==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 25-MAR-11 3R98 . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR M.P.BLAKELEY,S.J.FISHER,A.GUMIERO,P.C.E.MOODY,E.L.RAVEN . 293 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13370.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 61.8 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 . 41 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 34.8 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 5 0 0 0 2 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 . 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 . 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 . 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 2 A T 0 0 183 0, 0.0 2,-0.4 0, 0.0 58,-0.0 0.000 360.0 360.0 360.0 129.2 -16.3 3.8 11.5 2 3 A P - 0 0 80 0, 0.0 59,-0.2 0, 0.0 58,-0.1 -0.882 360.0-126.5-104.9 131.9 -12.6 4.8 12.3 3 4 A L - 0 0 76 57,-1.1 2,-0.4 -2,-0.4 269,-0.0 -0.219 18.7-136.7 -53.7 150.1 -10.5 3.9 15.4 4 5 A V - 0 0 99 2,-0.0 2,-0.5 269,-0.0 269,-0.1 -0.949 13.4-165.1-110.6 140.6 -8.9 6.6 17.4 5 6 A H - 0 0 24 -2,-0.4 269,-2.9 267,-0.4 2,-0.5 -0.952 10.0-164.7-123.4 105.1 -5.3 6.0 18.5 6 7 A V B -a 274 0A 75 -2,-0.5 2,-0.2 267,-0.2 269,-0.2 -0.832 21.2-118.9 -99.1 135.3 -4.3 8.5 21.2 7 8 A A - 0 0 11 267,-2.6 2,-0.5 -2,-0.5 122,-0.2 -0.497 27.1-170.1 -67.5 129.9 -0.7 9.0 22.1 8 9 A S - 0 0 78 120,-2.4 120,-0.2 -2,-0.2 2,-0.1 -0.979 23.8-126.3-125.4 116.2 0.2 8.1 25.7 9 10 A V - 0 0 54 -2,-0.5 3,-0.2 118,-0.1 4,-0.0 -0.353 37.0-103.0 -60.0 127.2 3.6 9.1 26.9 10 11 A E > - 0 0 22 1,-0.2 3,-2.0 -2,-0.1 -1,-0.1 -0.284 65.2 -69.4 -61.5 141.5 5.4 6.1 28.2 11 12 A K T 3 S- 0 0 193 1,-0.3 -1,-0.2 89,-0.1 3,-0.1 0.039 104.8 -19.7 -57.6 118.6 5.2 6.5 31.9 12 13 A G T 3 S+ 0 0 64 -3,-0.2 -1,-0.3 1,-0.2 2,-0.1 0.436 95.9 139.4 78.4 -3.0 7.2 9.3 33.5 13 14 A R < + 0 0 81 -3,-2.0 2,-0.2 3,-0.1 -1,-0.2 -0.423 24.5 175.2 -77.6 149.2 9.6 9.6 30.5 14 15 A S >> - 0 0 65 -2,-0.1 4,-1.5 -3,-0.1 3,-1.1 -0.769 49.7 -67.6-136.2-170.0 10.8 12.9 29.2 15 16 A Y H 3> S+ 0 0 81 1,-0.3 4,-2.1 -2,-0.2 5,-0.2 0.808 124.9 57.7 -56.3 -35.2 13.2 14.3 26.6 16 17 A E H 3> S+ 0 0 145 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.867 105.4 52.7 -65.9 -33.1 16.4 13.1 28.4 17 18 A D H <> S+ 0 0 23 -3,-1.1 4,-1.5 2,-0.2 -2,-0.2 0.913 111.9 42.8 -66.9 -45.3 15.1 9.5 28.2 18 19 A F H X S+ 0 0 0 -4,-1.5 4,-2.7 1,-0.2 5,-0.2 0.867 109.6 57.2 -73.1 -32.9 14.4 9.5 24.5 19 20 A Q H X S+ 0 0 11 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.839 102.8 56.9 -64.4 -30.5 17.7 11.3 23.8 20 21 A K H X S+ 0 0 109 -4,-1.2 4,-1.8 2,-0.2 -2,-0.2 0.928 108.7 45.5 -65.9 -41.5 19.3 8.4 25.6 21 22 A V H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 5,-0.2 0.945 110.2 52.7 -65.6 -46.9 17.7 5.9 23.1 22 23 A Y H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.948 110.0 50.8 -48.8 -51.3 18.6 8.0 20.1 23 24 A N H X S+ 0 0 23 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.866 107.7 51.4 -60.8 -35.4 22.2 8.0 21.4 24 25 A A H X S+ 0 0 16 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.899 113.8 44.5 -66.8 -43.6 22.2 4.2 21.7 25 26 A I H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 5,-0.2 0.967 113.8 49.9 -63.6 -50.0 20.9 3.8 18.2 26 27 A A H X S+ 0 0 1 -4,-3.1 4,-1.4 1,-0.2 -2,-0.2 0.863 110.9 50.0 -57.6 -40.7 23.4 6.4 16.8 27 28 A L H X S+ 0 0 68 -4,-2.2 4,-1.1 -5,-0.3 -1,-0.2 0.898 110.4 48.7 -68.9 -38.2 26.3 4.7 18.6 28 29 A K H X S+ 0 0 48 -4,-1.8 4,-2.9 1,-0.2 -1,-0.2 0.844 108.0 55.4 -67.0 -31.2 25.4 1.3 17.2 29 30 A L H < S+ 0 0 22 -4,-2.0 12,-0.2 1,-0.2 -1,-0.2 0.843 108.5 48.8 -71.0 -35.5 25.1 2.8 13.7 30 31 A R H < S+ 0 0 128 -4,-1.4 3,-0.2 -5,-0.2 -1,-0.2 0.792 119.8 36.6 -73.5 -24.8 28.6 4.1 14.0 31 32 A E H < S+ 0 0 146 -4,-1.1 2,-2.0 1,-0.2 -2,-0.2 0.882 108.1 58.1 -94.5 -45.2 30.0 0.8 15.2 32 33 A D S < S+ 0 0 57 -4,-2.9 3,-0.5 1,-0.2 9,-0.4 -0.428 73.3 140.0 -82.9 62.2 28.1 -1.9 13.3 33 34 A D + 0 0 72 -2,-2.0 -1,-0.2 -3,-0.2 -4,-0.1 0.330 44.8 72.8 -97.4 9.2 29.4 -0.2 10.2 34 35 A E >> + 0 0 123 -3,-0.1 4,-1.6 4,-0.1 3,-0.6 0.579 64.5 124.0-103.7 -8.4 30.2 -3.1 7.9 35 36 A Y H 3>>S+ 0 0 46 -3,-0.5 5,-2.7 1,-0.2 4,-1.2 -0.208 78.9 6.4 -56.1 138.5 26.7 -4.1 7.1 36 37 A D H >45S- 0 0 38 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.907 140.8 -46.4 53.3 53.7 25.8 -4.3 3.4 37 38 A N H <45S- 0 0 147 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.2 0.893 112.4 -49.4 56.5 45.8 29.3 -3.7 2.2 38 39 A Y H 3<5S+ 0 0 146 -4,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.688 108.5 118.3 71.5 17.7 29.9 -0.8 4.5 39 40 A I T <<5 - 0 0 16 -4,-1.2 3,-0.3 -3,-0.8 -3,-0.2 0.881 66.6-148.7 -70.1 -43.1 26.7 1.0 3.7 40 41 A G < - 0 0 8 -5,-2.7 4,-0.3 1,-0.1 -7,-0.1 -0.356 28.4 -70.1 95.4 176.5 25.8 0.6 7.4 41 42 A Y S > S+ 0 0 42 -9,-0.4 4,-2.0 -12,-0.2 5,-0.2 0.472 101.3 99.9 -89.0 -3.7 22.3 0.2 8.9 42 43 A G H > S+ 0 0 4 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.937 84.2 42.7 -45.1 -61.3 21.2 3.8 8.2 43 44 A P H > S+ 0 0 16 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.888 112.5 50.2 -61.9 -45.4 19.1 3.1 5.1 44 45 A V H > S+ 0 0 17 -4,-0.3 4,-2.5 1,-0.2 5,-0.2 0.852 109.5 54.8 -63.1 -32.0 17.4 -0.1 6.2 45 46 A L H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.938 109.2 46.1 -64.1 -42.1 16.4 1.8 9.4 46 47 A V H X S+ 0 0 8 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.911 113.0 50.9 -65.1 -40.0 14.8 4.6 7.3 47 48 A R H X S+ 0 0 77 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.923 109.6 50.1 -61.5 -45.2 13.0 1.9 5.2 48 49 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.905 108.2 52.0 -62.4 -41.3 11.8 0.2 8.3 49 50 A A H X S+ 0 0 0 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.920 114.6 45.2 -58.8 -38.8 10.4 3.5 9.7 50 51 A W H X S+ 0 0 46 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.890 111.7 48.5 -75.7 -40.6 8.6 4.0 6.3 51 52 A H H < S+ 0 0 14 -4,-2.9 4,-0.3 1,-0.2 -1,-0.2 0.874 112.3 49.1 -71.5 -33.2 7.2 0.5 5.9 52 53 A T H < S+ 0 0 6 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.754 120.1 38.3 -76.4 -23.9 5.8 0.4 9.4 53 54 A S H >< S+ 0 0 1 -4,-1.0 3,-1.2 -5,-0.2 -2,-0.2 0.758 105.6 68.0 -89.3 -27.6 4.2 3.8 8.9 54 55 A G T 3< S+ 0 0 0 -4,-2.3 -2,-0.1 1,-0.3 -1,-0.1 0.365 77.3 76.3 -89.5 9.3 3.1 3.3 5.3 55 56 A T T 3 S+ 0 0 6 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.331 72.5 127.6 -85.5 2.7 0.4 0.7 5.8 56 57 A W < - 0 0 24 -3,-1.2 2,-0.4 7,-0.2 7,-0.2 -0.315 45.8-160.5 -65.0 146.0 -1.8 3.5 7.1 57 58 A D B >>> -B 62 0B 26 5,-1.9 4,-1.8 1,-0.1 5,-0.6 -0.971 9.1-158.8-127.9 115.0 -5.2 4.0 5.6 58 59 A K T 345S+ 0 0 88 101,-2.0 102,-0.1 -2,-0.4 -1,-0.1 0.681 87.0 66.8 -61.3 -23.6 -6.8 7.5 6.0 59 60 A H T 345S+ 0 0 139 100,-0.2 -1,-0.2 1,-0.2 -3,-0.0 0.920 123.5 6.5 -69.4 -43.8 -10.2 6.1 5.4 60 61 A D T <45S- 0 0 56 -3,-0.5 -57,-1.1 2,-0.1 -2,-0.2 0.324 96.1-119.5-123.5 5.9 -10.5 3.9 8.6 61 62 A N T <5 + 0 0 22 -4,-1.8 2,-0.2 1,-0.2 -3,-0.2 0.760 62.4 146.1 59.9 28.3 -7.4 4.9 10.4 62 63 A T B < +B 57 0B 33 -5,-0.6 -5,-1.9 -7,-0.1 -1,-0.2 -0.611 49.2 12.7 -91.4 158.0 -6.0 1.3 10.4 63 64 A G S S+ 0 0 14 73,-0.4 3,-0.3 -7,-0.2 -7,-0.2 -0.295 73.0 120.4 72.2-158.1 -2.2 0.5 10.1 64 65 A G S S- 0 0 4 -13,-0.2 3,-0.4 -12,-0.2 5,-0.3 -0.238 81.0 -61.9 86.2 179.5 0.4 3.3 10.5 65 66 A S S > S+ 0 0 4 206,-0.4 3,-0.6 203,-0.3 -1,-0.2 0.629 107.8 88.5 -77.1 -15.2 3.2 3.6 13.1 66 67 A Y T 3 S+ 0 0 22 205,-0.3 38,-0.4 -3,-0.3 -1,-0.2 0.887 88.5 39.1 -56.8 -53.9 1.0 3.6 16.2 67 68 A G T 3 S- 0 0 6 -3,-0.4 65,-1.7 -4,-0.1 -1,-0.2 0.593 88.8-136.7 -82.0 -12.0 0.6 -0.0 17.1 68 69 A G X + 0 0 3 -3,-0.6 3,-1.0 -4,-0.3 -3,-0.1 0.894 45.1 157.8 60.1 42.1 4.1 -1.3 16.3 69 70 A T G > + 0 0 6 -5,-0.3 3,-2.0 1,-0.3 6,-0.4 0.465 47.2 90.2 -84.5 -6.7 2.6 -4.3 14.7 70 71 A Y G 3 S+ 0 0 0 1,-0.3 -1,-0.3 5,-0.2 6,-0.1 0.727 76.5 72.5 -56.2 -23.8 5.6 -5.1 12.4 71 72 A R G < S+ 0 0 77 -3,-1.0 -1,-0.3 4,-0.1 2,-0.2 0.684 83.8 84.2 -68.9 -18.1 6.6 -7.2 15.5 72 73 A F S <> S- 0 0 36 -3,-2.0 4,-3.0 1,-0.1 3,-0.4 -0.609 88.1-119.9 -86.1 153.0 3.8 -9.8 14.6 73 74 A K H > S+ 0 0 142 1,-0.2 4,-2.4 -2,-0.2 5,-0.1 0.802 106.3 61.4 -68.1 -35.2 4.4 -12.5 12.0 74 75 A K H 4 S+ 0 0 86 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.961 118.7 30.5 -55.5 -46.7 1.7 -11.5 9.5 75 76 A E H >4 S+ 0 0 4 -6,-0.4 3,-1.4 -3,-0.4 -2,-0.2 0.899 116.0 57.2 -79.6 -41.5 3.4 -8.2 9.0 76 77 A F H 3< S+ 0 0 45 -4,-3.0 -1,-0.2 -7,-0.3 -2,-0.2 0.851 112.2 44.9 -55.1 -33.3 7.0 -9.3 9.7 77 78 A N T 3< S+ 0 0 101 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.357 77.1 130.7 -99.3 3.1 6.5 -11.9 6.8 78 79 A D X - 0 0 10 -3,-1.4 3,-1.7 1,-0.2 4,-0.1 -0.391 62.8-133.4 -50.9 128.3 4.9 -9.5 4.3 79 80 A P G > S+ 0 0 96 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.822 106.7 63.2 -56.7 -34.9 6.8 -10.1 1.1 80 81 A S G 3 S+ 0 0 34 1,-0.2 -2,-0.1 3,-0.0 -3,-0.0 0.693 99.0 57.0 -56.9 -23.6 7.0 -6.3 0.8 81 82 A N G X S+ 0 0 0 -3,-1.7 3,-2.3 -6,-0.2 4,-0.3 0.344 73.7 139.4 -94.7 12.4 9.0 -6.3 4.0 82 83 A A T < S+ 0 0 25 -3,-1.6 -5,-0.1 1,-0.3 101,-0.0 -0.285 71.8 22.0 -63.4 123.8 11.8 -8.7 2.8 83 84 A G T > S+ 0 0 3 -2,-0.1 3,-1.6 99,-0.0 4,-0.4 -0.014 94.2 99.4 112.4 -26.4 15.1 -7.4 4.1 84 85 A L T X> + 0 0 0 -3,-2.3 4,-1.9 1,-0.3 3,-0.9 0.683 61.8 80.5 -71.6 -18.8 13.7 -5.4 7.0 85 86 A Q H 3> S+ 0 0 64 -4,-0.3 4,-2.5 1,-0.3 -1,-0.3 0.795 86.3 61.4 -51.3 -31.0 14.5 -8.2 9.5 86 87 A N H <> S+ 0 0 67 -3,-1.6 4,-1.6 1,-0.2 -1,-0.3 0.882 105.0 45.4 -68.4 -32.2 18.0 -6.8 9.4 87 88 A G H <> S+ 0 0 0 -3,-0.9 4,-1.6 -4,-0.4 -2,-0.2 0.886 111.3 53.4 -77.2 -36.3 16.8 -3.6 10.8 88 89 A F H X S+ 0 0 37 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.931 109.9 46.9 -60.5 -48.6 14.6 -5.4 13.4 89 90 A K H < S+ 0 0 127 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.882 107.9 56.5 -67.9 -33.2 17.6 -7.4 14.7 90 91 A F H < S+ 0 0 4 -4,-1.6 4,-0.4 -5,-0.2 -1,-0.2 0.909 113.0 42.4 -56.8 -41.1 19.7 -4.2 14.8 91 92 A L H >X S+ 0 0 2 -4,-1.6 4,-2.2 1,-0.2 3,-0.8 0.745 93.3 83.0 -81.1 -21.1 17.1 -2.7 17.1 92 93 A E H 3X S+ 0 0 78 -4,-1.5 4,-2.1 1,-0.3 5,-0.2 0.910 91.7 47.9 -54.6 -48.1 16.4 -5.7 19.3 93 94 A P H 3> S+ 0 0 61 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.816 110.0 53.2 -65.4 -24.7 19.4 -5.1 21.6 94 95 A I H <> S+ 0 0 7 -3,-0.8 4,-1.3 -4,-0.4 -2,-0.2 0.895 107.7 50.9 -72.3 -40.3 18.4 -1.4 21.9 95 96 A H H < S+ 0 0 46 -4,-2.2 3,-0.3 1,-0.2 6,-0.2 0.893 107.0 53.4 -66.1 -38.7 14.9 -2.5 23.0 96 97 A K H < S+ 0 0 170 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.902 110.5 48.5 -62.9 -37.6 16.3 -4.9 25.6 97 98 A E H < S+ 0 0 130 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.795 125.9 27.8 -70.4 -24.5 18.3 -2.0 27.0 98 99 A F S >< S+ 0 0 17 -4,-1.3 3,-1.8 -3,-0.3 -1,-0.3 -0.585 70.4 164.6-137.2 63.4 15.3 0.3 27.1 99 100 A P T 3 + 0 0 97 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.582 65.5 73.3 -70.5 -4.5 12.4 -2.0 27.5 100 101 A W T 3 S+ 0 0 53 -3,-0.1 2,-0.2 2,-0.1 -89,-0.1 0.658 75.1 93.0 -80.8 -16.7 10.1 0.8 28.4 101 102 A I S < S- 0 0 4 -3,-1.8 -3,-0.1 -6,-0.2 2,-0.0 -0.536 79.6-118.6 -82.7 137.9 9.8 2.3 24.9 102 103 A S > - 0 0 14 -2,-0.2 4,-1.7 27,-0.2 5,-0.1 -0.340 21.6-116.2 -67.9 162.3 6.9 1.1 22.7 103 104 A S H > S+ 0 0 6 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.928 114.9 53.4 -68.1 -45.7 7.6 -0.7 19.5 104 105 A G H > S+ 0 0 1 -38,-0.4 4,-2.0 1,-0.2 5,-0.3 0.893 109.6 47.9 -51.5 -42.3 6.0 2.1 17.4 105 106 A D H > S+ 0 0 0 24,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.874 113.9 48.1 -76.1 -32.1 8.2 4.7 19.1 106 107 A L H X S+ 0 0 1 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.928 111.4 46.9 -72.5 -45.3 11.3 2.6 18.5 107 108 A F H X S+ 0 0 6 -4,-2.8 4,-1.0 2,-0.2 -2,-0.2 0.896 119.0 42.5 -63.1 -39.5 10.7 1.8 14.9 108 109 A S H X S+ 0 0 0 -4,-2.0 4,-2.0 -5,-0.3 3,-0.5 0.926 112.9 51.0 -77.7 -44.4 10.0 5.4 14.1 109 110 A L H X S+ 0 0 0 -4,-2.3 4,-3.1 -5,-0.3 -1,-0.2 0.860 103.4 60.5 -58.3 -33.2 12.7 6.9 16.2 110 111 A G H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.901 106.2 47.7 -62.2 -39.1 15.2 4.6 14.5 111 112 A G H X S+ 0 0 0 -4,-1.0 4,-2.3 -3,-0.5 -2,-0.2 0.929 113.0 46.8 -66.6 -44.3 14.3 6.3 11.2 112 113 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.930 113.1 50.5 -59.5 -50.3 14.6 9.7 12.6 113 114 A T H X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.925 110.2 49.1 -53.0 -48.9 18.0 8.8 14.2 114 115 A A H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 6,-0.2 0.919 110.2 49.4 -64.5 -45.0 19.3 7.3 10.9 115 116 A V H <>S+ 0 0 0 -4,-2.3 5,-2.3 1,-0.2 -1,-0.2 0.931 114.6 45.2 -57.0 -48.7 18.4 10.4 8.8 116 117 A Q H ><5S+ 0 0 4 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.920 112.5 50.2 -65.1 -40.8 20.0 12.8 11.3 117 118 A E H 3<5S+ 0 0 48 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.819 103.9 59.9 -73.3 -21.8 23.2 10.7 11.8 118 119 A M T 3<5S- 0 0 16 -4,-1.9 79,-3.0 -5,-0.2 -1,-0.3 0.124 127.9 -99.3 -89.0 24.9 23.6 10.5 8.0 119 120 A Q T < 5S+ 0 0 135 -3,-1.6 -3,-0.2 77,-0.2 -2,-0.2 0.703 80.4 137.1 70.2 28.3 23.8 14.3 7.9 120 121 A G < - 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