==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE (H2O2(A)) 11-APR-95 1CMT . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR M.M.FITZGERALD,M.L.TRESTER,G.M.JENSEN,D.E.MCREE,D.B.GOODIN . 291 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13071.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 61.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 8 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 36.1 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 3 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 . 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 0 PARALLEL BRIDGES PER LADDER . 3 0 1 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 . 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 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 0 129 0, 0.0 2,-0.4 0, 0.0 269,-0.0 0.000 360.0 360.0 360.0 118.8 12.2 92.7 75.5 2 5 A V - 0 0 109 2,-0.0 2,-0.5 269,-0.0 269,-0.1 -0.913 360.0-168.3-113.1 137.4 9.8 90.2 73.9 3 6 A H - 0 0 29 -2,-0.4 269,-3.3 267,-0.4 2,-0.5 -0.917 7.6-162.2-126.0 104.7 8.6 90.6 70.3 4 7 A V B -a 272 0A 68 -2,-0.5 269,-0.2 267,-0.2 2,-0.2 -0.750 20.7-122.8 -95.7 126.7 5.7 88.4 69.3 5 8 A A - 0 0 11 267,-2.8 2,-0.4 -2,-0.5 122,-0.2 -0.494 28.2-170.4 -60.2 131.9 5.0 87.8 65.6 6 9 A S - 0 0 76 120,-2.5 120,-0.2 -2,-0.2 3,-0.1 -0.960 21.7-127.0-130.2 108.9 1.4 88.8 64.6 7 10 A V - 0 0 54 -2,-0.4 3,-0.2 118,-0.1 121,-0.0 -0.342 34.7-102.3 -55.7 129.6 0.1 87.8 61.2 8 11 A E > - 0 0 22 1,-0.2 3,-2.1 2,-0.1 -1,-0.1 -0.354 65.4 -74.1 -47.4 129.7 -1.3 90.8 59.3 9 12 A K T 3 S- 0 0 174 1,-0.3 -1,-0.2 89,-0.1 3,-0.1 0.041 105.7 -14.8 -50.1 120.8 -5.1 90.4 59.6 10 13 A G T 3 S+ 0 0 78 1,-0.2 -1,-0.3 -3,-0.2 2,-0.1 0.484 97.8 138.9 74.7 1.2 -6.6 87.6 57.5 11 14 A R < + 0 0 82 -3,-2.1 2,-0.2 3,-0.1 -1,-0.2 -0.413 23.0 169.1 -79.9 151.4 -3.6 87.3 55.3 12 15 A S >> - 0 0 47 -2,-0.1 4,-1.5 -3,-0.1 3,-1.1 -0.841 52.7 -63.7-140.6-172.9 -2.2 83.9 54.1 13 16 A Y H 3> S+ 0 0 67 1,-0.2 4,-2.9 -2,-0.2 5,-0.3 0.856 125.5 57.9 -44.5 -47.7 0.4 82.5 51.6 14 17 A E H 3> S+ 0 0 120 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.889 105.2 51.5 -58.6 -36.5 -1.4 83.8 48.5 15 18 A D H <> S+ 0 0 23 -3,-1.1 4,-1.7 2,-0.2 -1,-0.2 0.947 112.6 44.0 -64.9 -48.3 -1.3 87.4 49.8 16 19 A F H X S+ 0 0 0 -4,-1.5 4,-2.9 1,-0.2 -2,-0.2 0.910 109.0 56.9 -69.4 -34.5 2.5 87.3 50.4 17 20 A Q H X S+ 0 0 14 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.877 104.5 54.3 -64.0 -31.8 3.2 85.5 47.0 18 21 A K H X S+ 0 0 111 -4,-1.6 4,-2.2 -5,-0.3 -1,-0.2 0.937 110.2 45.8 -64.6 -43.6 1.4 88.6 45.4 19 22 A V H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.954 111.9 51.3 -63.2 -48.1 3.8 90.9 47.2 20 23 A Y H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 5,-0.2 0.934 111.5 48.7 -48.1 -52.1 6.8 88.7 46.2 21 24 A N H X S+ 0 0 22 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.894 107.9 53.7 -61.5 -37.1 5.7 88.8 42.6 22 25 A A H X S+ 0 0 16 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.950 112.5 44.0 -64.0 -44.5 5.3 92.6 42.6 23 26 A I H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.971 114.3 49.8 -64.1 -46.8 8.9 93.0 43.9 24 27 A A H X S+ 0 0 1 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.887 110.0 51.0 -60.1 -37.9 10.2 90.4 41.3 25 28 A L H X S+ 0 0 75 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.912 111.2 46.6 -66.9 -43.6 8.4 92.0 38.4 26 29 A K H X S+ 0 0 38 -4,-2.0 4,-3.0 -5,-0.2 -2,-0.2 0.895 108.4 57.7 -70.2 -31.6 9.8 95.5 39.3 27 30 A L H < S+ 0 0 23 -4,-2.4 12,-0.3 1,-0.2 -2,-0.2 0.903 111.0 43.2 -60.4 -39.5 13.4 93.9 39.7 28 31 A R H < S+ 0 0 135 -4,-1.8 3,-0.4 -5,-0.2 -2,-0.2 0.903 118.0 46.0 -69.8 -40.2 13.1 92.7 36.1 29 32 A E H < S+ 0 0 138 -4,-2.2 2,-1.6 1,-0.2 3,-0.3 0.944 108.0 51.8 -71.3 -53.8 11.6 96.0 34.9 30 33 A D >< + 0 0 29 -4,-3.0 3,-0.7 1,-0.2 9,-0.4 -0.287 69.8 141.0 -84.9 59.6 14.0 98.5 36.5 31 34 A D T 3 + 0 0 78 -2,-1.6 -1,-0.2 -3,-0.4 7,-0.1 0.641 50.0 74.8 -77.8 -16.5 17.1 96.8 35.2 32 35 A E T 3> + 0 0 89 -3,-0.3 4,-1.8 4,-0.1 3,-0.4 0.732 65.8 122.0 -72.6 -20.9 19.2 99.9 34.4 33 36 A Y H <>>S+ 0 0 41 -3,-0.7 5,-2.7 1,-0.2 4,-1.2 -0.098 78.9 4.4 -50.8 136.8 20.1 100.8 38.0 34 37 A D H >45S- 0 0 37 1,-0.2 3,-1.0 2,-0.2 -1,-0.2 0.946 139.7 -45.8 52.8 58.1 23.8 101.0 38.9 35 38 A N H 345S- 0 0 151 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.883 113.7 -49.3 48.1 51.3 25.1 100.4 35.4 36 39 A Y H 3<5S+ 0 0 155 -4,-1.8 -1,-0.2 1,-0.1 -2,-0.2 0.643 108.0 117.9 67.5 19.1 22.8 97.5 34.8 37 40 A I T <<5 - 0 0 17 -4,-1.2 3,-0.3 -3,-1.0 -3,-0.2 0.871 66.3-149.2 -72.2 -31.9 23.5 95.5 38.0 38 41 A G < - 0 0 8 -5,-2.7 4,-0.4 1,-0.2 -7,-0.1 -0.230 29.6 -68.3 83.4 175.2 19.8 96.1 38.8 39 42 A Y S > S+ 0 0 36 -9,-0.4 4,-1.8 -12,-0.3 -1,-0.2 0.508 102.4 97.4 -84.4 -3.6 18.3 96.4 42.4 40 43 A G H > S+ 0 0 5 -3,-0.3 4,-2.0 2,-0.2 3,-0.3 0.952 84.3 45.3 -50.0 -58.6 18.9 92.8 43.6 41 44 A P H > S+ 0 0 16 0, 0.0 4,-2.4 0, 0.0 3,-0.3 0.946 112.3 49.5 -56.6 -49.8 22.2 93.5 45.5 42 45 A V H > S+ 0 0 20 -4,-0.4 4,-2.2 1,-0.2 -2,-0.2 0.861 109.9 54.5 -63.8 -27.9 21.1 96.7 47.3 43 46 A L H X S+ 0 0 2 -4,-1.8 4,-2.0 -3,-0.3 -1,-0.2 0.903 108.5 45.6 -74.0 -34.2 17.9 94.9 48.4 44 47 A V H X S+ 0 0 10 -4,-2.0 4,-2.1 -3,-0.3 -2,-0.2 0.924 113.1 52.1 -76.4 -27.4 19.7 92.0 50.1 45 48 A R H X S+ 0 0 74 -4,-2.4 4,-2.8 -5,-0.2 5,-0.2 0.908 108.3 51.6 -66.7 -37.6 22.0 94.6 51.7 46 49 A L H X S+ 0 0 1 -4,-2.2 4,-2.5 -5,-0.2 5,-0.3 0.961 109.2 49.1 -62.8 -46.1 18.9 96.5 53.0 47 50 A A H X S+ 0 0 0 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.920 113.5 47.9 -59.9 -39.3 17.5 93.2 54.6 48 51 A W H X S+ 0 0 46 -4,-2.1 4,-2.9 2,-0.2 3,-0.3 0.951 112.3 48.5 -66.1 -47.7 20.9 92.5 56.2 49 52 A H H < S+ 0 0 13 -4,-2.8 4,-0.4 1,-0.2 -2,-0.2 0.866 110.8 49.1 -66.2 -33.4 21.3 96.1 57.6 50 53 A I H < S+ 0 0 4 -4,-2.5 -1,-0.2 -5,-0.2 3,-0.2 0.805 120.7 38.2 -75.9 -20.9 17.7 96.3 59.1 51 54 A S H >< S+ 0 0 1 -4,-1.1 3,-1.7 -3,-0.3 -2,-0.2 0.815 103.3 71.7 -90.1 -29.1 18.4 92.9 60.8 52 55 A G T 3< S+ 0 0 0 -4,-2.9 -2,-0.1 1,-0.3 -3,-0.1 0.479 80.5 73.4 -71.5 -8.0 22.1 93.5 61.6 53 56 A T T 3 S+ 0 0 4 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 0.475 72.6 121.3 -79.3 -6.4 21.2 96.0 64.4 54 57 A W < - 0 0 19 -3,-1.7 2,-0.4 7,-0.2 7,-0.2 -0.256 47.0-159.6 -63.3 145.7 20.0 93.2 66.7 55 58 A D B >>> -B 60 0B 29 5,-2.1 4,-1.3 1,-0.1 3,-0.7 -0.916 8.8-156.9-125.2 114.4 21.6 92.6 70.1 56 59 A K T 345S+ 0 0 85 101,-2.3 -1,-0.1 -2,-0.4 102,-0.1 0.752 88.0 65.7 -56.8 -23.9 21.1 89.1 71.6 57 60 A H T 345S+ 0 0 145 100,-0.2 -1,-0.2 1,-0.2 100,-0.0 0.931 123.8 6.8 -72.8 -39.7 21.7 90.5 75.2 58 61 A D T <45S- 0 0 77 -3,-0.7 -1,-0.2 2,-0.1 -2,-0.2 0.206 95.6-119.4-126.6 12.7 18.7 92.7 75.5 59 62 A N T <5 + 0 0 26 -4,-1.3 2,-0.2 1,-0.2 -3,-0.2 0.747 62.8 145.2 53.3 28.5 16.7 91.8 72.3 60 63 A T B < +B 55 0B 31 -5,-0.7 -5,-2.1 -7,-0.1 -1,-0.2 -0.658 49.3 13.8 -90.2 156.0 16.9 95.4 70.9 61 64 A G S S+ 0 0 16 73,-0.4 3,-0.2 -2,-0.2 -7,-0.2 -0.388 72.2 120.9 78.6-157.2 17.2 96.1 67.2 62 65 A G S S- 0 0 6 -13,-0.2 3,-0.4 1,-0.2 5,-0.3 -0.121 79.5 -65.0 85.4 173.7 16.6 93.5 64.6 63 66 A S S > S+ 0 0 2 206,-0.4 3,-1.0 203,-0.3 -1,-0.2 0.696 106.8 87.9 -74.5 -16.8 14.1 93.3 61.7 64 67 A Y T 3 S+ 0 0 21 205,-0.4 38,-0.3 1,-0.2 39,-0.2 0.864 87.8 41.9 -52.6 -52.2 10.9 93.2 63.8 65 68 A G T 3 S- 0 0 7 -3,-0.4 65,-1.7 -4,-0.2 -1,-0.2 0.556 90.4-136.6 -81.1 -10.3 10.0 96.8 64.3 66 69 A G X + 0 0 4 -3,-1.0 3,-1.6 -4,-0.2 4,-0.1 0.785 45.1 157.7 57.7 33.5 10.8 98.1 60.8 67 70 A T G > + 0 0 7 -5,-0.3 3,-1.7 1,-0.3 6,-0.4 0.542 47.6 88.9 -75.5 -2.8 12.6 101.1 62.4 68 71 A Y G 3 S+ 0 0 1 1,-0.3 -1,-0.3 5,-0.2 6,-0.2 0.765 76.5 71.2 -60.5 -24.3 14.7 101.9 59.3 69 72 A R G < S+ 0 0 73 -3,-1.6 2,-0.3 4,-0.1 -1,-0.3 0.750 84.7 87.5 -64.6 -20.0 11.7 104.1 58.2 70 73 A F S X> S- 0 0 31 -3,-1.7 4,-2.3 -4,-0.1 3,-0.7 -0.636 89.4-116.8 -86.1 140.7 12.7 106.6 61.1 71 74 A K H 3> S+ 0 0 142 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.783 107.9 58.2 -36.7 -51.0 15.2 109.4 60.5 72 75 A K H 34 S+ 0 0 80 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.933 116.2 32.9 -53.3 -49.3 17.8 108.1 63.0 73 76 A E H X4 S+ 0 0 3 -3,-0.7 3,-1.4 -6,-0.4 -1,-0.2 0.912 116.6 54.5 -77.1 -43.6 18.3 104.8 61.3 74 77 A F H 3< S+ 0 0 44 -4,-2.3 -1,-0.2 -7,-0.3 -2,-0.2 0.858 112.6 46.8 -56.5 -36.0 17.7 105.9 57.7 75 78 A N T 3< S+ 0 0 108 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.390 78.0 129.6 -89.2 1.7 20.4 108.5 58.3 76 79 A D X - 0 0 9 -3,-1.4 3,-1.9 1,-0.2 4,-0.2 -0.414 63.2-133.4 -53.7 128.7 23.0 106.2 59.9 77 80 A P G > S+ 0 0 101 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.869 107.6 61.6 -56.8 -32.9 26.3 106.7 57.9 78 81 A S G 3 S+ 0 0 38 1,-0.3 -2,-0.1 3,-0.0 -3,-0.0 0.730 99.9 54.6 -64.6 -21.6 26.6 102.9 57.8 79 82 A N G X S+ 0 0 0 -3,-1.9 3,-2.2 -6,-0.2 4,-0.4 0.281 76.0 142.4 -95.2 10.2 23.3 102.8 55.8 80 83 A A T < S+ 0 0 26 -3,-1.6 101,-0.1 1,-0.3 -5,-0.1 -0.267 70.3 19.9 -54.7 122.9 24.5 105.2 53.1 81 84 A G T > S+ 0 0 6 99,-0.1 3,-1.2 -2,-0.1 4,-0.4 0.103 94.2 100.3 102.7 -21.2 23.2 104.2 49.7 82 85 A L T X> + 0 0 0 -3,-2.2 4,-2.3 1,-0.2 3,-0.8 0.700 60.5 82.7 -75.4 -10.9 20.3 102.1 51.0 83 86 A Q H 3> S+ 0 0 49 -4,-0.4 4,-2.7 1,-0.3 -1,-0.2 0.864 84.9 62.2 -55.7 -31.8 17.9 104.9 50.3 84 87 A N H <> S+ 0 0 56 -3,-1.2 4,-1.6 2,-0.2 -1,-0.3 0.889 104.0 45.4 -61.3 -38.9 17.9 103.5 46.8 85 88 A G H <> S+ 0 0 0 -3,-0.8 4,-2.1 -4,-0.4 -2,-0.2 0.940 112.0 51.4 -70.6 -45.9 16.5 100.2 48.0 86 89 A F H X S+ 0 0 49 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.938 109.7 50.6 -54.0 -45.7 13.8 102.0 50.2 87 90 A K H < S+ 0 0 119 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.891 108.0 53.1 -63.3 -37.2 12.8 104.1 47.1 88 91 A F H X S+ 0 0 2 -4,-1.6 4,-0.5 1,-0.2 -1,-0.2 0.898 113.4 43.1 -61.1 -42.8 12.4 100.9 45.0 89 92 A L H X S+ 0 0 2 -4,-2.1 4,-2.3 1,-0.2 3,-0.2 0.747 93.2 83.5 -77.6 -20.5 10.1 99.3 47.7 90 93 A E H X S+ 0 0 89 -4,-1.7 4,-1.9 1,-0.2 5,-0.2 0.911 89.5 48.7 -56.8 -47.0 8.0 102.5 48.3 91 94 A P H > S+ 0 0 60 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.896 111.2 52.0 -57.7 -35.8 5.6 101.9 45.3 92 95 A I H X S+ 0 0 6 -4,-0.5 4,-2.2 1,-0.2 -2,-0.2 0.903 107.2 51.2 -70.9 -35.1 5.1 98.3 46.3 93 96 A H H < S+ 0 0 45 -4,-2.3 -1,-0.2 2,-0.2 6,-0.2 0.877 108.0 53.7 -67.1 -36.2 4.2 99.4 49.9 94 97 A K H < S+ 0 0 143 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.897 111.2 46.1 -61.5 -41.4 1.7 101.8 48.4 95 98 A E H < S+ 0 0 125 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.818 125.2 30.6 -71.7 -31.5 0.1 98.9 46.4 96 99 A F S >< S+ 0 0 21 -4,-2.2 3,-1.8 -5,-0.2 -1,-0.2 -0.545 70.2 164.7-125.1 72.7 0.0 96.6 49.5 97 100 A P T 3 + 0 0 99 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.669 67.2 70.8 -70.9 -13.1 -0.4 99.0 52.4 98 101 A W T 3 S+ 0 0 55 -3,-0.1 2,-0.2 2,-0.1 -89,-0.1 0.706 76.7 94.6 -72.6 -23.3 -1.4 96.1 54.8 99 102 A I S < S- 0 0 4 -3,-1.8 -3,-0.1 -6,-0.2 2,-0.0 -0.524 79.4-120.9 -75.5 135.8 2.1 94.6 54.9 100 103 A S > - 0 0 16 -2,-0.2 4,-2.2 27,-0.2 5,-0.2 -0.308 20.5-115.0 -66.7 159.5 4.2 95.8 57.8 101 104 A S H > S+ 0 0 8 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.960 114.0 50.5 -64.9 -45.5 7.6 97.5 57.2 102 105 A G H > S+ 0 0 0 -38,-0.3 4,-2.4 1,-0.2 5,-0.3 0.913 111.9 49.0 -57.0 -43.0 9.8 94.8 58.7 103 106 A D H > S+ 0 0 0 24,-0.2 4,-2.5 -39,-0.2 -1,-0.2 0.927 112.5 47.0 -64.0 -42.3 8.0 92.2 56.6 104 107 A L H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.926 113.8 46.9 -67.2 -44.8 8.4 94.1 53.4 105 108 A F H X S+ 0 0 7 -4,-2.7 4,-1.2 2,-0.2 -2,-0.2 0.924 117.0 43.8 -65.4 -41.4 12.1 95.0 53.9 106 109 A S H X S+ 0 0 0 -4,-2.4 4,-1.9 -5,-0.3 3,-0.2 0.927 113.3 50.6 -70.3 -38.4 13.0 91.3 54.9 107 110 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.3 5,-0.2 0.873 102.8 61.3 -65.9 -32.5 10.8 89.9 52.0 108 111 A G H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.928 105.8 47.7 -56.9 -40.6 12.7 92.3 49.6 109 112 A G H X S+ 0 0 0 -4,-1.2 4,-2.2 -3,-0.2 -2,-0.2 0.938 112.7 47.6 -66.2 -46.1 15.9 90.5 50.5 110 113 A V H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.951 112.2 49.4 -57.2 -49.9 14.4 87.0 50.1 111 114 A T H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.931 110.4 51.1 -58.7 -45.1 12.9 87.9 46.7 112 115 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 -5,-0.2 6,-0.2 0.940 110.4 47.5 -60.8 -49.8 16.2 89.3 45.4 113 116 A V H <>S+ 0 0 0 -4,-2.2 5,-2.6 2,-0.2 82,-0.3 0.953 116.3 44.3 -55.9 -52.0 18.3 86.2 46.3 114 117 A Q H ><5S+ 0 0 6 -4,-2.4 3,-1.3 1,-0.2 -2,-0.2 0.905 113.4 48.9 -62.0 -41.9 15.7 83.8 44.7 115 118 A E H 3<5S+ 0 0 43 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.791 106.4 56.8 -73.4 -22.3 15.2 85.9 41.5 116 119 A M T 3<5S- 0 0 17 -4,-1.9 79,-3.1 -5,-0.2 -1,-0.3 0.123 128.4-102.9 -88.5 25.3 19.0 86.2 41.1 117 120 A Q T < 5S+ 0 0 117 -3,-1.3 -3,-0.2 77,-0.2 -2,-0.1 0.738 76.2 139.6 52.2 36.3 18.9 82.3 41.2 118 121 A G < - 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