==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 24-DEC-03 1RZ5 . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MARINOBACTER HYDROCARBONOCLASTICUS; . AUTHOR J.M.DIAS,T.ALVES,C.BONIFACIO,A.S.PEREIRA,D.BOURGEOIS,I.MOURA . 309 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15198.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 189 61.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 19 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 15.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 25.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.6 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 1 0 1 2 0 2 1 1 2 0 1 0 0 0 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 . 5 1 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 1 A D > 0 0 101 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 119.8 54.5 98.1 89.0 2 2 A N H > + 0 0 101 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.864 360.0 58.2 -79.3 -38.5 57.5 97.4 86.7 3 3 A L H > S+ 0 0 28 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.909 107.0 50.0 -55.7 -41.8 58.8 94.7 89.1 4 4 A M H > S+ 0 0 47 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.913 111.0 45.2 -66.3 -45.6 55.6 92.9 88.7 5 5 A E H < S+ 0 0 123 -4,-1.3 4,-0.4 2,-0.2 -1,-0.2 0.816 111.9 54.0 -70.2 -27.2 55.5 93.0 84.9 6 6 A R H >X S+ 0 0 77 -4,-2.3 3,-2.0 2,-0.2 4,-1.5 0.978 109.1 48.3 -66.6 -51.0 59.1 92.0 84.8 7 7 A A H 3X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.3 -2,-0.2 0.830 109.0 54.2 -56.5 -36.8 58.3 89.0 87.0 8 8 A N H 3< S+ 0 0 69 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.548 105.7 52.3 -76.4 -7.6 55.4 88.1 84.7 9 9 A S H <4 S+ 0 0 80 -3,-2.0 -1,-0.2 -4,-0.4 -2,-0.2 0.733 119.2 35.8 -94.7 -26.5 57.7 88.1 81.7 10 10 A M H < S+ 0 0 70 -4,-1.5 187,-2.5 -5,-0.1 2,-0.2 0.852 123.1 29.5 -90.6 -40.8 60.1 85.7 83.4 11 11 A F B < -a 197 0A 2 -4,-3.2 187,-0.2 -5,-0.2 -1,-0.1 -0.733 56.2-150.7-123.4 169.3 57.6 83.5 85.4 12 12 A E - 0 0 123 185,-0.6 2,-0.2 -2,-0.2 188,-0.1 -0.942 27.1-115.4-132.0 152.7 54.1 82.0 85.5 13 13 A P - 0 0 28 0, 0.0 185,-0.1 0, 0.0 186,-0.1 -0.547 40.4 -94.5 -85.7 154.8 52.0 81.1 88.5 14 14 A I - 0 0 0 -2,-0.2 147,-0.4 145,-0.2 148,-0.0 -0.497 51.1-102.8 -66.0 135.0 50.9 77.5 89.1 15 15 A P - 0 0 45 0, 0.0 -1,-0.1 0, 0.0 143,-0.0 -0.252 21.7-128.4 -57.4 147.7 47.5 76.9 87.6 16 16 A K S S+ 0 0 107 144,-0.1 142,-0.1 2,-0.1 -2,-0.1 0.781 91.3 43.9 -70.1 -25.4 44.6 76.8 90.1 17 17 A Y S S- 0 0 183 1,-0.0 139,-0.0 143,-0.0 -1,-0.0 -0.882 102.1 -86.6-121.4 151.8 43.3 73.5 88.8 18 18 A P - 0 0 55 0, 0.0 138,-0.2 0, 0.0 2,-0.1 -0.278 52.7-127.1 -56.1 135.6 45.2 70.2 87.8 19 19 A P - 0 0 22 0, 0.0 2,-0.8 0, 0.0 136,-0.0 -0.424 7.2-119.1 -86.9 157.8 46.3 70.4 84.2 20 20 A V - 0 0 71 -2,-0.1 2,-0.5 5,-0.1 3,-0.3 -0.874 38.0-165.2 -92.3 110.5 45.8 68.0 81.2 21 21 A I B > -B 24 0B 44 -2,-0.8 3,-2.1 3,-0.6 134,-0.1 -0.908 65.6 -14.4-105.1 125.9 49.4 67.1 80.4 22 22 A D T 3 S- 0 0 164 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.870 126.9 -56.5 51.4 43.5 50.1 65.5 77.0 23 23 A G T 3 S+ 0 0 56 -3,-0.3 2,-1.4 1,-0.2 -1,-0.3 0.615 93.8 150.3 68.7 10.9 46.4 64.7 76.5 24 24 A N B < -B 21 0B 17 -3,-2.1 -3,-0.6 127,-0.1 -1,-0.2 -0.606 38.7-146.2 -82.7 93.1 46.2 62.8 79.8 25 25 A E - 0 0 105 -2,-1.4 2,-1.4 -5,-0.1 5,-0.1 -0.327 7.3-131.4 -64.9 134.0 42.6 63.4 80.8 26 26 A L + 0 0 49 -8,-0.1 -1,-0.1 -2,-0.1 2,-0.1 -0.408 39.6 164.0 -84.6 60.3 41.8 63.7 84.5 27 27 A T > - 0 0 68 -2,-1.4 4,-2.7 1,-0.1 5,-0.3 -0.401 46.8-118.7 -75.3 154.6 38.8 61.3 84.9 28 28 A Q H > S+ 0 0 147 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.918 112.5 53.3 -62.1 -41.2 38.0 60.3 88.4 29 29 A A H > S+ 0 0 30 1,-0.2 4,-1.7 2,-0.2 104,-0.2 0.904 113.1 43.9 -61.6 -38.7 38.5 56.6 87.7 30 30 A K H > S+ 0 0 20 2,-0.2 4,-2.8 102,-0.2 123,-0.2 0.929 113.9 48.3 -72.8 -45.0 42.0 57.3 86.4 31 31 A V H X S+ 0 0 29 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.886 112.7 49.3 -63.9 -36.5 43.1 59.7 89.1 32 32 A E H X S+ 0 0 69 -4,-2.5 4,-2.1 -5,-0.3 -1,-0.2 0.912 112.2 47.5 -69.2 -40.7 41.8 57.3 91.9 33 33 A L H X S+ 0 0 0 -4,-1.7 4,-2.6 -5,-0.3 -2,-0.2 0.930 111.3 52.0 -63.3 -45.3 43.7 54.4 90.3 34 34 A G H X S+ 0 0 0 -4,-2.8 4,-2.1 115,-0.3 -2,-0.2 0.880 107.5 52.0 -60.0 -39.4 46.8 56.6 90.0 35 35 A K H X S+ 0 0 46 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.914 109.8 48.2 -65.0 -43.5 46.6 57.6 93.7 36 36 A M H >< S+ 0 0 6 -4,-2.1 3,-0.8 1,-0.2 4,-0.4 0.950 112.4 50.5 -57.7 -47.3 46.4 53.9 94.7 37 37 A E H >< S+ 0 0 0 -4,-2.6 3,-0.8 1,-0.3 14,-0.4 0.830 104.1 57.4 -56.0 -43.1 49.4 53.2 92.5 38 38 A F H 3< S+ 0 0 1 -4,-2.1 14,-1.7 1,-0.2 13,-0.5 0.804 116.1 35.1 -62.3 -30.8 51.4 56.0 94.0 39 39 A F T << S+ 0 0 2 -4,-1.2 -1,-0.2 -3,-0.8 -2,-0.2 0.285 88.9 115.1-107.6 6.9 51.0 54.5 97.5 40 40 A E X - 0 0 1 -3,-0.8 3,-1.0 -4,-0.4 11,-0.2 -0.709 40.8-176.1 -82.6 105.1 51.2 50.9 96.4 41 41 A P G > S+ 0 0 35 0, 0.0 3,-1.7 0, 0.0 8,-0.7 0.657 74.6 77.8 -77.5 -12.3 54.4 49.4 97.8 42 42 A R G 3 S+ 0 0 30 1,-0.3 8,-0.1 5,-0.2 77,-0.1 0.432 73.5 77.9 -75.9 4.2 53.7 46.1 96.0 43 43 A L G < S+ 0 0 9 -3,-1.0 2,-0.3 6,-0.3 -1,-0.3 0.701 88.3 71.2 -79.3 -20.1 55.0 47.7 92.8 44 44 A S S X S- 0 0 3 -3,-1.7 3,-1.2 5,-0.4 67,-0.2 -0.696 93.0-125.1 -91.8 149.7 58.4 47.0 94.4 45 45 A S T 3 S+ 0 0 36 65,-2.7 262,-2.5 -2,-0.3 66,-0.1 0.804 113.3 52.4 -66.4 -26.1 59.6 43.4 94.6 46 46 A S T 3 S- 0 0 13 64,-0.3 -1,-0.3 260,-0.2 263,-0.1 0.635 105.1-132.1 -82.5 -11.1 60.1 43.8 98.4 47 47 A H S < S+ 0 0 29 -3,-1.2 -5,-0.2 -6,-0.4 -2,-0.1 0.733 86.8 88.7 66.7 24.0 56.5 45.1 98.7 48 48 A L + 0 0 118 -7,-0.3 2,-0.5 1,-0.1 -6,-0.1 0.569 65.7 73.7-124.4 -16.6 57.8 47.9 100.9 49 49 A I + 0 0 22 -8,-0.7 -5,-0.4 61,-0.1 -6,-0.3 -0.906 50.6 166.7-109.3 125.8 58.7 50.8 98.6 50 50 A S >> - 0 0 16 -2,-0.5 3,-1.5 -7,-0.1 4,-0.9 -0.747 55.1 -94.5-122.6 174.0 56.1 53.0 96.8 51 51 A C H >> S+ 0 0 34 -13,-0.5 4,-2.3 -14,-0.4 3,-0.6 0.897 125.9 60.7 -53.7 -36.4 56.4 56.3 95.0 52 52 A N H 34 S+ 0 0 22 -14,-1.7 -1,-0.3 1,-0.2 6,-0.2 0.704 90.2 68.1 -66.8 -20.4 55.5 57.9 98.3 53 53 A T H <4 S+ 0 0 49 -3,-1.5 3,-0.4 1,-0.2 -1,-0.2 0.942 117.1 22.6 -62.8 -45.0 58.5 56.4 100.0 54 54 A C H << S+ 0 0 23 -4,-0.9 9,-0.3 -3,-0.6 -2,-0.2 0.658 132.0 41.9 -97.0 -17.1 60.8 58.6 98.0 55 55 A H S < S- 0 0 51 -4,-2.3 2,-0.3 -5,-0.2 7,-0.3 -0.490 84.0-169.1-125.1 60.1 58.4 61.4 97.1 56 56 A N B > > -C 62 0C 47 6,-1.0 5,-2.6 -3,-0.4 3,-1.7 -0.322 16.5-154.8 -58.3 113.7 56.7 61.7 100.5 57 57 A V G > 5S+ 0 0 20 1,-0.3 3,-0.5 -2,-0.3 -1,-0.2 0.740 96.7 52.6 -64.7 -19.5 53.5 63.9 100.3 58 58 A G G 3 5S+ 0 0 65 1,-0.2 -1,-0.3 -6,-0.2 -2,-0.1 0.591 110.4 48.8 -88.9 -8.5 53.9 64.7 104.0 59 59 A L G < 5S- 0 0 69 -3,-1.7 3,-0.3 3,-0.2 -1,-0.2 0.048 132.7 -74.8-116.4 24.9 57.5 65.8 103.6 60 60 A G T < 5S- 0 0 9 -3,-0.5 24,-0.3 1,-0.2 -3,-0.2 0.634 81.9 -68.1 95.4 11.4 57.4 68.1 100.6 61 61 A G S S- 0 0 145 4,-0.2 3,-1.6 2,-0.1 2,-1.1 -0.299 129.2 -5.1 -64.2 138.6 69.8 48.9 95.1 72 72 A G T 3 S- 0 0 42 1,-0.2 -1,-0.1 -3,-0.1 238,-0.1 -0.719 126.4 -58.0 82.2-105.5 69.4 46.7 98.2 73 73 A W T 3 S+ 0 0 127 -2,-1.1 -1,-0.2 2,-0.1 2,-0.2 -0.109 103.5 128.2-160.9 34.1 68.9 49.5 100.8 74 74 A Q S < S- 0 0 151 -3,-1.6 -4,-3.5 1,-0.1 2,-0.1 -0.469 71.7 -72.7 -91.8 165.7 72.2 51.2 100.0 75 75 A K B -D 69 0D 149 -6,-0.2 -6,-0.2 -2,-0.2 -4,-0.2 -0.364 48.3-143.3 -63.1 131.0 72.8 54.8 99.2 76 76 A G - 0 0 8 -8,-2.4 -6,-0.1 -6,-0.2 -1,-0.1 -0.384 19.1-114.8 -87.0 173.8 71.6 55.9 95.8 77 77 A P S S+ 0 0 96 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.676 86.1 54.9 -86.2 -14.5 73.4 58.4 93.6 78 78 A R S S- 0 0 74 -10,-0.1 -10,-2.4 -9,-0.0 2,-0.3 -0.896 75.2-117.5-131.1 152.4 70.8 61.1 93.5 79 79 A N - 0 0 10 167,-2.1 -12,-0.2 -2,-0.3 15,-0.1 -0.614 41.6-119.1 -74.9 131.1 68.6 63.4 95.7 80 80 A S - 0 0 7 -2,-0.3 -17,-0.4 -15,-0.3 -16,-0.3 -0.668 28.9-140.3 -78.3 124.2 65.0 62.6 95.0 81 81 A P - 0 0 41 0, 0.0 2,-0.1 0, 0.0 -1,-0.0 -0.334 29.9 -87.7 -75.4 161.2 63.3 65.8 93.6 82 82 A T - 0 0 19 1,-0.1 -20,-0.2 2,-0.1 -21,-0.2 -0.475 20.6-148.1 -74.7 147.4 59.8 66.7 94.7 83 83 A V > + 0 0 5 -22,-1.3 3,-1.7 -2,-0.1 4,-0.4 0.643 67.5 112.2 -85.1 -14.4 56.9 65.3 92.7 84 84 A F T 3 S- 0 0 8 -24,-0.3 74,-0.2 1,-0.3 -2,-0.1 -0.404 98.1 -8.5 -64.0 121.9 54.9 68.6 93.5 85 85 A N T > S+ 0 0 2 72,-2.4 3,-2.0 69,-0.3 -1,-0.3 0.491 94.8 133.6 68.9 4.5 54.4 70.5 90.2 86 86 A A G X + 0 0 24 -3,-1.7 3,-2.1 71,-0.3 -2,-0.1 0.774 54.4 74.4 -58.5 -25.7 56.8 68.0 88.5 87 87 A V G 3 S+ 0 0 29 -4,-0.4 -1,-0.3 67,-0.3 68,-0.1 0.640 91.1 59.0 -63.2 -11.9 54.4 67.6 85.5 88 88 A F G < S+ 0 0 40 -3,-2.0 2,-0.7 -67,-0.0 -1,-0.3 0.478 81.9 101.2 -92.1 -7.0 55.5 71.1 84.3 89 89 A N < - 0 0 13 -3,-2.1 114,-0.2 -4,-0.2 113,-0.1 -0.718 48.0-171.7 -86.0 115.0 59.2 70.2 84.0 90 90 A A S S+ 0 0 79 -2,-0.7 2,-0.7 1,-0.1 113,-0.2 0.891 83.5 59.0 -70.1 -35.5 60.4 69.6 80.5 91 91 A A + 0 0 6 111,-2.1 -1,-0.1 1,-0.1 113,-0.1 -0.838 67.5 174.1 -93.5 119.3 63.8 68.4 81.9 92 92 A Q + 0 0 90 -2,-0.7 2,-0.3 111,-0.1 -1,-0.1 0.576 50.6 60.8-106.0 -11.2 63.0 65.5 84.2 93 93 A F S S- 0 0 79 1,-0.1 138,-0.2 2,-0.1 4,-0.0 -0.838 73.1-128.3-118.9 157.1 66.4 64.1 85.4 94 94 A W S S+ 0 0 30 -2,-0.3 137,-3.0 136,-0.1 2,-0.3 0.945 95.2 50.2 -61.6 -49.9 69.2 65.6 87.3 95 95 A D B S-E 230 0E 58 135,-0.2 135,-0.2 110,-0.1 2,-0.2 -0.737 85.9-121.2 -96.6 137.2 71.8 64.6 84.6 96 96 A G 0 0 23 133,-2.1 133,-0.2 -2,-0.3 -2,-0.0 -0.533 360.0 360.0 -67.6 139.7 71.7 65.1 80.9 97 97 A R 0 0 275 -2,-0.2 -1,-0.1 131,-0.1 132,-0.0 -0.305 360.0 360.0 -87.0 360.0 71.8 61.6 79.5 98 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 99 105 A A 0 0 137 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 44.9 64.3 57.2 76.9 100 106 A K - 0 0 127 1,-0.1 0, 0.0 4,-0.0 0, 0.0 -0.569 360.0-132.5 -88.4 150.6 62.4 56.2 80.2 101 107 A G > - 0 0 14 -2,-0.2 4,-3.0 1,-0.1 5,-0.2 -0.497 32.0 -95.9 -94.2 172.7 60.3 58.6 82.2 102 108 A P H > S+ 0 0 51 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.880 121.9 52.8 -53.5 -44.5 60.4 59.2 86.0 103 109 A V H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.964 114.0 41.0 -59.3 -53.7 57.5 56.8 86.6 104 110 A Q H > S+ 0 0 39 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.927 116.0 50.0 -60.2 -46.2 59.1 53.9 84.7 105 111 A A H X S+ 0 0 29 -4,-3.0 4,-0.8 1,-0.2 -1,-0.2 0.896 110.8 52.2 -60.7 -38.6 62.5 54.7 86.2 106 112 A G H >< S+ 0 0 38 -4,-2.9 3,-0.7 -5,-0.2 4,-0.3 0.953 112.4 42.2 -63.8 -50.0 61.0 54.7 89.6 107 113 A V H >< S+ 0 0 13 -4,-2.5 3,-1.9 1,-0.2 4,-0.5 0.935 111.6 54.1 -63.4 -45.6 59.3 51.4 89.4 108 114 A E H 3< S+ 0 0 56 -4,-2.6 -1,-0.2 1,-0.3 3,-0.2 0.664 89.0 79.6 -64.9 -14.4 62.2 49.7 87.7 109 115 A M T << S+ 0 0 100 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.779 116.6 12.2 -63.1 -23.2 64.5 50.8 90.5 110 116 A S S < S+ 0 0 43 -3,-1.9 -65,-2.7 -4,-0.3 -64,-0.3 0.210 131.5 13.1-139.1 15.8 63.0 47.9 92.5 111 117 A S - 0 0 15 -4,-0.5 -1,-0.1 -67,-0.2 -67,-0.1 -0.975 69.1 -98.5-172.5-177.9 61.1 45.6 90.2 112 118 A T > - 0 0 74 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.906 29.0-117.7-123.5 151.1 60.3 44.6 86.6 113 119 A P H > S+ 0 0 40 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.897 114.4 51.1 -48.9 -48.0 57.4 45.5 84.2 114 120 A D H > S+ 0 0 134 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.927 111.4 46.6 -60.1 -44.5 56.3 41.9 84.0 115 121 A R H > S+ 0 0 58 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.897 111.7 51.5 -65.8 -39.6 56.3 41.4 87.7 116 122 A V H X S+ 0 0 1 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.924 112.6 45.7 -62.3 -43.5 54.4 44.7 88.3 117 123 A V H X S+ 0 0 27 -4,-2.5 4,-2.7 -5,-0.2 5,-0.2 0.916 111.9 50.9 -66.6 -44.2 51.7 43.7 85.7 118 124 A A H X S+ 0 0 47 -4,-2.6 4,-1.1 -5,-0.3 -1,-0.2 0.913 110.5 51.2 -61.4 -39.6 51.4 40.2 87.2 119 125 A T H >< S+ 0 0 1 -4,-2.5 3,-0.6 -5,-0.2 4,-0.3 0.954 111.4 45.8 -62.3 -48.3 51.0 41.8 90.6 120 126 A L H >< S+ 0 0 1 -4,-2.5 3,-1.3 1,-0.2 7,-0.3 0.881 110.8 52.7 -64.3 -38.1 48.2 44.1 89.4 121 127 A K H 3< S+ 0 0 91 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.704 97.7 67.5 -72.3 -15.5 46.4 41.4 87.5 122 128 A S T << S+ 0 0 9 -4,-1.1 180,-0.3 -3,-0.6 -1,-0.2 0.605 91.7 69.6 -78.1 -10.1 46.4 39.2 90.6 123 129 A M S X> S- 0 0 0 -3,-1.3 4,-1.6 -4,-0.3 3,-1.2 -0.914 71.4-152.0-114.7 113.0 44.0 41.6 92.4 124 130 A P H 3> S+ 0 0 81 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.849 94.7 57.8 -46.9 -44.2 40.4 41.8 91.2 125 131 A E H 3> S+ 0 0 60 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.866 104.9 50.8 -59.5 -35.8 39.9 45.4 92.3 126 132 A Y H <> S+ 0 0 0 -3,-1.2 4,-2.7 -6,-0.2 5,-0.2 0.912 107.9 52.3 -69.3 -38.1 42.9 46.5 90.2 127 133 A I H X S+ 0 0 57 -4,-1.6 4,-2.6 -7,-0.3 -2,-0.2 0.953 110.4 48.6 -60.8 -47.1 41.5 44.9 87.1 128 134 A E H X S+ 0 0 110 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.914 112.0 48.6 -59.3 -42.6 38.2 46.6 87.6 129 135 A R H X S+ 0 0 63 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.901 111.0 49.1 -67.1 -37.3 39.8 50.0 88.1 130 136 A F H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.905 111.1 51.4 -66.3 -38.6 42.0 49.6 85.1 131 137 A E H < S+ 0 0 99 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.895 114.2 43.2 -64.6 -38.8 38.9 48.6 83.1 132 138 A D H < S+ 0 0 108 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.818 116.4 46.8 -77.4 -28.8 37.0 51.7 84.3 133 139 A A H < S+ 0 0 7 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.778 122.7 34.3 -82.1 -27.8 40.0 54.0 83.8 134 140 A F S >< S- 0 0 13 -4,-2.4 3,-1.0 -5,-0.2 -1,-0.3 -0.638 87.9-165.1-127.9 72.1 40.8 52.7 80.3 135 141 A P T 3 + 0 0 97 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 -0.200 65.8 19.6 -57.6 143.9 37.3 51.9 78.9 136 142 A G T 3 S+ 0 0 93 1,-0.2 2,-0.4 -5,-0.1 -4,-0.1 0.615 88.6 121.7 71.3 16.8 37.1 49.7 75.8 137 143 A Q < - 0 0 91 -3,-1.0 -1,-0.2 -6,-0.2 -3,-0.1 -0.936 53.6-149.8-111.6 133.1 40.5 48.1 75.9 138 144 A E S S+ 0 0 199 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.861 97.0 31.2 -70.4 -34.5 40.7 44.3 76.0 139 145 A N S S+ 0 0 83 1,-0.1 -1,-0.3 -8,-0.0 -8,-0.0 -0.615 72.0 159.3-121.4 70.4 44.0 44.3 78.0 140 146 A P + 0 0 8 0, 0.0 2,-1.4 0, 0.0 -1,-0.1 0.798 54.4 81.0 -64.5 -30.3 43.8 47.5 80.2 141 147 A V + 0 0 5 -3,-0.1 2,-0.3 4,-0.1 -20,-0.1 -0.625 63.8 135.3 -82.3 92.3 46.3 46.4 82.8 142 148 A T > - 0 0 37 -2,-1.4 4,-2.3 1,-0.1 5,-0.2 -0.911 68.1-110.5-133.4 160.4 49.6 47.2 81.1 143 149 A F H > S+ 0 0 25 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.863 118.1 52.7 -60.9 -35.3 52.7 48.9 82.3 144 150 A D H > S+ 0 0 110 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.918 108.8 47.3 -68.9 -43.0 52.0 51.9 80.1 145 151 A N H > S+ 0 0 19 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.871 107.8 57.6 -64.6 -34.8 48.5 52.4 81.4 146 152 A M H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.936 109.4 45.5 -59.1 -45.2 49.8 52.1 85.0 147 153 A A H X S+ 0 0 1 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.888 109.6 54.0 -65.1 -42.0 52.2 55.0 84.2 148 154 A V H X S+ 0 0 42 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.935 110.9 46.9 -59.6 -43.8 49.4 57.0 82.5 149 155 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -115,-0.3 0.931 112.2 48.6 -63.1 -47.6 47.2 56.6 85.7 150 156 A I H X S+ 0 0 1 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.942 111.5 51.4 -58.6 -42.5 50.1 57.5 88.0 151 157 A E H X S+ 0 0 65 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.843 105.9 54.0 -62.6 -36.3 50.8 60.5 85.8 152 158 A A H X S+ 0 0 0 -4,-2.0 4,-0.7 2,-0.2 3,-0.3 0.937 110.1 47.7 -63.5 -44.8 47.2 61.6 86.0 153 159 A Y H >X S+ 0 0 8 -4,-2.5 3,-1.6 -123,-0.2 4,-0.6 0.930 107.6 55.6 -63.3 -41.4 47.4 61.5 89.8 154 160 A E H >< S+ 0 0 31 -4,-2.8 3,-1.0 1,-0.3 -69,-0.3 0.823 96.8 65.2 -59.4 -31.3 50.7 63.5 89.7 155 161 A A H 3< S+ 0 0 2 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.794 101.0 50.7 -62.5 -23.1 48.9 66.2 87.7 156 162 A T H << S+ 0 0 36 -3,-1.6 2,-1.6 -4,-0.7 -1,-0.3 0.619 89.0 84.5 -89.0 -10.9 46.8 66.8 90.8 157 163 A L << + 0 0 1 -3,-1.0 -72,-2.4 -4,-0.6 -71,-0.3 -0.415 64.0 127.0 -88.1 62.3 49.9 67.1 93.0 158 164 A I - 0 0 6 -2,-1.6 -74,-0.1 -74,-0.2 -3,-0.0 -0.802 54.4-140.0-112.9 159.3 50.4 70.8 92.2 159 165 A T + 0 0 0 -2,-0.3 3,-0.4 129,-0.1 -145,-0.2 -0.668 28.5 178.2-122.9 77.2 50.8 73.5 94.8 160 166 A P + 0 0 20 0, 0.0 127,-2.9 0, 0.0 -144,-0.1 -0.108 50.4 43.6 -73.8 173.6 48.9 76.6 93.8 161 167 A E + 0 0 36 -147,-0.4 124,-0.1 125,-0.2 5,-0.0 0.672 60.9 163.4 67.8 27.4 48.5 79.9 95.6 162 168 A A >> - 0 0 0 -3,-0.4 4,-1.8 122,-0.2 3,-0.9 -0.390 55.0-107.6 -67.2 154.4 51.9 80.6 96.9 163 169 A P H >> S+ 0 0 51 0, 0.0 4,-2.7 0, 0.0 3,-0.7 0.950 122.9 55.8 -47.3 -49.9 52.3 84.3 98.0 164 170 A F H 3> S+ 0 0 0 119,-2.4 4,-2.6 1,-0.3 5,-0.2 0.827 104.9 51.2 -53.9 -36.3 54.5 84.8 94.8 165 171 A D H <> S+ 0 0 0 -3,-0.9 4,-1.5 118,-0.3 -1,-0.3 0.828 108.1 51.6 -71.5 -31.1 51.7 83.5 92.6 166 172 A K H S+ 0 0 87 -4,-1.8 5,-1.9 -3,-0.7 4,-0.7 0.929 110.7 50.3 -67.2 -42.7 49.2 85.9 94.2 167 173 A Y H ><5S+ 0 0 0 -4,-2.7 3,-1.6 1,-0.2 -2,-0.2 0.949 109.5 49.2 -57.2 -52.7 51.8 88.6 93.4 168 174 A L H 3<5S+ 0 0 5 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.818 109.3 54.0 -59.2 -31.0 52.1 87.5 89.8 169 175 A R H 3<5S- 0 0 99 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.614 134.6 -81.4 -82.7 -7.2 48.4 87.5 89.5 170 176 A G T <<5S+ 0 0 35 -3,-1.6 2,-1.7 -4,-0.7 -3,-0.2 0.139 86.4 126.7 139.0 -29.1 48.1 91.1 90.8 171 177 A D > < - 0 0 77 -5,-1.9 3,-2.2 1,-0.2 4,-0.4 -0.443 33.5-173.1 -69.5 92.5 48.4 91.4 94.5 172 178 A T T 3 S+ 0 0 64 -2,-1.7 3,-0.4 1,-0.3 -1,-0.2 0.702 84.1 56.7 -57.3 -18.8 51.2 93.9 94.8 173 179 A S T 3 S+ 0 0 91 1,-0.2 -1,-0.3 -7,-0.1 -2,-0.1 0.589 76.0 92.7 -91.6 -11.3 51.0 93.3 98.5 174 180 A A S < S+ 0 0 22 -3,-2.2 2,-0.4 -11,-0.1 -1,-0.2 0.803 88.0 51.2 -54.3 -29.4 51.5 89.5 98.4 175 181 A L S S- 0 0 5 -3,-0.4 105,-0.0 -4,-0.4 2,-0.0 -0.890 82.7-136.3-111.8 142.3 55.3 90.1 98.8 176 182 A N > - 0 0 61 -2,-0.4 4,-1.6 1,-0.1 5,-0.2 -0.248 34.5 -92.9 -85.0 179.8 56.8 92.3 101.5 177 183 A E H >> S+ 0 0 154 1,-0.2 4,-1.5 2,-0.2 3,-0.5 0.943 125.5 49.1 -55.2 -55.0 59.7 94.8 101.1 178 184 A S H 3> S+ 0 0 54 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.832 111.9 50.0 -54.9 -38.0 62.4 92.3 101.9 179 185 A E H 3> S+ 0 0 40 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.752 104.6 56.6 -75.2 -28.9 61.0 89.8 99.5 180 186 A K H X S+ 0 0 20 -4,-3.3 4,-3.0 1,-0.2 3,-0.7 0.937 107.3 55.6 -56.7 -47.7 68.1 90.5 92.9 186 192 A F H 3< S+ 0 0 5 -4,-2.7 6,-1.0 1,-0.3 5,-0.4 0.861 114.8 38.6 -55.7 -39.0 66.9 87.2 91.5 187 193 A M H 3< S+ 0 0 15 -4,-1.8 -1,-0.3 4,-0.2 -2,-0.2 0.615 120.2 46.4 -88.9 -11.0 66.1 88.9 88.2 188 194 A D H << S+ 0 0 89 -4,-1.4 -2,-0.2 -3,-0.7 -3,-0.2 0.718 106.5 53.4-101.5 -28.5 69.1 91.2 88.2 189 195 A R S < S- 0 0 71 -4,-3.0 -1,-0.1 -5,-0.2 -2,-0.1 0.203 116.8 -98.5 -95.9 17.6 72.0 88.9 89.1 190 196 A G S > S+ 0 0 30 -5,-0.1 3,-2.8 -3,-0.1 4,-0.5 0.244 83.7 125.4 93.3 -15.4 71.3 86.3 86.4 191 197 A C G >> S+ 0 0 25 -5,-0.4 4,-2.8 -6,-0.3 3,-1.6 0.843 72.7 61.0 -46.0 -40.1 69.4 83.5 88.2 192 198 A T G 34 S+ 0 0 25 -6,-1.0 -1,-0.3 1,-0.3 -5,-0.1 0.561 83.2 78.8 -68.4 -8.4 66.6 83.8 85.6 193 199 A A G <4 S+ 0 0 72 -3,-2.8 -1,-0.3 1,-0.1 -2,-0.2 0.868 119.8 8.4 -66.9 -31.7 69.0 82.8 82.9 194 200 A C T <4 S+ 0 0 41 -3,-1.6 2,-0.7 -4,-0.5 10,-0.3 0.651 128.1 56.5-118.2 -28.1 68.5 79.2 84.2 195 201 A H S < S+ 0 0 25 -4,-2.8 2,-0.2 6,-0.1 -1,-0.2 -0.799 78.9 105.9-112.1 88.6 65.7 79.2 86.8 196 202 A S > + 0 0 40 -2,-0.7 5,-2.5 -3,-0.1 3,-0.4 -0.742 35.9 61.4-144.4-166.5 62.5 80.7 85.2 197 203 A G B > 5S-a 11 0A 21 -187,-2.5 3,-1.4 -2,-0.2 -185,-0.6 -0.244 106.8 -27.8 76.6-167.6 59.1 79.7 83.8 198 204 A V T 3 5S+ 0 0 15 1,-0.3 -1,-0.2 -187,-0.2 -184,-0.1 0.844 147.0 28.9 -53.7 -38.9 56.3 78.1 85.8 199 205 A N T 3 5S- 0 0 2 2,-0.5 37,-1.4 -3,-0.4 36,-1.1 0.242 105.4-116.0-108.0 16.6 58.6 76.4 88.3 200 206 A L T < 5S+ 0 0 0 -3,-1.4 35,-1.6 34,-0.2 2,-0.3 0.965 93.7 1.8 47.4 54.4 61.6 78.8 88.2 201 207 A G S - 0 0 27 -16,-2.1 3,-2.7 5,-0.3 -1,-0.1 -0.491 41.7 -75.1 -82.5 154.4 82.0 71.2 84.0 224 239 A A G > S- 0 0 86 1,-0.3 3,-2.2 2,-0.2 4,-0.4 -0.192 113.5 -15.1 -50.0 123.2 85.0 70.2 81.8 225 240 A S G 3 S- 0 0 121 1,-0.3 -1,-0.3 2,-0.1 -2,-0.0 0.629 110.5 -86.1 55.7 13.0 84.4 71.4 78.2 226 241 A D G < S+ 0 0 72 -3,-2.7 -1,-0.3 -19,-0.2 -2,-0.2 0.827 95.9 132.1 59.4 34.0 80.7 71.9 79.2 227 242 A E < + 0 0 137 -3,-2.2 2,-0.3 -20,-0.1 -2,-0.1 0.934 53.7 54.8 -84.7 -48.5 80.1 68.3 78.3 228 243 A Y S S- 0 0 160 -4,-0.4 2,-0.3 -21,-0.1 -5,-0.3 -0.683 74.2-163.9 -86.6 137.8 78.2 67.0 81.4 229 244 A V - 0 0 38 -2,-0.3 -133,-2.1 -133,-0.2 2,-0.4 -0.923 12.6-156.8-127.3 152.6 75.1 68.9 82.3 230 245 A F E -EF 95 206E 36 -24,-3.1 -24,-2.2 -2,-0.3 -135,-0.2 -0.955 31.6-106.7-123.9 144.3 72.8 69.2 85.3 231 246 A R E - F 0 205E 17 -137,-3.0 2,-1.0 -2,-0.4 -26,-0.3 -0.472 31.3-122.2 -68.7 134.3 69.2 70.3 85.3 232 247 A A - 0 0 12 -28,-2.7 -30,-2.9 -2,-0.2 -28,-0.3 -0.744 45.0-116.0 -76.7 111.2 68.8 73.8 86.8 233 248 A S - 0 0 26 -2,-1.0 2,-0.4 -32,-0.2 -30,-0.1 -0.046 16.8-108.8 -53.3 145.1 66.4 72.7 89.6 234 249 A P - 0 0 21 0, 0.0 -33,-0.3 0, 0.0 -34,-0.2 -0.650 30.2-158.4 -73.2 124.0 62.8 74.0 89.7 235 250 A L > + 0 0 20 -35,-1.6 3,-2.2 -36,-1.1 4,-0.2 0.543 50.7 120.2 -86.7 -7.1 63.0 76.3 92.8 236 251 A R T 3 S+ 0 0 6 -37,-1.4 49,-0.2 1,-0.3 46,-0.1 -0.318 87.8 7.3 -58.5 137.5 59.3 76.3 93.6 237 252 A N T > S+ 0 0 3 47,-0.6 3,-2.2 44,-0.2 4,-0.3 0.647 84.5 146.3 61.0 18.7 58.8 75.0 97.1 238 253 A I G X + 0 0 14 -3,-2.2 3,-1.5 1,-0.3 -2,-0.1 0.816 62.3 66.5 -53.8 -34.6 62.5 75.0 97.6 239 254 A E G 3 S+ 0 0 75 42,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.832 107.4 41.1 -57.9 -29.0 62.0 75.9 101.3 240 255 A L G < S+ 0 0 71 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.347 102.5 68.6-104.0 10.6 60.4 72.4 101.7 241 256 A T S < S+ 0 0 17 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.1 0.077 75.8 176.9-120.0 28.8 62.8 70.3 99.6 242 257 A A + 0 0 15 -3,-0.3 -178,-0.2 -4,-0.1 2,-0.1 -0.271 46.0 65.6 -65.8 155.7 66.1 70.2 101.5 243 258 A P S S- 0 0 1 0, 0.0 8,-0.2 0, 0.0 2,-0.2 0.651 83.1-135.2 -78.5 169.4 68.8 69.0 101.3 244 259 A Y B > +H 250 0G 17 6,-3.8 6,-1.2 4,-0.1 5,-0.7 -0.467 47.9 24.1-104.4 164.3 70.0 70.6 98.1 245 260 A F T > 5S- 0 0 34 3,-0.2 3,-2.2 1,-0.2 -166,-0.1 0.194 97.6 -61.5 74.2 165.7 71.7 69.9 94.8 246 261 A H T 3 5S+ 0 0 24 1,-0.3 -167,-2.1 2,-0.1 -1,-0.2 0.693 139.8 40.6 -53.0 -23.2 71.9 66.7 92.9 247 262 A S T 3 5S- 0 0 33 -169,-0.2 -1,-0.3 -3,-0.2 -2,-0.2 0.449 102.3-127.8-105.9 -3.5 73.7 65.0 95.7 248 263 A G T < 5 + 0 0 1 -3,-2.2 -3,-0.2 -4,-0.2 -4,-0.1 0.855 63.3 140.1 59.7 34.6 71.7 66.6 98.6 249 264 A A < + 0 0 30 -5,-0.7 2,-0.5 -6,-0.1 -4,-0.1 0.636 51.4 65.7 -85.4 -13.8 75.0 67.6 100.1 250 265 A V B +H 244 0G 0 -6,-1.2 -6,-3.8 1,-0.1 -1,-0.1 -0.939 51.4 177.8-115.1 118.9 73.8 71.1 101.3 251 266 A W + 0 0 141 -2,-0.5 2,-0.5 -8,-0.2 -1,-0.1 0.777 60.1 81.8 -88.8 -26.2 71.2 71.4 104.0 252 267 A S > - 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