==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 07-JUN-93 7CCP . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.WANG,M.A.MILLER,J.KRAUT . 291 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12618.0 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 . 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 . 8 2.7 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 . 104 35.7 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 0 1 0 2 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 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 0 116 0, 0.0 2,-0.4 0, 0.0 269,-0.0 0.000 360.0 360.0 360.0 165.1 12.4 77.8 22.8 2 5 A V - 0 0 113 2,-0.0 2,-0.5 270,-0.0 269,-0.1 -0.979 360.0-165.8-124.7 131.9 14.0 77.1 19.4 3 6 A H - 0 0 25 -2,-0.4 269,-4.0 267,-0.3 2,-0.5 -0.955 6.4-168.6-123.1 101.9 14.6 73.4 18.6 4 7 A V B -a 272 0A 67 -2,-0.5 2,-0.2 267,-0.2 269,-0.2 -0.816 24.7-121.0 -93.1 132.2 16.9 73.1 15.7 5 8 A A - 0 0 9 267,-3.0 2,-0.5 -2,-0.5 122,-0.2 -0.534 28.6-168.3 -70.1 137.2 17.2 69.6 14.2 6 9 A S - 0 0 74 120,-3.1 120,-0.2 -2,-0.2 3,-0.1 -0.952 21.4-125.1-132.8 109.6 20.8 68.4 14.3 7 10 A V - 0 0 55 -2,-0.5 3,-0.1 118,-0.2 2,-0.1 -0.262 36.1 -98.5 -50.8 137.9 21.7 65.3 12.4 8 11 A E > - 0 0 18 1,-0.2 3,-2.4 2,-0.1 -1,-0.1 -0.361 62.5 -85.1 -59.7 127.5 23.3 62.5 14.4 9 12 A K T 3 S- 0 0 170 1,-0.3 -1,-0.2 -3,-0.1 3,-0.1 -0.182 101.6 -11.9 -49.1 115.8 27.0 63.1 13.6 10 13 A G T 3 S+ 0 0 77 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.571 97.7 131.6 71.0 16.4 28.1 61.3 10.5 11 14 A R < - 0 0 91 -3,-2.4 -1,-0.2 87,-0.1 2,-0.2 -0.751 31.9-176.5 -97.4 148.5 25.0 59.2 10.0 12 15 A S >> - 0 0 48 -2,-0.3 4,-1.6 -3,-0.1 3,-0.7 -0.636 45.8 -73.1-126.9-171.0 23.1 59.0 6.7 13 16 A Y H 3> S+ 0 0 67 1,-0.3 4,-2.8 -2,-0.2 3,-0.3 0.906 126.4 55.4 -48.8 -54.2 20.0 57.4 5.2 14 17 A E H 3> S+ 0 0 115 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.826 103.8 56.0 -53.5 -36.4 21.5 53.9 5.3 15 18 A D H <> S+ 0 0 35 -3,-0.7 4,-1.2 1,-0.2 -1,-0.2 0.918 111.4 43.2 -62.1 -47.1 22.2 54.2 9.0 16 19 A F H X S+ 0 0 0 -4,-1.6 4,-2.7 -3,-0.3 -2,-0.2 0.870 106.9 59.5 -67.8 -40.2 18.5 55.0 9.7 17 20 A Q H X S+ 0 0 13 -4,-2.8 4,-2.5 1,-0.3 -1,-0.2 0.846 104.4 53.4 -59.3 -31.7 17.2 52.3 7.3 18 21 A K H X S+ 0 0 125 -4,-1.4 4,-1.7 2,-0.2 -1,-0.3 0.834 106.8 49.4 -70.7 -37.6 19.1 49.8 9.5 19 22 A V H X S+ 0 0 0 -4,-1.2 4,-2.2 -3,-0.2 5,-0.2 0.961 112.7 49.6 -63.4 -47.8 17.3 51.1 12.7 20 23 A Y H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.904 109.9 48.9 -52.6 -52.2 14.0 50.8 10.8 21 24 A N H X S+ 0 0 24 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.855 108.6 55.6 -60.0 -36.1 14.8 47.2 9.7 22 25 A A H X S+ 0 0 18 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.925 110.9 42.8 -65.1 -45.2 15.7 46.3 13.3 23 26 A I H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.925 114.6 51.9 -64.7 -45.1 12.4 47.5 14.6 24 27 A A H X S+ 0 0 2 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.894 108.4 48.9 -61.8 -41.8 10.5 45.8 11.7 25 28 A L H X S+ 0 0 79 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.853 112.5 49.4 -67.0 -37.2 12.2 42.4 12.2 26 29 A K H X S+ 0 0 38 -4,-1.8 4,-3.0 2,-0.2 -2,-0.2 0.869 107.8 53.9 -69.7 -35.2 11.4 42.6 15.9 27 30 A L H < S+ 0 0 22 -4,-2.8 12,-0.2 1,-0.2 -2,-0.2 0.919 110.3 47.9 -59.9 -44.4 7.8 43.5 15.1 28 31 A R H < S+ 0 0 131 -4,-1.9 3,-0.4 -5,-0.2 -1,-0.2 0.853 116.5 43.7 -61.7 -39.6 7.6 40.4 12.9 29 32 A E H < S+ 0 0 139 -4,-1.7 2,-1.3 1,-0.2 -2,-0.2 0.896 106.1 55.6 -79.3 -44.3 9.1 38.2 15.6 30 33 A D >< + 0 0 46 -4,-3.0 3,-0.7 1,-0.2 9,-0.3 -0.406 67.0 140.2 -88.9 57.4 7.3 39.3 18.8 31 34 A D T 3 + 0 0 86 -2,-1.3 -1,-0.2 -3,-0.4 -2,-0.1 0.406 51.1 73.6 -81.0 -4.6 3.9 38.6 17.3 32 35 A E T 3> + 0 0 59 -3,-0.2 4,-1.9 4,-0.1 3,-0.4 0.666 67.4 122.6 -86.3 -15.7 2.2 37.1 20.4 33 36 A Y H <>>S+ 0 0 46 -3,-0.7 5,-2.4 2,-0.2 4,-1.9 -0.053 79.5 3.9 -50.8 135.2 1.9 40.5 22.2 34 37 A D H >45S- 0 0 38 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.960 140.4 -46.2 51.0 59.5 -1.6 41.5 23.3 35 38 A N H 345S- 0 0 143 -3,-0.4 -2,-0.2 1,-0.2 -1,-0.2 0.884 114.5 -47.6 55.1 45.3 -3.3 38.3 22.1 36 39 A Y H 3<5S+ 0 0 153 -4,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.656 108.9 115.5 70.8 23.0 -1.5 38.2 18.8 37 40 A I T <<5 - 0 0 18 -4,-1.9 3,-0.2 -3,-0.8 -3,-0.2 0.833 68.3-145.9 -83.5 -37.7 -2.1 41.9 17.8 38 41 A G < - 0 0 9 -5,-2.4 4,-0.3 1,-0.2 -7,-0.1 -0.315 28.1 -71.5 96.3 179.3 1.7 42.5 18.0 39 42 A Y S > S+ 0 0 40 -9,-0.3 4,-2.1 -12,-0.2 5,-0.2 0.484 101.6 99.4 -86.6 -6.7 3.4 45.7 19.0 40 43 A G H > S+ 0 0 4 -3,-0.2 4,-2.0 1,-0.2 3,-0.2 0.920 84.4 45.1 -44.6 -59.0 2.6 47.8 16.0 41 44 A P H > S+ 0 0 16 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.886 110.5 53.0 -57.8 -42.4 -0.3 49.6 17.6 42 45 A V H > S+ 0 0 17 -4,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.880 108.2 52.3 -65.1 -34.1 1.5 50.4 20.8 43 46 A L H X S+ 0 0 2 -4,-2.1 4,-2.6 2,-0.2 66,-0.2 0.892 108.6 49.6 -65.3 -41.8 4.4 51.9 18.9 44 47 A V H X S+ 0 0 8 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.923 112.2 48.1 -64.0 -42.3 2.0 54.2 16.9 45 48 A L H X S+ 0 0 61 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.883 110.4 52.8 -61.3 -40.9 0.4 55.3 20.3 46 49 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.939 107.8 50.0 -64.9 -44.4 3.8 55.9 21.7 47 50 A A H X S+ 0 0 0 -4,-2.6 4,-0.8 1,-0.2 -1,-0.2 0.804 113.7 46.6 -62.9 -30.7 4.8 58.1 18.8 48 51 A W H X S+ 0 0 51 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.911 111.4 51.0 -78.6 -42.6 1.6 60.1 19.2 49 52 A H H < S+ 0 0 18 -4,-2.8 4,-0.2 1,-0.2 -2,-0.2 0.834 109.9 48.0 -64.3 -36.2 2.0 60.5 23.0 50 53 A I H < S+ 0 0 3 -4,-2.1 12,-0.3 1,-0.2 3,-0.2 0.784 119.8 40.9 -76.5 -23.1 5.6 61.8 22.8 51 54 A S H >< S+ 0 0 0 -4,-0.8 3,-1.1 -5,-0.2 -2,-0.2 0.707 101.7 70.0 -90.2 -29.3 4.5 64.2 20.2 52 55 A G T 3< S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.1 0.415 78.9 75.6 -72.1 -4.2 1.2 65.3 21.6 53 56 A T T 3 S+ 0 0 5 -4,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.453 71.0 125.4 -85.9 -2.3 2.5 67.2 24.6 54 57 A W < - 0 0 25 -3,-1.1 2,-0.5 7,-0.2 7,-0.2 -0.228 45.6-160.8 -64.5 141.0 3.5 70.1 22.2 55 58 A D B >>> -B 60 0B 29 5,-2.3 4,-1.5 1,-0.1 3,-0.8 -0.925 8.7-160.1-127.1 104.8 2.3 73.6 22.9 56 59 A K T 345S+ 0 0 73 101,-2.0 -1,-0.1 -2,-0.5 102,-0.1 0.535 86.7 69.9 -59.6 -10.1 2.4 75.9 19.9 57 60 A H T 345S+ 0 0 145 100,-0.2 -1,-0.2 1,-0.1 -3,-0.0 0.934 120.9 4.9 -79.6 -45.6 2.2 78.8 22.3 58 61 A D T <45S- 0 0 75 -3,-0.8 -2,-0.2 2,-0.1 -1,-0.1 0.168 97.6-115.5-123.5 11.7 5.7 78.5 23.9 59 62 A N T <5 + 0 0 32 -4,-1.5 -3,-0.2 1,-0.2 2,-0.2 0.657 65.9 144.3 62.8 22.3 7.2 75.7 21.8 60 63 A T B < +B 55 0B 36 -5,-0.6 -5,-2.3 -7,-0.1 -1,-0.2 -0.491 47.9 12.5 -87.5 160.2 7.5 73.3 24.8 61 64 A G + 0 0 13 73,-0.4 3,-0.3 -7,-0.2 -7,-0.2 -0.230 69.2 118.3 71.9-164.0 6.9 69.5 24.5 62 65 A G S S- 0 0 4 -12,-0.3 3,-0.4 1,-0.2 5,-0.3 -0.309 82.9 -61.1 90.3 178.8 6.7 67.6 21.2 63 66 A S S > S+ 0 0 1 206,-0.4 3,-1.1 203,-0.3 -1,-0.2 0.633 106.8 91.5 -76.0 -20.6 9.0 64.8 20.1 64 67 A Y T 3 S+ 0 0 24 205,-0.4 38,-0.4 -3,-0.3 64,-0.3 0.838 86.6 42.8 -42.9 -57.2 12.3 66.8 20.0 65 68 A G T 3 S- 0 0 6 -3,-0.4 65,-2.0 64,-0.1 -1,-0.2 0.543 89.1-134.9 -75.1 -13.4 13.6 66.1 23.5 66 69 A G X + 0 0 3 -3,-1.1 3,-1.5 -4,-0.2 -2,-0.1 0.811 48.4 157.2 59.0 31.7 12.9 62.4 23.9 67 70 A T G > + 0 0 6 -5,-0.3 3,-3.6 1,-0.3 6,-0.4 0.648 50.1 84.3 -63.8 -21.5 11.6 63.5 27.3 68 71 A Y G 3 S+ 0 0 1 1,-0.3 -1,-0.3 5,-0.2 -2,-0.1 0.749 78.4 73.8 -52.9 -22.0 9.3 60.4 27.7 69 72 A R G < S+ 0 0 78 -3,-1.5 -1,-0.3 4,-0.1 2,-0.3 0.713 83.3 86.5 -65.3 -20.5 12.6 58.9 28.9 70 73 A F S <> S- 0 0 30 -3,-3.6 4,-2.9 1,-0.1 3,-0.3 -0.605 86.3-124.1 -89.4 142.4 12.1 60.9 32.1 71 74 A K H > S+ 0 0 103 -2,-0.3 4,-2.9 1,-0.2 5,-0.1 0.856 106.5 59.1 -46.5 -50.9 10.1 59.6 35.0 72 75 A K H 4 S+ 0 0 78 1,-0.2 -1,-0.2 2,-0.2 -4,-0.1 0.912 117.1 30.9 -47.0 -57.0 7.8 62.5 35.1 73 76 A E H >4 S+ 0 0 4 -6,-0.4 3,-1.1 -3,-0.3 -1,-0.2 0.780 117.5 57.8 -73.1 -32.5 6.5 62.0 31.6 74 77 A F H 3< S+ 0 0 44 -4,-2.9 -2,-0.2 -7,-0.3 -1,-0.2 0.820 107.5 47.6 -69.0 -33.0 7.0 58.3 31.7 75 78 A N T 3< S+ 0 0 96 -4,-2.9 -1,-0.3 -5,-0.3 -2,-0.2 0.204 78.2 138.2 -95.2 15.3 4.7 58.0 34.7 76 79 A D X - 0 0 8 -3,-1.1 3,-3.2 1,-0.2 4,-0.3 -0.437 58.0-135.7 -64.2 124.9 2.0 60.2 33.1 77 80 A P G > S+ 0 0 96 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.885 107.7 58.2 -48.5 -39.6 -1.3 58.5 33.9 78 81 A S G 3 S+ 0 0 49 1,-0.3 -2,-0.1 63,-0.1 -3,-0.0 0.616 101.1 56.8 -66.4 -15.2 -2.2 59.2 30.2 79 82 A N G X S+ 0 0 0 -3,-3.2 3,-2.9 -6,-0.1 4,-0.3 0.325 74.3 140.0 -99.1 4.1 0.9 57.1 29.2 80 83 A A T < S+ 0 0 39 -3,-1.6 101,-0.1 -4,-0.3 -5,-0.1 -0.224 71.2 22.3 -49.2 132.6 -0.2 54.0 31.1 81 84 A G T > S+ 0 0 12 99,-0.1 3,-1.1 100,-0.0 -1,-0.3 0.169 94.3 100.8 93.8 -19.1 0.6 51.0 29.0 82 85 A L T X> + 0 0 0 -3,-2.9 4,-2.0 1,-0.2 3,-1.6 0.676 59.7 82.2 -70.7 -21.4 3.2 52.7 26.9 83 86 A Q H 3> S+ 0 0 62 -4,-0.3 4,-2.8 1,-0.3 -1,-0.2 0.775 85.5 61.9 -56.2 -23.2 6.0 51.1 29.0 84 87 A N H <> S+ 0 0 65 -3,-1.1 4,-0.9 2,-0.2 -1,-0.3 0.818 103.2 45.5 -70.2 -35.3 5.4 48.1 26.7 85 88 A G H <> S+ 0 0 0 -3,-1.6 4,-1.8 -4,-0.3 -2,-0.2 0.846 113.0 53.9 -74.3 -34.5 6.5 50.1 23.6 86 89 A F H >X S+ 0 0 48 -4,-2.0 4,-1.7 1,-0.2 3,-0.7 0.973 108.2 45.7 -62.9 -58.2 9.4 51.4 25.6 87 90 A K H 3< S+ 0 0 71 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.724 109.5 58.5 -58.8 -25.8 10.7 48.0 26.6 88 91 A F H 3< S+ 0 0 4 -4,-0.9 4,-0.3 1,-0.2 -1,-0.3 0.910 110.7 41.0 -69.4 -42.0 10.2 46.9 23.0 89 92 A L H XX S+ 0 0 2 -4,-1.8 4,-2.0 -3,-0.7 3,-1.0 0.699 94.9 82.2 -78.2 -26.1 12.6 49.6 21.7 90 93 A E H 3X S+ 0 0 100 -4,-1.7 4,-2.8 1,-0.3 3,-0.5 0.914 90.0 49.4 -45.6 -61.3 15.2 49.3 24.4 91 94 A P H 3> S+ 0 0 61 0, 0.0 4,-1.0 0, 0.0 -1,-0.3 0.790 112.7 52.1 -49.4 -30.7 17.1 46.4 22.9 92 95 A I H <> S+ 0 0 5 -3,-1.0 4,-1.4 -4,-0.3 -2,-0.2 0.870 107.1 49.3 -73.9 -42.6 17.1 48.4 19.7 93 96 A H H < S+ 0 0 47 -4,-2.0 3,-0.4 -3,-0.5 6,-0.2 0.894 107.2 57.0 -61.5 -44.3 18.5 51.5 21.2 94 97 A K H < S+ 0 0 103 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.837 108.7 47.1 -57.0 -36.1 21.2 49.3 22.8 95 98 A E H < S+ 0 0 131 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.768 124.1 30.7 -77.4 -29.1 22.1 48.2 19.3 96 99 A F >< + 0 0 24 -4,-1.4 3,-1.6 -3,-0.4 -1,-0.3 -0.630 70.0 165.4-132.7 69.6 22.1 51.7 17.8 97 100 A P T 3 + 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.600 66.2 69.9 -63.6 -16.5 23.2 53.9 20.7 98 101 A W T 3 S+ 0 0 60 -3,-0.1 2,-0.3 2,-0.1 -89,-0.1 0.586 77.1 95.7 -79.5 -13.2 24.0 56.9 18.4 99 102 A I S < S- 0 0 4 -3,-1.6 -3,-0.1 -6,-0.2 2,-0.0 -0.656 79.3-121.6 -81.0 137.3 20.3 57.5 17.6 100 103 A S > - 0 0 14 -2,-0.3 4,-2.4 27,-0.2 5,-0.2 -0.318 20.5-115.5 -71.7 159.5 18.6 60.1 19.8 101 104 A S H > S+ 0 0 8 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.924 115.1 51.4 -56.5 -54.2 15.5 59.1 21.8 102 105 A G H > S+ 0 0 0 -38,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.891 110.2 51.0 -55.9 -42.3 13.1 61.4 20.0 103 106 A D H > S+ 0 0 0 24,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.937 113.7 44.5 -62.3 -46.0 14.4 60.0 16.7 104 107 A L H X S+ 0 0 2 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.906 112.4 49.5 -63.7 -47.5 13.8 56.4 17.9 105 108 A F H X S+ 0 0 6 -4,-3.1 4,-0.9 1,-0.2 -1,-0.2 0.898 116.4 42.6 -58.5 -44.6 10.4 56.9 19.5 106 109 A S H X S+ 0 0 0 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.825 110.7 55.4 -74.4 -35.0 9.1 58.7 16.3 107 110 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 -5,-0.2 -2,-0.2 0.844 101.3 58.8 -66.7 -33.7 10.7 56.2 13.9 108 111 A G H X S+ 0 0 1 -4,-2.0 4,-3.0 2,-0.2 -1,-0.2 0.911 104.8 51.2 -59.9 -42.5 8.9 53.2 15.7 109 112 A G H X S+ 0 0 0 -4,-0.9 4,-2.6 -66,-0.2 -1,-0.2 0.945 112.5 44.7 -58.9 -51.6 5.6 54.9 14.8 110 113 A V H X S+ 0 0 0 -4,-1.6 4,-2.8 1,-0.2 -2,-0.2 0.909 115.2 48.7 -58.7 -50.0 6.5 55.3 11.1 111 114 A T H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 -2,-0.2 0.902 111.0 49.6 -58.4 -47.4 7.9 51.7 11.0 112 115 A A H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 6,-0.3 0.942 112.8 47.2 -57.5 -52.8 4.8 50.3 12.7 113 116 A V H <>S+ 0 0 0 -4,-2.6 5,-2.8 1,-0.2 3,-0.3 0.923 115.9 43.6 -56.6 -50.5 2.5 52.1 10.3 114 117 A Q H ><5S+ 0 0 6 -4,-2.8 3,-0.9 1,-0.2 -1,-0.2 0.851 113.9 49.6 -66.0 -38.5 4.4 51.1 7.2 115 118 A E H 3<5S+ 0 0 50 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.682 104.9 59.0 -74.1 -18.4 4.9 47.5 8.3 116 119 A M T 3<5S- 0 0 15 -4,-1.7 79,-3.0 -3,-0.3 -1,-0.2 0.054 128.0-100.5 -96.2 21.6 1.1 47.2 9.0 117 120 A Q T < 5S+ 0 0 137 -3,-0.9 -3,-0.2 77,-0.2 -2,-0.2 0.663 79.2 138.3 68.6 23.5 0.6 48.1 5.4 118 121 A G < - 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