==== 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 3M2D . 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) . 13024.0 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 . 14 4.8 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 . 42 14.4 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 . 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 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 . 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 0 133 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 118.9 11.4 90.6 74.6 2 5 A V - 0 0 104 2,-0.0 2,-0.7 269,-0.0 269,-0.1 -0.905 360.0-156.3-100.8 130.6 9.7 87.6 72.9 3 6 A H E -a 271 0A 25 267,-0.6 269,-3.2 -2,-0.5 2,-0.5 -0.899 10.8-163.1-112.6 102.6 8.7 88.1 69.3 4 7 A V E -a 272 0A 70 -2,-0.7 269,-0.2 267,-0.2 2,-0.1 -0.734 22.9-118.1 -92.3 125.7 5.9 85.6 68.5 5 8 A A - 0 0 10 267,-2.7 2,-0.4 -2,-0.5 122,-0.2 -0.410 30.0-168.2 -58.8 133.0 5.1 85.1 64.8 6 9 A S - 0 0 74 120,-2.5 120,-0.2 -2,-0.1 3,-0.1 -0.966 20.6-127.3-133.2 109.3 1.6 86.2 63.9 7 10 A V - 0 0 54 -2,-0.4 3,-0.2 118,-0.1 5,-0.0 -0.332 34.3-100.9 -60.9 130.8 0.3 85.1 60.6 8 11 A E > - 0 0 19 1,-0.2 3,-2.6 2,-0.1 -1,-0.1 -0.305 64.3 -79.1 -53.6 134.0 -1.1 88.0 58.5 9 12 A K T 3 S- 0 0 200 1,-0.3 -1,-0.2 89,-0.1 3,-0.1 -0.126 106.0 -11.8 -60.3 123.4 -4.9 87.6 59.0 10 13 A G T 3 S+ 0 0 73 1,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.383 98.9 138.1 78.5 0.7 -6.4 84.9 56.9 11 14 A R < + 0 0 81 -3,-2.6 -1,-0.2 3,-0.1 2,-0.2 -0.465 24.4 172.9 -84.4 151.5 -3.3 84.5 54.7 12 15 A S >> - 0 0 61 -2,-0.2 4,-1.6 -3,-0.1 3,-1.1 -0.749 51.5 -67.9-142.0-173.9 -1.9 81.2 53.5 13 16 A Y H 3> S+ 0 0 65 1,-0.3 4,-2.4 -2,-0.2 5,-0.2 0.856 125.6 57.1 -53.0 -40.1 0.7 79.9 51.2 14 17 A E H 3> S+ 0 0 114 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.852 103.7 53.5 -63.3 -34.5 -1.0 81.0 48.0 15 18 A D H <> S+ 0 0 20 -3,-1.1 4,-1.5 2,-0.2 -1,-0.2 0.934 112.2 44.1 -61.6 -47.0 -1.0 84.7 49.2 16 19 A F H X S+ 0 0 0 -4,-1.6 4,-2.9 2,-0.2 -2,-0.2 0.854 108.3 57.4 -71.2 -30.4 2.7 84.6 49.8 17 20 A Q H X S+ 0 0 13 -4,-2.4 4,-2.9 -5,-0.2 -1,-0.2 0.889 104.7 53.8 -64.6 -36.0 3.4 82.8 46.5 18 21 A K H X S+ 0 0 105 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.903 110.0 45.9 -63.0 -39.9 1.6 85.8 44.9 19 22 A V H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.929 112.5 51.0 -66.9 -45.4 4.0 88.2 46.6 20 23 A Y H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 5,-0.2 0.933 110.8 50.1 -46.7 -53.8 7.0 85.9 45.7 21 24 A N H X S+ 0 0 22 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.889 107.9 50.7 -63.3 -38.0 5.8 86.0 42.1 22 25 A A H X S+ 0 0 16 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.919 113.0 47.1 -65.6 -39.9 5.4 89.8 42.0 23 26 A I H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.942 113.6 48.3 -60.8 -47.0 9.0 90.1 43.3 24 27 A A H X S+ 0 0 1 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.873 110.7 50.0 -65.0 -38.5 10.2 87.6 40.9 25 28 A L H X S+ 0 0 78 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.885 111.5 48.6 -68.9 -36.7 8.5 89.2 37.9 26 29 A K H X S+ 0 0 51 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.877 107.7 55.8 -72.4 -32.2 9.9 92.7 38.8 27 30 A L H < S+ 0 0 23 -4,-2.4 12,-0.2 1,-0.2 -2,-0.2 0.894 110.9 44.9 -61.0 -39.7 13.3 91.1 39.2 28 31 A R H < S+ 0 0 129 -4,-1.9 3,-0.3 -5,-0.2 -2,-0.2 0.928 117.7 43.4 -68.4 -42.8 13.0 89.9 35.7 29 32 A E H < S+ 0 0 136 -4,-2.2 2,-1.7 1,-0.2 3,-0.2 0.879 106.3 58.0 -71.0 -45.9 11.6 93.2 34.3 30 33 A D >< + 0 0 31 -4,-2.9 3,-0.6 1,-0.2 9,-0.4 -0.410 67.0 142.2 -88.0 61.7 13.9 95.7 36.0 31 34 A D T 3 + 0 0 83 -2,-1.7 -1,-0.2 -3,-0.3 -2,-0.1 0.570 49.2 72.6 -87.6 -9.1 17.0 94.1 34.6 32 35 A E T 3> + 0 0 84 -3,-0.2 4,-2.2 5,-0.1 3,-0.4 0.721 66.4 119.4 -76.6 -26.6 19.1 97.3 33.9 33 36 A Y H <>>S+ 0 0 24 -3,-0.6 5,-3.0 1,-0.2 4,-0.9 -0.053 79.9 7.2 -52.6 136.0 20.0 98.1 37.5 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 -48.0 61.4 52.3 23.6 98.1 38.5 35 38 A N H 345S- 0 0 152 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.893 113.0 -49.4 51.7 46.8 25.0 97.7 34.9 36 39 A Y H 3<5S+ 0 0 157 -4,-2.2 -1,-0.3 1,-0.1 -2,-0.2 0.570 110.3 117.5 71.6 17.9 22.6 94.8 34.2 37 40 A I T <<5 - 0 0 16 -3,-1.3 3,-0.3 -4,-0.9 -3,-0.2 0.896 66.3-151.1 -69.7 -35.1 23.4 92.9 37.4 38 41 A G < - 0 0 8 -5,-3.0 4,-0.4 1,-0.2 -7,-0.1 -0.196 29.3 -67.5 83.6 174.3 19.8 93.4 38.3 39 42 A Y S > S+ 0 0 33 -9,-0.4 4,-2.2 -12,-0.2 5,-0.2 0.398 102.0 98.1 -82.6 -1.8 18.3 93.7 41.8 40 43 A G H > S+ 0 0 4 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.955 85.5 42.9 -54.6 -56.0 18.9 90.1 42.9 41 44 A P H > S+ 0 0 14 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.930 113.7 49.7 -60.0 -46.1 22.1 90.7 44.9 42 45 A V H > S+ 0 0 13 -4,-0.4 4,-2.5 1,-0.2 -2,-0.2 0.861 109.8 53.1 -68.7 -27.5 21.0 93.9 46.6 43 46 A L H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.891 108.8 49.3 -68.6 -37.1 17.7 92.1 47.7 44 47 A V H X S+ 0 0 7 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.922 112.9 47.2 -64.2 -45.2 19.7 89.3 49.2 45 48 A R H X S+ 0 0 93 -4,-2.7 4,-3.2 1,-0.2 5,-0.3 0.884 108.9 54.5 -64.2 -36.8 21.9 91.8 51.0 46 49 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 5,-0.2 0.946 108.2 49.2 -59.6 -47.0 18.8 93.7 52.2 47 50 A A H X S+ 0 0 0 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.909 114.4 46.4 -57.5 -42.0 17.4 90.5 53.7 48 51 A W H X S+ 0 0 40 -4,-2.1 4,-2.9 2,-0.2 3,-0.4 0.937 113.1 46.2 -69.1 -44.9 20.7 89.8 55.4 49 52 A H H < S+ 0 0 4 -4,-3.2 4,-0.4 1,-0.2 -1,-0.2 0.828 110.9 52.6 -69.7 -31.1 21.2 93.3 56.8 50 53 A T H < S+ 0 0 6 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.756 120.3 35.9 -73.9 -20.3 17.7 93.6 58.1 51 54 A S H >< S+ 0 0 0 -4,-1.0 3,-1.4 -3,-0.4 12,-0.3 0.751 105.3 70.1 -94.0 -30.5 18.2 90.3 59.9 52 55 A G T 3< S+ 0 0 0 -4,-2.9 -2,-0.1 1,-0.3 -3,-0.1 0.388 77.5 76.6 -79.7 -1.4 21.8 90.7 60.9 53 56 A T T 3 S+ 0 0 4 -4,-0.4 -1,-0.3 -3,-0.1 -2,-0.1 0.432 71.7 124.3 -77.5 -3.9 21.3 93.4 63.5 54 57 A W < - 0 0 23 -3,-1.4 2,-0.5 7,-0.2 7,-0.2 -0.286 47.2-160.5 -63.1 144.7 20.1 90.6 65.8 55 58 A D B >>> -B 60 0B 30 5,-2.0 4,-2.2 1,-0.1 3,-1.2 -0.971 7.2-157.6-122.4 113.4 21.7 90.2 69.2 56 59 A K T 345S+ 0 0 87 101,-2.2 -1,-0.1 -2,-0.5 102,-0.1 0.729 86.9 69.0 -61.1 -22.6 21.1 86.7 70.7 57 60 A H T 345S+ 0 0 137 100,-0.2 -1,-0.3 1,-0.2 -3,-0.0 0.826 123.9 2.7 -71.7 -30.6 21.8 88.1 74.1 58 61 A D T <45S- 0 0 78 -3,-1.2 -2,-0.2 2,-0.1 -1,-0.2 0.352 94.4-114.7-139.0 7.6 18.7 90.3 74.4 59 62 A N T <5 + 0 0 23 -4,-2.2 -3,-0.2 1,-0.2 2,-0.1 0.697 62.6 150.6 63.6 25.5 16.8 89.6 71.2 60 63 A T B < +B 55 0B 39 -5,-0.6 -5,-2.0 -7,-0.1 -1,-0.2 -0.436 53.6 5.6 -81.5 160.4 17.2 93.2 70.0 61 64 A G S S+ 0 0 12 73,-0.5 3,-0.2 -7,-0.2 -7,-0.2 -0.250 77.0 126.9 63.4-151.8 17.3 93.9 66.3 62 65 A G S S- 0 0 3 1,-0.2 3,-0.4 -13,-0.2 5,-0.4 -0.111 75.1 -68.9 87.3 173.4 16.6 90.9 63.9 63 66 A S S > S+ 0 0 4 206,-0.5 3,-0.8 203,-0.3 -1,-0.2 0.665 106.7 85.9 -71.1 -21.5 14.1 90.5 61.0 64 67 A Y T 3 S+ 0 0 22 205,-0.4 38,-0.4 1,-0.2 64,-0.3 0.877 90.2 41.6 -55.7 -48.5 10.9 90.5 63.1 65 68 A G T 3 S- 0 0 5 -3,-0.4 65,-1.8 -4,-0.2 -1,-0.2 0.582 89.3-136.2 -85.6 -7.7 10.2 94.2 63.4 66 69 A G X + 0 0 3 -3,-0.8 3,-1.4 -4,-0.3 -3,-0.1 0.850 43.3 160.4 60.6 38.5 11.0 95.4 59.9 67 70 A T G > + 0 0 5 -5,-0.4 3,-2.8 1,-0.3 6,-0.4 0.606 48.6 88.4 -75.8 -10.2 12.8 98.4 61.4 68 71 A Y G 3 S+ 0 0 2 1,-0.3 6,-0.3 5,-0.2 -1,-0.3 0.775 76.2 72.6 -52.6 -30.0 14.8 99.2 58.3 69 72 A R G < S+ 0 0 62 -3,-1.4 2,-0.3 4,-0.1 -1,-0.3 0.641 83.6 84.7 -64.1 -12.2 11.8 101.4 57.3 70 73 A F S X> S- 0 0 33 -3,-2.8 4,-2.4 1,-0.1 3,-0.9 -0.765 88.3-121.4 -95.6 146.8 12.9 103.8 60.0 71 74 A K H 3> S+ 0 0 125 -2,-0.3 4,-2.3 1,-0.3 -1,-0.1 0.763 106.0 61.3 -61.0 -33.8 15.5 106.5 59.3 72 75 A K H 34 S+ 0 0 81 1,-0.2 -1,-0.3 2,-0.2 -4,-0.1 0.937 116.1 33.8 -59.6 -41.7 18.1 105.5 61.9 73 76 A E H X4 S+ 0 0 3 -3,-0.9 3,-1.7 -6,-0.4 -2,-0.2 0.881 116.3 52.0 -82.4 -41.2 18.4 102.1 60.3 74 77 A F H 3< S+ 0 0 68 -4,-2.4 -1,-0.2 -7,-0.3 -2,-0.2 0.843 113.1 49.1 -68.8 -23.8 18.0 103.0 56.6 75 78 A N T 3< S+ 0 0 94 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.305 77.5 129.1 -94.6 11.6 20.7 105.6 57.1 76 79 A D X - 0 0 8 -3,-1.7 3,-2.5 1,-0.2 4,-0.2 -0.483 64.0-133.7 -58.1 128.2 23.1 103.3 58.8 77 80 A P G > S+ 0 0 97 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.845 107.3 62.4 -52.2 -33.5 26.4 103.8 56.9 78 81 A S G 3 S+ 0 0 37 1,-0.3 -2,-0.1 63,-0.0 -3,-0.0 0.675 101.0 53.3 -63.5 -20.2 26.6 100.0 56.8 79 82 A N G X S+ 0 0 0 -3,-2.5 3,-2.5 -6,-0.2 4,-0.4 0.243 74.3 145.5 -98.4 12.2 23.4 99.9 54.8 80 83 A A T < S+ 0 0 31 -3,-1.8 -5,-0.1 1,-0.3 101,-0.0 -0.311 72.1 18.4 -56.3 125.4 24.6 102.3 52.1 81 84 A G T > S+ 0 0 6 100,-0.0 3,-1.8 -2,-0.0 4,-0.4 0.004 93.0 102.3 103.4 -23.6 23.0 101.2 48.8 82 85 A L T X> + 0 0 2 -3,-2.5 4,-2.1 1,-0.3 3,-0.8 0.713 61.7 81.1 -68.1 -16.7 20.2 99.1 50.3 83 86 A Q H 3> S+ 0 0 75 -4,-0.4 4,-2.5 1,-0.3 -1,-0.3 0.802 85.0 62.4 -56.5 -27.7 17.8 101.9 49.6 84 87 A N H <> S+ 0 0 53 -3,-1.8 4,-1.9 2,-0.2 -1,-0.3 0.898 104.1 45.8 -65.1 -39.0 17.7 100.5 46.0 85 88 A G H <> S+ 0 0 0 -3,-0.8 4,-2.0 -4,-0.4 -2,-0.2 0.901 112.6 51.0 -67.5 -39.2 16.3 97.2 47.3 86 89 A F H X S+ 0 0 60 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.911 109.8 48.7 -62.8 -44.7 13.8 99.1 49.4 87 90 A K H < S+ 0 0 145 -4,-2.5 3,-0.4 1,-0.2 -1,-0.2 0.898 109.1 54.5 -65.6 -38.2 12.7 101.2 46.5 88 91 A F H < S+ 0 0 3 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.903 110.1 46.9 -54.0 -49.7 12.3 98.0 44.4 89 92 A L H X S+ 0 0 2 -4,-2.0 4,-2.8 1,-0.2 3,-0.3 0.681 90.9 85.4 -71.9 -17.0 10.1 96.5 47.1 90 93 A E H X S+ 0 0 97 -4,-1.2 4,-2.2 -3,-0.4 -1,-0.2 0.904 90.7 44.3 -55.3 -49.6 7.9 99.6 47.4 91 94 A P H > S+ 0 0 60 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.810 112.3 55.5 -65.7 -26.6 5.5 98.8 44.6 92 95 A I H > S+ 0 0 7 -4,-0.5 4,-2.1 -3,-0.3 -2,-0.2 0.941 108.8 46.4 -64.6 -47.3 5.3 95.3 45.8 93 96 A H H < S+ 0 0 48 -4,-2.8 6,-0.2 1,-0.2 -1,-0.2 0.871 109.9 54.5 -64.3 -36.8 4.3 96.5 49.2 94 97 A K H < S+ 0 0 183 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.871 110.9 45.3 -62.7 -39.0 1.7 98.8 47.7 95 98 A E H < S+ 0 0 128 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.866 126.4 30.9 -71.6 -32.8 0.2 95.9 45.8 96 99 A F >< + 0 0 21 -4,-2.1 3,-1.9 -5,-0.1 -1,-0.3 -0.595 69.4 163.5-124.7 67.6 0.2 93.7 48.9 97 100 A P T 3 + 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.655 66.8 70.5 -68.1 -14.3 -0.2 96.1 51.8 98 101 A W T 3 S+ 0 0 55 -3,-0.1 2,-0.2 2,-0.1 -89,-0.1 0.616 76.2 95.4 -73.9 -17.7 -1.1 93.3 54.2 99 102 A I S < S- 0 0 4 -3,-1.9 -3,-0.0 -6,-0.2 2,-0.0 -0.549 80.4-117.5 -78.4 142.0 2.3 91.8 54.3 100 103 A S > - 0 0 12 -2,-0.2 4,-2.4 27,-0.2 5,-0.1 -0.347 20.2-117.3 -71.5 160.4 4.5 92.9 57.2 101 104 A S H > S+ 0 0 8 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.925 115.3 49.0 -62.8 -44.8 7.8 94.8 56.4 102 105 A G H > S+ 0 0 1 -38,-0.4 4,-2.2 2,-0.2 5,-0.3 0.900 110.8 50.7 -63.3 -40.4 9.9 92.1 58.0 103 106 A D H > S+ 0 0 0 24,-0.2 4,-2.6 -39,-0.2 -2,-0.2 0.946 113.1 46.4 -62.9 -39.9 8.1 89.5 56.0 104 107 A L H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.940 112.2 48.3 -71.2 -44.6 8.6 91.5 52.8 105 108 A F H X S+ 0 0 3 -4,-3.0 4,-1.2 2,-0.2 -1,-0.2 0.925 117.3 42.4 -60.9 -43.5 12.3 92.2 53.3 106 109 A S H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.3 3,-0.4 0.929 113.3 51.8 -69.7 -40.5 13.1 88.6 54.2 107 110 A L H X S+ 0 0 0 -4,-2.6 4,-3.1 -5,-0.3 5,-0.3 0.855 102.5 61.1 -64.0 -34.0 10.9 87.2 51.4 108 111 A G H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.900 106.3 46.9 -57.4 -40.1 12.7 89.5 48.9 109 112 A G H X S+ 0 0 0 -4,-1.2 4,-2.6 -3,-0.4 -2,-0.2 0.902 112.6 47.3 -68.2 -45.4 16.0 87.7 49.8 110 113 A V H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.927 113.4 49.0 -57.0 -48.7 14.5 84.2 49.5 111 114 A T H X S+ 0 0 0 -4,-3.1 4,-3.1 1,-0.2 5,-0.2 0.931 111.3 50.0 -62.3 -45.2 12.9 85.2 46.2 112 115 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 -59.4 -47.3 16.1 86.6 44.9 113 116 A V H <>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 82,-0.3 0.950 116.2 43.3 -57.7 -48.4 18.2 83.5 45.8 114 117 A Q H ><5S+ 0 0 4 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.919 112.4 50.5 -67.7 -43.0 15.7 81.2 44.2 115 118 A E H 3<5S+ 0 0 46 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.810 103.6 61.4 -66.2 -28.0 15.1 83.2 41.1 116 119 A M T 3<5S- 0 0 16 -4,-2.1 79,-2.7 -5,-0.2 -1,-0.3 0.209 128.0-100.5 -81.3 22.5 18.9 83.4 40.6 117 120 A Q T < 5S+ 0 0 121 -3,-1.5 -3,-0.2 77,-0.2 -2,-0.1 0.636 80.7 138.7 67.7 25.2 18.9 79.5 40.4 118 121 A G < - 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