==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 25-JUL-01 1EBE . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR V.FULOP,R.P.PHIZACKERLEY,S.M.SOLTIS,I.J.CLIFTON,S.WAKATSUKI, . 293 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12429.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 194 66.2 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 . 15 5.1 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 . 12 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 16.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 35.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 2 A T 0 0 123 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 86.1 14.0 92.3 80.6 2 3 A P - 0 0 84 0, 0.0 59,-0.2 0, 0.0 2,-0.1 -0.566 360.0-103.3 -66.6 147.9 14.9 91.3 77.0 3 4 A L - 0 0 59 57,-1.6 2,-0.6 -2,-0.3 0, 0.0 -0.475 23.3-139.7 -82.9 146.4 12.1 92.2 74.8 4 5 A V - 0 0 111 -2,-0.1 2,-0.8 269,-0.0 269,-0.1 -0.914 17.4-175.1-107.7 116.7 9.6 89.6 73.5 5 6 A H E -a 273 0A 33 267,-0.6 269,-3.6 -2,-0.6 2,-0.4 -0.943 10.8-169.8-105.5 104.0 8.6 90.3 69.8 6 7 A V E -a 274 0A 62 -2,-0.8 269,-0.2 267,-0.2 2,-0.1 -0.828 23.6-111.2-100.9 142.6 6.0 87.7 68.9 7 8 A A - 0 0 10 267,-2.7 2,-0.4 -2,-0.4 122,-0.2 -0.407 28.0-171.2 -64.3 143.1 4.8 87.3 65.4 8 9 A S - 0 0 67 120,-2.1 120,-0.2 -2,-0.1 3,-0.1 -0.935 22.4-130.6-140.9 111.7 1.3 88.3 64.3 9 10 A V - 0 0 57 -2,-0.4 2,-0.2 118,-0.1 3,-0.1 -0.296 35.4-100.9 -63.9 138.4 0.2 87.3 60.9 10 11 A E > - 0 0 23 1,-0.1 3,-1.3 2,-0.1 2,-0.2 -0.521 60.5 -78.8 -58.1 132.0 -1.3 90.2 59.0 11 12 A K T 3 S- 0 0 180 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.179 108.1 -10.4 -57.0 112.6 -5.1 89.8 59.2 12 13 A G T 3 S+ 0 0 73 1,-0.3 -1,-0.3 -2,-0.2 5,-0.1 -0.056 97.6 140.9 93.7 -21.6 -6.5 87.2 56.9 13 14 A R < + 0 0 77 -3,-1.3 -1,-0.3 87,-0.1 2,-0.2 -0.136 18.9 161.0 -62.2 123.2 -3.2 86.9 55.0 14 15 A S > - 0 0 65 -3,-0.1 4,-1.3 -5,-0.1 5,-0.2 -0.569 56.3 -66.4-121.7-159.7 -2.1 83.5 53.8 15 16 A Y H > S+ 0 0 87 2,-0.2 4,-3.2 1,-0.2 3,-0.5 0.887 126.6 55.8 -61.6 -49.9 0.3 82.1 51.2 16 17 A E H > S+ 0 0 57 1,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.933 106.8 55.3 -48.8 -44.9 -1.4 83.4 48.1 17 18 A D H > S+ 0 0 29 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.874 112.9 38.0 -57.9 -43.4 -1.2 86.8 49.6 18 19 A F H X S+ 0 0 0 -4,-1.3 4,-2.8 -3,-0.5 -1,-0.2 0.851 111.3 59.1 -84.7 -30.3 2.5 86.8 50.1 19 20 A Q H X S+ 0 0 12 -4,-3.2 4,-2.3 2,-0.2 5,-0.3 0.957 104.5 52.8 -60.6 -45.5 3.2 85.0 46.8 20 21 A K H X S+ 0 0 100 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.899 109.8 47.9 -50.3 -45.6 1.4 88.0 45.1 21 22 A V H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 5,-0.2 0.934 110.5 51.5 -63.1 -51.6 3.8 90.4 46.9 22 23 A Y H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.870 109.9 49.5 -51.1 -44.8 6.8 88.2 45.9 23 24 A N H X S+ 0 0 26 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.905 107.1 56.3 -64.7 -39.6 5.7 88.3 42.2 24 25 A A H X S+ 0 0 15 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.946 111.7 40.8 -58.8 -43.0 5.3 92.0 42.5 25 26 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.935 116.8 50.2 -71.6 -40.2 9.0 92.4 43.5 26 27 A A H X S+ 0 0 0 -4,-2.7 4,-1.8 -5,-0.2 5,-0.2 0.978 112.2 46.3 -62.3 -48.6 10.1 89.8 41.0 27 28 A L H X S+ 0 0 80 -4,-3.2 4,-2.4 1,-0.3 3,-0.3 0.915 113.6 48.7 -60.7 -43.5 8.2 91.4 38.1 28 29 A K H X S+ 0 0 44 -4,-2.4 4,-2.9 -5,-0.3 -1,-0.3 0.878 106.9 57.7 -63.5 -33.7 9.6 94.8 39.1 29 30 A L H < S+ 0 0 24 -4,-2.3 12,-0.3 1,-0.2 -1,-0.2 0.835 109.5 44.8 -64.2 -37.8 13.1 93.2 39.3 30 31 A R H >< S+ 0 0 130 -4,-1.8 3,-0.8 -3,-0.3 -2,-0.2 0.903 115.4 47.4 -67.8 -44.9 12.8 92.2 35.7 31 32 A E H 3< S+ 0 0 67 -4,-2.4 2,-0.6 1,-0.3 3,-0.2 0.920 110.9 48.5 -69.2 -41.8 11.4 95.5 34.6 32 33 A D T >< + 0 0 55 -4,-2.9 3,-0.9 1,-0.2 -1,-0.3 -0.191 69.4 133.8 -93.7 52.3 13.9 97.7 36.3 33 34 A D T < + 0 0 86 -3,-0.8 -1,-0.2 -2,-0.6 -2,-0.1 0.483 51.2 78.3 -78.1 -7.4 17.1 95.9 35.2 34 35 A E T 3> + 0 0 51 -3,-0.2 4,-2.9 5,-0.1 5,-0.3 0.773 66.4 124.0 -72.5 -25.7 19.1 99.0 34.1 35 36 A Y H <>>S+ 0 0 48 -3,-0.9 5,-2.9 3,-0.2 4,-0.7 0.089 76.1 3.3 -49.7 136.4 20.0 99.9 37.7 36 37 A D H >45S- 0 0 40 2,-0.2 3,-1.7 1,-0.2 -1,-0.2 0.932 138.7 -45.9 47.5 62.5 23.6 100.2 38.6 37 38 A N H 345S- 0 0 115 1,-0.3 -2,-0.2 -3,-0.3 -1,-0.2 0.919 113.4 -48.9 47.0 60.7 24.9 99.7 35.1 38 39 A Y H 3<5S+ 0 0 164 -4,-2.9 -1,-0.3 1,-0.1 -3,-0.2 0.371 108.9 114.3 64.7 8.1 22.8 96.7 34.4 39 40 A I T <<5S- 0 0 20 -3,-1.7 3,-0.3 -4,-0.7 -3,-0.2 0.902 70.0-149.3 -67.3 -30.9 23.5 94.7 37.7 40 41 A G < - 0 0 9 -5,-2.9 4,-0.3 1,-0.2 -7,-0.2 -0.311 28.2 -66.1 86.7-174.7 19.8 95.3 38.4 41 42 A Y S > S+ 0 0 43 -12,-0.3 4,-1.1 -9,-0.2 -1,-0.2 0.545 103.0 95.0 -96.1 -7.0 18.3 95.7 41.9 42 43 A G H >> S+ 0 0 4 -3,-0.3 4,-2.2 2,-0.2 3,-1.4 0.941 82.1 51.4 -47.8 -65.5 18.8 92.2 43.3 43 44 A P H 3> S+ 0 0 19 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.875 112.3 43.8 -39.2 -58.2 22.1 92.8 45.2 44 45 A V H 3> S+ 0 0 23 -4,-0.3 4,-1.4 2,-0.3 -2,-0.2 0.690 110.7 57.1 -64.3 -25.6 21.0 96.0 47.2 45 46 A L H X S+ 0 0 41 -4,-2.4 4,-3.0 1,-0.2 3,-0.7 0.954 114.7 47.3 -60.7 -52.4 20.8 91.9 55.8 51 52 A H H 3< S+ 0 0 5 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.754 111.5 50.3 -66.6 -23.6 21.2 95.5 57.1 52 53 A T H 3< S+ 0 0 6 -4,-2.7 -1,-0.2 -3,-0.2 3,-0.2 0.721 120.0 37.9 -83.7 -21.6 17.6 95.6 58.6 53 54 A S H X< S+ 0 0 0 -4,-1.5 3,-1.5 -3,-0.7 -2,-0.2 0.822 103.8 69.5 -86.4 -37.3 18.2 92.3 60.3 54 55 A G T 3< S+ 0 0 0 -4,-3.0 -1,-0.1 1,-0.3 -2,-0.1 0.314 77.3 78.9 -75.4 8.0 21.8 92.8 61.3 55 56 A T T 3 S+ 0 0 6 -3,-0.2 -1,-0.3 -5,-0.1 84,-0.1 0.499 71.3 123.4 -86.3 -8.5 21.2 95.5 64.0 56 57 A W < - 0 0 26 -3,-1.5 2,-0.5 7,-0.2 7,-0.3 -0.183 48.2-158.9 -60.4 143.8 20.1 92.8 66.5 57 58 A D B >> -B 62 0B 31 5,-2.5 4,-1.7 103,-0.1 5,-0.6 -0.987 6.1-158.0-119.9 119.8 21.6 92.2 69.8 58 59 A K T 45S+ 0 0 83 101,-1.9 102,-0.1 -2,-0.5 -1,-0.1 0.596 88.5 64.8 -70.5 -15.5 21.1 88.7 71.2 59 60 A H T 45S+ 0 0 132 100,-0.2 -1,-0.2 1,-0.1 -3,-0.0 0.894 123.9 9.8 -74.9 -41.8 21.7 90.0 74.8 60 61 A D T 45S- 0 0 61 -3,-0.3 -57,-1.6 2,-0.1 -2,-0.2 0.394 94.1-119.6-121.1 8.8 18.7 92.3 74.9 61 62 A N T <5 + 0 0 17 -4,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.767 65.0 141.1 54.3 26.9 16.6 91.4 71.8 62 63 A T B < +B 57 0B 38 -5,-0.6 -5,-2.5 -7,-0.1 -1,-0.2 -0.660 51.6 19.1 -88.0 156.1 16.9 95.0 70.5 63 64 A G S S+ 0 0 15 73,-0.4 3,-0.3 -2,-0.3 -7,-0.2 -0.342 73.2 113.0 79.2-170.5 17.4 95.5 66.7 64 65 A G S S- 0 0 5 1,-0.2 5,-0.4 -13,-0.1 3,-0.3 -0.185 80.4 -65.8 94.8 176.2 16.6 92.9 64.1 65 66 A S S > S+ 0 0 2 206,-0.3 3,-0.6 203,-0.3 43,-0.2 0.449 101.2 94.5 -80.3 -7.7 14.0 92.7 61.3 66 67 A Y T 3 S+ 0 0 20 205,-0.3 38,-0.4 -3,-0.3 64,-0.2 0.904 90.8 27.7 -58.5 -52.8 10.9 92.6 63.5 67 68 A G T 3 S- 0 0 6 -3,-0.3 65,-2.2 62,-0.2 -1,-0.2 0.316 92.3-128.4 -99.7 8.4 9.7 96.1 63.7 68 69 A G X + 0 0 3 -3,-0.6 3,-1.4 63,-0.2 -3,-0.1 0.790 43.1 162.7 46.2 54.9 11.0 97.7 60.4 69 70 A T G > + 0 0 8 -5,-0.4 3,-2.2 1,-0.3 6,-0.4 0.593 54.4 88.2 -82.3 -8.6 12.7 100.7 62.0 70 71 A Y G 3 S+ 0 0 2 1,-0.3 -1,-0.3 5,-0.2 6,-0.2 0.767 75.7 69.8 -54.0 -31.2 14.7 101.4 58.9 71 72 A R G < S+ 0 0 69 -3,-1.4 2,-0.4 4,-0.1 -1,-0.3 0.485 85.4 88.3 -66.0 -8.2 11.7 103.5 57.8 72 73 A F S X> S- 0 0 33 -3,-2.2 4,-2.2 1,-0.1 3,-0.8 -0.871 89.3-118.3 -94.9 136.4 12.7 106.1 60.6 73 74 A K H 3> S+ 0 0 56 -2,-0.4 4,-3.4 1,-0.2 5,-0.2 0.782 106.2 61.4 -34.0 -54.3 15.2 108.8 59.9 74 75 A K H 34 S+ 0 0 83 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.856 115.9 28.4 -39.3 -60.1 17.8 107.6 62.5 75 76 A E H X4 S+ 0 0 5 -3,-0.8 3,-1.6 -6,-0.4 -1,-0.2 0.896 118.7 57.1 -74.7 -48.0 18.5 104.1 61.0 76 77 A F H 3< S+ 0 0 47 -4,-2.2 -2,-0.2 -7,-0.4 -3,-0.2 0.920 111.6 46.2 -45.7 -45.5 17.7 105.2 57.4 77 78 A N T 3< S+ 0 0 106 -4,-3.4 -1,-0.3 -5,-0.3 -2,-0.2 0.417 79.8 126.7 -86.1 3.3 20.4 107.9 57.9 78 79 A D X - 0 0 12 -3,-1.6 3,-1.9 -5,-0.2 4,-0.1 -0.355 65.9-128.5 -54.3 131.8 23.0 105.6 59.5 79 80 A P G > S+ 0 0 100 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 0.852 107.2 61.1 -54.4 -36.6 26.4 106.0 57.5 80 81 A S G 3 S+ 0 0 37 1,-0.3 -2,-0.1 63,-0.1 -3,-0.0 0.614 98.6 58.5 -63.6 -16.0 26.6 102.1 57.1 81 82 A N G X S+ 0 0 1 -3,-1.9 3,-2.5 -6,-0.1 4,-0.4 0.360 72.7 141.5 -95.7 7.9 23.4 102.2 55.3 82 83 A A T < S+ 0 0 30 -3,-2.0 101,-0.1 1,-0.3 -5,-0.0 -0.294 73.6 21.3 -53.8 117.4 24.8 104.6 52.6 83 84 A G T > S+ 0 0 5 99,-0.1 3,-1.8 100,-0.0 4,-0.4 -0.141 92.7 100.1 110.2 -29.3 23.3 103.3 49.4 84 85 A L T <> + 0 0 1 -3,-2.5 4,-2.5 1,-0.3 5,-0.2 0.607 60.7 80.9 -78.9 -2.0 20.2 101.4 50.6 85 86 A Q H 3> S+ 0 0 70 -4,-0.4 4,-1.8 2,-0.2 -1,-0.3 0.705 85.0 64.2 -72.9 -6.5 17.7 104.1 49.9 86 87 A N H <> S+ 0 0 58 -3,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.968 107.1 42.4 -68.6 -52.6 17.8 102.8 46.3 87 88 A G H > S+ 0 0 0 -4,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.907 112.6 52.5 -59.8 -44.5 16.4 99.5 47.6 88 89 A F H X S+ 0 0 69 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.909 110.8 48.2 -61.2 -41.7 13.9 101.4 49.8 89 90 A K H < S+ 0 0 81 -4,-1.8 3,-0.3 2,-0.2 -1,-0.2 0.905 107.8 55.8 -66.1 -34.5 12.7 103.4 46.8 90 91 A F H X S+ 0 0 3 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.936 109.4 46.6 -60.7 -47.1 12.4 100.2 44.8 91 92 A L H X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 3,-0.3 0.771 91.5 84.1 -69.8 -20.7 10.1 98.7 47.4 92 93 A E H X S+ 0 0 49 -4,-1.3 4,-2.0 -3,-0.3 5,-0.2 0.909 88.0 49.5 -55.5 -56.1 7.9 101.8 47.7 93 94 A P H > S+ 0 0 74 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.880 112.8 51.2 -48.7 -40.1 5.5 101.1 44.7 94 95 A I H X S+ 0 0 5 -4,-0.6 4,-1.6 -3,-0.3 -2,-0.2 0.954 106.9 49.8 -66.1 -47.7 5.1 97.6 46.1 95 96 A H H < S+ 0 0 50 -4,-2.3 -1,-0.2 1,-0.2 6,-0.2 0.871 110.8 52.8 -61.4 -29.6 4.2 98.7 49.6 96 97 A K H < S+ 0 0 76 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.899 109.5 47.3 -76.3 -32.8 1.6 101.1 48.1 97 98 A E H < S+ 0 0 133 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.690 126.8 29.9 -76.0 -23.2 -0.0 98.3 46.1 98 99 A F >< + 0 0 17 -4,-1.6 3,-1.0 -5,-0.2 -1,-0.3 -0.691 69.5 165.9-132.8 82.6 -0.1 96.1 49.2 99 100 A P T 3 + 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.712 68.3 72.9 -75.8 -14.0 -0.4 98.6 52.0 100 101 A W T 3 S+ 0 0 53 -3,-0.1 2,-0.2 -4,-0.1 -89,-0.1 0.684 74.1 89.7 -71.6 -28.2 -1.3 95.7 54.3 101 102 A I S < S- 0 0 4 -3,-1.0 2,-0.1 -6,-0.2 -3,-0.1 -0.511 79.9-116.4 -74.3 148.3 2.2 94.1 54.6 102 103 A S > - 0 0 14 -2,-0.2 4,-2.4 27,-0.2 5,-0.2 -0.429 22.9-110.9 -78.3 157.0 4.4 95.3 57.5 103 104 A S H > S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.803 115.7 46.1 -53.9 -34.6 7.7 97.0 56.9 104 105 A G H > S+ 0 0 2 -38,-0.4 4,-2.5 2,-0.2 5,-0.2 0.809 111.2 52.6 -85.8 -32.5 9.9 94.2 58.2 105 106 A D H > S+ 0 0 0 24,-0.2 4,-2.7 2,-0.2 5,-0.2 0.917 114.7 43.0 -63.9 -41.8 8.0 91.6 56.2 106 107 A L H X S+ 0 0 2 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.962 115.5 47.5 -67.4 -50.9 8.5 93.7 53.1 107 108 A F H X S+ 0 0 5 -4,-2.6 4,-0.8 1,-0.2 -2,-0.2 0.891 119.8 39.6 -60.8 -37.0 12.2 94.5 53.9 108 109 A S H >X S+ 0 0 0 -4,-2.5 4,-1.2 2,-0.2 3,-0.6 0.931 115.6 49.3 -83.7 -39.7 13.0 90.8 54.6 109 110 A L H 3X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.2 3,-0.3 0.891 102.5 65.3 -62.3 -38.1 10.8 89.3 51.8 110 111 A G H 3X S+ 0 0 1 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.889 104.8 44.2 -43.9 -44.9 12.5 91.7 49.4 111 112 A G H S+ 0 0 0 -4,-2.1 5,-2.6 2,-0.2 3,-0.4 0.942 116.6 44.7 -67.2 -46.6 18.1 85.6 46.0 116 117 A Q H ><5S+ 0 0 6 -4,-2.9 3,-1.9 1,-0.2 4,-0.2 0.970 112.5 51.7 -64.0 -47.8 15.6 83.2 44.5 117 118 A E H 3<5S+ 0 0 45 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.719 105.6 56.4 -57.6 -25.3 15.1 85.4 41.4 118 119 A M T 3<5S- 0 0 14 -4,-1.3 79,-3.1 -3,-0.4 -1,-0.3 0.000 129.0 -97.3 -96.3 27.3 18.9 85.5 40.8 119 120 A Q T < 5S+ 0 0 105 -3,-1.9 -3,-0.2 77,-0.2 -2,-0.2 0.819 80.0 141.4 63.7 30.9 19.0 81.7 40.8 120 121 A G < - 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0 0 40 -2,-0.6 3,-0.5 -26,-0.2 -23,-0.1 -0.910 65.9-101.4-139.1 178.1 26.7 81.3 42.8 199 200 A N T >> S+ 0 0 10 -2,-0.3 4,-1.3 1,-0.2 3,-1.3 0.206 81.0 122.3 -82.6 20.2 29.7 80.2 45.0 200 201 A E H 3> + 0 0 26 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.843 60.4 65.7 -53.4 -38.5 31.9 82.4 42.8 201 202 A F H <> S+ 0 0 2 -3,-0.5 4,-2.0 -29,-0.3 -1,-0.2 0.841 104.1 45.1 -50.2 -39.2 33.1 84.5 45.9 202 203 A Y H <> S+ 0 0 0 -3,-1.3 4,-2.2 2,-0.2 5,-0.2 0.956 112.7 48.9 -73.1 -53.2 34.9 81.4 47.3 203 204 A L H X S+ 0 0 64 -4,-1.3 4,-2.4 1,-0.2 5,-0.4 0.945 114.3 48.1 -51.3 -48.2 36.5 80.4 43.9 204 205 A N H X S+ 0 0 12 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.933 108.6 52.0 -58.5 -47.5 37.7 84.0 43.4 205 206 A L H < S+ 0 0 3 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.896 118.3 38.2 -58.0 -40.7 39.1 84.3 46.9 206 207 A L H < S+ 0 0 59 -4,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.752 126.5 31.2 -80.9 -27.9 41.1 81.1 46.5 207 208 A N H < S+ 0 0 115 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.735 95.6 85.2-110.3 -24.9 42.2 81.4 42.9 208 209 A E S < S- 0 0 47 -4,-2.4 2,-0.8 -5,-0.4 16,-0.0 -0.400 79.2-120.6 -72.4 161.8 42.6 85.1 42.0 209 210 A D - 0 0 101 -2,-0.1 16,-0.5 2,-0.0 2,-0.3 -0.877 34.8-155.7-105.1 105.9 46.0 86.7 42.8 210 211 A W - 0 0 26 -2,-0.8 2,-0.4 -5,-0.2 14,-0.2 -0.619 9.8-163.3 -86.6 145.9 45.1 89.5 45.2 211 212 A K E -E 223 0E 53 12,-2.2 12,-3.1 -2,-0.3 2,-0.7 -0.986 21.4-127.0-126.9 134.2 47.2 92.6 45.7 212 213 A L E +E 222 0E 81 -2,-0.4 2,-0.3 10,-0.2 10,-0.2 -0.690 47.0 156.7 -76.6 113.9 46.9 94.9 48.7 213 214 A E E -E 221 0E 92 8,-2.6 8,-2.3 -2,-0.7 2,-0.3 -0.894 40.6-115.4-138.3 158.2 46.5 98.3 47.2 214 215 A K E -E 220 0E 134 -2,-0.3 6,-0.2 6,-0.2 2,-0.2 -0.773 28.2-143.2-101.2 146.6 45.0 101.6 48.3 215 216 A N > - 0 0 20 4,-2.5 3,-2.3 -2,-0.3 4,-0.1 -0.586 33.0 -92.4-102.7 170.7 41.9 103.1 46.5 216 217 A D T 3 S+ 0 0 164 1,-0.3 -30,-0.1 -2,-0.2 -2,-0.0 0.593 127.4 57.5 -63.5 -19.9 41.0 106.7 45.7 217 218 A A T 3 S- 0 0 41 -32,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.175 121.7-115.5 -92.1 15.3 39.1 107.0 49.0 218 219 A N S < S+ 0 0 70 -3,-2.3 2,-0.3 1,-0.2 -2,-0.2 0.535 74.2 126.3 58.3 29.8 42.5 106.1 50.5 219 220 A N - 0 0 62 -34,-0.3 -4,-2.5 -4,-0.1 2,-0.3 -0.716 60.0-115.3-110.6 147.7 41.4 102.8 51.9 220 221 A E E +E 214 0E 96 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.631 38.8 162.1 -83.3 146.2 43.1 99.6 51.3 221 222 A Q E -E 213 0E 5 -8,-2.3 -8,-2.6 -2,-0.3 2,-0.5 -0.922 42.4-100.9-152.1 158.8 41.4 96.8 49.5 222 223 A W E -EF 212 230E 42 8,-2.8 8,-2.4 -2,-0.3 2,-0.3 -0.830 39.6-162.0 -89.0 123.5 42.6 93.6 47.8 223 224 A D E -EF 211 229E 31 -12,-3.1 -12,-2.2 -2,-0.5 2,-0.3 -0.839 7.2-155.3-116.2 137.1 42.7 93.8 44.0 224 225 A S > - 0 0 11 4,-2.5 3,-2.0 -2,-0.3 4,-0.2 -0.833 28.0-119.9-103.4 151.2 42.8 91.1 41.2 225 226 A K T 3 S+ 0 0 107 -16,-0.5 -1,-0.1 -2,-0.3 -15,-0.1 0.838 112.0 63.2 -51.3 -39.4 44.2 91.5 37.7 226 227 A S T 3 S- 0 0 67 1,-0.1 -1,-0.3 2,-0.0 -18,-0.0 0.260 125.9 -96.7 -73.9 3.9 40.9 90.6 36.3 227 228 A G S < S+ 0 0 50 -3,-2.0 2,-0.2 1,-0.3 -2,-0.2 0.636 82.1 129.2 93.4 13.4 39.2 93.7 37.9 228 229 A Y - 0 0 41 -4,-0.2 -4,-2.5 -38,-0.1 2,-0.3 -0.631 37.3-159.9 -96.7 159.6 37.9 92.2 41.0 229 230 A M E -F 223 0E 1 -40,-2.6 2,-0.4 -6,-0.2 -6,-0.2 -0.977 9.4-158.2-140.7 151.4 38.3 93.3 44.7 230 231 A M E -F 222 0E 0 -8,-2.4 -8,-2.8 -2,-0.3 -40,-0.0 -0.967 22.5-127.6-121.1 143.2 38.0 91.9 48.3 231 232 A L >> - 0 0 16 -2,-0.4 4,-2.7 -10,-0.2 3,-0.9 -0.616 33.0-107.7 -75.5 156.0 37.4 94.0 51.4 232 233 A P H 3> S+ 0 0 25 0, 0.0 4,-2.2 0, 0.0 -85,-0.2 0.903 124.3 52.6 -53.3 -37.3 40.0 93.4 54.3 233 234 A T H 34 S+ 0 0 13 -87,-1.9 4,-0.5 1,-0.2 -86,-0.1 0.810 110.2 48.7 -68.3 -31.4 37.1 91.5 56.2 234 235 A D H X4 S+ 0 0 0 -3,-0.9 3,-0.7 -88,-0.2 -1,-0.2 0.846 110.6 49.7 -71.0 -41.6 36.6 89.4 53.1 235 236 A Y H >X S+ 0 0 43 -4,-2.7 3,-2.5 1,-0.2 4,-0.9 0.895 95.9 70.1 -69.6 -34.4 40.2 88.6 52.7 236 237 A S H >X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.3 3,-0.6 0.813 82.2 76.5 -55.2 -24.4 40.5 87.6 56.4 237 238 A L H <4 S+ 0 0 0 -3,-0.7 10,-0.3 -4,-0.5 -1,-0.3 0.619 102.2 38.3 -64.4 -11.1 38.4 84.4 55.6 238 239 A I H <4 S+ 0 0 34 -3,-2.5 -1,-0.3 -4,-0.1 -2,-0.2 0.562 110.8 59.7-109.2 -15.2 41.5 82.9 54.0 239 240 A Q H << S+ 0 0 110 -4,-0.9 -2,-0.2 -3,-0.6 -3,-0.1 0.846 96.2 70.5 -77.0 -37.1 43.9 84.3 56.5 240 241 A D S X S- 0 0 25 -4,-2.2 4,-3.0 1,-0.1 3,-0.3 -0.737 76.5-143.0 -85.6 131.1 42.2 82.4 59.4 241 242 A P H > S+ 0 0 101 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.868 99.5 50.7 -59.9 -38.2 42.6 78.6 59.5 242 243 A K H > S+ 0 0 44 1,-0.2 4,-0.5 2,-0.2 -5,-0.1 0.934 117.2 39.7 -71.6 -36.1 39.0 78.0 60.8 243 244 A Y H >> S+ 0 0 0 -3,-0.3 4,-2.6 1,-0.2 3,-1.4 0.929 107.9 61.7 -76.4 -45.2 37.4 80.1 58.0 244 245 A L H 3X S+ 0 0 55 -4,-3.0 4,-2.2 1,-0.3 -1,-0.2 0.849 100.6 55.7 -49.7 -39.5 39.8 79.0 55.2 245 246 A S H 3X S+ 0 0 80 -4,-1.4 4,-0.6 -5,-0.2 -1,-0.3 0.819 110.0 43.7 -61.0 -34.5 38.6 75.4 55.6 246 247 A I H < S+ 0 0 69 -4,-0.6 3,-0.7 2,-0.2 -1,-0.2 0.934 111.1 41.5 -80.0 -47.9 34.5 73.7 51.2 250 251 A Y H >< S+ 0 0 0 -4,-2.3 3,-0.8 1,-0.2 7,-0.2 0.807 108.8 62.2 -72.2 -28.0 32.1 76.0 49.5 251 252 A A H 3< S+ 0 0 8 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.726 112.6 36.2 -57.2 -34.0 34.6 76.5 46.7 252 253 A N T << S+ 0 0 136 -3,-0.7 -1,-0.2 -4,-0.6 -2,-0.2 0.255 118.6 46.0-110.4 13.1 34.3 72.8 45.9 253 254 A D <> - 0 0 73 -3,-0.8 4,-1.8 -4,-0.2 3,-0.3 -0.639 55.2-175.8-156.9 95.3 30.6 72.0 46.6 254 255 A Q H > S+ 0 0 136 1,-0.2 4,-1.6 -2,-0.2 -1,-0.1 0.823 84.5 53.0 -62.2 -32.4 28.0 74.4 45.2 255 256 A D H > S+ 0 0 98 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.817 103.7 54.1 -77.8 -35.4 25.1 72.7 46.8 256 257 A K H > S+ 0 0 57 -3,-0.3 4,-2.8 2,-0.2 5,-0.2 0.935 110.0 50.0 -57.0 -50.4 26.5 72.7 50.4 257 258 A F H X S+ 0 0 0 -4,-1.8 4,-2.3 -7,-0.2 5,-0.3 0.868 111.1 48.9 -57.4 -41.2 26.9 76.5 50.0 258 259 A F H X S+ 0 0 50 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.962 113.4 45.9 -64.4 -45.4 23.3 76.8 48.8 259 260 A K H X S+ 0 0 96 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.939 116.3 43.1 -61.9 -53.9 21.9 74.8 51.6 260 261 A D H X S+ 0 0 26 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.908 111.9 53.5 -63.7 -43.3 23.9 76.5 54.4 261 262 A F H X S+ 0 0 1 -4,-2.3 4,-3.3 -5,-0.2 5,-0.4 0.937 107.8 52.2 -56.1 -47.9 23.4 80.0 53.1 262 263 A S H X S+ 0 0 18 -4,-2.2 4,-2.6 -5,-0.3 5,-0.2 0.932 113.2 43.5 -57.5 -46.9 19.6 79.3 53.0 263 264 A K H X S+ 0 0 79 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.985 117.9 44.0 -58.2 -54.5 19.6 78.2 56.7 264 265 A A H X S+ 0 0 2 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.890 115.5 47.3 -61.4 -39.0 21.9 81.0 57.9 265 266 A F H X S+ 0 0 4 -4,-3.3 4,-1.5 -5,-0.3 -1,-0.2 0.925 111.9 51.5 -78.5 -35.0 20.0 83.7 55.9 266 267 A E H X S+ 0 0 30 -4,-2.6 4,-0.8 -5,-0.4 3,-0.5 0.981 112.2 47.2 -61.7 -43.2 16.7 82.4 57.2 267 268 A K H >X S+ 0 0 54 -4,-2.9 4,-1.4 1,-0.3 3,-0.9 0.892 108.9 52.6 -61.8 -43.2 18.1 82.6 60.7 268 269 A L H 3< S+ 0 0 2 -4,-2.3 -203,-0.3 1,-0.3 -1,-0.3 0.833 111.0 47.4 -64.2 -32.4 19.5 86.1 60.4 269 270 A L H 3< S+ 0 0 3 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.583 116.1 45.3 -87.4 -12.2 16.1 87.4 59.1 270 271 A E H X< S+ 0 0 38 -3,-0.9 3,-2.6 -4,-0.8 -2,-0.2 0.448 80.0 127.3-101.0 -17.3 14.2 85.6 62.0 271 272 A D T 3< S+ 0 0 18 -4,-1.4 -206,-0.3 1,-0.3 -205,-0.3 -0.136 76.0 18.2 -45.7 131.5 16.5 86.5 64.9 272 273 A G T 3 S+ 0 0 16 1,-0.2 -267,-0.6 -208,-0.1 2,-0.6 0.282 97.5 116.5 89.3 -9.4 14.6 88.1 67.7 273 274 A I E < -a 5 0A 15 -3,-2.6 2,-0.5 -269,-0.1 -267,-0.2 -0.770 50.8-152.9-102.6 123.3 11.2 86.8 66.7 274 275 A T E -a 6 0A 72 -269,-3.6 -267,-2.7 -2,-0.6 -3,-0.0 -0.747 11.8-158.2 -85.3 128.8 9.0 84.5 68.7 275 276 A F - 0 0 41 -2,-0.5 -267,-0.1 -269,-0.2 -269,-0.0 -0.915 17.0-128.6-106.4 124.5 6.6 82.4 66.5 276 277 A P > - 0 0 52 0, 0.0 3,-1.7 0, 0.0 -268,-0.0 -0.328 21.9-116.4 -55.5 150.7 3.6 81.0 68.4 277 278 A K T 3 S+ 0 0 115 1,-0.3 -2,-0.0 -2,-0.0 0, 0.0 0.683 119.2 56.3 -66.9 -20.3 3.0 77.2 67.9 278 279 A D T 3 S+ 0 0 123 2,-0.0 -1,-0.3 0, 0.0 -3,-0.0 0.393 84.9 109.0 -76.7 -14.5 -0.2 78.1 66.2 279 280 A A S < S- 0 0 29 -3,-1.7 -4,-0.1 1,-0.1 -151,-0.0 -0.411 79.7 -96.9 -66.7 142.5 1.7 80.3 63.7 280 281 A P - 0 0 64 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.136 39.8 -94.7 -56.1 155.7 1.8 78.9 60.1 281 282 A S - 0 0 94 1,-0.2 -156,-0.1 -155,-0.1 0, 0.0 -0.369 56.4 -82.6 -61.1 148.7 4.7 76.9 58.6 282 283 A P - 0 0 51 0, 0.0 2,-0.3 0, 0.0 -156,-0.3 -0.152 47.9-120.9 -48.8 143.8 7.3 78.9 56.7 283 284 A F B -C 125 0C 27 -158,-3.9 -158,-2.1 -3,-0.1 2,-0.5 -0.684 15.7-158.1 -85.5 147.7 6.4 79.7 53.0 284 285 A I - 0 0 78 -2,-0.3 2,-0.4 -160,-0.2 -162,-0.0 -0.985 21.9-148.4-118.9 115.6 8.6 78.5 50.0 285 286 A F - 0 0 0 -2,-0.5 2,-0.1 -162,-0.3 -162,-0.1 -0.682 8.0-125.9 -91.8 138.0 7.8 80.7 47.0 286 287 A K - 0 0 90 -2,-0.4 2,-0.2 1,-0.1 3,-0.0 -0.438 26.5-125.5 -67.2 142.0 7.8 79.8 43.4 287 288 A T >> - 0 0 18 -2,-0.1 4,-1.2 1,-0.1 3,-0.6 -0.563 28.2-105.4 -75.8 166.2 10.0 82.0 41.2 288 289 A L H >>>S+ 0 0 0 1,-0.3 5,-2.0 2,-0.2 3,-1.1 0.968 124.8 57.1 -60.2 -45.5 8.3 83.6 38.1 289 290 A E H 345S+ 0 0 167 1,-0.3 3,-0.3 4,-0.2 -1,-0.3 0.810 106.3 47.3 -55.0 -33.1 10.2 81.0 36.0 290 291 A E H <45S+ 0 0 99 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.692 114.3 48.7 -81.1 -14.8 8.5 78.2 38.1 291 292 A Q H <<5S- 0 0 61 -4,-1.2 -2,-0.2 -3,-1.1 -1,-0.2 0.413 113.2-120.4 -95.1 -2.5 5.2 79.9 37.5 292 293 A G T <5 0 0 67 -4,-0.8 -3,-0.2 -3,-0.3 -4,-0.1 0.944 360.0 360.0 59.7 41.7 5.8 80.3 33.8 293 294 A L < 0 0 99 -5,-2.0 -4,-0.2 -6,-0.1 -5,-0.1 0.356 360.0 360.0-116.5 360.0 5.6 84.1 34.3