==== 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 2EUR . 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) . 13176.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 63.0 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 . 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 35.3 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 . 3 1 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 . 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 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 0 170 0, 0.0 59,-0.1 0, 0.0 58,-0.1 0.000 360.0 360.0 360.0 90.5 -11.6 99.5 36.3 2 4 A L - 0 0 92 57,-0.5 2,-0.4 1,-0.1 0, 0.0 -0.086 360.0-158.5 -38.0 130.2 -11.5 96.3 38.3 3 5 A V - 0 0 92 2,-0.0 2,-0.6 269,-0.0 269,-0.1 -0.969 3.6-162.5-116.8 135.3 -8.1 95.1 39.6 4 6 A H E -a 272 0A 24 267,-0.6 269,-3.0 -2,-0.4 2,-0.5 -0.946 10.0-162.5-116.7 105.3 -7.4 91.5 40.5 5 7 A V E -a 273 0A 71 -2,-0.6 269,-0.2 267,-0.2 2,-0.1 -0.775 22.7-118.3 -92.0 125.5 -4.4 91.1 42.8 6 8 A A - 0 0 11 267,-2.6 2,-0.4 -2,-0.5 122,-0.2 -0.402 30.7-170.4 -59.4 132.4 -2.8 87.7 43.1 7 9 A S - 0 0 74 120,-2.3 120,-0.2 -2,-0.1 3,-0.1 -0.963 21.9-126.7-132.9 111.4 -3.0 86.4 46.7 8 10 A V - 0 0 54 -2,-0.4 3,-0.2 118,-0.1 121,-0.0 -0.347 36.5 -99.2 -61.0 129.4 -1.0 83.3 47.5 9 11 A E > - 0 0 20 1,-0.2 3,-2.2 2,-0.1 -1,-0.1 -0.306 62.2 -85.4 -49.7 129.7 -3.2 80.6 49.2 10 12 A K T 3 S- 0 0 195 1,-0.3 -1,-0.2 89,-0.1 3,-0.1 -0.142 105.1 -3.6 -59.5 123.5 -2.3 81.1 52.8 11 13 A G T 3 S+ 0 0 76 1,-0.2 2,-0.3 -3,-0.2 -1,-0.3 0.473 99.0 131.1 82.4 4.1 0.8 79.3 54.0 12 14 A R < + 0 0 90 -3,-2.2 -1,-0.2 87,-0.1 2,-0.2 -0.676 29.0 176.2 -97.5 146.9 1.4 77.5 50.6 13 15 A S >> - 0 0 51 -2,-0.3 4,-1.5 -3,-0.1 3,-1.0 -0.718 50.1 -72.9-134.1-178.4 4.7 77.3 48.7 14 16 A Y H 3> S+ 0 0 48 1,-0.3 4,-2.4 -2,-0.2 5,-0.2 0.853 125.5 56.7 -45.7 -46.9 6.1 75.7 45.6 15 17 A E H 3> S+ 0 0 108 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.856 104.1 53.3 -60.1 -38.2 6.2 72.2 47.2 16 18 A D H <> S+ 0 0 35 -3,-1.0 4,-1.2 2,-0.2 -1,-0.2 0.929 111.1 45.2 -62.6 -43.9 2.5 72.3 47.9 17 19 A F H X S+ 0 0 0 -4,-1.5 4,-2.7 1,-0.2 -2,-0.2 0.857 106.8 59.4 -71.9 -31.7 1.6 73.2 44.3 18 20 A Q H X S+ 0 0 11 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.875 102.8 54.2 -62.6 -32.7 4.0 70.5 43.0 19 21 A K H X S+ 0 0 123 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.881 108.6 47.4 -68.4 -36.3 1.9 68.0 45.0 20 22 A V H X S+ 0 0 0 -4,-1.2 4,-2.5 2,-0.2 -2,-0.2 0.948 111.8 50.7 -67.5 -48.5 -1.2 69.2 43.2 21 23 A Y H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.940 110.4 50.6 -47.5 -51.2 0.6 68.9 39.8 22 24 A N H X S+ 0 0 19 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.870 108.0 51.1 -62.9 -39.5 1.7 65.4 40.7 23 25 A A H X S+ 0 0 13 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.934 112.4 46.9 -64.3 -41.1 -1.9 64.3 41.6 24 26 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.934 113.8 48.7 -61.4 -46.8 -3.1 65.7 38.2 25 27 A A H X S+ 0 0 1 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.869 110.1 50.3 -65.1 -38.7 -0.3 63.9 36.4 26 28 A L H X S+ 0 0 76 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.888 111.9 48.1 -67.0 -40.5 -0.9 60.6 38.2 27 29 A K H X S+ 0 0 47 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.895 107.9 55.0 -67.5 -37.4 -4.6 60.7 37.3 28 30 A L H < S+ 0 0 24 -4,-2.5 12,-0.2 1,-0.2 -2,-0.2 0.901 109.8 47.8 -56.7 -44.3 -3.7 61.6 33.7 29 31 A R H < S+ 0 0 134 -4,-1.9 3,-0.4 1,-0.2 -2,-0.2 0.919 115.1 45.2 -63.1 -43.6 -1.5 58.4 33.6 30 32 A E H < S+ 0 0 137 -4,-2.1 2,-1.6 1,-0.2 3,-0.2 0.892 105.5 58.5 -68.1 -42.4 -4.3 56.3 35.1 31 33 A D >< + 0 0 42 -4,-2.7 3,-0.8 1,-0.2 9,-0.4 -0.301 64.5 139.2 -92.8 55.2 -7.3 57.5 33.0 32 34 A D T 3 + 0 0 95 -2,-1.6 -1,-0.2 -3,-0.4 -2,-0.1 0.542 56.3 66.0 -82.1 -6.8 -5.7 56.5 29.7 33 35 A E T 3> S+ 0 0 130 -3,-0.2 4,-2.1 5,-0.1 3,-0.4 0.653 70.1 122.4 -88.9 -16.0 -8.9 55.1 28.0 34 36 A Y H <>>S+ 0 0 43 -3,-0.8 5,-2.6 1,-0.2 4,-1.1 -0.116 79.2 6.5 -55.3 135.7 -10.8 58.4 27.9 35 37 A D H >45S- 0 0 37 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.944 140.8 -45.9 58.1 55.8 -12.0 59.6 24.4 36 38 A N H 345S- 0 0 142 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.910 115.4 -46.3 50.3 50.8 -10.9 56.4 22.6 37 39 A Y H 3<5S+ 0 0 148 -4,-2.1 -1,-0.2 1,-0.1 -3,-0.2 0.592 110.1 114.4 75.6 14.6 -7.5 56.3 24.3 38 40 A I T <<5 - 0 0 14 -4,-1.1 3,-0.3 -3,-0.8 -3,-0.2 0.863 66.3-148.1 -71.7 -38.2 -6.5 59.9 23.9 39 41 A G < - 0 0 7 -5,-2.6 4,-0.4 1,-0.2 -7,-0.1 -0.188 30.6 -69.2 83.0 175.5 -6.6 60.5 27.6 40 42 A Y S > S+ 0 0 40 -9,-0.4 4,-1.9 -12,-0.2 5,-0.2 0.450 102.0 97.7 -84.5 -0.9 -7.6 63.7 29.4 41 43 A G H > S+ 0 0 4 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.948 85.0 44.2 -57.6 -55.8 -4.5 65.8 28.4 42 44 A P H > S+ 0 0 17 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.916 112.1 50.7 -57.7 -44.9 -6.1 67.7 25.5 43 45 A V H > S+ 0 0 19 -4,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.851 108.7 53.5 -65.9 -31.7 -9.4 68.5 27.2 44 46 A L H X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.843 108.4 49.7 -68.1 -36.0 -7.5 69.9 30.2 45 47 A V H X S+ 0 0 8 -4,-1.7 4,-2.1 -5,-0.2 -2,-0.2 0.934 111.9 48.0 -64.9 -46.6 -5.6 72.2 27.9 46 48 A R H X S+ 0 0 97 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.900 110.4 52.8 -60.3 -39.1 -8.8 73.4 26.3 47 49 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.946 108.2 49.3 -62.1 -48.4 -10.4 73.9 29.7 48 50 A A H X S+ 0 0 0 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.895 114.0 47.3 -60.5 -38.7 -7.4 76.1 30.9 49 51 A W H X S+ 0 0 41 -4,-2.1 4,-2.5 2,-0.2 3,-0.4 0.930 111.4 49.5 -67.6 -42.6 -7.8 78.1 27.6 50 52 A H H < S+ 0 0 5 -4,-2.8 4,-0.4 1,-0.2 -2,-0.2 0.848 109.0 51.0 -71.8 -29.0 -11.6 78.5 27.9 51 53 A I H < S+ 0 0 4 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.766 119.5 38.9 -75.8 -22.2 -11.5 79.8 31.5 52 54 A S H >< S+ 0 0 0 -4,-0.9 3,-1.5 -3,-0.4 -2,-0.2 0.759 103.0 69.5 -90.9 -31.9 -8.9 82.3 30.4 53 55 A G T 3< S+ 0 0 0 -4,-2.5 -2,-0.1 1,-0.3 -3,-0.1 0.453 80.5 74.8 -76.0 -6.1 -10.3 83.3 27.0 54 56 A T T 3 S+ 0 0 4 -4,-0.4 -1,-0.3 -5,-0.1 -2,-0.1 0.470 72.1 123.1 -75.1 -8.2 -13.3 85.1 28.4 55 57 A W < - 0 0 27 -3,-1.5 2,-0.5 7,-0.2 7,-0.2 -0.275 46.9-161.2 -60.1 141.5 -11.0 88.0 29.4 56 58 A D B >>> -B 61 0B 30 5,-2.0 4,-1.8 1,-0.1 3,-0.9 -0.967 7.5-158.7-123.4 114.1 -11.7 91.5 28.1 57 59 A K T 345S+ 0 0 75 101,-2.0 -1,-0.1 -2,-0.5 102,-0.1 0.704 86.4 67.6 -61.9 -23.4 -8.7 93.8 28.3 58 60 A H T 345S+ 0 0 133 1,-0.2 -1,-0.2 100,-0.2 100,-0.0 0.833 124.3 5.4 -70.5 -35.6 -11.0 96.9 28.2 59 61 A D T <45S- 0 0 69 -3,-0.9 -57,-0.5 2,-0.1 -2,-0.2 0.325 95.0-117.0-129.9 7.5 -12.6 96.4 31.6 60 62 A N T <5 + 0 0 20 -4,-1.8 2,-0.2 1,-0.2 -3,-0.2 0.767 63.0 146.4 56.8 30.7 -10.8 93.4 33.1 61 63 A T B < +B 56 0B 37 -5,-0.7 -5,-2.0 -7,-0.1 -1,-0.2 -0.579 51.6 10.9 -86.9 162.0 -13.9 91.2 33.2 62 64 A G S S+ 0 0 13 73,-0.5 3,-0.2 -7,-0.2 -7,-0.2 -0.280 73.3 122.6 65.6-156.4 -13.6 87.4 32.7 63 65 A G S S- 0 0 3 -13,-0.2 3,-0.4 1,-0.2 5,-0.3 -0.127 78.1 -69.0 84.6 172.8 -10.2 85.7 32.7 64 66 A S S > S+ 0 0 2 206,-0.4 3,-1.1 203,-0.3 -1,-0.2 0.675 106.5 88.5 -72.0 -21.3 -8.9 82.9 34.9 65 67 A Y T 3 S+ 0 0 21 205,-0.4 38,-0.3 1,-0.3 64,-0.2 0.854 87.3 42.5 -52.7 -48.4 -8.7 84.8 38.1 66 68 A G T 3 S- 0 0 4 -3,-0.4 65,-2.0 -4,-0.2 -1,-0.3 0.504 91.7-133.0 -87.7 -6.7 -12.1 84.3 39.6 67 69 A G X + 0 0 3 -3,-1.1 3,-1.6 -4,-0.2 -2,-0.1 0.805 48.0 156.5 63.9 30.0 -12.7 80.6 38.8 68 70 A T G > + 0 0 5 -5,-0.3 3,-2.3 1,-0.3 6,-0.4 0.574 48.3 87.1 -74.1 -10.8 -16.1 81.4 37.5 69 71 A Y G 3 S+ 0 0 1 1,-0.3 -1,-0.3 5,-0.1 6,-0.1 0.742 77.0 72.5 -56.9 -23.1 -16.4 78.3 35.3 70 72 A R G < S+ 0 0 76 -3,-1.6 2,-0.3 4,-0.1 -1,-0.3 0.638 83.4 85.4 -66.0 -14.0 -17.7 76.6 38.4 71 73 A F S X> S- 0 0 33 -3,-2.3 4,-2.5 1,-0.1 3,-0.9 -0.709 87.5-120.8 -94.4 144.3 -21.0 78.6 38.0 72 74 A K H 3> S+ 0 0 137 -2,-0.3 4,-2.4 1,-0.3 5,-0.1 0.786 106.4 61.9 -56.0 -36.0 -23.8 77.3 35.8 73 75 A K H 34 S+ 0 0 79 1,-0.2 -1,-0.3 2,-0.2 -4,-0.1 0.932 117.0 31.2 -58.1 -43.5 -23.9 80.3 33.4 74 76 A E H X4 S+ 0 0 2 -3,-0.9 3,-1.2 -6,-0.4 -2,-0.2 0.870 117.0 55.0 -82.8 -40.4 -20.3 79.6 32.3 75 77 A F H 3< S+ 0 0 49 -4,-2.5 -2,-0.2 -7,-0.3 -3,-0.2 0.886 112.1 46.7 -58.6 -36.4 -20.3 75.8 32.7 76 78 A N T 3< S+ 0 0 104 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.343 78.9 130.6 -93.4 3.2 -23.4 75.7 30.4 77 79 A D X - 0 0 10 -3,-1.2 3,-1.9 1,-0.2 4,-0.2 -0.395 62.9-133.7 -51.2 125.8 -21.9 78.1 27.7 78 80 A P G > S+ 0 0 98 0, 0.0 3,-1.5 0, 0.0 -1,-0.2 0.857 107.3 62.1 -52.4 -34.1 -22.4 76.3 24.4 79 81 A S G 3 S+ 0 0 39 1,-0.3 -2,-0.1 63,-0.0 -3,-0.0 0.700 102.5 52.0 -63.3 -20.4 -18.8 77.2 23.6 80 82 A N G X S+ 0 0 0 -3,-1.9 3,-2.3 -6,-0.2 4,-0.4 0.277 75.1 141.0 -99.5 9.6 -17.7 75.1 26.6 81 83 A A T < S+ 0 0 28 -3,-1.5 101,-0.1 1,-0.3 -5,-0.1 -0.327 72.4 22.2 -58.7 129.5 -19.6 71.9 25.6 82 84 A G T > S+ 0 0 7 99,-0.1 3,-1.4 100,-0.0 4,-0.4 0.026 93.9 99.5 99.2 -23.1 -17.5 68.9 26.5 83 85 A L T X> + 0 0 1 -3,-2.3 4,-2.0 1,-0.3 3,-0.8 0.717 62.0 81.2 -71.1 -17.4 -15.4 70.7 29.1 84 86 A Q H 3> S+ 0 0 57 -4,-0.4 4,-2.5 1,-0.3 -1,-0.3 0.823 84.8 62.2 -55.7 -29.4 -17.5 69.1 31.8 85 87 A N H <> S+ 0 0 59 -3,-1.4 4,-1.8 2,-0.2 -1,-0.3 0.899 104.4 45.9 -61.4 -43.0 -15.3 66.1 31.3 86 88 A G H <> S+ 0 0 0 -3,-0.8 4,-1.9 -4,-0.4 -2,-0.2 0.878 111.6 52.1 -65.8 -39.8 -12.2 68.1 32.4 87 89 A F H X S+ 0 0 46 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.930 109.5 48.8 -62.1 -45.4 -14.1 69.5 35.4 88 90 A K H < S+ 0 0 138 -4,-2.5 3,-0.4 1,-0.2 -1,-0.2 0.872 108.7 54.4 -65.9 -36.1 -15.1 66.1 36.5 89 91 A F H < S+ 0 0 4 -4,-1.8 4,-0.4 1,-0.2 -1,-0.2 0.901 110.3 47.0 -59.6 -41.8 -11.5 64.9 36.1 90 92 A L H X S+ 0 0 3 -4,-1.9 4,-2.4 1,-0.2 3,-0.3 0.659 90.2 85.2 -78.6 -15.2 -10.3 67.7 38.4 91 93 A E H X S+ 0 0 102 -4,-1.1 4,-2.3 -3,-0.4 -1,-0.2 0.920 90.7 45.7 -56.2 -50.7 -13.0 67.1 41.1 92 94 A P H > S+ 0 0 60 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.807 111.1 54.8 -63.7 -28.7 -11.1 64.4 43.0 93 95 A I H > S+ 0 0 4 -4,-0.4 4,-1.8 -3,-0.3 -2,-0.2 0.919 108.1 48.0 -67.7 -42.6 -8.0 66.6 42.8 94 96 A H H < S+ 0 0 51 -4,-2.4 6,-0.2 1,-0.2 -1,-0.2 0.902 109.3 54.0 -64.7 -36.3 -9.8 69.5 44.4 95 97 A K H < S+ 0 0 179 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.873 110.5 46.4 -63.3 -37.4 -11.1 67.2 47.1 96 98 A E H < S+ 0 0 128 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.809 126.8 29.6 -71.8 -32.5 -7.5 66.1 47.9 97 99 A F >< + 0 0 21 -4,-1.8 3,-1.6 1,-0.1 -1,-0.2 -0.609 68.5 163.7-127.8 67.8 -6.3 69.7 47.9 98 100 A P T 3 + 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.734 67.7 71.5 -64.0 -20.0 -9.3 71.8 49.0 99 101 A W T 3 S+ 0 0 59 -3,-0.1 2,-0.2 2,-0.0 -89,-0.1 0.657 77.1 93.6 -69.5 -18.8 -7.0 74.8 49.8 100 102 A I S < S- 0 0 3 -3,-1.6 2,-0.1 -6,-0.2 -3,-0.1 -0.513 79.7-117.3 -78.9 142.4 -6.3 75.6 46.1 101 103 A S > - 0 0 11 27,-0.2 4,-2.3 -2,-0.2 5,-0.1 -0.375 21.1-116.4 -71.9 160.6 -8.5 78.1 44.3 102 104 A S H > S+ 0 0 9 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.925 115.1 49.7 -65.0 -44.9 -10.6 77.1 41.4 103 105 A G H > S+ 0 0 0 -38,-0.3 4,-2.2 1,-0.2 5,-0.3 0.895 111.1 49.6 -61.9 -41.3 -8.8 79.3 38.9 104 106 A D H > S+ 0 0 0 24,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.930 113.1 47.4 -61.3 -43.4 -5.4 78.0 40.1 105 107 A L H X S+ 0 0 1 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.938 113.0 46.5 -65.6 -45.5 -6.6 74.4 39.7 106 108 A F H X S+ 0 0 3 -4,-2.8 4,-1.1 2,-0.2 -1,-0.2 0.917 117.4 43.4 -67.0 -39.9 -8.1 74.9 36.2 107 109 A S H X S+ 0 0 0 -4,-2.2 4,-1.8 -5,-0.3 3,-0.4 0.923 112.2 52.8 -71.2 -42.0 -5.0 76.7 35.0 108 110 A L H X S+ 0 0 0 -4,-2.6 4,-2.9 -5,-0.3 5,-0.2 0.868 101.4 62.1 -60.5 -33.3 -2.6 74.3 36.6 109 111 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.906 105.1 47.2 -57.5 -41.0 -4.5 71.4 34.9 110 112 A G H X S+ 0 0 0 -4,-1.1 4,-2.3 -3,-0.4 -1,-0.2 0.912 112.1 48.0 -69.4 -42.4 -3.5 72.9 31.5 111 113 A V H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.927 112.6 49.4 -59.5 -46.7 0.1 73.4 32.5 112 114 A T H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.926 110.5 51.0 -61.2 -44.2 0.3 69.8 33.9 113 115 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 -5,-0.2 6,-0.2 0.923 109.6 48.8 -61.5 -48.2 -1.2 68.4 30.7 114 116 A V H <>S+ 0 0 0 -4,-2.3 5,-2.4 1,-0.2 82,-0.2 0.941 115.7 43.9 -57.7 -48.1 1.2 70.2 28.4 115 117 A Q H ><5S+ 0 0 4 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.905 112.4 50.2 -67.2 -42.1 4.2 69.0 30.4 116 118 A E H 3<5S+ 0 0 53 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.764 104.1 60.3 -70.2 -22.2 3.1 65.5 30.9 117 119 A M T 3<5S- 0 0 14 -4,-1.8 79,-2.9 -5,-0.2 -1,-0.3 0.168 128.1-100.3 -86.3 17.2 2.4 65.2 27.1 118 120 A Q T < 5S+ 0 0 142 -3,-1.6 -3,-0.2 77,-0.2 -2,-0.2 0.692 79.5 139.5 73.1 25.0 6.2 66.0 26.6 119 121 A G < - 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