==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 06-MAR-10 3M2A . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE, MITOCHONDRIAL; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR Y.T.MEHARENNA,T.L.POULOS . 291 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12969.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 182 62.5 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 5.2 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 . 41 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 35.4 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 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 4 A L 0 0 119 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 142.9 11.5 90.4 74.5 2 5 A V - 0 0 109 269,-0.0 2,-0.7 2,-0.0 269,-0.1 -0.859 360.0-158.9-102.7 131.0 9.7 87.5 72.8 3 6 A H E -a 271 0A 26 267,-0.6 269,-3.3 -2,-0.4 2,-0.5 -0.899 10.9-162.8-113.5 102.4 8.6 88.0 69.2 4 7 A V E -a 272 0A 69 -2,-0.7 269,-0.2 267,-0.2 2,-0.1 -0.731 23.1-117.8 -91.2 126.5 5.9 85.6 68.4 5 8 A A - 0 0 10 267,-2.7 2,-0.4 -2,-0.5 122,-0.2 -0.409 30.5-168.6 -58.6 131.5 5.1 85.0 64.7 6 9 A S - 0 0 74 120,-2.5 120,-0.2 -2,-0.1 3,-0.1 -0.964 20.7-127.5-132.3 109.1 1.6 86.1 63.8 7 10 A V - 0 0 54 -2,-0.4 3,-0.2 118,-0.1 5,-0.0 -0.326 34.2-100.6 -61.1 131.4 0.3 85.0 60.4 8 11 A E > - 0 0 18 1,-0.2 3,-2.7 2,-0.1 -1,-0.1 -0.297 64.3 -78.9 -53.5 133.6 -1.1 87.9 58.4 9 12 A K T 3 S- 0 0 199 1,-0.3 -1,-0.2 89,-0.1 3,-0.1 -0.155 106.1 -11.9 -59.1 122.4 -4.9 87.5 58.9 10 13 A G T 3 S+ 0 0 74 1,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.368 98.9 138.2 79.1 0.1 -6.4 84.9 56.8 11 14 A R < + 0 0 81 -3,-2.7 -1,-0.2 3,-0.1 2,-0.2 -0.470 24.3 172.5 -85.1 152.2 -3.3 84.4 54.6 12 15 A S >> - 0 0 61 -2,-0.2 4,-1.6 -3,-0.1 3,-1.1 -0.746 51.6 -67.6-142.1-173.4 -1.9 81.1 53.4 13 16 A Y H 3> S+ 0 0 65 1,-0.3 4,-2.4 -2,-0.2 5,-0.2 0.850 125.6 57.0 -52.8 -40.7 0.7 79.8 51.1 14 17 A E H 3> S+ 0 0 113 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.856 103.7 53.7 -63.2 -34.6 -1.0 81.0 47.9 15 18 A D H <> S+ 0 0 19 -3,-1.1 4,-1.5 1,-0.2 -1,-0.2 0.936 112.3 44.0 -61.0 -47.4 -1.0 84.6 49.1 16 19 A F H X S+ 0 0 0 -4,-1.6 4,-2.9 2,-0.2 -2,-0.2 0.843 108.3 57.3 -70.7 -31.1 2.7 84.5 49.7 17 20 A Q H X S+ 0 0 13 -4,-2.4 4,-2.9 -5,-0.2 -1,-0.2 0.884 104.7 53.7 -64.6 -35.8 3.4 82.7 46.4 18 21 A K H X S+ 0 0 105 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.899 110.1 46.1 -62.4 -40.5 1.6 85.7 44.8 19 22 A V H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.930 112.5 50.9 -66.5 -45.8 4.0 88.1 46.6 20 23 A Y H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 5,-0.2 0.927 110.6 50.2 -46.4 -53.5 7.0 85.9 45.6 21 24 A N H X S+ 0 0 22 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.880 107.9 50.9 -63.4 -37.5 5.8 85.9 42.0 22 25 A A H X S+ 0 0 16 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.919 112.7 47.1 -66.6 -39.7 5.4 89.7 41.9 23 26 A I H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.941 113.7 48.4 -60.3 -46.5 9.0 90.1 43.3 24 27 A A H X S+ 0 0 1 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.868 110.6 49.9 -65.6 -39.4 10.2 87.5 40.8 25 28 A L H X S+ 0 0 78 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.884 111.7 48.5 -68.0 -36.4 8.5 89.2 37.8 26 29 A K H X S+ 0 0 53 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.870 107.8 55.7 -72.7 -32.2 9.9 92.6 38.8 27 30 A L H < S+ 0 0 23 -4,-2.4 12,-0.2 1,-0.2 -1,-0.2 0.886 111.1 44.8 -61.1 -39.7 13.3 91.0 39.1 28 31 A R H < S+ 0 0 128 -4,-1.8 3,-0.3 -5,-0.2 -2,-0.2 0.919 117.9 43.4 -68.2 -42.6 13.0 89.8 35.6 29 32 A E H < S+ 0 0 137 -4,-2.1 2,-1.6 1,-0.2 3,-0.2 0.886 106.4 57.9 -72.0 -45.9 11.6 93.1 34.2 30 33 A D >< + 0 0 31 -4,-3.0 3,-0.6 1,-0.2 9,-0.4 -0.400 67.2 142.0 -88.3 61.8 13.9 95.6 36.0 31 34 A D T 3 + 0 0 82 -2,-1.6 -1,-0.2 -3,-0.3 -2,-0.1 0.585 49.2 72.6 -87.8 -10.0 17.0 94.0 34.5 32 35 A E T 3> + 0 0 86 -3,-0.2 4,-2.2 5,-0.1 3,-0.4 0.719 66.5 119.4 -75.4 -26.8 19.1 97.2 33.8 33 36 A Y H <>>S+ 0 0 24 -3,-0.6 5,-3.0 1,-0.2 4,-0.9 -0.051 79.8 7.2 -53.0 136.2 20.0 98.0 37.4 34 37 A D H >45S- 0 0 31 1,-0.2 3,-1.3 2,-0.2 -1,-0.2 0.951 139.2 -47.9 61.6 52.3 23.6 98.0 38.4 35 38 A N H 345S- 0 0 151 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.894 113.2 -49.5 51.7 46.3 25.0 97.6 34.9 36 39 A Y H 3<5S+ 0 0 158 -4,-2.2 -1,-0.3 1,-0.1 -2,-0.2 0.573 110.2 117.8 71.3 18.5 22.6 94.7 34.2 37 40 A I T <<5 - 0 0 16 -3,-1.3 3,-0.3 -4,-0.9 -3,-0.2 0.892 66.2-150.9 -70.0 -34.8 23.4 92.8 37.3 38 41 A G < - 0 0 8 -5,-3.0 4,-0.4 1,-0.2 -7,-0.1 -0.189 29.3 -67.8 82.9 174.3 19.7 93.3 38.2 39 42 A Y S > S+ 0 0 33 -9,-0.4 4,-2.2 -12,-0.2 5,-0.2 0.397 101.9 98.1 -82.9 -1.4 18.3 93.6 41.7 40 43 A G H > S+ 0 0 5 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.956 85.6 43.1 -54.6 -55.7 18.9 90.0 42.9 41 44 A P H > S+ 0 0 15 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.929 113.7 49.4 -59.5 -46.5 22.1 90.6 44.8 42 45 A V H > S+ 0 0 13 -4,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.866 109.9 53.1 -69.5 -27.0 21.0 93.8 46.5 43 46 A L H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.887 108.9 49.2 -69.0 -36.7 17.7 92.0 47.6 44 47 A V H X S+ 0 0 8 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.924 112.8 47.6 -64.0 -45.0 19.7 89.2 49.1 45 48 A R H X S+ 0 0 94 -4,-2.7 4,-3.1 1,-0.2 5,-0.2 0.877 109.0 54.3 -64.7 -36.5 21.9 91.7 50.9 46 49 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 5,-0.2 0.946 108.3 49.1 -60.3 -47.1 18.8 93.6 52.1 47 50 A A H X S+ 0 0 0 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.914 114.6 46.4 -56.7 -43.0 17.4 90.4 53.6 48 51 A W H X S+ 0 0 40 -4,-2.2 4,-2.9 2,-0.2 3,-0.4 0.937 113.3 45.8 -68.0 -45.5 20.7 89.8 55.3 49 52 A H H < S+ 0 0 4 -4,-3.1 4,-0.4 1,-0.2 -1,-0.2 0.831 111.1 52.5 -70.4 -31.8 21.2 93.2 56.7 50 53 A T H < S+ 0 0 5 -4,-2.5 -1,-0.2 -5,-0.2 17,-0.2 0.757 120.4 35.9 -72.8 -20.4 17.6 93.5 58.0 51 54 A S H >< S+ 0 0 0 -4,-1.0 3,-1.4 -3,-0.4 12,-0.3 0.759 105.6 69.8 -94.1 -31.1 18.2 90.2 59.8 52 55 A G T 3< S+ 0 0 0 -4,-2.9 -3,-0.1 1,-0.3 -2,-0.1 0.385 77.6 76.5 -80.4 -0.7 21.8 90.6 60.8 53 56 A T T 3 S+ 0 0 4 -4,-0.4 -1,-0.3 -5,-0.1 -2,-0.1 0.445 71.9 123.9 -77.5 -3.4 21.3 93.3 63.3 54 57 A W < - 0 0 23 -3,-1.4 2,-0.5 7,-0.2 7,-0.2 -0.288 47.6-160.1 -64.1 145.3 20.0 90.6 65.7 55 58 A D B >>> -B 60 0B 30 5,-2.0 4,-2.1 1,-0.1 3,-1.2 -0.972 7.1-157.5-122.4 113.3 21.7 90.1 69.0 56 59 A K T 345S+ 0 0 87 101,-2.2 -1,-0.1 -2,-0.5 102,-0.1 0.721 87.1 68.8 -60.6 -22.6 21.1 86.7 70.6 57 60 A H T 345S+ 0 0 138 100,-0.2 -1,-0.3 1,-0.2 -3,-0.0 0.835 123.9 2.7 -72.3 -30.5 21.8 88.0 74.0 58 61 A D T <45S- 0 0 77 -3,-1.2 -2,-0.2 2,-0.1 -1,-0.2 0.352 94.5-114.6-138.8 8.1 18.7 90.2 74.3 59 62 A N T <5 + 0 0 22 -4,-2.1 -3,-0.2 1,-0.2 2,-0.1 0.703 62.5 150.9 62.7 26.0 16.7 89.5 71.1 60 63 A T B < +B 55 0B 40 -5,-0.6 -5,-2.0 -7,-0.1 -1,-0.2 -0.445 53.6 5.1 -81.3 160.7 17.2 93.1 69.9 61 64 A G S S+ 0 0 12 73,-0.5 3,-0.2 -7,-0.2 -7,-0.2 -0.248 76.9 127.1 62.8-151.8 17.2 93.8 66.1 62 65 A G S S- 0 0 3 1,-0.2 3,-0.4 -13,-0.2 5,-0.4 -0.114 74.9 -68.8 87.4 172.7 16.6 90.9 63.8 63 66 A S S > S+ 0 0 3 206,-0.5 3,-0.8 203,-0.3 -1,-0.2 0.666 106.8 85.7 -71.1 -21.0 14.1 90.4 60.9 64 67 A Y T 3 S+ 0 0 22 205,-0.4 38,-0.4 1,-0.2 64,-0.2 0.878 90.3 41.6 -57.0 -46.8 10.9 90.4 62.9 65 68 A G T 3 S- 0 0 5 -3,-0.4 65,-1.8 -4,-0.2 -1,-0.2 0.591 89.4-136.4 -86.5 -6.6 10.1 94.1 63.2 66 69 A G X + 0 0 3 -3,-0.8 3,-1.4 -4,-0.3 -3,-0.1 0.858 43.2 160.5 59.0 40.0 11.0 95.3 59.7 67 70 A T G > + 0 0 5 -5,-0.4 3,-2.7 1,-0.3 6,-0.4 0.610 48.7 88.7 -76.5 -9.7 12.8 98.3 61.3 68 71 A Y G 3 S+ 0 0 2 1,-0.3 6,-0.3 5,-0.2 -1,-0.3 0.778 76.0 72.6 -52.6 -30.1 14.8 99.1 58.2 69 72 A R G < S+ 0 0 61 -3,-1.4 2,-0.3 4,-0.1 -1,-0.3 0.642 83.6 84.4 -63.6 -13.1 11.8 101.3 57.2 70 73 A F S X> S- 0 0 34 -3,-2.7 4,-2.5 1,-0.1 3,-0.8 -0.759 88.3-121.1 -95.1 146.9 12.9 103.7 59.9 71 74 A K H 3> S+ 0 0 124 -2,-0.3 4,-2.3 1,-0.3 -1,-0.1 0.771 106.1 61.4 -61.3 -33.3 15.5 106.4 59.1 72 75 A K H 34 S+ 0 0 81 1,-0.2 -1,-0.3 2,-0.2 -4,-0.1 0.940 115.8 33.8 -60.2 -41.0 18.0 105.4 61.8 73 76 A E H X4 S+ 0 0 3 -3,-0.8 3,-1.7 -6,-0.4 -2,-0.2 0.875 116.5 51.8 -82.8 -41.2 18.4 102.0 60.2 74 77 A F H 3< S+ 0 0 69 -4,-2.5 -1,-0.2 -7,-0.3 -2,-0.2 0.836 113.0 49.5 -69.0 -23.4 17.9 102.9 56.5 75 78 A N T 3< S+ 0 0 94 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.311 77.4 128.9 -94.4 10.7 20.6 105.5 57.0 76 79 A D X - 0 0 8 -3,-1.7 3,-2.5 1,-0.2 4,-0.1 -0.468 64.1-133.8 -57.9 127.9 23.1 103.2 58.7 77 80 A P G > S+ 0 0 97 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.849 107.2 62.6 -51.7 -34.0 26.4 103.7 56.8 78 81 A S G 3 S+ 0 0 37 1,-0.3 -2,-0.1 63,-0.0 -3,-0.0 0.680 100.9 53.0 -63.8 -19.5 26.6 99.9 56.7 79 82 A N G X S+ 0 0 0 -3,-2.5 3,-2.4 -6,-0.2 4,-0.4 0.226 74.4 145.9 -99.5 12.6 23.4 99.8 54.7 80 83 A A T < S+ 0 0 31 -3,-1.8 -5,-0.1 1,-0.3 101,-0.0 -0.311 72.3 18.3 -56.4 125.9 24.5 102.2 52.0 81 84 A G T > S+ 0 0 6 -2,-0.0 3,-1.9 100,-0.0 4,-0.4 0.010 92.9 102.7 102.7 -23.4 23.0 101.1 48.7 82 85 A L T X> + 0 0 2 -3,-2.4 4,-2.2 1,-0.3 3,-0.8 0.721 61.8 81.1 -68.2 -16.4 20.2 99.0 50.2 83 86 A Q H 3> S+ 0 0 74 -4,-0.4 4,-2.5 1,-0.3 -1,-0.3 0.798 84.7 62.6 -55.9 -27.2 17.7 101.8 49.5 84 87 A N H <> S+ 0 0 52 -3,-1.9 4,-1.9 2,-0.2 -1,-0.3 0.896 104.2 45.5 -66.1 -38.4 17.7 100.4 45.9 85 88 A G H <> S+ 0 0 0 -3,-0.8 4,-2.0 -4,-0.4 -2,-0.2 0.904 112.6 50.8 -68.9 -39.1 16.3 97.2 47.2 86 89 A F H X S+ 0 0 60 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.908 110.0 49.0 -62.4 -44.6 13.8 99.0 49.4 87 90 A K H < S+ 0 0 144 -4,-2.5 3,-0.4 1,-0.2 -1,-0.2 0.901 108.9 54.4 -65.0 -38.7 12.6 101.1 46.4 88 91 A F H < S+ 0 0 3 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.901 110.2 46.8 -53.6 -50.6 12.3 97.9 44.3 89 92 A L H X S+ 0 0 2 -4,-2.0 4,-2.8 1,-0.2 3,-0.3 0.682 90.9 85.4 -70.7 -17.6 10.1 96.4 47.0 90 93 A E H X S+ 0 0 98 -4,-1.2 4,-2.3 -3,-0.4 5,-0.2 0.909 90.8 44.3 -55.6 -49.3 7.9 99.5 47.3 91 94 A P H > S+ 0 0 60 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.824 112.3 55.4 -65.9 -26.0 5.5 98.7 44.5 92 95 A I H > S+ 0 0 6 -4,-0.5 4,-2.1 -3,-0.3 -2,-0.2 0.944 108.8 46.3 -65.3 -46.7 5.3 95.2 45.7 93 96 A H H < S+ 0 0 48 -4,-2.8 6,-0.2 1,-0.2 -1,-0.2 0.876 110.1 54.5 -65.2 -35.6 4.3 96.4 49.2 94 97 A K H < S+ 0 0 184 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.863 110.7 45.4 -63.8 -38.5 1.7 98.7 47.6 95 98 A E H < S+ 0 0 129 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.868 126.5 30.9 -71.9 -31.8 0.2 95.8 45.7 96 99 A F >< + 0 0 20 -4,-2.1 3,-1.9 -5,-0.1 -1,-0.3 -0.602 69.3 163.4-125.7 68.0 0.2 93.6 48.8 97 100 A P T 3 + 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.646 67.1 70.5 -68.4 -13.8 -0.2 96.0 51.7 98 101 A W T 3 S+ 0 0 55 -3,-0.1 2,-0.2 2,-0.1 -89,-0.1 0.618 76.4 95.4 -73.7 -18.4 -1.1 93.2 54.1 99 102 A I S < S- 0 0 4 -3,-1.9 -3,-0.0 -6,-0.2 29,-0.0 -0.549 80.4-117.9 -78.1 142.5 2.4 91.7 54.2 100 103 A S > - 0 0 12 -2,-0.2 4,-2.4 27,-0.2 5,-0.2 -0.351 20.3-116.5 -72.0 161.6 4.5 92.9 57.1 101 104 A S H > S+ 0 0 8 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.928 115.5 48.4 -62.9 -44.7 7.7 94.7 56.3 102 105 A G H > S+ 0 0 1 -38,-0.4 4,-2.2 2,-0.2 5,-0.3 0.895 110.8 50.9 -64.8 -40.5 9.9 92.0 57.8 103 106 A D H > S+ 0 0 0 24,-0.2 4,-2.6 -39,-0.2 -1,-0.2 0.943 113.1 46.5 -61.9 -39.9 8.1 89.4 55.9 104 107 A L H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.940 112.3 48.1 -71.5 -44.7 8.6 91.4 52.7 105 108 A F H X S+ 0 0 3 -4,-3.1 4,-1.2 2,-0.2 -1,-0.2 0.924 117.6 42.1 -60.5 -43.2 12.3 92.1 53.2 106 109 A S H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.3 3,-0.4 0.923 113.4 51.8 -71.1 -40.1 13.1 88.5 54.1 107 110 A L H X S+ 0 0 0 -4,-2.6 4,-3.1 -5,-0.3 5,-0.3 0.853 102.6 61.2 -64.0 -33.8 10.9 87.1 51.3 108 111 A G H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.907 106.3 46.6 -56.3 -41.1 12.7 89.4 48.9 109 112 A G H X S+ 0 0 0 -4,-1.2 4,-2.6 -3,-0.4 -2,-0.2 0.897 112.8 47.5 -69.0 -45.0 15.9 87.6 49.7 110 113 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.930 113.4 48.7 -56.9 -48.6 14.4 84.2 49.4 111 114 A T H X S+ 0 0 0 -4,-3.1 4,-3.1 1,-0.2 5,-0.2 0.927 111.4 50.1 -62.5 -45.0 12.9 85.1 46.1 112 115 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 6,-0.2 0.936 110.6 48.5 -59.2 -47.8 16.1 86.5 44.8 113 116 A V H <>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 82,-0.3 0.948 116.2 43.3 -57.5 -48.5 18.2 83.5 45.7 114 117 A Q H ><5S+ 0 0 5 -4,-2.5 3,-1.8 1,-0.2 -2,-0.2 0.920 112.5 50.3 -67.6 -42.9 15.7 81.1 44.1 115 118 A E H 3<5S+ 0 0 47 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.815 104.5 60.5 -66.5 -25.6 15.1 83.1 41.0 116 119 A M T 3<5S- 0 0 13 -4,-2.1 79,-2.2 -5,-0.2 -1,-0.3 0.304 127.8-100.3 -79.6 8.5 18.9 83.3 40.6 117 120 A Q T < 5S+ 0 0 122 -3,-1.8 -3,-0.2 77,-0.2 -2,-0.2 0.716 80.0 137.7 80.7 21.4 18.9 79.5 40.4 118 121 A G < - 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