4.5 18.4 26 29 A K H X S+ 0 0 51 -4,-2.0 4,-3.0 2,-0.2 -2,-0.2 0.880 107.1 56.6 -72.1 -33.1 -24.9 -1.1 17.0 27 30 A L H < S+ 0 0 24 -4,-2.4 12,-0.3 1,-0.2 -1,-0.2 0.899 111.7 43.6 -57.7 -43.2 -24.5 -2.6 13.5 28 31 A R H < S+ 0 0 131 -4,-1.8 3,-0.3 -5,-0.2 -2,-0.2 0.910 118.0 44.8 -65.7 -44.3 -28.1 -3.9 13.9 29 32 A E H < S+ 0 0 84 -4,-2.3 2,-1.7 1,-0.2 3,-0.2 0.908 106.6 55.0 -73.6 -47.8 -29.4 -0.6 15.3 30 33 A D >< + 0 0 51 -4,-3.0 3,-0.6 1,-0.2 9,-0.4 -0.466 68.7 144.3 -88.0 65.3 -27.8 2.0 13.0 31 34 A D T 3 + 0 0 90 -2,-1.7 -1,-0.2 -3,-0.3 7,-0.1 0.527 50.0 72.1 -89.2 -8.2 -29.2 0.4 9.9 32 35 A E T 3> + 0 0 51 -3,-0.2 4,-2.3 5,-0.1 3,-0.4 0.730 66.2 122.6 -81.3 -23.5 -29.9 3.5 7.8 33 36 A Y H <>>S+ 0 0 41 -3,-0.6 5,-2.8 1,-0.2 4,-0.7 -0.032 79.5 4.5 -50.3 136.7 -26.3 4.3 6.9 34 37 A D H >45S- 0 0 37 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.938 139.4 -46.7 54.9 57.9 -25.3 4.5 3.3 35 38 A N H 345S- 0 0 151 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.890 113.4 -51.0 49.5 45.7 -28.9 3.9 1.9 36 39 A Y H 3<5S+ 0 0 154 -4,-2.3 -1,-0.3 1,-0.1 -3,-0.2 0.519 108.7 117.8 70.4 15.1 -29.4 1.0 4.3 37 40 A I T <<5 - 0 0 18 -3,-1.4 3,-0.3 -4,-0.7 -3,-0.2 0.876 67.5-149.8 -64.1 -35.8 -26.3 -0.9 3.5 38 41 A G < - 0 0 8 -5,-2.8 4,-0.4 1,-0.2 -7,-0.1 -0.215 28.6 -66.7 83.7 177.9 -25.4 -0.3 7.1 39 42 A Y S > S+ 0 0 42 -9,-0.4 4,-2.0 -12,-0.3 5,-0.2 0.429 102.6 96.8 -88.2 -4.0 -21.9 -0.0 8.6 40 43 A G H > S+ 0 0 5 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.950 85.0 44.5 -53.0 -58.3 -20.7 -3.6 8.0 41 44 A P H > S+ 0 0 16 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.928 112.4 50.5 -58.1 -45.3 -18.8 -3.0 4.8 42 45 A V H > S+ 0 0 19 -4,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.871 109.0 53.0 -65.2 -29.7 -17.1 0.2 5.9 43 46 A L H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.883 108.4 49.9 -70.0 -36.3 -15.9 -1.5 9.1 44 47 A V H X S+ 0 0 7 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.938 111.8 48.5 -64.0 -43.9 -14.4 -4.3 7.1 45 48 A R H X S+ 0 0 92 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.902 109.4 52.9 -64.7 -38.0 -12.6 -1.7 4.9 46 49 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 5,-0.3 0.953 108.2 50.1 -60.6 -47.0 -11.4 0.1 8.0 47 50 A A H X S+ 0 0 0 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.902 114.0 46.2 -59.5 -38.3 -9.9 -3.1 9.4 48 51 A W H X S+ 0 0 40 -4,-2.1 4,-2.7 1,-0.2 3,-0.4 0.930 111.6 49.6 -69.9 -44.7 -8.1 -3.8 6.1 49 52 A H H < S+ 0 0 6 -4,-3.0 4,-0.4 1,-0.2 -2,-0.2 0.820 109.1 51.3 -68.7 -30.4 -6.8 -0.2 5.7 50 53 A I H < S+ 0 0 4 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.775 119.3 38.5 -75.4 -20.2 -5.3 -0.1 9.2 51 54 A S H >< S+ 0 0 0 -4,-0.9 3,-1.6 -3,-0.4 -2,-0.2 0.771 103.4 69.4 -92.2 -31.8 -3.6 -3.4 8.5 52 55 A G T 3< S+ 0 0 0 -4,-2.7 -2,-0.1 1,-0.3 -3,-0.1 0.463 80.4 75.5 -78.2 -0.8 -2.7 -2.8 4.9 53 56 A T T 3 S+ 0 0 4 -4,-0.4 -1,-0.3 -5,-0.1 -2,-0.1 0.513 72.9 120.8 -79.3 -6.2 -0.1 -0.1 5.7 54 57 A W < - 0 0 25 -3,-1.6 2,-0.5 7,-0.2 7,-0.2 -0.254 48.2-161.1 -62.9 145.4 2.3 -2.9 6.8 55 58 A D B >>> -B 60 0B 30 5,-2.0 4,-2.1 1,-0.1 3,-1.1 -0.971 8.4-157.5-127.6 112.7 5.6 -3.4 5.2 56 59 A K T 345S+ 0 0 87 101,-2.2 -1,-0.1 -2,-0.5 102,-0.1 0.725 86.9 68.9 -59.2 -22.8 7.2 -6.9 5.7 57 60 A H T 345S+ 0 0 138 100,-0.2 -1,-0.2 1,-0.2 -3,-0.0 0.822 124.2 2.6 -71.8 -32.2 10.6 -5.5 5.0 58 61 A D T <45S- 0 0 77 -3,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.374 94.9-115.6-137.1 6.0 11.0 -3.4 8.1 59 62 A N T <5 + 0 0 20 -4,-2.1 -3,-0.2 1,-0.2 2,-0.1 0.737 62.6 149.8 58.7 30.0 7.7 -4.1 10.1 60 63 A T B < +B 55 0B 46 -5,-0.6 -5,-2.0 -7,-0.1 -1,-0.2 -0.490 52.0 9.3 -81.6 161.6 6.5 -0.5 9.7 61 64 A G S S+ 0 0 12 73,-0.5 -7,-0.2 -7,-0.2 4,-0.2 -0.262 74.3 125.9 66.9-156.8 2.8 0.2 9.6 62 65 A G S S- 0 0 4 1,-0.2 3,-0.5 -13,-0.2 5,-0.4 -0.045 75.2 -70.0 89.7 170.4 0.3 -2.6 10.3 63 66 A S S > S+ 0 0 2 206,-0.4 3,-1.2 203,-0.3 -1,-0.2 0.703 106.7 85.8 -69.9 -23.2 -2.6 -2.9 12.8 64 67 A Y T 3 S+ 0 0 23 205,-0.4 38,-0.4 1,-0.3 64,-0.2 0.854 88.0 44.2 -53.9 -48.8 -0.5 -3.1 16.0 65 68 A G T 3 S- 0 0 5 -3,-0.5 65,-2.0 -4,-0.2 -1,-0.3 0.569 92.2-133.8 -84.3 -7.6 -0.0 0.6 16.8 66 69 A G X + 0 0 2 -3,-1.2 3,-1.5 -4,-0.3 -2,-0.1 0.829 46.9 157.7 66.2 32.0 -3.5 1.9 16.1 67 70 A T G > + 0 0 7 -5,-0.4 3,-2.2 1,-0.3 6,-0.4 0.593 48.6 86.2 -79.6 -6.2 -2.1 4.8 14.2 68 71 A Y G 3 S+ 0 0 0 1,-0.3 -1,-0.3 5,-0.2 6,-0.2 0.763 77.9 71.6 -59.2 -24.6 -5.2 5.5 12.1 69 72 A R G < S+ 0 0 74 -3,-1.5 2,-0.3 4,-0.1 -1,-0.3 0.626 83.9 85.7 -66.7 -11.5 -6.2 7.7 15.1 70 73 A F S X> S- 0 0 35 -3,-2.2 4,-2.5 1,-0.1 3,-0.8 -0.748 88.2-118.5 -99.0 145.8 -3.5 10.2 14.1 71 74 A K H 3> S+ 0 0 73 -2,-0.3 4,-2.4 1,-0.3 -1,-0.1 0.766 106.5 60.0 -56.2 -37.4 -4.3 12.9 11.6 72 75 A K H 34 S+ 0 0 78 1,-0.2 -1,-0.3 2,-0.2 -4,-0.1 0.949 117.1 31.7 -60.5 -42.8 -1.7 11.9 9.0 73 76 A E H X4 S+ 0 0 4 -3,-0.8 3,-1.6 -6,-0.4 -2,-0.2 0.893 116.0 57.2 -80.9 -42.2 -3.2 8.5 8.5 74 77 A F H 3< S+ 0 0 48 -4,-2.5 -2,-0.2 -7,-0.3 -1,-0.2 0.883 111.7 44.9 -53.0 -37.4 -6.8 9.5 9.2 75 78 A N T 3< S+ 0 0 101 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.315 78.6 133.2 -98.0 9.4 -6.5 12.0 6.3 76 79 A D X - 0 0 8 -3,-1.6 3,-2.3 1,-0.2 4,-0.2 -0.419 61.6-133.0 -52.3 126.7 -4.8 9.7 3.8 77 80 A P G > S+ 0 0 97 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.859 107.6 62.3 -52.5 -31.7 -6.6 10.2 0.5 78 81 A S G 3 S+ 0 0 38 1,-0.3 -2,-0.1 3,-0.0 -3,-0.0 0.701 101.1 53.1 -66.6 -18.3 -6.7 6.4 0.3 79 82 A N G X S+ 0 0 0 -3,-2.3 3,-2.3 -6,-0.2 4,-0.4 0.260 73.7 142.4-102.3 12.3 -8.8 6.3 3.5 80 83 A A T < S+ 0 0 27 -3,-1.6 -5,-0.1 1,-0.3 101,-0.1 -0.342 72.2 22.4 -59.0 127.8 -11.5 8.8 2.4 81 84 A G T > S+ 0 0 8 -2,-0.1 3,-1.8 99,-0.1 4,-0.5 -0.039 93.4 99.1 106.0 -29.1 -14.8 7.5 3.8 82 85 A L T X> + 0 0 1 -3,-2.3 4,-2.1 1,-0.3 3,-0.8 0.719 62.7 80.8 -69.0 -17.6 -13.4 5.5 6.7 83 86 A Q H 3> S+ 0 0 63 -4,-0.4 4,-2.6 1,-0.3 -1,-0.3 0.811 85.9 61.3 -51.4 -33.4 -14.1 8.4 9.0 84 87 A N H <> S+ 0 0 63 -3,-1.8 4,-1.8 2,-0.2 -1,-0.3 0.886 104.5 46.6 -63.3 -38.9 -17.6 7.0 9.1 85 88 A G H <> S+ 0 0 0 -3,-0.8 4,-1.9 -4,-0.5 -2,-0.2 0.902 111.6 50.6 -67.6 -41.0 -16.4 3.7 10.5 86 89 A F H X S+ 0 0 44 -4,-2.1 4,-1.1 1,-0.2 -2,-0.2 0.927 109.9 50.3 -63.9 -41.6 -14.2 5.5 13.1 87 90 A K H < S+ 0 0 66 -4,-2.6 3,-0.4 1,-0.3 -1,-0.2 0.889 107.8 54.2 -64.7 -38.0 -17.2 7.6 14.2 88 91 A F H < S+ 0 0 3 -4,-1.8 4,-0.5 1,-0.2 -1,-0.3 0.886 110.5 46.6 -55.1 -49.5 -19.3 4.4 14.5 89 92 A L H X S+ 0 0 2 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.654 89.9 87.1 -75.8 -13.1 -16.7 2.9 16.8 90 93 A E H X S+ 0 0 108 -4,-1.1 4,-2.0 -3,-0.4 -1,-0.2 0.917 90.6 44.2 -54.6 -51.1 -16.4 6.1 19.0 91 94 A P H > S+ 0 0 63 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.829 111.7 55.9 -65.4 -28.2 -19.2 5.2 21.4 92 95 A I H > S+ 0 0 7 -4,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.950 108.5 46.3 -64.9 -46.3 -17.9 1.7 21.5 93 96 A H H < S+ 0 0 47 -4,-2.6 -1,-0.2 1,-0.2 6,-0.2 0.863 109.6 55.5 -64.3 -34.9 -14.5 2.9 22.6 94 97 A K H < S+ 0 0 78 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.898 110.9 44.1 -63.9 -39.7 -16.1 5.2 25.2 95 98 A E H < S+ 0 0 129 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.841 127.0 31.0 -73.1 -34.5 -17.9 2.3 26.7 96 99 A F >< + 0 0 21 -4,-2.2 3,-1.7 -5,-0.1 -1,-0.3 -0.612 69.7 162.8-121.7 68.8 -14.8 0.1 26.7 97 100 A P T 3 + 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.616 65.5 71.8 -67.9 -13.0 -11.9 2.6 27.1 98 101 A W T 3 S+ 0 0 56 -3,-0.1 2,-0.2 2,-0.1 -89,-0.1 0.621 75.6 95.7 -77.5 -17.3 -9.5 -0.2 28.0 99 102 A I S < S- 0 0 4 -3,-1.7 -3,-0.0 -6,-0.2 2,-0.0 -0.518 79.8-116.7 -78.9 141.6 -9.3 -1.7 24.6 100 103 A S > - 0 0 12 27,-0.2 4,-2.6 -2,-0.2 5,-0.2 -0.354 21.9-116.6 -70.6 160.1 -6.4 -0.6 22.4 101 104 A S H > S+ 0 0 8 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.930 115.1 48.5 -65.1 -43.7 -7.2 1.3 19.2 102 105 A G H > S+ 0 0 0 -38,-0.4 4,-2.3 1,-0.2 5,-0.3 0.903 111.2 50.8 -65.4 -38.3 -5.7 -1.4 16.9 103 106 A D H > S+ 0 0 0 24,-0.2 4,-2.6 -39,-0.2 5,-0.2 0.933 112.5 47.7 -60.9 -43.6 -7.6 -4.1 18.8 104 107 A L H X S+ 0 0 2 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.944 113.0 45.9 -63.4 -47.9 -10.8 -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 0.924 117.0 44.1 -64.6 -43.0 -10.4 -1.4 14.6 106 109 A S H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.3 3,-0.3 0.920 112.7 51.5 -68.5 -38.7 -9.5 -5.0 13.8 107 110 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 -5,-0.3 5,-0.2 0.871 103.2 61.0 -66.4 -32.6 -12.3 -6.4 16.0 108 111 A G H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.911 105.9 46.2 -57.3 -43.2 -14.7 -4.1 14.2 109 112 A G H X S+ 0 0 0 -4,-1.3 4,-2.4 -3,-0.3 -2,-0.2 0.905 112.7 48.8 -68.6 -42.9 -13.9 -5.9 10.9 110 113 A V H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.937 112.5 48.9 -59.7 -46.1 -14.1 -9.3 12.4 111 114 A T H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.926 111.0 50.4 -60.8 -45.2 -17.5 -8.5 14.0 112 115 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.2 6,-0.2 0.935 110.2 48.8 -60.4 -47.3 -18.8 -7.1 10.7 113 116 A V H <>S+ 0 0 0 -4,-2.4 5,-2.5 1,-0.2 82,-0.2 0.949 116.0 43.3 -58.5 -47.1 -17.8 -10.1 8.7 114 117 A Q H ><5S+ 0 0 5 -4,-2.4 3,-1.7 1,-0.2 -1,-0.2 0.899 112.8 50.5 -67.2 -41.7 -19.4 -12.5 11.2 115 118 A E H 3<5S+ 0 0 46 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.812 104.1 59.6 -69.9 -24.8 -22.6 -10.5 11.7 116 119 A M T 3<5S- 0 0 15 -4,-2.0 79,-3.1 -5,-0.2 -1,-0.3 0.184 128.5 -99.9 -85.1 18.8 -23.0 -10.3 7.9 117 120 A Q T < 5S+ 0 0 127 -3,-1.7 -3,-0.2 77,-0.2 -2,-0.2 0.668 79.6 139.6 74.1 22.3 -23.1 -14.1 7.9 118 121 A G < - 0 0 14 -5,-2.5 -1,-0.2 -6,-0.2 3,-0.1 -0.060 59.9 -65.1 -78.9-172.8 -19.5 -14.5 6.8 119 122 A P - 0 0 13 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.335 57.5 -93.9 -70.9 155.9 -17.1 -17.1 8.2 120 123 A K - 0 0 62 -3,-0.1 162,-0.1 -6,-0.1 164,-0.1 -0.555 39.2-156.1 -60.9 135.9 -15.8 -17.1 11.7 121 124 A I - 0 0 0 -2,-0.2 162,-0.3 -11,-0.1 -7,-0.1 -0.957 12.0-135.3-118.2 106.8 -12.6 -15.2 11.9 122 125 A P - 0 0 28 0, 0.0 2,-0.4 0, 0.0 160,-0.2 -0.359 28.1-163.5 -59.4 144.6 -10.3 -16.1 14.9 123 126 A W B -C 281 0C 2 158,-2.4 158,-3.0 156,-0.1 2,-0.4 -0.992 11.4-154.1-138.9 137.8 -9.0 -12.9 16.5 124 127 A R - 0 0 53 -2,-0.4 3,-0.2 156,-0.2 2,-0.1 -0.929 11.2-144.5-115.2 138.7 -6.2 -12.2 18.9 125 128 A C + 0 0 8 -2,-0.4 -118,-0.1 1,-0.1 -120,-0.0 -0.364 59.2 84.0 -87.2 172.7 -5.9 -9.4 21.4 126 129 A G + 0 0 0 1,-0.3 -120,-2.5 -120,-0.2 -1,-0.1 0.484 39.5 147.4 113.6 6.8 -2.9 -7.4 22.5 127 130 A R - 0 0 2 -3,-0.2 2,-0.4 -122,-0.2 -1,-0.3 -0.437 36.4-148.4 -61.7 143.3 -2.2 -4.7 19.9 128 131 A V - 0 0 55 -64,-0.2 -121,-0.0 -28,-0.1 -1,-0.0 -0.985 15.8-111.3-123.5 129.2 -0.7 -1.7 21.8 129 132 A D - 0 0 64 -2,-0.4 -63,-0.2 -63,-0.1 -64,-0.2 -0.304 35.3-161.1 -55.5 135.3 -1.1 2.0 20.8 130 133 A T - 0 0 22 -65,-2.0 -1,-0.0 1,-0.1 5,-0.0 -0.780 26.6 -83.7-117.7 162.5 2.1 3.5 19.6 131 134 A P > - 0 0 78 0, 0.0 3,-2.4 0, 0.0 4,-0.2 -0.086 40.1-101.0 -70.8 169.2 3.0 7.2 19.4 132 135 A E G > S+ 0 0 108 1,-0.3 3,-1.8 2,-0.2 -60,-0.1 0.819 117.3 63.2 -58.2 -33.6 2.2 9.6 16.6 133 136 A D G 3 S+ 0 0 140 1,-0.3 -1,-0.3 3,-0.0 0, 0.0 0.608 93.1 64.4 -74.2 -4.6 5.6 9.5 15.1 134 137 A T G < S+ 0 0 57 -3,-2.4 -73,-0.5 -69,-0.1 -1,-0.3 0.405 74.8 118.2 -92.4 1.1 5.1 5.7 14.3 135 138 A T < - 0 0 8 -3,-1.8 2,-0.1 -4,-0.2 -67,-0.0 -0.490 69.2-120.2 -68.0 132.4 2.3 6.5 11.9 136 139 A P - 0 0 9 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.475 28.2-106.1 -74.9 145.4 3.1 5.4 8.4 137 140 A D - 0 0 113 -2,-0.1 3,-0.4 1,-0.1 -64,-0.0 -0.240 43.8 -92.5 -59.6 153.3 3.2 8.0 5.6 138 141 A N S S+ 0 0 73 1,-0.2 -1,-0.1 2,-0.1 -65,-0.1 -0.288 99.8 61.8 -58.0 156.3 0.4 8.0 3.1 139 142 A G + 0 0 63 -3,-0.1 -1,-0.2 3,-0.0 -2,-0.1 0.467 65.2 104.5 107.5 7.8 0.8 6.0 -0.1 140 143 A R + 0 0 53 -3,-0.4 -2,-0.1 2,-0.1 -3,-0.0 0.550 62.1 85.1 -95.1 -9.4 1.1 2.4 1.2 141 144 A L S S- 0 0 5 1,-0.1 2,-0.1 -88,-0.1 -88,-0.1 -0.572 88.4 -93.0 -95.1 155.0 -2.5 1.4 0.2 142 145 A P - 0 0 40 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.348 25.0-126.4 -80.3 150.9 -3.2 0.2 -3.3 143 146 A D - 0 0 73 1,-0.1 3,-0.3 -2,-0.1 -65,-0.0 -0.590 10.5-149.4 -79.0 154.7 -4.4 2.0 -6.4 144 147 A A S S+ 0 0 22 -2,-0.2 87,-1.6 1,-0.2 88,-0.2 0.506 83.5 73.6-104.9 -6.3 -7.5 0.7 -8.2 145 148 A D S S+ 0 0 97 85,-0.2 -1,-0.2 84,-0.1 2,-0.1 0.292 83.3 91.9 -92.5 13.6 -6.7 1.8 -11.8 146 149 A K - 0 0 72 -3,-0.3 88,-0.2 1,-0.1 2,-0.1 -0.248 68.4-107.0-109.9-178.4 -4.0 -0.9 -12.3 147 150 A D > - 0 0 97 -2,-0.1 4,-1.9 86,-0.1 3,-0.2 -0.298 41.0 -85.1-109.2-176.2 -3.6 -4.4 -13.7 148 151 A A H > S+ 0 0 9 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.862 123.7 54.7 -63.2 -37.7 -2.9 -7.9 -12.4 149 152 A G H > S+ 0 0 35 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.896 108.1 50.3 -65.6 -37.4 0.8 -7.6 -12.2 150 153 A Y H > S+ 0 0 58 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.907 111.3 48.4 -58.0 -51.2 0.4 -4.5 -10.1 151 154 A V H X S+ 0 0 5 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.931 112.0 49.4 -58.9 -44.1 -1.9 -6.3 -7.7 152 155 A R H X S+ 0 0 44 -4,-2.8 4,-1.1 1,-0.2 -2,-0.2 0.939 115.0 42.3 -62.8 -48.7 0.4 -9.3 -7.4 153 156 A T H X S+ 0 0 92 -4,-2.3 4,-0.7 1,-0.2 3,-0.5 0.923 111.6 56.1 -66.8 -39.9 3.5 -7.2 -6.7 154 157 A F H >< S+ 0 0 20 -4,-2.8 3,-1.2 1,-0.2 4,-0.3 0.906 107.2 48.4 -52.8 -54.4 1.6 -4.9 -4.3 155 158 A F H ><>S+ 0 0 11 -4,-2.2 5,-2.3 1,-0.3 3,-1.0 0.697 94.0 74.0 -72.5 -15.7 0.5 -7.8 -2.1 156 159 A Q H ><5S+ 0 0 97 -4,-1.1 3,-1.7 -3,-0.5 -1,-0.3 0.856 90.1 60.8 -59.7 -30.2 3.9 -9.3 -1.9 157 160 A R T <<5S+ 0 0 45 -3,-1.2 -101,-2.2 -4,-0.7 -1,-0.2 0.768 106.0 46.4 -67.5 -24.8 4.7 -6.4 0.5 158 161 A L T < 5S- 0 0 0 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.2 0.188 118.9-113.7 -97.0 11.2 2.0 -7.8 2.7 159 162 A N T < 5 + 0 0 84 -3,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.845 68.4 145.0 56.2 39.4 3.3 -11.3 2.4 160 163 A M < - 0 0 8 -5,-2.3 -1,-0.2 -8,-0.1 -2,-0.1 -0.897 35.0-153.2-109.9 137.4 0.2 -12.5 0.5 161 164 A N > - 0 0 88 -2,-0.4 4,-2.7 -5,-0.0 5,-0.2 -0.282 39.7 -83.9 -95.2-176.6 0.3 -15.0 -2.3 162 165 A D H > S+ 0 0 38 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.906 128.0 46.8 -58.8 -45.1 -2.1 -15.4 -5.3 163 166 A R H > S+ 0 0 80 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.917 113.3 49.0 -66.9 -39.0 -4.7 -17.5 -3.4 164 167 A E H > S+ 0 0 40 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.905 112.0 49.2 -65.9 -39.7 -4.6 -15.1 -0.4 165 168 A V H X S+ 0 0 2 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.945 112.7 45.8 -64.4 -48.1 -5.1 -12.1 -2.7 166 169 A V H X S+ 0 0 0 -4,-2.6 4,-0.6 -5,-0.2 -2,-0.2 0.922 114.2 49.6 -65.8 -38.4 -8.0 -13.6 -4.6 167 170 A A H >< S+ 0 0 0 -4,-2.5 3,-1.4 -5,-0.2 4,-0.3 0.944 110.8 49.0 -60.7 -51.1 -9.6 -14.7 -1.3 168 171 A L H >< S+ 0 0 17 -4,-2.8 3,-2.0 1,-0.3 -1,-0.2 0.894 103.1 61.7 -57.9 -38.7 -9.2 -11.3 0.3 169 172 A M H >< S+ 0 0 21 -4,-2.3 3,-2.4 1,-0.3 -1,-0.3 0.682 82.1 81.2 -65.5 -16.3 -10.7 -9.5 -2.8 170 173 A G G X< S+ 0 0 1 -3,-1.4 3,-1.8 -4,-0.6 29,-0.3 0.713 73.2 78.1 -61.9 -16.8 -14.0 -11.4 -2.3 171 174 A A G X S+ 0 0 19 -3,-2.0 3,-2.2 -4,-0.3 -1,-0.3 0.672 72.2 82.5 -62.1 -15.6 -14.7 -8.7 0.3 172 175 A H G < S+ 0 0 63 -3,-2.4 -1,-0.3 1,-0.3 16,-0.3 0.494 70.5 76.5 -74.5 2.0 -15.6 -6.5 -2.7 173 176 A A G < S+ 0 0 1 -3,-1.8 -1,-0.3 23,-0.2 2,-0.3 0.614 87.4 85.1 -68.4 -17.8 -19.0 -8.2 -2.7 174 177 A L S < S- 0 0 16 -3,-2.2 19,-0.2 -4,-0.1 18,-0.1 -0.651 96.1 -26.7 -92.4 146.8 -19.6 -5.9 0.3 175 178 A G S S- 0 0 3 17,-3.1 13,-0.5 -2,-0.3 2,-0.3 -0.192 80.2 -92.4 61.2-142.1 -20.7 -2.3 0.3 176 179 A K E -D 187 0D 55 11,-0.2 2,-0.3 12,-0.1 -3,-0.0 -0.987 24.2 -95.8-161.9 163.4 -20.0 -0.1 -2.8 177 180 A T E -D 186 0D 24 9,-2.8 9,-2.3 -2,-0.3 2,-0.5 -0.704 36.4-151.4 -83.7 142.0 -17.6 2.4 -4.4 178 181 A H >>> - 0 0 45 -2,-0.3 4,-2.2 7,-0.2 3,-1.3 -0.987 10.6-141.5-119.4 122.6 -18.6 6.0 -3.8 179 182 A L H 3>5S+ 0 0 50 -2,-0.5 4,-1.8 1,-0.3 -1,-0.1 0.863 101.0 51.7 -53.1 -39.8 -17.6 8.6 -6.4 180 183 A K H 345S+ 0 0 102 1,-0.2 -1,-0.3 2,-0.2 5,-0.1 0.743 114.4 42.9 -73.6 -22.5 -16.8 11.2 -3.8 181 184 A N H <45S- 0 0 60 -3,-1.3 -101,-0.2 3,-0.2 -2,-0.2 0.896 137.1 -0.2 -84.0 -47.0 -14.5 8.9 -1.8 182 185 A S H <5S- 0 0 53 -4,-2.2 -3,-0.2 2,-0.4 -2,-0.2 0.452 92.5-105.2-129.7 -7.2 -12.5 7.1 -4.5 183 186 A G S < + 0 0 35 1,-0.2 3,-1.0 3,-0.1 -1,-0.2 -0.628 62.6 155.8-106.5 72.9 -26.3 -8.7 -1.7 192 195 A N T 3 S+ 0 0 29 -2,-0.9 -17,-3.1 1,-0.3 -1,-0.2 0.466 70.8 45.3 -98.5 12.6 -23.8 -6.1 -0.5 193 196 A N T 3 S+ 0 0 67 -19,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.155 101.2 77.1-125.3 24.7 -24.4 -6.4 3.3 194 197 A V S < S- 0 0 35 -3,-1.0 2,-0.7 -21,-0.2 -77,-0.2 -0.993 83.9-125.6-123.6 129.4 -24.3 -10.2 3.3 195 198 A F + 0 0 5 -79,-3.1 2,-0.2 -2,-0.4 -3,-0.1 -0.692 53.5 133.9 -79.6 111.2 -21.0 -11.9 3.1 196 199 A T - 0 0 33 -2,-0.7 3,-0.4 -26,-0.2 -23,-0.2 -0.817 68.9 -98.0-139.7-176.5 -21.1 -14.4 0.2 197 200 A N S >> S+ 0 0 7 -2,-0.2 4,-1.5 1,-0.2 3,-1.0 0.096 79.9 120.8 -93.0 23.9 -19.0 -15.5 -2.8 198 201 A E H 3> + 0 0 25 1,-0.3 4,-2.9 2,-0.2 5,-0.3 0.770 60.0 69.3 -61.2 -27.8 -21.0 -13.3 -5.1 199 202 A F H 3> S+ 0 0 1 -3,-0.4 4,-2.2 -29,-0.3 -1,-0.3 0.925 104.2 41.8 -56.9 -42.3 -18.0 -11.3 -6.2 200 203 A Y H <> S+ 0 0 0 -3,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.902 113.9 51.1 -75.2 -42.5 -16.5 -14.3 -8.1 201 204 A L H X S+ 0 0 61 -4,-1.5 4,-2.3 1,-0.2 5,-0.3 0.920 112.2 47.7 -58.4 -43.6 -19.9 -15.4 -9.5 202 205 A N H X S+ 0 0 14 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.922 108.1 54.2 -68.6 -40.3 -20.5 -11.9 -10.8 203 206 A L H < S+ 0 0 3 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.928 118.6 36.2 -55.2 -42.7 -17.0 -11.6 -12.3 204 207 A L H < S+ 0 0 53 -4,-2.1 -1,-0.2 1,-0.1 -2,-0.2 0.798 125.4 35.3 -80.4 -30.6 -17.6 -14.8 -14.2 205 208 A N H < S+ 0 0 115 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.656 94.0 86.7-109.8 -19.7 -21.3 -14.5 -15.1 206 209 A E S < S- 0 0 44 -4,-2.2 2,-0.9 -5,-0.3 16,-0.0 -0.459 77.7-117.6 -78.5 159.5 -22.0 -10.8 -15.8 207 210 A D - 0 0 73 -2,-0.1 16,-0.6 2,-0.0 2,-0.4 -0.843 39.3-158.2 -93.0 102.5 -21.6 -9.1 -19.2 208 211 A W E -E 222 0E 29 -2,-0.9 2,-0.4 -5,-0.1 14,-0.2 -0.685 12.8-170.9 -94.3 135.2 -19.0 -6.5 -18.4 209 212 A K E -E 221 0E 65 12,-2.5 12,-2.8 -2,-0.4 2,-0.8 -0.980 25.4-125.8-124.4 134.2 -18.4 -3.3 -20.4 210 213 A L E +E 220 0E 76 -2,-0.4 2,-0.2 10,-0.2 10,-0.2 -0.690 46.8 160.9 -80.5 109.8 -15.5 -0.9 -19.9 211 214 A E E -E 219 0E 99 8,-2.8 8,-2.5 -2,-0.8 2,-0.4 -0.751 39.5-113.2-121.6 169.6 -17.0 2.5 -19.3 212 215 A K E -E 218 0E 123 -2,-0.2 6,-0.2 6,-0.2 2,-0.1 -0.899 29.1-145.3-102.7 141.0 -16.1 5.9 -17.9 213 216 A N > - 0 0 19 4,-2.7 3,-2.0 -2,-0.4 -29,-0.0 -0.269 38.1 -85.9 -92.5-176.7 -17.8 7.1 -14.8 214 217 A D T 3 S+ 0 0 155 1,-0.3 -30,-0.1 2,-0.1 -1,-0.1 0.518 127.7 58.6 -72.5 -5.7 -18.7 10.7 -13.9 215 218 A A T 3 S- 0 0 41 -32,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.277 118.3-110.7-102.1 12.5 -15.2 11.3 -12.5 216 219 A N S < S+ 0 0 105 -3,-2.0 2,-0.4 1,-0.3 -2,-0.1 0.707 77.3 129.2 67.4 24.5 -13.6 10.4 -15.9 217 220 A N - 0 0 61 -34,-0.2 -4,-2.7 -4,-0.0 -1,-0.3 -0.867 60.0-115.7-106.6 143.7 -12.2 7.1 -14.6 218 221 A E E +E 212 0E 102 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.528 41.1 160.3 -75.4 139.0 -12.6 3.8 -16.3 219 222 A Q E -E 211 0E 6 -8,-2.5 -8,-2.8 -2,-0.2 2,-0.5 -0.972 41.4-106.4-150.4 160.4 -14.5 1.0 -14.5 220 223 A W E -EF 210 228E 40 8,-2.5 8,-2.4 -2,-0.3 2,-0.4 -0.822 38.8-171.2 -95.3 125.9 -16.3 -2.2 -15.6 221 224 A D E -EF 209 227E 31 -12,-2.8 -12,-2.5 -2,-0.5 2,-0.3 -0.920 10.2-155.8-120.8 143.2 -20.1 -2.0 -15.6 222 225 A S E > -E 208 0E 11 4,-2.5 3,-2.2 -2,-0.4 -14,-0.1 -0.802 30.3-117.6-114.3 158.4 -22.8 -4.6 -16.0 223 226 A K T 3 S+ 0 0 129 -16,-0.6 -1,-0.1 -2,-0.3 -15,-0.1 0.730 112.6 68.5 -68.3 -14.9 -26.4 -4.2 -17.1 224 227 A S T 3 S- 0 0 65 -17,-0.1 -1,-0.3 2,-0.1 -35,-0.0 0.552 122.7-104.8 -74.0 -8.8 -27.5 -5.5 -13.7 225 228 A G S < S+ 0 0 51 -3,-2.2 2,-0.2 1,-0.3 -2,-0.2 0.635 78.8 131.1 90.9 19.3 -26.1 -2.3 -12.2 226 229 A Y - 0 0 40 -4,-0.1 -4,-2.5 -38,-0.1 -1,-0.3 -0.603 37.5-158.4 -95.5 163.4 -22.9 -3.9 -10.8 227 230 A M E -F 221 0E 7 -40,-2.3 2,-0.4 -6,-0.2 -6,-0.2 -0.955 9.3-157.7-137.4 156.4 -19.3 -2.6 -11.2 228 231 A M E -F 220 0E 1 -8,-2.4 -8,-2.5 -2,-0.3 -40,-0.0 -0.998 22.0-126.8-127.1 136.0 -15.8 -3.9 -11.0 229 232 A L > - 0 0 16 -2,-0.4 4,-2.8 -10,-0.2 3,-0.5 -0.431 33.9-108.1 -63.3 156.4 -12.6 -1.8 -10.4 230 233 A P H > S+ 0 0 21 0, 0.0 4,-1.7 0, 0.0 -85,-0.2 0.917 124.5 51.5 -53.1 -38.6 -9.9 -2.3 -13.0 231 234 A T H 4 S+ 0 0 12 -87,-1.6 4,-0.3 1,-0.2 -86,-0.1 0.833 109.4 49.9 -71.1 -29.7 -8.0 -4.2 -10.2 232 235 A D H >4 S+ 0 0 6 -3,-0.5 3,-1.7 -88,-0.2 4,-0.2 0.931 110.7 48.3 -65.1 -52.1 -11.0 -6.4 -9.6 233 236 A Y H >X S+ 0 0 42 -4,-2.8 3,-2.1 1,-0.3 4,-0.7 0.800 97.2 72.8 -61.3 -26.6 -11.5 -7.2 -13.3 234 237 A S H >X S+ 0 0 0 -4,-1.7 4,-1.9 -5,-0.3 3,-0.6 0.772 81.7 72.4 -59.1 -24.2 -7.7 -8.0 -13.4 235 238 A L H <4 S+ 0 0 0 -3,-1.7 10,-0.3 -4,-0.3 -1,-0.3 0.681 103.4 39.3 -70.3 -14.6 -8.5 -11.2 -11.5 236 239 A I H <4 S+ 0 0 35 -3,-2.1 -1,-0.3 -4,-0.2 -2,-0.2 0.495 110.5 59.5-108.7 -0.5 -10.1 -12.7 -14.6 237 240 A Q H << S+ 0 0 112 -4,-0.7 -2,-0.2 -3,-0.6 -3,-0.1 0.785 95.2 69.0 -89.9 -30.5 -7.6 -11.2 -17.0 238 241 A D S X S- 0 0 21 -4,-1.9 4,-2.5 1,-0.1 5,-0.2 -0.730 79.6-141.7 -91.0 129.3 -4.6 -13.1 -15.4 239 242 A P H > S+ 0 0 91 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.815 98.8 50.6 -66.7 -28.8 -4.8 -16.8 -15.9 240 243 A K H > S+ 0 0 122 2,-0.2 4,-1.1 1,-0.2 5,-0.1 0.929 114.0 43.6 -74.3 -43.0 -3.5 -17.7 -12.5 241 244 A Y H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 3,-0.4 0.911 109.0 60.0 -63.8 -39.0 -6.0 -15.5 -10.7 242 245 A L H X S+ 0 0 42 -4,-2.5 4,-2.5 1,-0.3 5,-0.2 0.896 100.3 53.8 -61.6 -40.3 -8.8 -16.7 -13.0 243 246 A S H X S+ 0 0 79 -4,-1.5 4,-1.8 2,-0.2 -1,-0.3 0.880 111.5 45.6 -59.7 -39.3 -8.4 -20.3 -11.9 244 247 A I H X S+ 0 0 13 -4,-1.1 4,-2.5 -3,-0.4 5,-0.2 0.893 108.5 55.7 -75.7 -36.2 -8.8 -19.3 -8.3 245 248 A V H X S+ 0 0 0 -4,-2.7 4,-2.4 -10,-0.3 -2,-0.2 0.938 109.1 48.4 -54.7 -47.6 -11.8 -17.0 -9.1 246 249 A K H X S+ 0 0 104 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.909 108.8 54.3 -62.3 -39.1 -13.4 -20.1 -10.6 247 250 A E H >< S+ 0 0 66 -4,-1.8 3,-0.6 1,-0.2 4,-0.4 0.949 112.5 41.7 -58.8 -49.6 -12.6 -22.2 -7.6 248 251 A Y H >< S+ 0 0 0 -4,-2.5 3,-0.8 1,-0.2 7,-0.2 0.864 110.0 57.4 -72.7 -30.7 -14.2 -19.8 -5.2 249 252 A A H 3< S+ 0 0 9 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.758 114.7 40.8 -62.6 -25.9 -17.2 -19.2 -7.5 250 253 A N T << S+ 0 0 137 -4,-1.2 2,-0.2 -3,-0.6 -1,-0.2 0.373 117.3 45.0-107.0 5.1 -17.8 -23.0 -7.3 251 254 A D <> + 0 0 76 -3,-0.8 4,-2.2 -4,-0.4 -1,-0.2 -0.703 52.9 180.0-155.6 89.3 -17.1 -23.6 -3.6 252 255 A Q H > S+ 0 0 127 -2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.866 86.8 51.6 -56.6 -43.8 -18.6 -21.3 -1.0 253 256 A D H > S+ 0 0 98 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.923 108.4 50.6 -65.4 -41.7 -17.1 -23.2 1.9 254 257 A K H > S+ 0 0 66 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.921 110.7 49.6 -62.4 -43.3 -13.6 -23.1 0.5 255 258 A F H X S+ 0 0 0 -4,-2.2 4,-3.2 -7,-0.2 5,-0.3 0.950 111.0 50.2 -59.3 -47.2 -13.9 -19.4 -0.1 256 259 A F H X S+ 0 0 45 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.935 113.1 45.3 -58.8 -45.3 -15.1 -18.9 3.5 257 260 A K H X S+ 0 0 97 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.927 116.6 44.3 -67.4 -41.7 -12.2 -21.0 5.0 258 261 A D H X S+ 0 0 26 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.893 113.5 50.6 -71.0 -39.7 -9.5 -19.3 2.8 259 262 A F H X S+ 0 0 1 -4,-3.2 4,-3.0 -5,-0.3 5,-0.3 0.912 108.4 53.2 -58.0 -49.8 -10.9 -15.8 3.4 260 263 A S H X S+ 0 0 15 -4,-2.3 4,-2.3 -5,-0.3 5,-0.2 0.943 112.2 44.1 -55.6 -46.2 -11.0 -16.4 7.2 261 264 A K H X S+ 0 0 104 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.924 116.3 46.0 -62.9 -46.4 -7.3 -17.5 7.2 262 265 A A H X S+ 0 0 1 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.887 113.2 49.4 -66.6 -39.5 -6.1 -14.6 5.0 263 266 A F H X S+ 0 0 5 -4,-3.0 4,-2.3 -5,-0.2 -2,-0.2 0.924 111.5 48.1 -70.2 -39.6 -8.1 -12.0 6.8 264 267 A E H X S+ 0 0 30 -4,-2.3 4,-1.2 -5,-0.3 -2,-0.2 0.950 112.9 49.8 -61.1 -43.7 -6.8 -13.1 10.2 265 268 A K H >X S+ 0 0 52 -4,-2.3 4,-1.4 -5,-0.2 3,-0.7 0.937 109.5 50.9 -59.9 -45.3 -3.3 -13.1 8.8 266 269 A L H 3< S+ 0 0 2 -4,-2.6 3,-0.5 1,-0.2 -203,-0.3 0.921 111.4 47.9 -55.6 -46.1 -3.8 -9.6 7.4 267 270 A L H 3< S+ 0 0 3 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.670 117.1 43.2 -74.9 -14.9 -5.0 -8.3 10.7 268 271 A E H X< S+ 0 0 33 -4,-1.2 3,-2.2 -3,-0.7 -1,-0.2 0.498 78.8 126.8-109.6 -6.4 -2.0 -10.0 12.5 269 272 A N T 3< S+ 0 0 18 -4,-1.4 -206,-0.4 -3,-0.5 -205,-0.4 -0.242 77.1 21.9 -54.1 131.6 0.8 -9.1 10.2 270 273 A G T 3 S+ 0 0 16 1,-0.2 -267,-0.6 -208,-0.1 2,-0.4 0.248 97.9 114.7 97.5 -12.6 3.6 -7.4 12.1 271 274 A I E < -a 3 0A 19 -3,-2.2 2,-0.6 -269,-0.1 -1,-0.2 -0.796 52.1-152.3-103.1 132.0 2.7 -8.8 15.5 272 275 A T E -a 4 0A 71 -269,-3.2 -267,-2.8 -2,-0.4 -3,-0.0 -0.888 12.9-156.5 -96.7 119.1 4.7 -11.2 17.6 273 276 A F - 0 0 41 -2,-0.6 -267,-0.1 -269,-0.2 -269,-0.1 -0.875 19.7-121.1 -99.0 122.5 2.6 -13.3 19.9 274 277 A P > - 0 0 45 0, 0.0 3,-2.3 0, 0.0 -1,-0.0 -0.262 23.3-115.8 -53.3 149.2 4.3 -14.7 23.0 275 278 A K T 3 S+ 0 0 118 1,-0.3 -2,-0.0 0, 0.0 0, 0.0 0.797 119.4 50.5 -56.3 -29.5 4.3 -18.5 23.2 276 279 A D T 3 S+ 0 0 116 2,-0.0 -1,-0.3 3,-0.0 3,-0.1 0.233 84.0 123.4 -96.3 9.7 2.2 -18.1 26.4 277 280 A A S < S- 0 0 23 -3,-2.3 -4,-0.1 1,-0.1 -271,-0.0 -0.337 74.6 -91.0 -61.8 152.7 -0.3 -15.7 24.7 278 281 A P - 0 0 55 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.250 48.0-101.9 -56.8 151.7 -4.0 -16.7 24.8 279 282 A S - 0 0 94 1,-0.1 -156,-0.1 -3,-0.1 -3,-0.0 -0.320 55.2 -75.1 -64.7 162.1 -5.2 -18.8 21.9 280 283 A P - 0 0 54 0, 0.0 2,-0.3 0, 0.0 -156,-0.2 -0.291 50.9-124.4 -58.0 142.0 -7.2 -16.9 19.3 281 284 A F B -C 123 0C 24 -158,-3.0 -158,-2.4 -3,-0.1 2,-0.6 -0.706 14.4-158.0 -87.0 139.6 -10.7 -16.1 20.3 282 285 A I - 0 0 88 -2,-0.3 2,-0.2 -160,-0.2 -162,-0.0 -0.957 20.7-147.1-116.8 105.2 -13.7 -17.2 18.2 283 286 A F - 0 0 0 -2,-0.6 2,-0.3 -162,-0.3 -162,-0.1 -0.524 9.1-124.0 -73.6 142.6 -16.6 -14.9 19.0 284 287 A K - 0 0 62 -2,-0.2 -1,-0.1 1,-0.1 2,-0.0 -0.595 28.8-120.6 -75.8 140.3 -20.2 -16.1 19.0 285 288 A T > - 0 0 13 -2,-0.3 4,-1.3 1,-0.1 6,-0.2 -0.302 25.8-107.3 -70.3 167.0 -22.6 -14.0 16.8 286 289 A L H >>>S+ 0 0 0 1,-0.2 5,-2.6 2,-0.2 4,-0.7 0.951 123.0 54.0 -57.0 -46.5 -25.5 -12.3 18.3 287 290 A E H >45S+ 0 0 162 1,-0.3 3,-1.0 4,-0.2 -1,-0.2 0.908 105.7 51.3 -55.3 -44.4 -27.7 -14.9 16.6 288 291 A E H 345S+ 0 0 113 1,-0.2 -1,-0.3 2,-0.1 -2,-0.2 0.801 112.4 47.5 -66.5 -23.6 -25.8 -17.8 18.2 289 292 A Q H <<5S- 0 0 61 -4,-1.3 -1,-0.2 -3,-0.7 -2,-0.2 0.492 112.9-117.1 -91.6 -4.2 -26.2 -16.1 21.7 290 293 A G T <<5 0 0 69 -3,-1.0 -3,-0.2 -4,-0.7 -2,-0.1 0.784 360.0 360.0 70.2 29.4 -30.0 -15.5 21.2 291 294 A L < 0 0 102 -5,-2.6 -4,-0.2 -6,-0.2 -5,-0.1 0.531 360.0 360.0-108.0 360.0 -29.3 -11.7 21.4