==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE (H2O2(A)) 27-AUG-85 2CYP . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR B.C.FINZEL,T.L.POULOS,J.KRAUT . 293 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12438.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 63.5 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 . 9 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 35.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 2 A T 0 0 117 0, 0.0 59,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 59.8 13.9 92.6 80.5 2 3 A P - 0 0 90 0, 0.0 2,-0.2 0, 0.0 59,-0.2 -0.232 360.0-112.0 -56.8 142.6 14.6 91.2 77.0 3 4 A L - 0 0 59 57,-1.2 2,-0.4 2,-0.0 269,-0.0 -0.564 18.3-134.6 -83.1 153.7 11.7 92.1 74.8 4 5 A V - 0 0 108 -2,-0.2 2,-0.5 2,-0.0 269,-0.1 -0.924 15.1-167.6-111.6 130.4 9.3 89.5 73.3 5 6 A H - 0 0 33 -2,-0.4 269,-4.0 267,-0.4 2,-0.5 -0.940 7.5-169.2-121.9 95.9 8.5 89.9 69.6 6 7 A V B -a 274 0A 68 -2,-0.5 269,-0.2 267,-0.2 2,-0.2 -0.800 19.2-130.6 -91.6 126.0 5.5 87.7 68.8 7 8 A A - 0 0 10 267,-2.6 2,-0.4 -2,-0.5 122,-0.2 -0.582 23.1-169.1 -70.7 141.3 4.8 87.3 65.1 8 9 A S - 0 0 70 120,-1.9 120,-0.2 -2,-0.2 3,-0.1 -0.923 23.9-121.1-138.1 122.3 1.1 87.9 64.0 9 10 A V - 0 0 55 -2,-0.4 3,-0.2 118,-0.2 2,-0.1 -0.190 39.5 -98.2 -59.5 126.3 -0.1 87.0 60.6 10 11 A E > - 0 0 21 1,-0.2 3,-2.6 2,-0.1 -1,-0.1 -0.422 67.8 -71.2 -49.1 131.8 -1.5 90.0 58.7 11 12 A K T 3 S- 0 0 179 1,-0.3 -1,-0.2 -3,-0.1 89,-0.0 0.136 108.4 -20.2 -47.8 114.8 -5.3 89.7 59.2 12 13 A G T 3 S+ 0 0 77 -3,-0.2 -1,-0.3 1,-0.2 2,-0.1 0.524 96.2 140.6 64.6 15.4 -6.5 86.8 57.3 13 14 A R < + 0 0 81 -3,-2.6 2,-0.2 87,-0.1 -1,-0.2 -0.397 23.0 175.2 -83.3 144.1 -3.6 86.5 54.8 14 15 A S >> - 0 0 66 -2,-0.1 4,-1.6 -5,-0.0 3,-0.9 -0.693 50.3 -63.5-134.4-167.4 -2.3 83.2 53.6 15 16 A Y H 3> S+ 0 0 87 1,-0.3 4,-2.4 -2,-0.2 5,-0.2 0.901 126.4 56.5 -48.6 -49.2 0.2 81.7 51.2 16 17 A E H 3> S+ 0 0 60 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.768 104.3 52.6 -57.6 -35.7 -1.5 83.0 48.1 17 18 A D H <> S+ 0 0 31 -3,-0.9 4,-1.2 2,-0.2 -1,-0.2 0.873 112.4 44.1 -68.9 -43.0 -1.4 86.6 49.3 18 19 A F H X S+ 0 0 0 -4,-1.6 4,-2.6 1,-0.2 -2,-0.2 0.853 107.7 59.1 -69.1 -42.0 2.4 86.5 49.9 19 20 A Q H X S+ 0 0 12 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.823 104.3 51.8 -51.6 -43.0 2.9 84.7 46.6 20 21 A K H X S+ 0 0 99 -4,-1.2 4,-1.8 -5,-0.2 -1,-0.2 0.833 110.3 48.1 -63.4 -41.7 1.4 87.7 44.9 21 22 A V H X S+ 0 0 0 -4,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.929 110.8 50.0 -65.5 -45.3 3.7 90.1 46.8 22 23 A Y H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.910 111.4 51.5 -56.8 -44.9 6.8 88.0 45.8 23 24 A N H X S+ 0 0 23 -4,-2.2 4,-2.6 1,-0.3 -1,-0.2 0.848 107.4 51.2 -62.1 -38.1 5.5 88.1 42.2 24 25 A A H X S+ 0 0 18 -4,-1.8 4,-1.9 2,-0.2 -1,-0.3 0.833 113.4 43.5 -67.3 -48.9 5.2 91.8 42.2 25 26 A I H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.949 115.6 51.1 -59.6 -47.6 8.7 92.3 43.5 26 27 A A H X S+ 0 0 1 -4,-3.0 4,-1.4 1,-0.3 -2,-0.2 0.898 110.2 46.8 -52.3 -51.7 9.9 89.7 41.1 27 28 A L H X S+ 0 0 76 -4,-2.6 4,-1.2 -5,-0.2 -1,-0.3 0.877 112.0 51.5 -65.0 -37.0 8.3 91.2 38.0 28 29 A K H X S+ 0 0 46 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.821 105.5 56.2 -69.5 -33.5 9.6 94.7 39.0 29 30 A L H < S+ 0 0 23 -4,-2.3 12,-0.3 1,-0.2 -1,-0.2 0.839 109.2 46.6 -59.6 -46.0 13.1 93.2 39.3 30 31 A R H < S+ 0 0 122 -4,-1.4 3,-0.4 -5,-0.2 -1,-0.2 0.774 117.5 42.2 -62.5 -39.9 12.8 91.9 35.7 31 32 A E H < S+ 0 0 67 -4,-1.2 2,-1.1 1,-0.2 -2,-0.2 0.809 108.7 53.8 -80.9 -42.8 11.5 95.2 34.4 32 33 A D S >< S+ 0 0 60 -4,-2.8 3,-0.5 1,-0.2 9,-0.4 -0.510 71.6 137.0 -91.4 61.9 13.7 97.7 36.2 33 34 A D T 3 + 0 0 83 -2,-1.1 -1,-0.2 -3,-0.4 -2,-0.1 0.320 47.6 75.1 -95.9 3.4 16.9 96.1 35.0 34 35 A E T 3> + 0 0 49 -3,-0.2 4,-1.5 4,-0.1 3,-0.4 0.592 65.3 120.2 -89.3 -12.0 19.0 99.0 34.0 35 36 A Y H <>>S+ 0 0 50 -3,-0.5 5,-2.7 1,-0.2 4,-1.3 -0.203 79.7 8.4 -59.7 143.2 19.9 100.1 37.6 36 37 A D H >45S- 0 0 43 1,-0.2 3,-1.0 2,-0.2 -1,-0.2 0.946 139.8 -47.9 52.0 54.0 23.6 100.2 38.5 37 38 A N H 345S- 0 0 116 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.856 113.8 -46.4 55.9 45.5 24.9 99.5 35.0 38 39 A Y H 3<5S+ 0 0 161 -4,-1.5 -1,-0.3 1,-0.0 -2,-0.2 0.707 109.8 117.9 73.6 16.9 22.5 96.7 34.3 39 40 A I T <<5 - 0 0 21 -4,-1.3 3,-0.2 -3,-1.0 -3,-0.2 0.848 64.0-151.9 -70.7 -45.0 23.2 95.0 37.6 40 41 A G < - 0 0 8 -5,-2.7 4,-0.3 1,-0.2 -7,-0.2 -0.167 32.0 -68.4 91.9 178.1 19.5 95.4 38.5 41 42 A Y S > S+ 0 0 43 -9,-0.4 4,-1.9 -12,-0.3 5,-0.2 0.507 103.3 97.8 -87.2 -2.1 18.0 95.8 42.0 42 43 A G H > S+ 0 0 5 -3,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.924 83.9 43.0 -48.4 -62.1 18.7 92.2 43.1 43 44 A P H > S+ 0 0 15 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.931 112.8 52.3 -58.1 -49.5 21.9 92.8 45.1 44 45 A V H > S+ 0 0 18 -4,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.923 108.0 53.0 -56.9 -30.5 20.7 96.0 46.8 45 46 A L H X S+ 0 0 1 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.847 107.6 50.6 -73.6 -42.8 17.5 94.2 48.0 46 47 A V H X S+ 0 0 8 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.931 112.7 47.4 -55.9 -48.4 19.7 91.4 49.5 47 48 A R H X S+ 0 0 78 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.848 108.6 53.0 -58.3 -42.7 21.7 94.0 51.3 48 49 A L H X S+ 0 0 1 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.937 109.0 50.8 -62.3 -41.6 18.6 95.9 52.5 49 50 A A H X S+ 0 0 0 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.851 112.9 46.7 -60.4 -40.5 17.4 92.6 54.0 50 51 A W H X S+ 0 0 47 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.907 113.0 46.5 -69.0 -47.8 20.7 92.1 55.7 51 52 A H H < S+ 0 0 15 -4,-3.1 4,-0.3 1,-0.2 -2,-0.2 0.795 112.0 50.9 -67.5 -30.4 21.1 95.5 57.2 52 53 A T H < S+ 0 0 8 -4,-2.2 -1,-0.2 -5,-0.3 3,-0.2 0.786 120.9 35.3 -72.2 -31.8 17.5 95.6 58.5 53 54 A S H >< S+ 0 0 0 -4,-1.0 3,-1.0 -5,-0.2 12,-0.2 0.745 105.8 70.2 -88.4 -21.5 18.1 92.2 60.2 54 55 A G T 3< S+ 0 0 0 -4,-2.4 -2,-0.1 1,-0.3 -1,-0.1 0.356 78.5 75.9 -85.6 0.7 21.7 92.8 61.2 55 56 A T T 3 S+ 0 0 5 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.464 72.9 123.1 -79.7 -8.0 21.0 95.4 63.9 56 57 A W < - 0 0 22 -3,-1.0 2,-0.4 7,-0.2 7,-0.2 -0.267 47.4-160.8 -62.8 145.7 19.8 92.6 66.1 57 58 A D B >>> -B 62 0B 25 5,-2.0 4,-1.6 103,-0.1 5,-0.7 -0.977 10.5-157.2-128.5 112.0 21.4 92.0 69.5 58 59 A K T 345S+ 0 0 86 101,-2.3 102,-0.1 -2,-0.4 -1,-0.1 0.593 88.2 70.2 -58.0 -20.6 20.9 88.5 71.0 59 60 A H T 345S+ 0 0 135 1,-0.1 -1,-0.2 100,-0.1 -3,-0.0 0.928 122.3 3.3 -71.3 -42.1 21.5 90.1 74.5 60 61 A D T <45S- 0 0 62 -3,-0.6 -57,-1.2 2,-0.1 -2,-0.2 0.203 95.0-115.9-127.7 7.7 18.3 92.1 74.8 61 62 A N T <5 + 0 0 21 -4,-1.6 2,-0.2 1,-0.2 -3,-0.2 0.741 64.4 149.6 57.6 32.8 16.4 91.2 71.6 62 63 A T B < +B 57 0B 34 -5,-0.7 -5,-2.0 -7,-0.1 -1,-0.2 -0.590 50.0 5.1 -90.0 158.0 16.6 94.8 70.4 63 64 A G S S+ 0 0 15 73,-0.4 3,-0.3 -7,-0.2 -7,-0.2 -0.160 74.8 120.2 64.3-155.2 16.8 95.5 66.6 64 65 A G S S- 0 0 4 1,-0.2 3,-0.3 -12,-0.2 5,-0.3 -0.371 81.0 -56.2 89.9-176.7 16.4 92.8 64.0 65 66 A S S > S+ 0 0 3 206,-0.6 3,-0.8 203,-0.3 -1,-0.2 0.635 108.7 86.6 -74.3 -21.8 13.9 92.3 61.2 66 67 A Y T 3 S+ 0 0 21 205,-0.3 38,-0.4 -3,-0.3 -1,-0.2 0.827 89.8 37.5 -53.3 -57.2 10.7 92.4 63.4 67 68 A G T 3 S- 0 0 7 -3,-0.3 65,-1.4 64,-0.1 -1,-0.2 0.460 88.1-136.2 -79.1 -2.5 9.8 96.1 63.7 68 69 A G X + 0 0 5 -3,-0.8 3,-1.3 -4,-0.2 -3,-0.1 0.844 43.0 161.3 45.8 45.2 10.7 97.3 60.2 69 70 A T G > + 0 0 7 -5,-0.3 3,-2.0 1,-0.3 6,-0.4 0.502 49.3 88.8 -72.2 -8.4 12.4 100.4 61.8 70 71 A Y G 3 S+ 0 0 1 1,-0.3 -1,-0.3 5,-0.2 -2,-0.1 0.672 76.8 71.3 -65.3 -19.2 14.5 101.3 58.7 71 72 A R G < S+ 0 0 73 -3,-1.3 2,-0.3 4,-0.1 -1,-0.3 0.709 84.6 82.9 -69.9 -17.3 11.4 103.3 57.7 72 73 A F S X> S- 0 0 35 -3,-2.0 4,-2.2 1,-0.1 3,-0.9 -0.709 90.1-117.0 -88.5 141.1 12.3 105.8 60.6 73 74 A K H 3> S+ 0 0 55 -2,-0.3 4,-2.1 1,-0.3 -1,-0.1 0.703 107.9 59.5 -40.8 -51.0 14.9 108.6 60.0 74 75 A K H 34 S+ 0 0 85 1,-0.2 -1,-0.3 2,-0.2 -4,-0.1 0.920 116.7 33.6 -52.6 -47.6 17.5 107.6 62.6 75 76 A E H X4 S+ 0 0 3 -3,-0.9 3,-1.3 -6,-0.4 -2,-0.2 0.864 116.4 54.2 -75.5 -44.4 17.9 104.1 60.9 76 77 A F H 3< S+ 0 0 53 -4,-2.2 -2,-0.2 -7,-0.3 -1,-0.2 0.848 112.1 46.8 -59.1 -35.9 17.4 105.3 57.3 77 78 A N T 3< S+ 0 0 112 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.273 77.1 131.2 -91.4 -0.4 20.1 107.9 57.8 78 79 A D X - 0 0 10 -3,-1.3 3,-3.0 1,-0.2 4,-0.1 -0.426 62.9-132.6 -53.6 126.9 22.7 105.5 59.4 79 80 A P G > S+ 0 0 99 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.870 107.9 62.2 -58.7 -28.4 25.9 106.1 57.5 80 81 A S G 3 S+ 0 0 38 1,-0.3 -2,-0.1 63,-0.1 -3,-0.0 0.674 98.6 56.6 -66.0 -20.7 26.2 102.3 57.3 81 82 A N G X S+ 0 0 0 -3,-3.0 3,-2.5 -6,-0.2 4,-0.3 0.182 74.1 140.9 -96.6 12.5 23.0 102.3 55.3 82 83 A A T < S+ 0 0 27 -3,-1.6 -5,-0.1 1,-0.3 101,-0.1 -0.338 71.3 20.5 -55.5 134.4 24.2 104.6 52.6 83 84 A G T > S+ 0 0 3 -2,-0.1 3,-1.3 99,-0.1 -1,-0.3 0.092 96.0 99.1 95.2 -29.2 22.9 103.5 49.2 84 85 A L T X> + 0 0 0 -3,-2.5 4,-2.0 1,-0.3 3,-1.1 0.590 61.5 80.0 -71.2 -15.4 20.0 101.4 50.6 85 86 A Q H 3> S+ 0 0 63 -4,-0.3 4,-2.5 1,-0.3 -1,-0.3 0.799 84.9 65.2 -59.0 -22.9 17.6 104.2 49.9 86 87 A N H <> S+ 0 0 61 -3,-1.3 4,-0.9 2,-0.2 -1,-0.3 0.854 104.4 41.7 -64.6 -38.5 17.7 102.7 46.4 87 88 A G H <> S+ 0 0 0 -3,-1.1 4,-1.3 -4,-0.2 -2,-0.2 0.829 111.9 55.5 -77.5 -40.7 16.1 99.5 47.5 88 89 A F H >X S+ 0 0 65 -4,-2.0 4,-1.1 1,-0.2 3,-0.7 0.931 108.6 48.8 -54.2 -50.9 13.6 101.3 49.7 89 90 A K H 3< S+ 0 0 80 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.777 107.2 54.9 -55.0 -44.9 12.5 103.3 46.7 90 91 A F H 3< S+ 0 0 4 -4,-0.9 4,-0.3 1,-0.2 -1,-0.3 0.781 111.6 43.9 -57.4 -45.6 12.1 100.2 44.6 91 92 A L H S+ 0 0 67 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.817 111.5 50.7 -55.3 -39.1 5.4 101.1 44.8 94 95 A I H > S+ 0 0 5 -3,-0.4 4,-2.0 -4,-0.3 -2,-0.2 0.833 106.7 52.4 -66.2 -40.7 4.9 97.5 45.9 95 96 A H H < S+ 0 0 51 -4,-2.0 -1,-0.2 -3,-0.4 6,-0.2 0.812 107.8 53.9 -67.0 -30.1 4.0 98.5 49.5 96 97 A K H < S+ 0 0 77 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.819 108.6 48.6 -74.6 -35.2 1.3 100.8 48.0 97 98 A E H < S+ 0 0 130 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.851 124.9 30.0 -71.9 -32.4 -0.1 98.0 46.0 98 99 A F >< + 0 0 18 -4,-2.0 3,-1.5 1,-0.1 -1,-0.3 -0.671 69.5 166.8-129.2 73.8 -0.2 95.7 49.1 99 100 A P T 3 + 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.580 67.9 69.5 -69.8 -15.2 -0.7 98.1 52.0 100 101 A W T 3 S+ 0 0 56 -90,-0.0 2,-0.3 2,-0.0 -89,-0.1 0.605 75.4 98.8 -76.5 -23.3 -1.5 95.2 54.5 101 102 A I S < S- 0 0 4 -3,-1.5 -3,-0.0 -6,-0.2 5,-0.0 -0.543 78.7-119.4 -71.7 133.9 2.1 93.8 54.5 102 103 A S > - 0 0 11 -2,-0.3 4,-1.4 27,-0.2 28,-0.1 -0.250 20.4-118.8 -63.2 150.0 4.2 94.9 57.5 103 104 A S H > S+ 0 0 8 2,-0.2 4,-2.2 1,-0.1 5,-0.1 0.891 115.7 52.9 -63.4 -39.6 7.4 96.8 56.7 104 105 A G H > S+ 0 0 1 -38,-0.4 4,-2.5 1,-0.3 5,-0.3 0.863 109.4 50.1 -68.3 -42.0 9.5 94.1 58.3 105 106 A D H > S+ 0 0 0 24,-0.3 4,-2.1 1,-0.2 -1,-0.3 0.865 112.0 45.8 -58.5 -46.3 7.8 91.5 56.2 106 107 A L H X S+ 0 0 2 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.885 113.1 49.1 -65.7 -42.7 8.4 93.4 52.9 107 108 A F H X S+ 0 0 8 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.904 116.9 42.9 -67.6 -46.6 12.1 94.2 53.7 108 109 A S H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.853 114.7 49.3 -60.1 -51.3 12.7 90.5 54.5 109 110 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.882 103.2 59.8 -63.0 -34.8 10.6 89.2 51.6 110 111 A G H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.882 106.6 49.6 -60.5 -30.8 12.4 91.5 49.1 111 112 A G H X S+ 0 0 0 -4,-1.2 4,-2.3 1,-0.2 5,-0.2 0.902 111.1 48.2 -74.8 -37.9 15.7 89.8 50.2 112 113 A V H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.919 112.5 48.6 -64.0 -49.1 14.2 86.3 49.7 113 114 A T H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.933 109.3 51.7 -60.6 -48.8 12.8 87.2 46.3 114 115 A A H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 6,-0.2 0.911 110.6 48.9 -55.6 -48.4 16.1 88.7 45.0 115 116 A V H <>S+ 0 0 0 -4,-2.3 5,-2.3 1,-0.2 82,-0.2 0.961 115.6 41.8 -56.1 -51.4 18.0 85.6 46.0 116 117 A Q H ><5S+ 0 0 7 -4,-2.2 3,-1.1 -5,-0.2 -1,-0.2 0.911 114.8 51.6 -63.0 -39.9 15.6 83.2 44.3 117 118 A E H 3<5S+ 0 0 45 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.882 104.2 57.2 -70.7 -29.3 15.2 85.3 41.3 118 119 A M T 3<5S- 0 0 16 -4,-2.8 79,-3.5 -5,-0.2 -1,-0.3 0.137 129.2 -96.4 -84.4 19.8 19.0 85.6 40.8 119 120 A Q T < 5S+ 0 0 102 -3,-1.1 -3,-0.2 77,-0.2 -2,-0.1 0.592 80.2 139.4 71.8 18.6 19.1 81.7 40.7 120 121 A G < - 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