==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 24-FEB-97 1AEE . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR R.A.MUSAH,G.M.JENSEN,M.M.FITZGERALD,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) . 13103.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 62.2 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 . 11 3.8 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 . 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 . 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 4 A L 0 0 126 0, 0.0 2,-0.4 0, 0.0 269,-0.0 0.000 360.0 360.0 360.0 115.3 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 -0.903 360.0-170.3-108.9 134.2 9.7 90.2 73.9 3 6 A H - 0 0 29 267,-0.5 269,-3.3 -2,-0.4 2,-0.5 -0.928 8.1-163.1-122.2 104.3 8.6 90.6 70.3 4 7 A V B -a 272 0A 66 -2,-0.5 2,-0.2 267,-0.2 269,-0.2 -0.772 20.4-122.9 -96.3 127.5 5.7 88.3 69.3 5 8 A A - 0 0 13 267,-2.9 2,-0.4 -2,-0.5 122,-0.2 -0.534 27.5-170.0 -63.0 130.9 5.0 87.8 65.7 6 9 A S - 0 0 76 120,-2.5 120,-0.2 -2,-0.2 3,-0.1 -0.961 21.8-126.8-127.6 107.5 1.4 88.7 64.7 7 10 A V - 0 0 55 -2,-0.4 3,-0.2 118,-0.1 121,-0.0 -0.334 35.5-101.8 -55.4 132.0 0.1 87.7 61.2 8 11 A E > - 0 0 23 1,-0.2 3,-2.1 2,-0.1 -1,-0.1 -0.313 65.4 -73.6 -50.2 132.7 -1.4 90.7 59.3 9 12 A K T 3 S- 0 0 172 1,-0.3 -1,-0.2 89,-0.1 3,-0.1 -0.045 105.5 -16.2 -51.3 119.4 -5.2 90.3 59.7 10 13 A G T 3 S+ 0 0 77 1,-0.2 -1,-0.3 -3,-0.2 2,-0.1 0.448 97.5 139.4 73.5 1.9 -6.7 87.5 57.6 11 14 A R < + 0 0 83 -3,-2.1 2,-0.2 3,-0.1 -1,-0.2 -0.427 23.7 171.9 -77.8 147.7 -3.7 87.2 55.3 12 15 A S >> - 0 0 49 -2,-0.1 4,-1.4 -3,-0.1 3,-1.0 -0.788 51.4 -65.2-136.8-171.9 -2.3 83.8 54.1 13 16 A Y H 3> S+ 0 0 67 1,-0.2 4,-2.6 -2,-0.2 5,-0.2 0.853 125.3 57.8 -44.8 -46.2 0.3 82.4 51.6 14 17 A E H 3> S+ 0 0 119 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.868 103.8 53.5 -60.6 -34.7 -1.4 83.7 48.5 15 18 A D H <> S+ 0 0 22 -3,-1.0 4,-1.6 2,-0.2 3,-0.3 0.962 111.5 43.6 -64.8 -49.4 -1.3 87.3 49.8 16 19 A F H X S+ 0 0 0 -4,-1.4 4,-3.1 1,-0.2 -2,-0.2 0.889 108.0 58.5 -70.1 -33.3 2.5 87.2 50.4 17 20 A Q H X S+ 0 0 13 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.883 104.4 53.7 -63.2 -30.9 3.1 85.5 47.0 18 21 A K H X S+ 0 0 111 -4,-1.5 4,-2.1 -3,-0.3 -2,-0.2 0.925 110.1 45.5 -66.7 -42.3 1.4 88.5 45.4 19 22 A V H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.951 113.1 51.3 -65.4 -44.5 3.8 90.9 47.2 20 23 A Y H X S+ 0 0 0 -4,-3.1 4,-3.0 1,-0.2 5,-0.3 0.951 111.3 47.3 -50.2 -56.5 6.7 88.6 46.2 21 24 A N H X S+ 0 0 22 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.890 108.8 54.6 -59.6 -35.0 5.6 88.7 42.5 22 25 A A H X S+ 0 0 17 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.955 112.0 43.2 -64.7 -45.4 5.2 92.5 42.6 23 26 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.968 115.4 49.5 -61.8 -48.9 8.8 92.9 43.9 24 27 A A H X S+ 0 0 1 -4,-3.0 4,-1.4 1,-0.2 -2,-0.2 0.871 109.8 51.3 -61.1 -35.4 10.2 90.3 41.4 25 28 A L H X S+ 0 0 76 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.904 110.9 46.8 -70.4 -39.3 8.3 91.9 38.5 26 29 A K H X S+ 0 0 36 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.861 107.0 59.3 -73.7 -29.5 9.7 95.4 39.3 27 30 A L H < S+ 0 0 26 -4,-2.4 12,-0.2 1,-0.2 -2,-0.2 0.886 109.8 44.1 -60.7 -36.3 13.3 93.8 39.6 28 31 A R H < S+ 0 0 132 -4,-1.4 3,-0.5 -5,-0.2 -2,-0.2 0.900 117.1 45.3 -72.0 -41.5 12.9 92.6 36.0 29 32 A E H < S+ 0 0 133 -4,-1.9 2,-1.4 1,-0.2 3,-0.3 0.942 108.8 52.3 -71.7 -52.8 11.5 96.0 34.8 30 33 A D >< + 0 0 32 -4,-3.0 3,-0.7 1,-0.2 9,-0.4 -0.227 69.5 139.0 -85.0 56.9 14.0 98.4 36.5 31 34 A D T 3 + 0 0 81 -2,-1.4 -1,-0.2 -3,-0.5 -2,-0.1 0.567 51.8 72.0 -77.5 -12.1 17.0 96.6 35.2 32 35 A E T 3> + 0 0 85 -3,-0.3 4,-2.2 4,-0.1 3,-0.3 0.760 66.6 121.3 -79.9 -22.9 19.2 99.7 34.3 33 36 A Y H <>>S+ 0 0 40 -3,-0.7 5,-2.7 2,-0.2 4,-1.0 -0.037 78.9 6.3 -47.8 136.6 20.0 100.8 37.9 34 37 A D H >45S- 0 0 39 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.956 139.5 -46.9 50.9 59.0 23.7 101.0 38.8 35 38 A N H 345S- 0 0 153 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.2 0.894 113.0 -48.8 47.4 53.7 25.0 100.3 35.3 36 39 A Y H 3<5S+ 0 0 155 -4,-2.2 -1,-0.3 1,-0.1 -2,-0.2 0.592 110.0 114.1 66.3 17.4 22.7 97.4 34.7 37 40 A I T <<5 - 0 0 19 -3,-1.2 3,-0.3 -4,-1.0 -3,-0.2 0.884 67.3-152.3 -73.6 -35.3 23.4 95.5 37.9 38 41 A G < - 0 0 8 -5,-2.7 4,-0.4 1,-0.2 -7,-0.2 -0.184 29.6 -64.8 85.0 174.9 19.8 96.2 38.8 39 42 A Y S > S+ 0 0 36 -9,-0.4 4,-1.8 -12,-0.2 -1,-0.2 0.554 102.8 95.2 -78.5 -8.1 18.2 96.4 42.3 40 43 A G H > S+ 0 0 6 -3,-0.3 4,-2.0 2,-0.2 5,-0.2 0.944 85.3 46.8 -50.6 -54.7 18.8 92.8 43.6 41 44 A P H > S+ 0 0 17 0, 0.0 4,-2.7 0, 0.0 3,-0.4 0.955 111.7 48.6 -57.7 -51.9 22.1 93.5 45.5 42 45 A V H > S+ 0 0 20 -4,-0.4 4,-2.5 1,-0.2 -2,-0.2 0.861 109.8 55.3 -62.8 -26.7 21.0 96.7 47.3 43 46 A L H X S+ 0 0 2 -4,-1.8 4,-2.0 -3,-0.2 -1,-0.2 0.898 108.4 45.0 -75.3 -34.4 17.8 94.9 48.4 44 47 A V H X S+ 0 0 10 -4,-2.0 4,-2.2 -3,-0.4 -2,-0.2 0.944 113.3 53.1 -75.8 -27.8 19.6 92.0 50.1 45 48 A R H X S+ 0 0 75 -4,-2.7 4,-2.9 -5,-0.2 5,-0.2 0.943 108.5 49.9 -62.7 -41.4 22.0 94.7 51.6 46 49 A L H X S+ 0 0 1 -4,-2.5 4,-2.4 -5,-0.2 5,-0.3 0.953 109.0 50.8 -61.4 -45.2 18.9 96.5 53.0 47 50 A A H X S+ 0 0 0 -4,-2.0 4,-0.9 1,-0.2 -1,-0.2 0.905 112.7 47.4 -62.3 -38.0 17.4 93.3 54.5 48 51 A W H X S+ 0 0 47 -4,-2.2 4,-3.1 2,-0.2 3,-0.4 0.945 111.7 49.2 -67.7 -46.5 20.8 92.6 56.2 49 52 A H H < S+ 0 0 14 -4,-2.9 4,-0.4 1,-0.2 -2,-0.2 0.871 109.9 50.2 -66.4 -30.8 21.2 96.2 57.6 50 53 A I H < S+ 0 0 4 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.783 121.0 36.9 -76.6 -21.0 17.6 96.3 59.1 51 54 A S H >< S+ 0 0 1 -4,-0.9 3,-2.0 -3,-0.4 -2,-0.2 0.814 102.7 73.1 -90.1 -33.0 18.4 92.9 60.8 52 55 A G T 3< S+ 0 0 0 -4,-3.1 -3,-0.1 1,-0.3 -2,-0.1 0.471 81.2 72.6 -64.1 -10.3 22.0 93.6 61.6 53 56 A T T 3 S+ 0 0 4 -4,-0.4 -1,-0.3 -5,-0.1 -2,-0.1 0.460 71.9 120.9 -80.6 -7.7 21.2 96.0 64.4 54 57 A W < - 0 0 21 -3,-2.0 2,-0.4 7,-0.2 7,-0.2 -0.267 46.5-160.2 -61.4 146.1 20.0 93.1 66.7 55 58 A D B >>> -B 60 0B 28 5,-2.0 4,-1.3 1,-0.1 3,-0.8 -0.927 9.1-155.6-126.9 115.2 21.6 92.6 70.1 56 59 A K T 345S+ 0 0 86 101,-2.5 -1,-0.1 -2,-0.4 102,-0.1 0.738 87.8 65.8 -58.8 -21.7 21.2 89.2 71.7 57 60 A H T 345S+ 0 0 142 100,-0.2 -1,-0.2 1,-0.2 100,-0.0 0.908 123.6 7.1 -74.6 -38.3 21.7 90.5 75.2 58 61 A D T <45S- 0 0 77 -3,-0.8 -1,-0.2 2,-0.1 -2,-0.2 0.236 95.1-119.4-127.0 12.4 18.6 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 0.755 62.4 145.8 53.3 28.9 16.7 91.8 72.3 60 63 A T B < +B 55 0B 33 -5,-0.7 -5,-2.0 -7,-0.1 -1,-0.2 -0.609 49.5 14.0 -88.1 159.8 16.8 95.4 70.9 61 64 A G S S+ 0 0 15 73,-0.4 -7,-0.2 -7,-0.2 3,-0.2 -0.289 72.0 120.5 71.4-158.8 17.1 96.1 67.2 62 65 A G S S- 0 0 6 -13,-0.2 3,-0.4 -12,-0.2 5,-0.3 -0.170 79.4 -65.5 87.1 174.8 16.5 93.5 64.5 63 66 A S S > S+ 0 0 2 206,-0.3 3,-1.2 203,-0.3 -1,-0.2 0.735 106.5 88.2 -76.0 -20.9 14.0 93.3 61.7 64 67 A Y T 3 S+ 0 0 21 205,-0.4 38,-0.4 1,-0.2 -1,-0.2 0.840 88.4 42.6 -44.9 -53.8 10.8 93.1 63.8 65 68 A G T 3 S- 0 0 6 -3,-0.4 65,-1.8 -4,-0.2 -1,-0.2 0.546 89.9-136.6 -80.3 -11.6 10.0 96.8 64.3 66 69 A G X + 0 0 3 -3,-1.2 3,-1.6 -4,-0.2 4,-0.1 0.804 45.1 158.0 57.2 33.8 10.7 98.2 60.8 67 70 A T G > + 0 0 5 -5,-0.3 3,-1.7 1,-0.3 6,-0.4 0.558 48.2 87.2 -75.2 -3.5 12.5 101.1 62.4 68 71 A Y G 3 S+ 0 0 2 1,-0.3 -1,-0.3 5,-0.2 6,-0.2 0.745 75.4 72.6 -63.2 -23.0 14.6 102.0 59.3 69 72 A R G < S+ 0 0 75 -3,-1.6 2,-0.3 4,-0.1 -1,-0.3 0.748 85.0 87.5 -65.7 -17.5 11.6 104.1 58.2 70 73 A F S <> S- 0 0 30 -3,-1.7 4,-2.6 -4,-0.1 3,-0.5 -0.625 88.6-117.5 -86.5 143.1 12.6 106.6 61.0 71 74 A K H > S+ 0 0 144 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.798 108.1 56.7 -43.1 -48.8 15.1 109.4 60.5 72 75 A K H 4 S+ 0 0 84 2,-0.2 -1,-0.2 1,-0.2 4,-0.1 0.948 117.2 33.5 -56.8 -50.5 17.8 108.2 63.0 73 76 A E H >4 S+ 0 0 4 -3,-0.5 3,-1.6 -6,-0.4 -2,-0.2 0.934 117.1 53.9 -73.0 -42.9 18.2 104.8 61.4 74 77 A F H 3< S+ 0 0 43 -4,-2.6 -1,-0.2 -7,-0.3 -2,-0.2 0.836 112.8 46.5 -58.1 -32.3 17.6 106.0 57.8 75 78 A N T 3< S+ 0 0 106 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.307 77.4 129.1 -96.7 10.3 20.3 108.6 58.3 76 79 A D X - 0 0 10 -3,-1.6 3,-2.1 1,-0.2 4,-0.1 -0.484 63.7-132.4 -59.3 128.6 22.9 106.2 59.9 77 80 A P G > S+ 0 0 100 0, 0.0 3,-1.7 0, 0.0 -1,-0.2 0.890 107.9 62.2 -52.8 -35.4 26.2 106.8 57.9 78 81 A S G 3 S+ 0 0 40 1,-0.3 -2,-0.1 63,-0.1 -3,-0.0 0.697 99.1 55.6 -63.2 -20.5 26.5 102.9 57.7 79 82 A N G X S+ 0 0 0 -3,-2.1 3,-2.0 -6,-0.2 4,-0.4 0.236 75.2 142.1 -96.9 12.0 23.2 102.9 55.7 80 83 A A T < S+ 0 0 27 -3,-1.7 101,-0.1 1,-0.3 -5,-0.1 -0.293 70.8 19.0 -57.3 124.5 24.4 105.3 53.0 81 84 A G T > S+ 0 0 6 -2,-0.1 3,-1.3 99,-0.1 4,-0.4 0.087 94.9 100.7 100.2 -22.3 23.1 104.3 49.5 82 85 A L T X> + 0 0 0 -3,-2.0 4,-2.2 1,-0.2 3,-1.0 0.753 60.2 82.9 -71.2 -15.0 20.2 102.1 50.9 83 86 A Q H 3> S+ 0 0 47 -4,-0.4 4,-2.6 1,-0.3 -1,-0.2 0.876 84.8 61.1 -53.5 -33.3 17.8 105.0 50.2 84 87 A N H <> S+ 0 0 61 -3,-1.3 4,-1.6 2,-0.2 -1,-0.3 0.895 104.1 46.8 -61.6 -39.8 17.8 103.6 46.7 85 88 A G H <> S+ 0 0 0 -3,-1.0 4,-2.2 -4,-0.4 -2,-0.2 0.954 111.9 51.2 -66.4 -46.0 16.4 100.2 48.0 86 89 A F H X S+ 0 0 46 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.931 109.3 49.3 -56.2 -47.6 13.7 102.0 50.1 87 90 A K H < S+ 0 0 112 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.873 108.7 54.4 -63.5 -33.5 12.6 104.1 47.1 88 91 A F H X S+ 0 0 3 -4,-1.6 4,-0.6 -5,-0.2 -1,-0.2 0.923 112.7 42.4 -62.7 -45.6 12.3 100.9 45.1 89 92 A L H X S+ 0 0 3 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.732 94.8 82.3 -74.7 -19.3 10.0 99.3 47.7 90 93 A E H X S+ 0 0 81 -4,-1.7 4,-1.9 1,-0.2 5,-0.2 0.922 89.4 49.3 -60.8 -48.2 7.9 102.4 48.3 91 94 A P H > S+ 0 0 60 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.897 110.9 52.5 -51.6 -41.0 5.5 101.9 45.3 92 95 A I H X S+ 0 0 6 -4,-0.6 4,-2.2 1,-0.2 -2,-0.2 0.902 107.1 51.1 -68.4 -34.0 5.0 98.3 46.4 93 96 A H H < S+ 0 0 47 -4,-2.2 -1,-0.2 2,-0.2 6,-0.2 0.904 107.7 52.9 -68.1 -37.7 4.1 99.3 49.9 94 97 A K H < S+ 0 0 143 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.904 111.0 47.9 -59.5 -42.9 1.5 101.8 48.4 95 98 A E H < S+ 0 0 126 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.838 124.0 30.6 -69.3 -33.3 0.1 98.9 46.5 96 99 A F >< + 0 0 19 -4,-2.2 3,-1.8 -5,-0.2 -1,-0.3 -0.560 69.5 166.8-124.1 72.6 -0.1 96.5 49.5 97 100 A P T 3 + 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.681 68.5 69.5 -65.4 -17.0 -0.6 98.9 52.5 98 101 A W T 3 S+ 0 0 55 -3,-0.1 2,-0.3 2,-0.1 -89,-0.1 0.669 77.0 93.3 -72.7 -23.3 -1.5 96.0 54.8 99 102 A I S < S- 0 0 4 -3,-1.8 -3,-0.1 -6,-0.2 2,-0.0 -0.560 79.3-121.0 -75.7 135.6 2.1 94.5 54.9 100 103 A S > - 0 0 16 -2,-0.3 4,-2.2 27,-0.2 5,-0.2 -0.287 20.5-114.4 -66.8 158.8 4.2 95.7 57.9 101 104 A S H > S+ 0 0 8 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.957 115.0 50.1 -63.0 -46.5 7.5 97.5 57.2 102 105 A G H > S+ 0 0 0 -38,-0.4 4,-2.5 1,-0.2 5,-0.2 0.892 112.2 49.5 -58.0 -40.6 9.8 94.8 58.7 103 106 A D H > S+ 0 0 0 24,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.918 112.2 46.2 -66.2 -43.8 8.0 92.2 56.6 104 107 A L H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.925 113.4 49.0 -66.2 -43.1 8.3 94.1 53.4 105 108 A F H X S+ 0 0 7 -4,-2.8 4,-1.3 2,-0.2 -2,-0.2 0.961 116.3 42.2 -64.4 -43.9 12.1 94.9 54.0 106 109 A S H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.921 113.2 52.4 -71.2 -35.6 12.9 91.3 54.8 107 110 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.888 103.2 59.6 -65.2 -34.0 10.7 89.9 52.0 108 111 A G H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.928 106.5 47.9 -55.6 -41.7 12.6 92.2 49.5 109 112 A G H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.938 112.9 47.0 -65.8 -45.5 15.8 90.4 50.5 110 113 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 5,-0.3 0.957 112.3 49.8 -59.5 -49.7 14.3 86.9 50.1 111 114 A T H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.911 110.3 50.5 -59.1 -45.9 12.8 87.8 46.7 112 115 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 6,-0.2 0.966 110.4 48.3 -60.4 -48.9 16.1 89.3 45.3 113 116 A V H <>S+ 0 0 0 -4,-2.1 5,-2.8 1,-0.2 82,-0.2 0.939 116.6 42.9 -57.0 -48.0 18.2 86.2 46.3 114 117 A Q H ><5S+ 0 0 6 -4,-2.3 3,-1.3 1,-0.2 -1,-0.2 0.899 114.3 49.6 -66.9 -40.6 15.7 83.8 44.7 115 118 A E H 3<5S+ 0 0 43 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.802 106.2 56.1 -72.5 -24.7 15.2 85.9 41.6 116 119 A M T 3<5S- 0 0 17 -4,-2.4 79,-3.1 -5,-0.2 -1,-0.3 0.126 128.4-102.4 -88.0 27.4 19.0 86.2 41.2 117 120 A Q T < 5S+ 0 0 117 -3,-1.3 -3,-0.2 77,-0.2 -2,-0.1 0.706 76.4 139.3 53.5 34.0 18.9 82.3 41.2 118 121 A G < - 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