==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 22-AUG-05 2AS1 . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE, MITOCHONDRIAL; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR R.BRENK,S.W.VETTER,S.E.BOYCE,D.B.GOODIN,B.K.SHOICHET . 291 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12473.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 185 63.6 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 . 11 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 14.8 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 0 109 0, 0.0 2,-0.5 0, 0.0 269,-0.0 0.000 360.0 360.0 360.0 122.8 11.0 -3.3 14.2 2 5 A V - 0 0 108 2,-0.0 2,-0.6 269,-0.0 269,-0.1 -0.930 360.0-170.9-115.3 126.8 9.3 -5.7 16.7 3 6 A H E -a 271 0A 38 267,-0.6 269,-3.4 -2,-0.5 2,-0.5 -0.914 9.8-162.2-114.3 106.2 5.8 -5.3 18.0 4 7 A V E -a 272 0A 72 -2,-0.6 269,-0.2 267,-0.2 2,-0.1 -0.749 23.8-119.4 -91.6 121.5 4.9 -7.7 20.8 5 8 A A - 0 0 10 267,-2.8 2,-0.4 -2,-0.5 122,-0.2 -0.388 29.9-167.7 -54.8 132.2 1.2 -8.3 21.5 6 9 A S - 0 0 75 120,-2.6 120,-0.2 267,-0.1 3,-0.1 -0.963 20.2-127.4-130.1 109.9 0.4 -7.2 25.0 7 10 A V - 0 0 54 -2,-0.4 3,-0.2 118,-0.1 121,-0.0 -0.320 34.8-101.4 -59.5 130.3 -3.0 -8.2 26.4 8 11 A E > - 0 0 19 1,-0.2 3,-2.4 2,-0.1 -1,-0.1 -0.343 64.7 -76.9 -51.5 131.0 -5.0 -5.3 27.8 9 12 A K T 3 S- 0 0 195 1,-0.3 -1,-0.2 89,-0.1 89,-0.0 -0.038 105.8 -13.9 -53.5 120.1 -4.5 -5.6 31.5 10 13 A G T 3 S+ 0 0 73 1,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.423 98.4 137.7 79.2 1.6 -6.6 -8.4 33.1 11 14 A R < + 0 0 85 -3,-2.4 -1,-0.2 3,-0.0 2,-0.2 -0.472 24.9 173.9 -87.5 152.0 -8.9 -8.8 30.1 12 15 A S >> - 0 0 64 -2,-0.2 4,-1.6 -5,-0.0 3,-0.9 -0.748 51.2 -66.3-140.3-173.7 -10.1 -12.1 28.7 13 16 A Y H 3> S+ 0 0 80 1,-0.3 4,-2.6 -2,-0.2 5,-0.2 0.865 125.8 57.0 -47.7 -45.3 -12.5 -13.6 26.1 14 17 A E H 3> S+ 0 0 60 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.854 103.7 52.8 -60.9 -38.3 -15.6 -12.3 27.8 15 18 A D H <> S+ 0 0 34 -3,-0.9 4,-1.5 1,-0.2 -1,-0.2 0.936 112.6 44.5 -60.5 -45.3 -14.4 -8.7 27.8 16 19 A F H X S+ 0 0 0 -4,-1.6 4,-2.7 1,-0.2 -2,-0.2 0.855 107.9 57.2 -73.7 -32.4 -13.9 -8.9 24.0 17 20 A Q H X S+ 0 0 16 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.874 104.9 54.2 -62.4 -34.4 -17.1 -10.7 23.4 18 21 A K H X S+ 0 0 85 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.893 109.0 46.7 -65.3 -38.5 -18.8 -7.7 25.1 19 22 A V H X S+ 0 0 0 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.936 112.0 51.2 -68.6 -45.9 -17.1 -5.3 22.7 20 23 A Y H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 -1,-0.2 0.895 110.2 50.2 -44.5 -57.5 -18.1 -7.5 19.8 21 24 A N H X S+ 0 0 22 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.902 108.3 51.5 -59.5 -41.4 -21.7 -7.5 21.0 22 25 A A H X S+ 0 0 14 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.938 113.2 45.3 -59.4 -46.3 -21.7 -3.7 21.3 23 26 A I H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.936 114.2 49.0 -60.4 -45.9 -20.4 -3.4 17.7 24 27 A A H X S+ 0 0 1 -4,-3.0 4,-1.5 1,-0.2 -2,-0.2 0.847 110.6 50.0 -64.4 -38.0 -22.9 -6.0 16.5 25 28 A L H X S+ 0 0 81 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.895 111.6 48.3 -70.4 -37.4 -25.9 -4.3 18.3 26 29 A K H X S+ 0 0 56 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.867 106.2 57.3 -69.8 -34.3 -25.0 -1.0 16.8 27 30 A L H < S+ 0 0 24 -4,-2.2 12,-0.3 1,-0.2 -1,-0.2 0.898 111.0 45.1 -59.0 -40.7 -24.6 -2.6 13.3 28 31 A R H < S+ 0 0 131 -4,-1.5 3,-0.4 -5,-0.1 -2,-0.2 0.887 115.3 46.4 -65.1 -44.1 -28.2 -3.7 13.8 29 32 A E H < S+ 0 0 145 -4,-2.1 2,-1.5 1,-0.2 3,-0.3 0.909 106.5 55.0 -72.8 -44.6 -29.5 -0.3 15.1 30 33 A D >< + 0 0 45 -4,-2.7 3,-0.6 1,-0.2 9,-0.3 -0.447 67.0 142.8 -90.5 62.9 -27.9 2.0 12.6 31 34 A D T 3 + 0 0 89 -2,-1.5 -1,-0.2 -3,-0.4 -2,-0.1 0.631 54.1 69.5 -80.3 -19.3 -29.4 0.3 9.6 32 35 A E T 3> + 0 0 48 -3,-0.3 4,-2.3 4,-0.1 3,-0.4 0.722 68.1 121.5 -76.8 -22.0 -30.1 3.3 7.4 33 36 A Y H <>>S+ 0 0 45 -3,-0.6 5,-2.9 1,-0.2 4,-0.9 -0.073 80.1 4.8 -53.4 136.6 -26.5 4.2 6.6 34 37 A D H >45S- 0 0 36 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.944 140.4 -45.2 57.1 55.1 -25.5 4.3 3.0 35 38 A N H 345S- 0 0 145 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.880 113.7 -51.6 54.4 44.2 -29.0 3.7 1.6 36 39 A Y H 3<5S+ 0 0 155 -4,-2.3 -1,-0.3 1,-0.1 -3,-0.2 0.572 109.6 117.6 69.1 19.1 -29.6 0.9 4.0 37 40 A I T <<5 - 0 0 17 -3,-1.2 3,-0.3 -4,-0.9 -3,-0.2 0.874 66.2-151.0 -68.7 -37.1 -26.5 -1.0 3.3 38 41 A G < - 0 0 8 -5,-2.9 4,-0.4 1,-0.2 -7,-0.1 -0.298 29.2 -66.4 84.8 179.2 -25.5 -0.4 6.9 39 42 A Y S > S+ 0 0 43 -9,-0.3 4,-2.0 -12,-0.3 5,-0.2 0.416 102.2 97.0 -89.6 -2.5 -22.0 -0.1 8.4 40 43 A G H > S+ 0 0 5 -3,-0.3 4,-1.9 1,-0.2 3,-0.3 0.966 86.1 44.1 -53.5 -57.5 -20.8 -3.7 7.9 41 44 A P H > S+ 0 0 15 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.921 112.3 50.8 -57.7 -45.0 -18.9 -3.1 4.6 42 45 A V H > S+ 0 0 16 -4,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.873 108.9 53.1 -67.4 -27.1 -17.2 0.2 5.7 43 46 A L H X S+ 0 0 1 -4,-2.0 4,-2.1 -3,-0.3 -1,-0.2 0.873 108.4 49.9 -71.8 -34.9 -16.0 -1.5 8.9 44 47 A V H X S+ 0 0 7 -4,-1.9 4,-2.1 -3,-0.2 -2,-0.2 0.942 111.5 48.3 -65.2 -45.9 -14.5 -4.3 6.8 45 48 A R H X S+ 0 0 71 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.902 109.8 53.5 -60.5 -40.5 -12.7 -1.8 4.6 46 49 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 5,-0.3 0.947 107.8 49.1 -58.9 -48.7 -11.5 0.1 7.7 47 50 A A H X S+ 0 0 0 -4,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.902 113.7 47.7 -61.0 -37.2 -9.9 -3.1 9.1 48 51 A W H X S+ 0 0 43 -4,-2.1 4,-2.7 1,-0.2 3,-0.5 0.939 111.4 49.3 -66.9 -46.5 -8.2 -3.8 5.8 49 52 A H H < S+ 0 0 14 -4,-2.9 4,-0.3 1,-0.2 -2,-0.2 0.816 109.0 50.9 -69.3 -29.7 -6.9 -0.3 5.3 50 53 A I H < S+ 0 0 4 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.759 119.7 39.0 -76.3 -19.7 -5.4 -0.1 8.8 51 54 A S H >< S+ 0 0 1 -4,-0.9 3,-1.6 -3,-0.5 -2,-0.2 0.776 103.2 69.4 -90.2 -32.8 -3.7 -3.4 8.2 52 55 A G T 3< S+ 0 0 0 -4,-2.7 -3,-0.1 1,-0.3 -2,-0.1 0.434 80.9 74.4 -78.0 -1.6 -2.8 -2.8 4.5 53 56 A T T 3 S+ 0 0 3 -4,-0.3 -1,-0.3 -5,-0.1 -2,-0.1 0.494 73.0 120.5 -80.2 -7.8 -0.1 -0.2 5.3 54 57 A W < - 0 0 24 -3,-1.6 2,-0.4 7,-0.2 7,-0.2 -0.267 48.6-160.1 -61.4 146.3 2.2 -2.9 6.5 55 58 A D B >>> -B 60 0B 30 5,-2.0 4,-2.1 1,-0.1 3,-1.0 -0.968 8.2-157.0-126.1 116.2 5.5 -3.5 4.9 56 59 A K T 345S+ 0 0 88 101,-2.2 -1,-0.1 -2,-0.4 102,-0.1 0.726 87.5 67.5 -60.9 -22.4 7.1 -6.9 5.5 57 60 A H T 345S+ 0 0 139 100,-0.2 -1,-0.2 1,-0.2 -3,-0.0 0.833 124.9 2.9 -72.1 -32.9 10.6 -5.5 4.8 58 61 A D T <45S- 0 0 75 -3,-1.0 -2,-0.2 2,-0.1 -1,-0.2 0.374 94.4-116.7-135.5 3.8 10.8 -3.3 7.8 59 62 A N T <5 + 0 0 20 -4,-2.1 2,-0.2 1,-0.2 -3,-0.2 0.770 61.7 149.7 57.0 33.2 7.6 -4.0 9.8 60 63 A T B < +B 55 0B 45 -5,-0.6 -5,-2.0 -7,-0.1 -1,-0.2 -0.522 52.6 10.3 -82.9 163.0 6.4 -0.4 9.4 61 64 A G S S+ 0 0 14 73,-0.5 -7,-0.2 -7,-0.2 3,-0.2 -0.224 75.0 128.2 64.9-157.6 2.7 0.3 9.2 62 65 A G S S- 0 0 4 -12,-0.2 3,-0.4 -13,-0.2 5,-0.4 -0.113 74.2 -73.3 94.1 166.9 0.3 -2.6 10.1 63 66 A S S > S+ 0 0 2 206,-0.4 3,-1.2 203,-0.3 -1,-0.2 0.700 107.1 85.9 -70.3 -23.7 -2.7 -2.8 12.5 64 67 A Y T 3 S+ 0 0 22 205,-0.4 38,-0.4 1,-0.3 -1,-0.2 0.862 87.6 45.1 -52.6 -49.3 -0.6 -2.9 15.7 65 68 A G T 3 S- 0 0 5 -3,-0.4 65,-1.9 -4,-0.2 -1,-0.3 0.589 91.3-135.2 -80.8 -9.8 -0.1 0.8 16.4 66 69 A G X + 0 0 2 -3,-1.2 3,-1.5 -4,-0.2 -2,-0.1 0.842 47.1 156.9 64.0 31.5 -3.7 2.0 15.8 67 70 A T G > + 0 0 7 -5,-0.4 3,-2.3 1,-0.3 6,-0.4 0.592 48.1 86.6 -76.8 -8.3 -2.1 4.9 13.8 68 71 A Y G 3 S+ 0 0 0 1,-0.3 -1,-0.3 5,-0.2 6,-0.2 0.739 76.9 72.2 -56.9 -25.1 -5.3 5.5 11.8 69 72 A R G < S+ 0 0 75 -3,-1.5 2,-0.3 4,-0.1 -1,-0.3 0.565 83.8 86.5 -68.7 -9.6 -6.3 7.7 14.7 70 73 A F S X> S- 0 0 34 -3,-2.3 4,-2.7 1,-0.1 3,-0.8 -0.754 87.4-119.4 -97.7 146.8 -3.7 10.3 13.6 71 74 A K H 3> S+ 0 0 70 -2,-0.3 4,-2.4 1,-0.3 -1,-0.1 0.774 106.4 59.3 -55.4 -39.2 -4.4 12.9 11.0 72 75 A K H 34 S+ 0 0 81 2,-0.2 -1,-0.3 1,-0.2 -4,-0.1 0.940 117.5 32.2 -60.2 -41.6 -1.8 11.9 8.4 73 76 A E H X4 S+ 0 0 4 -3,-0.8 3,-1.7 -6,-0.4 -2,-0.2 0.903 115.5 57.6 -82.9 -41.6 -3.4 8.5 8.0 74 77 A F H 3< S+ 0 0 48 -4,-2.7 -2,-0.2 -7,-0.3 -1,-0.2 0.878 111.8 43.9 -49.7 -41.4 -7.0 9.6 8.7 75 78 A N T 3< S+ 0 0 101 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.288 78.9 134.2 -98.1 12.7 -6.7 12.0 5.8 76 79 A D X - 0 0 9 -3,-1.7 3,-2.6 1,-0.2 4,-0.2 -0.460 61.1-133.0 -55.4 126.7 -5.0 9.6 3.4 77 80 A P G > S+ 0 0 95 0, 0.0 3,-1.7 0, 0.0 -1,-0.2 0.864 108.7 61.4 -50.4 -33.2 -6.8 10.0 0.1 78 81 A S G 3 S+ 0 0 37 1,-0.3 -2,-0.1 63,-0.0 -3,-0.0 0.666 102.3 53.0 -66.3 -15.2 -6.9 6.2 -0.0 79 82 A N G X S+ 0 0 0 -3,-2.6 3,-2.3 -6,-0.1 4,-0.4 0.252 74.2 142.1-105.4 10.1 -8.9 6.3 3.2 80 83 A A T < S+ 0 0 25 -3,-1.7 -5,-0.1 1,-0.3 101,-0.1 -0.346 72.3 20.1 -59.7 126.5 -11.6 8.7 2.0 81 84 A G T > S+ 0 0 4 -2,-0.1 3,-1.4 99,-0.1 4,-0.4 0.042 93.7 100.1 103.1 -21.3 -15.0 7.6 3.5 82 85 A L T X> + 0 0 0 -3,-2.3 4,-2.4 1,-0.3 3,-0.9 0.730 61.6 81.6 -73.6 -14.9 -13.5 5.5 6.3 83 86 A Q H 3> S+ 0 0 61 -4,-0.4 4,-2.5 1,-0.3 -1,-0.3 0.838 85.6 61.9 -54.6 -30.1 -14.2 8.4 8.7 84 87 A N H <> S+ 0 0 64 -3,-1.4 4,-1.9 2,-0.2 -1,-0.3 0.882 104.5 45.3 -60.7 -40.0 -17.7 7.0 8.7 85 88 A G H <> S+ 0 0 0 -3,-0.9 4,-1.9 -4,-0.4 -2,-0.2 0.913 111.9 52.2 -72.7 -38.0 -16.4 3.7 10.2 86 89 A F H X S+ 0 0 41 -4,-2.4 4,-1.3 1,-0.2 -2,-0.2 0.928 109.4 49.0 -60.8 -43.3 -14.3 5.6 12.7 87 90 A K H < S+ 0 0 66 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.897 108.0 55.1 -67.4 -36.9 -17.3 7.6 13.8 88 91 A F H < S+ 0 0 3 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.882 111.1 45.0 -54.7 -47.0 -19.4 4.5 14.2 89 92 A L H X S+ 0 0 2 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.658 90.8 85.7 -79.4 -15.0 -16.7 3.0 16.5 90 93 A E H X S+ 0 0 108 -4,-1.3 4,-2.3 -3,-0.3 -1,-0.2 0.919 90.8 45.5 -55.2 -49.7 -16.3 6.1 18.6 91 94 A P H > S+ 0 0 63 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.858 111.4 54.8 -64.5 -32.2 -19.1 5.4 21.0 92 95 A I H > S+ 0 0 7 -4,-0.5 4,-2.1 2,-0.2 -2,-0.2 0.940 109.7 45.9 -60.8 -47.8 -17.9 1.8 21.3 93 96 A H H < S+ 0 0 45 -4,-2.7 6,-0.2 1,-0.2 -1,-0.2 0.886 109.7 55.5 -64.7 -36.6 -14.4 3.0 22.3 94 97 A K H < S+ 0 0 79 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.856 111.5 43.8 -60.8 -36.3 -16.1 5.5 24.7 95 98 A E H < S+ 0 0 125 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.820 126.2 32.5 -78.5 -28.8 -17.9 2.6 26.4 96 99 A F >< + 0 0 19 -4,-2.1 3,-1.7 -5,-0.1 -1,-0.3 -0.632 68.7 162.6-125.4 67.5 -14.8 0.3 26.4 97 100 A P T 3 + 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.676 66.7 70.9 -67.7 -14.0 -11.9 2.8 26.8 98 101 A W T 3 S+ 0 0 57 -3,-0.1 2,-0.2 2,-0.1 -89,-0.1 0.647 77.3 93.6 -77.4 -16.2 -9.5 -0.0 27.8 99 102 A I S < S- 0 0 4 -3,-1.7 -3,-0.1 -6,-0.2 2,-0.0 -0.562 80.1-117.6 -82.2 143.0 -9.4 -1.5 24.3 100 103 A S > - 0 0 12 -2,-0.2 4,-2.5 27,-0.2 5,-0.1 -0.343 20.9-117.2 -71.9 160.3 -6.5 -0.4 22.1 101 104 A S H > S+ 0 0 7 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.927 114.9 49.6 -65.5 -43.8 -7.3 1.4 18.8 102 105 A G H > S+ 0 0 0 -38,-0.4 4,-2.2 2,-0.2 5,-0.3 0.903 111.7 48.8 -61.2 -41.9 -5.8 -1.4 16.6 103 106 A D H > S+ 0 0 0 24,-0.2 4,-2.6 -39,-0.2 5,-0.2 0.934 113.8 47.7 -62.7 -43.0 -7.7 -4.1 18.5 104 107 A L H X S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.944 112.9 46.3 -63.6 -49.3 -10.9 -2.0 18.1 105 108 A F H X S+ 0 0 2 -4,-3.1 4,-1.3 1,-0.2 -1,-0.2 0.909 117.6 43.1 -62.5 -43.4 -10.4 -1.3 14.4 106 109 A S H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.893 112.4 52.4 -69.2 -40.1 -9.6 -4.9 13.6 107 110 A L H X S+ 0 0 0 -4,-2.6 4,-3.1 -5,-0.3 5,-0.2 0.878 102.8 61.1 -65.7 -32.2 -12.3 -6.3 15.8 108 111 A G H X S+ 0 0 1 -4,-2.3 4,-2.6 -5,-0.2 -1,-0.2 0.936 106.0 46.0 -53.7 -47.7 -14.8 -4.0 13.9 109 112 A G H X S+ 0 0 0 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.918 113.1 48.2 -63.2 -46.7 -13.9 -5.9 10.7 110 113 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.933 112.8 49.2 -58.4 -48.3 -14.2 -9.3 12.3 111 114 A T H X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 5,-0.3 0.921 110.7 50.2 -58.5 -48.2 -17.5 -8.4 13.8 112 115 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 -5,-0.2 6,-0.2 0.939 110.4 49.5 -56.2 -48.5 -18.9 -7.0 10.5 113 116 A V H <>S+ 0 0 0 -4,-2.5 5,-2.7 1,-0.2 82,-0.2 0.950 115.4 42.9 -58.9 -47.0 -17.9 -10.2 8.6 114 117 A Q H ><5S+ 0 0 5 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.905 113.1 50.6 -69.2 -39.9 -19.5 -12.5 11.1 115 118 A E H 3<5S+ 0 0 45 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.815 104.4 58.8 -71.9 -24.0 -22.7 -10.5 11.6 116 119 A M T 3<5S- 0 0 15 -4,-2.0 79,-2.7 -5,-0.3 -1,-0.3 0.219 128.4-100.7 -85.2 16.9 -23.2 -10.3 7.8 117 120 A Q T < 5S+ 0 0 128 -3,-1.6 -3,-0.2 77,-0.2 -2,-0.2 0.706 78.7 139.8 74.5 23.3 -23.2 -14.1 7.9 118 121 A G < - 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