==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 29-OCT-05 2EUN . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR R.BRENK,S.W.VETTER,S.E.BOYCE,D.B.GOODIN,B.K.SHOICHET . 292 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13311.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 62.7 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 . 9 3.1 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 35.3 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 0 2 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 3 A T 0 0 202 0, 0.0 2,-0.6 0, 0.0 58,-0.1 0.000 360.0 360.0 360.0 -13.6 -10.6 100.6 37.6 2 4 A L - 0 0 88 57,-0.1 2,-0.4 2,-0.0 0, 0.0 -0.845 360.0-178.5-103.1 120.2 -11.1 96.8 38.4 3 5 A V - 0 0 92 -2,-0.6 2,-0.6 2,-0.0 269,-0.1 -0.913 18.7-162.5-127.1 135.4 -8.0 95.1 39.8 4 6 A H E -a 272 0A 31 267,-0.6 269,-3.0 -2,-0.4 2,-0.5 -0.935 14.5-161.4-119.4 108.9 -7.4 91.5 40.9 5 7 A V E -a 273 0A 67 -2,-0.6 269,-0.2 267,-0.2 267,-0.1 -0.777 24.4-114.3 -96.1 128.9 -4.4 91.1 43.1 6 8 A A - 0 0 12 267,-2.5 2,-0.4 -2,-0.5 122,-0.2 -0.310 32.4-169.9 -57.9 135.3 -2.8 87.7 43.4 7 9 A S - 0 0 73 120,-2.5 120,-0.2 267,-0.1 3,-0.1 -0.941 20.8-128.8-138.2 104.3 -3.2 86.4 47.0 8 10 A V - 0 0 55 -2,-0.4 3,-0.2 118,-0.1 121,-0.0 -0.321 34.7 -99.7 -54.9 129.9 -1.3 83.3 47.9 9 11 A E > - 0 0 19 1,-0.2 3,-2.2 2,-0.1 -1,-0.1 -0.249 62.4 -84.3 -54.0 129.4 -3.5 80.6 49.5 10 12 A K T 3 S- 0 0 202 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 -0.134 104.4 -6.2 -59.3 124.5 -2.6 81.1 53.2 11 13 A G T 3 S+ 0 0 77 1,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.467 98.5 131.3 76.2 10.8 0.5 79.3 54.3 12 14 A R < + 0 0 92 -3,-2.2 -1,-0.2 87,-0.1 2,-0.2 -0.621 29.4 178.0 -97.9 148.6 1.1 77.4 51.0 13 15 A S >> - 0 0 53 -2,-0.2 4,-1.6 -5,-0.0 3,-0.7 -0.738 49.8 -72.8-133.2-177.9 4.4 77.2 49.1 14 16 A Y H 3> S+ 0 0 59 1,-0.2 4,-2.7 -2,-0.2 3,-0.3 0.879 125.7 57.8 -44.6 -51.2 5.9 75.6 46.0 15 17 A E H 3> S+ 0 0 115 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.834 103.9 51.6 -60.4 -39.9 5.9 72.1 47.6 16 18 A D H <> S+ 0 0 36 -3,-0.7 4,-1.4 2,-0.2 -1,-0.3 0.895 111.5 47.4 -57.5 -46.4 2.1 72.2 48.3 17 19 A F H X S+ 0 0 0 -4,-1.6 4,-2.6 -3,-0.3 -2,-0.2 0.892 105.7 58.2 -68.7 -35.5 1.4 73.1 44.7 18 20 A Q H X S+ 0 0 12 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.836 102.4 56.4 -58.0 -34.7 3.7 70.4 43.5 19 21 A K H X S+ 0 0 124 -4,-1.3 4,-2.1 -5,-0.2 -1,-0.2 0.905 107.8 46.6 -63.9 -38.5 1.5 68.0 45.4 20 22 A V H X S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 5,-0.2 0.943 111.2 50.9 -66.6 -46.6 -1.5 69.2 43.5 21 23 A Y H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.933 109.8 52.0 -54.8 -49.3 0.3 68.9 40.1 22 24 A N H X S+ 0 0 20 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.888 107.8 51.4 -58.9 -38.4 1.4 65.4 41.1 23 25 A A H X S+ 0 0 14 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.944 111.5 46.4 -61.3 -47.2 -2.2 64.4 41.8 24 26 A I H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.931 114.0 49.3 -59.0 -47.6 -3.4 65.7 38.5 25 27 A A H X S+ 0 0 1 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.872 109.3 50.3 -66.1 -38.3 -0.6 64.0 36.7 26 28 A L H X S+ 0 0 75 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.886 112.3 48.1 -67.5 -33.5 -1.1 60.6 38.4 27 29 A K H X S+ 0 0 49 -4,-2.0 4,-2.7 -5,-0.2 -2,-0.2 0.903 108.1 53.7 -75.2 -39.1 -4.8 60.8 37.5 28 30 A L H < S+ 0 0 23 -4,-2.5 12,-0.3 1,-0.2 -2,-0.2 0.888 111.3 48.0 -53.9 -42.4 -3.9 61.7 33.8 29 31 A R H < S+ 0 0 135 -4,-2.0 3,-0.3 -5,-0.2 -2,-0.2 0.869 115.1 45.4 -68.5 -36.7 -1.7 58.6 33.8 30 32 A E H < S+ 0 0 136 -4,-1.9 2,-1.6 1,-0.2 3,-0.2 0.914 105.4 57.9 -74.3 -39.8 -4.5 56.4 35.3 31 33 A D >< + 0 0 43 -4,-2.7 3,-0.5 1,-0.2 9,-0.5 -0.409 64.1 139.8 -97.1 61.5 -7.5 57.6 33.2 32 34 A D T 3 + 0 0 85 -2,-1.6 -1,-0.2 -3,-0.3 -2,-0.1 0.503 54.1 69.6 -86.7 -5.9 -6.0 56.7 29.8 33 35 A E T 3> + 0 0 116 -3,-0.2 4,-2.2 4,-0.1 3,-0.3 0.730 69.4 119.5 -84.9 -19.8 -9.2 55.2 28.2 34 36 A Y H <>>S+ 0 0 45 -3,-0.5 5,-2.4 2,-0.2 4,-1.3 -0.035 79.5 5.6 -57.3 139.6 -11.0 58.5 27.9 35 37 A D H >45S- 0 0 44 1,-0.2 3,-1.1 2,-0.2 -1,-0.2 0.953 139.5 -44.8 55.0 57.9 -12.0 59.7 24.4 36 38 A N H 345S- 0 0 143 1,-0.3 -1,-0.2 -3,-0.3 -2,-0.2 0.910 115.3 -49.8 55.4 45.9 -10.9 56.6 22.5 37 39 A Y H 3<5S+ 0 0 132 -4,-2.2 -1,-0.3 1,-0.1 -2,-0.2 0.644 109.0 117.8 68.1 21.0 -7.6 56.4 24.5 38 40 A I T <<5 - 0 0 13 -4,-1.3 3,-0.3 -3,-1.1 -3,-0.2 0.895 65.6-146.0 -72.4 -40.7 -6.5 60.1 24.0 39 41 A G < - 0 0 8 -5,-2.4 4,-0.4 1,-0.1 -7,-0.2 -0.288 28.9 -70.3 93.1 177.6 -6.7 60.7 27.7 40 42 A Y S > S+ 0 0 38 -9,-0.5 4,-2.0 -12,-0.3 5,-0.2 0.465 102.5 97.7 -85.5 -2.1 -7.7 63.8 29.6 41 43 A G H > S+ 0 0 5 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.932 84.2 44.8 -55.6 -57.5 -4.7 65.9 28.7 42 44 A P H > S+ 0 0 16 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.928 112.0 49.8 -56.2 -46.2 -6.2 67.8 25.7 43 45 A V H > S+ 0 0 16 -4,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.835 108.5 55.9 -63.0 -32.3 -9.5 68.6 27.4 44 46 A L H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.864 108.3 47.3 -67.9 -37.8 -7.6 69.9 30.5 45 47 A V H X S+ 0 0 8 -4,-1.7 4,-1.9 -5,-0.2 -2,-0.2 0.916 111.1 50.0 -68.8 -39.3 -5.7 72.3 28.2 46 48 A R H X S+ 0 0 68 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.883 110.0 53.6 -60.3 -38.0 -8.8 73.5 26.5 47 49 A L H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.958 107.0 48.8 -62.7 -46.3 -10.3 74.0 30.0 48 50 A A H X S+ 0 0 0 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.871 114.6 47.1 -62.2 -36.1 -7.5 76.2 31.1 49 51 A W H X S+ 0 0 42 -4,-1.9 4,-3.0 2,-0.2 3,-0.4 0.932 111.8 49.1 -67.9 -47.2 -7.8 78.2 27.9 50 52 A H H < S+ 0 0 15 -4,-3.0 4,-0.3 1,-0.2 -2,-0.2 0.822 110.2 49.7 -70.6 -29.3 -11.6 78.6 28.1 51 53 A I H < S+ 0 0 4 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.759 120.2 38.3 -73.6 -23.0 -11.5 79.8 31.7 52 54 A S H >< S+ 0 0 0 -4,-0.8 3,-1.4 -3,-0.4 -2,-0.2 0.788 104.1 69.0 -92.1 -35.0 -8.8 82.3 30.8 53 55 A G T 3< S+ 0 0 0 -4,-3.0 -1,-0.1 1,-0.3 -3,-0.1 0.423 78.6 77.6 -73.5 0.6 -10.1 83.3 27.4 54 56 A T T 3 S+ 0 0 3 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.460 72.6 123.0 -79.3 -2.8 -13.2 85.1 28.8 55 57 A W < - 0 0 24 -3,-1.4 2,-0.4 7,-0.2 7,-0.2 -0.302 48.1-161.7 -65.9 144.5 -11.0 88.0 29.6 56 58 A D B >>> -B 61 0B 34 5,-2.0 4,-1.8 1,-0.1 3,-1.1 -0.966 6.2-159.3-126.5 109.7 -11.5 91.5 28.3 57 59 A K T 345S+ 0 0 71 101,-2.1 -1,-0.1 -2,-0.4 102,-0.1 0.697 86.7 67.1 -60.0 -22.3 -8.4 93.7 28.6 58 60 A H T 345S+ 0 0 150 100,-0.2 -1,-0.2 1,-0.2 -3,-0.0 0.808 123.9 5.5 -72.3 -36.1 -10.5 96.9 28.4 59 61 A D T <45S- 0 0 81 -3,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.327 95.4-116.5-132.7 9.4 -12.3 96.4 31.8 60 62 A N T <5 + 0 0 20 -4,-1.8 -3,-0.2 1,-0.2 2,-0.1 0.713 62.3 148.7 53.5 27.4 -10.7 93.4 33.4 61 63 A T B < +B 56 0B 42 -5,-0.6 -5,-2.0 -7,-0.0 -1,-0.2 -0.461 52.5 8.2 -78.9 161.6 -13.9 91.4 33.3 62 64 A G S S+ 0 0 11 73,-0.5 -7,-0.2 -7,-0.2 3,-0.2 -0.275 75.1 125.3 66.4-157.4 -13.7 87.6 32.9 63 65 A G S S- 0 0 2 1,-0.2 3,-0.4 -13,-0.2 5,-0.3 -0.154 75.1 -71.6 90.1 174.2 -10.3 85.9 33.0 64 66 A S S > S+ 0 0 2 206,-0.5 3,-1.1 203,-0.3 -1,-0.2 0.626 106.1 87.2 -79.4 -15.3 -9.0 83.0 35.2 65 67 A Y T 3 S+ 0 0 23 205,-0.4 38,-0.4 1,-0.3 64,-0.3 0.860 87.9 44.3 -59.0 -45.5 -8.7 84.8 38.4 66 68 A G T 3 S- 0 0 5 -3,-0.4 65,-2.1 -4,-0.2 -1,-0.3 0.488 91.2-134.9 -82.0 -10.9 -12.2 84.3 39.8 67 69 A G X + 0 0 3 -3,-1.1 3,-1.5 63,-0.2 -3,-0.1 0.792 47.5 156.5 58.3 37.9 -12.7 80.7 39.0 68 70 A T G > + 0 0 6 -5,-0.3 3,-2.0 1,-0.3 6,-0.4 0.533 48.5 85.7 -77.0 -10.0 -16.1 81.5 37.7 69 71 A Y G 3 S+ 0 0 0 1,-0.3 -1,-0.3 5,-0.2 6,-0.2 0.700 75.7 73.5 -65.9 -17.2 -16.4 78.5 35.5 70 72 A R G < S+ 0 0 77 -3,-1.5 2,-0.3 4,-0.1 -1,-0.3 0.671 84.5 85.7 -63.6 -18.4 -17.7 76.7 38.6 71 73 A F S X> S- 0 0 33 -3,-2.0 4,-2.9 1,-0.1 3,-0.7 -0.691 87.1-121.9 -90.4 144.6 -21.0 78.7 38.1 72 74 A K H 3> S+ 0 0 143 -2,-0.3 4,-2.5 1,-0.2 -1,-0.1 0.791 105.7 61.4 -57.6 -36.0 -23.7 77.4 35.8 73 75 A K H 34 S+ 0 0 84 1,-0.2 -1,-0.2 2,-0.2 -4,-0.1 0.930 117.9 31.4 -55.1 -49.3 -23.9 80.4 33.5 74 76 A E H X4 S+ 0 0 3 -3,-0.7 3,-2.1 -6,-0.4 -2,-0.2 0.919 117.1 54.8 -73.9 -49.4 -20.3 79.8 32.5 75 77 A F H 3< S+ 0 0 50 -4,-2.9 -2,-0.2 -7,-0.3 -3,-0.2 0.858 112.5 47.0 -51.0 -37.4 -20.3 75.9 32.9 76 78 A N T 3< S+ 0 0 100 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.285 78.6 130.0 -92.8 7.0 -23.3 75.8 30.5 77 79 A D X - 0 0 9 -3,-2.1 3,-1.8 1,-0.2 4,-0.1 -0.502 62.7-133.3 -57.6 128.7 -21.8 78.2 27.8 78 80 A P G > S+ 0 0 96 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.817 107.3 62.8 -48.2 -35.7 -22.2 76.4 24.4 79 81 A S G 3 S+ 0 0 36 1,-0.3 -2,-0.1 63,-0.1 -3,-0.0 0.682 102.3 50.5 -65.9 -23.2 -18.6 77.4 23.7 80 82 A N G X S+ 0 0 0 -3,-1.8 3,-2.5 -6,-0.2 4,-0.4 0.241 75.5 141.5 -94.9 9.8 -17.6 75.2 26.7 81 83 A A T < S+ 0 0 25 -3,-1.6 -5,-0.1 101,-0.3 101,-0.0 -0.380 73.1 23.5 -59.0 128.1 -19.6 72.1 25.6 82 84 A G T > S+ 0 0 5 -2,-0.1 3,-1.3 99,-0.1 4,-0.5 0.001 93.6 99.2 102.4 -21.3 -17.4 69.0 26.5 83 85 A L T X> + 0 0 0 -3,-2.5 4,-2.1 1,-0.3 3,-0.8 0.753 62.2 80.5 -76.4 -20.2 -15.4 70.8 29.2 84 86 A Q H 3> S+ 0 0 54 -4,-0.4 4,-2.6 1,-0.2 -1,-0.3 0.799 86.2 61.4 -50.6 -31.7 -17.6 69.2 32.0 85 87 A N H <> S+ 0 0 61 -3,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.925 105.2 45.5 -62.1 -43.0 -15.4 66.1 31.5 86 88 A G H <> S+ 0 0 0 -3,-0.8 4,-2.1 -4,-0.5 -2,-0.2 0.904 111.8 51.5 -64.0 -42.7 -12.4 68.1 32.5 87 89 A F H X S+ 0 0 47 -4,-2.1 4,-1.0 1,-0.2 -2,-0.2 0.946 110.7 48.2 -62.6 -44.4 -14.2 69.7 35.5 88 90 A K H < S+ 0 0 128 -4,-2.6 3,-0.4 1,-0.2 -1,-0.2 0.857 108.5 54.9 -62.6 -39.7 -15.3 66.2 36.7 89 91 A F H < S+ 0 0 3 -4,-1.9 4,-0.4 1,-0.2 -1,-0.2 0.920 110.4 45.8 -55.7 -45.5 -11.7 64.9 36.3 90 92 A L H X S+ 0 0 3 -4,-2.1 4,-2.4 1,-0.2 3,-0.4 0.640 91.2 87.3 -75.4 -16.9 -10.5 67.7 38.5 91 93 A E H X S+ 0 0 107 -4,-1.0 4,-2.2 -3,-0.4 -1,-0.2 0.915 88.9 44.9 -53.3 -53.4 -13.2 67.2 41.2 92 94 A P H > S+ 0 0 63 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.817 111.8 54.8 -62.2 -29.9 -11.4 64.5 43.3 93 95 A I H > S+ 0 0 4 -4,-0.4 4,-2.2 -3,-0.4 -2,-0.2 0.904 107.4 49.1 -67.8 -44.5 -8.2 66.6 43.1 94 96 A H H < S+ 0 0 48 -4,-2.4 6,-0.2 1,-0.2 -1,-0.2 0.908 109.8 52.9 -64.1 -37.0 -10.1 69.6 44.6 95 97 A K H < S+ 0 0 182 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.874 110.3 46.8 -61.7 -36.7 -11.4 67.2 47.3 96 98 A E H < S+ 0 0 127 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.863 126.6 29.3 -72.3 -36.2 -7.9 66.1 48.2 97 99 A F >< + 0 0 21 -4,-2.2 3,-1.7 1,-0.1 -1,-0.3 -0.594 69.4 163.2-125.2 71.7 -6.6 69.7 48.2 98 100 A P T 3 + 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.653 67.9 71.6 -66.7 -18.4 -9.6 71.8 49.2 99 101 A W T 3 S+ 0 0 58 -3,-0.1 2,-0.1 2,-0.1 -89,-0.1 0.657 78.1 95.8 -71.1 -20.9 -7.4 74.8 50.1 100 102 A I S < S- 0 0 4 -3,-1.7 2,-0.1 -6,-0.2 -3,-0.0 -0.441 79.2-116.8 -75.9 140.9 -6.6 75.5 46.4 101 103 A S > - 0 0 12 27,-0.2 4,-2.4 -2,-0.1 5,-0.2 -0.365 18.8-120.0 -72.4 157.5 -8.6 78.1 44.6 102 104 A S H > S+ 0 0 7 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.927 113.9 49.6 -64.3 -46.5 -10.8 77.1 41.6 103 105 A G H > S+ 0 0 0 -38,-0.4 4,-2.3 2,-0.2 5,-0.3 0.905 112.4 49.1 -58.3 -42.3 -8.9 79.4 39.2 104 106 A D H > S+ 0 0 0 24,-0.3 4,-2.5 1,-0.2 -2,-0.2 0.941 112.3 47.4 -64.1 -42.4 -5.6 78.0 40.4 105 107 A L H X S+ 0 0 1 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.924 113.5 46.7 -64.0 -49.2 -6.8 74.4 40.0 106 108 A F H X S+ 0 0 2 -4,-2.7 4,-1.2 2,-0.2 -58,-0.2 0.937 117.1 43.4 -61.8 -45.7 -8.2 74.9 36.5 107 109 A S H X S+ 0 0 0 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.899 112.6 52.4 -68.2 -37.6 -5.1 76.8 35.2 108 110 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 -5,-0.3 5,-0.2 0.875 102.1 60.9 -69.8 -28.9 -2.8 74.3 36.9 109 111 A G H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.925 104.9 49.3 -60.8 -36.6 -4.6 71.4 35.2 110 112 A G H X S+ 0 0 0 -4,-1.2 4,-2.3 1,-0.2 -1,-0.2 0.931 112.0 46.0 -69.3 -44.0 -3.7 73.0 31.9 111 113 A V H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.933 112.4 52.5 -62.2 -49.2 -0.0 73.3 32.8 112 114 A T H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.946 109.3 49.4 -48.8 -50.8 0.1 69.8 34.2 113 115 A A H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 6,-0.2 0.923 109.5 48.9 -63.1 -46.0 -1.3 68.4 31.1 114 116 A V H <>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 82,-0.3 0.915 115.3 45.3 -58.7 -43.4 1.0 70.1 28.7 115 117 A Q H ><5S+ 0 0 5 -4,-2.3 3,-1.2 1,-0.2 -2,-0.2 0.875 112.1 49.5 -73.7 -38.8 4.0 69.0 30.7 116 118 A E H 3<5S+ 0 0 49 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.737 103.8 61.1 -72.8 -20.2 2.9 65.4 31.2 117 119 A M T 3<5S- 0 0 15 -4,-1.8 79,-3.1 -5,-0.2 -1,-0.3 0.138 127.7-101.7 -85.6 16.0 2.3 65.2 27.4 118 120 A Q T < 5S+ 0 0 139 -3,-1.2 -3,-0.2 77,-0.2 -2,-0.1 0.695 79.7 138.3 75.0 21.7 6.0 65.9 27.1 119 121 A G < - 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