==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-JUN-01 1JDR . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR C.A.BONAGURA,M.SUNDARAMOORTHY,B.BHASKAR,T.L.POULOS . 294 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13325.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 189 64.3 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 . 16 5.4 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 . 10 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 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 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 . 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 1 A T 0 0 175 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 103.9 14.8 96.1 80.4 2 2 A T - 0 0 121 1,-0.1 2,-0.1 0, 0.0 59,-0.1 -0.314 360.0-104.0 -46.8 129.6 13.3 92.6 80.3 3 3 A P - 0 0 72 0, 0.0 59,-0.2 0, 0.0 -1,-0.1 -0.425 41.2-121.0 -60.9 126.7 14.2 91.1 76.9 4 4 A L - 0 0 105 57,-0.7 2,-0.5 -2,-0.1 0, 0.0 -0.400 12.5-138.1 -71.8 153.8 11.1 91.2 74.7 5 5 A V - 0 0 100 -2,-0.1 2,-0.8 2,-0.0 269,-0.1 -0.953 12.6-155.2-112.3 124.0 9.5 88.2 73.1 6 6 A H E -a 274 0A 28 267,-0.7 269,-3.6 -2,-0.5 2,-0.5 -0.892 9.7-163.0-105.6 101.0 8.4 88.7 69.5 7 7 A V E -a 275 0A 68 -2,-0.8 269,-0.2 267,-0.2 2,-0.1 -0.736 22.9-118.2 -87.0 126.5 5.7 86.3 68.7 8 8 A A - 0 0 10 267,-2.9 2,-0.5 -2,-0.5 122,-0.2 -0.389 29.4-168.0 -63.8 132.7 5.0 85.8 65.0 9 9 A S - 0 0 75 120,-2.7 120,-0.2 -2,-0.1 2,-0.1 -0.966 19.7-129.1-128.7 110.6 1.4 86.8 64.1 10 10 A V - 0 0 53 -2,-0.5 3,-0.2 118,-0.1 121,-0.0 -0.378 34.7-100.7 -59.6 130.9 0.1 85.8 60.6 11 11 A E > - 0 0 22 1,-0.2 3,-2.5 -2,-0.1 -1,-0.1 -0.331 63.6 -76.5 -54.0 127.9 -1.3 88.7 58.7 12 12 A K T 3 S- 0 0 194 1,-0.3 -1,-0.2 89,-0.1 3,-0.1 0.011 107.4 -13.5 -36.8 117.2 -5.1 88.4 59.1 13 13 A G T 3 S+ 0 0 76 1,-0.2 -1,-0.3 -3,-0.2 2,-0.1 0.398 98.9 140.2 69.0 0.9 -6.6 85.6 56.9 14 14 A R < + 0 0 83 -3,-2.5 2,-0.2 3,-0.1 -1,-0.2 -0.432 22.0 168.2 -79.4 148.9 -3.4 85.3 54.8 15 15 A S >> - 0 0 52 -2,-0.1 4,-1.5 -3,-0.1 3,-0.8 -0.768 53.5 -65.4-142.0-173.5 -2.0 81.9 53.6 16 16 A Y H 3> S+ 0 0 82 1,-0.2 4,-2.6 -2,-0.2 5,-0.2 0.857 125.7 57.6 -47.0 -49.0 0.6 80.6 51.1 17 17 A E H 3> S+ 0 0 115 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.872 104.7 51.8 -52.6 -43.8 -1.2 81.8 48.0 18 18 A D H <> S+ 0 0 20 -3,-0.8 4,-1.5 1,-0.2 -1,-0.2 0.936 112.9 43.7 -61.2 -47.8 -1.1 85.4 49.3 19 19 A F H X S+ 0 0 0 -4,-1.5 4,-2.8 1,-0.2 -2,-0.2 0.843 108.6 57.3 -69.7 -31.3 2.6 85.3 49.9 20 20 A Q H X S+ 0 0 15 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.863 105.1 54.1 -66.3 -32.4 3.3 83.5 46.6 21 21 A K H X S+ 0 0 113 -4,-1.6 4,-2.1 -5,-0.2 -2,-0.2 0.905 109.3 46.0 -67.3 -40.2 1.5 86.5 45.0 22 22 A V H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.929 112.3 51.3 -67.6 -43.6 3.9 88.9 46.7 23 23 A Y H X S+ 0 0 0 -4,-2.8 4,-3.2 1,-0.2 -2,-0.2 0.949 110.3 49.8 -55.6 -50.6 6.9 86.8 45.8 24 24 A N H X S+ 0 0 21 -4,-2.8 4,-3.0 1,-0.2 -1,-0.2 0.889 108.4 52.1 -57.8 -41.9 5.7 86.8 42.2 25 25 A A H X S+ 0 0 15 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.906 112.9 45.2 -62.1 -41.9 5.3 90.6 42.2 26 26 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.956 114.4 48.6 -65.5 -48.3 8.9 91.0 43.5 27 27 A A H X S+ 0 0 1 -4,-3.2 4,-1.8 1,-0.2 -2,-0.2 0.882 110.6 50.5 -58.8 -43.7 10.2 88.4 41.0 28 28 A L H X S+ 0 0 77 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.894 111.4 47.9 -64.5 -39.0 8.4 90.1 38.1 29 29 A K H X S+ 0 0 48 -4,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.838 107.6 56.0 -71.7 -31.6 9.8 93.5 39.0 30 30 A L H < S+ 0 0 24 -4,-2.1 12,-0.3 2,-0.2 -1,-0.2 0.889 111.3 44.8 -64.2 -38.8 13.3 92.0 39.3 31 31 A R H >< S+ 0 0 128 -4,-1.8 3,-0.6 -5,-0.2 -2,-0.2 0.916 116.0 46.6 -69.6 -44.5 12.9 90.8 35.7 32 32 A E H 3< S+ 0 0 143 -4,-2.4 2,-0.7 1,-0.2 3,-0.3 0.912 109.4 51.2 -64.8 -48.4 11.5 94.1 34.6 33 33 A D T >< + 0 0 43 -4,-2.9 3,-0.9 1,-0.2 9,-0.3 -0.260 66.9 137.1 -91.7 49.9 14.1 96.5 36.2 34 34 A D T < + 0 0 76 -2,-0.7 -1,-0.2 -3,-0.6 7,-0.2 0.596 55.3 73.4 -70.0 -19.7 17.2 94.7 34.9 35 35 A E T 3> + 0 0 132 -3,-0.3 4,-2.5 4,-0.1 3,-0.4 0.799 69.5 118.3 -68.3 -28.8 19.1 97.9 33.9 36 36 A Y H <>>S+ 0 0 44 -3,-0.9 5,-2.7 1,-0.2 4,-1.4 -0.022 80.7 4.7 -44.8 135.3 19.8 98.7 37.6 37 37 A D H >45S- 0 0 36 1,-0.2 3,-0.9 2,-0.2 -1,-0.2 0.942 139.6 -46.4 51.5 59.6 23.5 98.9 38.6 38 38 A N H 345S- 0 0 147 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.888 113.1 -50.3 51.8 46.4 24.9 98.3 35.1 39 39 A Y H 3<5S+ 0 0 145 -4,-2.5 -1,-0.2 -6,-0.1 -2,-0.2 0.695 109.9 116.9 69.3 21.1 22.5 95.5 34.4 40 40 A I T <<5 - 0 0 17 -4,-1.4 3,-0.3 -3,-0.9 -3,-0.2 0.837 68.2-146.0 -81.4 -33.5 23.3 93.5 37.5 41 41 A G < - 0 0 8 -5,-2.7 4,-0.4 -7,-0.2 -7,-0.2 -0.181 27.3 -71.6 89.6 170.1 19.6 94.0 38.5 42 42 A Y S > S+ 0 0 40 -9,-0.3 4,-2.0 -12,-0.3 5,-0.2 0.496 103.3 97.6 -79.0 -6.3 18.1 94.5 42.0 43 43 A G H > S+ 0 0 5 -3,-0.3 4,-1.7 1,-0.2 3,-0.2 0.933 84.1 44.4 -48.2 -58.8 18.6 91.0 43.1 44 44 A P H > S+ 0 0 14 0, 0.0 4,-2.4 0, 0.0 3,-0.2 0.923 112.7 49.5 -56.0 -48.8 21.9 91.6 45.0 45 45 A V H > S+ 0 0 14 -4,-0.4 4,-2.2 1,-0.2 -2,-0.2 0.833 109.0 54.3 -63.5 -29.7 20.8 94.7 46.8 46 46 A L H X S+ 0 0 1 -4,-2.0 4,-2.3 -3,-0.2 -1,-0.2 0.885 108.4 48.4 -70.5 -37.8 17.6 93.0 47.9 47 47 A V H X S+ 0 0 5 -4,-1.7 4,-2.3 -3,-0.2 -2,-0.2 0.939 112.3 49.0 -66.6 -43.2 19.5 90.2 49.5 48 48 A R H X S+ 0 0 67 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.881 109.5 52.5 -63.3 -38.0 21.8 92.7 51.3 49 49 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.937 109.3 49.1 -63.0 -45.6 18.7 94.6 52.5 50 50 A A H X S+ 0 0 0 -4,-2.3 4,-0.9 2,-0.2 -2,-0.2 0.897 114.4 45.7 -60.4 -42.0 17.3 91.3 53.9 51 51 A W H >X S+ 0 0 47 -4,-2.3 4,-3.4 1,-0.2 3,-0.5 0.941 113.7 47.7 -69.5 -44.0 20.5 90.6 55.7 52 52 A H H 3< S+ 0 0 16 -4,-3.1 4,-0.3 1,-0.2 -2,-0.2 0.845 109.8 51.8 -67.0 -33.4 21.1 94.1 57.0 53 53 A T H 3< S+ 0 0 6 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.730 120.2 36.1 -74.7 -21.1 17.5 94.3 58.4 54 54 A S H X< S+ 0 0 1 -4,-0.9 3,-1.6 -3,-0.5 -2,-0.2 0.780 104.3 71.8 -97.1 -32.0 18.0 91.0 60.2 55 55 A G T 3< S+ 0 0 0 -4,-3.4 -2,-0.1 1,-0.3 -3,-0.1 0.399 77.7 76.0 -68.1 -1.8 21.7 91.4 61.1 56 56 A T T 3 S+ 0 0 4 -4,-0.3 -1,-0.3 -5,-0.1 -2,-0.1 0.457 72.1 124.1 -85.2 -4.9 21.1 94.1 63.8 57 57 A W < - 0 0 24 -3,-1.6 2,-0.5 7,-0.2 7,-0.2 -0.227 47.0-159.9 -59.7 144.8 19.9 91.3 66.1 58 58 A D B >>> -B 63 0B 30 5,-1.8 4,-1.8 1,-0.1 3,-1.0 -0.952 8.5-157.5-129.6 111.1 21.5 90.8 69.5 59 59 A K T 345S+ 0 0 87 101,-2.2 -1,-0.1 -2,-0.5 102,-0.1 0.744 87.5 68.4 -57.9 -25.2 20.9 87.3 71.0 60 60 A H T 345S+ 0 0 133 100,-0.2 -1,-0.2 1,-0.2 -3,-0.0 0.856 124.0 2.9 -66.6 -37.9 21.6 88.7 74.5 61 61 A D T <45S- 0 0 52 -3,-1.0 -57,-0.7 2,-0.1 -2,-0.2 0.269 94.8-116.4-133.0 8.6 18.5 90.9 74.8 62 62 A N T <5 + 0 0 26 -4,-1.8 2,-0.2 1,-0.2 -3,-0.2 0.757 62.6 149.2 59.0 28.4 16.6 90.2 71.5 63 63 A T B < +B 58 0B 48 -5,-0.7 -5,-1.8 -7,-0.1 -1,-0.2 -0.528 52.1 11.1 -85.4 161.3 16.9 93.8 70.3 64 64 A G S S+ 0 0 11 73,-0.5 4,-0.2 -7,-0.2 -7,-0.2 -0.284 75.5 126.7 69.0-158.1 17.1 94.4 66.6 65 65 A G S S- 0 0 4 -13,-0.2 5,-0.3 1,-0.1 4,-0.3 -0.195 75.0 -70.8 95.3 172.0 16.3 91.6 64.2 66 66 A S S > S+ 0 0 4 206,-0.5 3,-0.9 203,-0.3 -1,-0.1 0.753 108.0 84.5 -74.4 -27.7 13.9 91.3 61.2 67 67 A Y T 3 S+ 0 0 24 205,-0.4 38,-0.4 1,-0.2 39,-0.2 0.860 90.4 43.4 -43.7 -55.5 10.7 91.2 63.3 68 68 A G T 3 S- 0 0 5 -3,-0.3 65,-1.7 -4,-0.2 -1,-0.2 0.641 87.7-140.9 -71.7 -20.8 10.1 94.9 63.7 69 69 A G X + 0 0 3 -3,-0.9 3,-1.5 -4,-0.3 -3,-0.1 0.780 42.0 159.3 62.2 31.8 10.9 96.1 60.1 70 70 A T G > + 0 0 4 -5,-0.3 3,-2.3 1,-0.3 6,-0.4 0.518 46.1 90.5 -66.6 -7.5 12.5 99.1 61.7 71 71 A Y G 3 S+ 0 0 1 1,-0.3 -1,-0.3 5,-0.1 6,-0.2 0.783 74.3 73.6 -60.5 -22.0 14.6 100.0 58.6 72 72 A R G < S+ 0 0 73 -3,-1.5 2,-0.3 4,-0.1 -1,-0.3 0.665 82.6 84.7 -66.4 -14.5 11.7 102.2 57.6 73 73 A F S X> S- 0 0 31 -3,-2.3 4,-2.5 1,-0.1 3,-0.7 -0.725 88.6-120.5 -92.4 140.6 12.7 104.7 60.3 74 74 A K H 3> S+ 0 0 136 -2,-0.3 4,-3.1 1,-0.2 5,-0.1 0.783 106.2 62.3 -47.5 -41.3 15.4 107.3 59.6 75 75 A K H 34 S+ 0 0 82 1,-0.2 -1,-0.2 2,-0.2 -4,-0.1 0.944 116.9 30.4 -53.7 -50.4 17.8 106.2 62.3 76 76 A E H X4 S+ 0 0 3 -3,-0.7 3,-1.3 -6,-0.4 -1,-0.2 0.853 117.6 56.8 -76.1 -38.0 18.3 102.8 60.7 77 77 A F H 3< S+ 0 0 51 -4,-2.5 -2,-0.2 -7,-0.3 -1,-0.2 0.873 111.0 45.7 -59.8 -38.7 17.7 104.0 57.2 78 78 A N T 3< S+ 0 0 102 -4,-3.1 -1,-0.3 -5,-0.2 -2,-0.2 0.292 79.0 131.8 -90.1 8.1 20.5 106.5 57.6 79 79 A D X - 0 0 8 -3,-1.3 3,-2.4 1,-0.2 4,-0.1 -0.439 60.7-135.6 -61.1 127.6 22.9 104.0 59.2 80 80 A P G > S+ 0 0 95 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.868 106.1 61.7 -54.9 -34.4 26.2 104.4 57.3 81 81 A S G 3 S+ 0 0 37 1,-0.3 -2,-0.1 63,-0.1 -3,-0.0 0.650 102.0 53.2 -65.0 -16.5 26.5 100.7 57.2 82 82 A N G X S+ 0 0 1 -3,-2.4 3,-2.3 -6,-0.1 4,-0.4 0.262 74.4 142.1-102.7 11.7 23.2 100.7 55.1 83 83 A A T < S+ 0 0 25 -3,-1.8 101,-0.1 1,-0.3 -5,-0.1 -0.322 73.2 21.2 -56.9 123.0 24.5 103.2 52.5 84 84 A G T > S+ 0 0 4 -2,-0.1 3,-1.6 99,-0.1 4,-0.4 0.019 93.7 100.3 106.2 -26.1 23.0 102.0 49.2 85 85 A L T X> + 0 0 0 -3,-2.3 4,-2.1 1,-0.3 3,-0.6 0.672 62.1 81.0 -66.8 -17.2 20.1 100.0 50.6 86 86 A Q H 3> S+ 0 0 50 -4,-0.4 4,-2.7 1,-0.3 -1,-0.3 0.834 86.3 61.5 -57.2 -29.7 17.7 102.8 49.9 87 87 A N H <> S+ 0 0 44 -3,-1.6 4,-1.6 2,-0.2 -1,-0.3 0.900 103.6 46.4 -63.5 -43.3 17.8 101.4 46.4 88 88 A G H <> S+ 0 0 0 -3,-0.6 4,-1.8 -4,-0.4 -2,-0.2 0.897 112.7 50.9 -65.9 -39.5 16.3 98.1 47.6 89 89 A F H X S+ 0 0 48 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.911 108.1 51.1 -64.5 -43.2 13.7 100.0 49.6 90 90 A K H < S+ 0 0 115 -4,-2.7 3,-0.3 1,-0.2 -1,-0.2 0.861 108.4 53.6 -63.1 -34.9 12.7 102.1 46.7 91 91 A F H X S+ 0 0 3 -4,-1.6 4,-0.5 1,-0.2 -1,-0.2 0.893 108.7 49.5 -65.3 -41.3 12.3 98.9 44.6 92 92 A L H X S+ 0 0 3 -4,-1.8 4,-2.7 1,-0.2 5,-0.2 0.675 89.4 84.3 -73.6 -18.2 10.0 97.4 47.3 93 93 A E H X S+ 0 0 94 -4,-1.2 4,-2.2 -3,-0.3 -1,-0.2 0.909 91.1 45.3 -52.2 -51.8 7.7 100.5 47.5 94 94 A P H > S+ 0 0 46 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.877 113.0 53.2 -62.1 -35.4 5.5 99.5 44.6 95 95 A I H X S+ 0 0 6 -4,-0.5 4,-2.0 1,-0.2 -2,-0.2 0.936 110.5 45.4 -63.9 -46.6 5.3 96.0 46.0 96 96 A H H < S+ 0 0 50 -4,-2.7 -1,-0.2 1,-0.2 6,-0.2 0.843 109.7 56.3 -67.3 -32.1 4.2 97.3 49.4 97 97 A K H < S+ 0 0 155 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.903 110.8 43.4 -66.5 -38.2 1.7 99.6 47.7 98 98 A E H < S+ 0 0 127 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.819 127.0 31.7 -76.2 -31.1 0.1 96.7 45.9 99 99 A F >< + 0 0 21 -4,-2.0 3,-1.8 -5,-0.2 -1,-0.3 -0.527 69.0 162.0-124.6 66.7 0.1 94.5 49.0 100 100 A P T 3 + 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.649 67.0 72.3 -60.5 -15.6 -0.2 97.0 51.9 101 101 A W T 3 S+ 0 0 57 -3,-0.1 2,-0.2 2,-0.1 -89,-0.1 0.684 75.8 92.2 -74.7 -22.3 -1.3 94.1 54.2 102 102 A I S < S- 0 0 3 -3,-1.8 -3,-0.1 -6,-0.2 29,-0.0 -0.535 80.8-118.2 -76.6 138.7 2.2 92.6 54.5 103 103 A S > - 0 0 13 27,-0.2 4,-2.1 -2,-0.2 5,-0.1 -0.354 21.2-115.7 -70.5 159.9 4.4 93.8 57.4 104 104 A S H > S+ 0 0 8 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.916 115.6 51.5 -62.8 -44.7 7.7 95.6 56.6 105 105 A G H > S+ 0 0 1 -38,-0.4 4,-2.3 1,-0.2 5,-0.3 0.905 110.6 48.1 -59.7 -44.0 9.7 92.8 58.2 106 106 A D H > S+ 0 0 0 24,-0.3 4,-2.5 -39,-0.2 -1,-0.2 0.893 114.2 47.5 -63.9 -39.6 8.0 90.2 56.1 107 107 A L H X S+ 0 0 2 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.941 111.7 48.5 -67.5 -48.1 8.5 92.2 53.0 108 108 A F H X S+ 0 0 3 -4,-3.1 4,-1.1 1,-0.2 -2,-0.2 0.929 118.2 40.9 -58.4 -47.6 12.2 93.0 53.6 109 109 A S H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.2 3,-0.4 0.912 113.2 52.6 -68.4 -42.9 13.0 89.3 54.4 110 110 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 -5,-0.3 -1,-0.2 0.844 103.0 60.2 -62.8 -32.6 10.8 88.0 51.6 111 111 A G H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.903 106.4 46.5 -61.3 -40.4 12.6 90.3 49.1 112 112 A G H X S+ 0 0 0 -4,-1.1 4,-2.5 -3,-0.4 -2,-0.2 0.926 112.7 48.4 -67.1 -46.1 15.9 88.5 50.0 113 113 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.929 113.2 48.4 -59.0 -46.4 14.4 85.0 49.7 114 114 A T H X S+ 0 0 0 -4,-2.9 4,-3.0 2,-0.2 5,-0.2 0.929 111.1 50.1 -60.3 -47.4 12.8 86.0 46.3 115 115 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 6,-0.2 0.932 111.0 48.3 -59.1 -48.5 16.0 87.4 45.0 116 116 A V H <>S+ 0 0 0 -4,-2.5 5,-2.6 1,-0.2 82,-0.2 0.943 115.8 43.6 -59.3 -48.9 18.1 84.4 45.9 117 117 A Q H ><5S+ 0 0 5 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.922 113.3 50.4 -64.8 -43.4 15.6 81.9 44.3 118 118 A E H 3<5S+ 0 0 47 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.842 104.4 59.4 -65.1 -29.2 15.1 84.0 41.2 119 119 A M T 3<5S- 0 0 15 -4,-2.1 79,-3.1 -5,-0.2 -1,-0.3 0.110 128.5 -98.0 -87.0 23.9 18.9 84.2 40.8 120 120 A Q T < 5S+ 0 0 134 -3,-1.5 -3,-0.2 77,-0.2 -2,-0.2 0.625 80.6 139.0 69.8 21.3 19.0 80.4 40.6 121 121 A G < - 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