==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 03-FEB-92 2FCR . COMPND 2 MOLECULE: FLAVODOXIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CHONDRUS CRISPUS; . AUTHOR K.FUKUYAMA . 173 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7941.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 15.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 2.9 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 40 23.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 0 0 0 1 0 0 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 1 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 PARALLEL 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 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 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 K 0 0 100 0, 0.0 46,-3.4 0, 0.0 47,-0.7 0.000 360.0 360.0 360.0 138.8 40.4 47.9 32.0 2 2 A I E -ab 28 48A 1 25,-1.9 27,-2.5 44,-0.2 2,-0.3 -0.905 360.0-154.7-105.8 134.7 41.0 44.5 30.4 3 3 A G E - b 0 49A 0 45,-2.7 47,-2.7 -2,-0.4 2,-0.5 -0.827 4.8-157.3-109.5 151.2 41.9 44.3 26.7 4 4 A I E + b 0 50A 1 26,-0.4 28,-2.5 -2,-0.3 2,-0.4 -0.987 15.0 179.1-129.2 113.3 41.4 41.4 24.3 5 5 A F E +cb 32 51A 2 45,-2.9 47,-2.5 -2,-0.5 2,-0.3 -0.963 14.2 145.1-120.3 136.4 43.6 41.3 21.2 6 6 A F E -cb 33 52A 12 26,-2.3 28,-3.1 -2,-0.4 29,-0.3 -0.894 28.3-153.9-152.5 178.6 43.5 38.5 18.6 7 7 A S - 0 0 2 45,-0.8 2,-0.3 -2,-0.3 6,-0.1 -0.941 16.0-178.5-152.8 163.4 43.7 37.6 15.0 8 8 A T - 0 0 31 -2,-0.3 60,-0.3 45,-0.1 -2,-0.0 -0.974 28.3-159.5-158.1 168.0 42.3 34.8 12.9 9 9 A S S S+ 0 0 69 -2,-0.3 -1,-0.1 58,-0.1 57,-0.0 0.655 99.8 20.7-118.7 -49.0 42.1 33.3 9.4 10 10 A T S S- 0 0 97 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.259 107.3-108.0-108.1 10.8 38.9 31.2 9.5 11 11 A G S > S+ 0 0 25 1,-0.0 4,-1.1 3,-0.0 -3,-0.0 0.385 86.2 115.0 82.3 -0.5 37.1 33.0 12.4 12 12 A N H > S+ 0 0 54 1,-0.2 4,-1.3 2,-0.2 3,-0.2 0.877 79.2 51.5 -66.1 -41.5 37.4 30.3 15.2 13 13 A T H > S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.803 103.7 59.3 -64.0 -35.8 39.6 32.6 17.3 14 14 A T H > S+ 0 0 42 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.877 102.1 53.2 -58.7 -44.5 37.1 35.4 16.9 15 15 A E H X S+ 0 0 113 -4,-1.1 4,-1.9 -3,-0.2 -1,-0.2 0.873 111.1 45.8 -58.5 -43.8 34.5 33.2 18.6 16 16 A V H X S+ 0 0 0 -4,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.886 110.9 52.5 -67.8 -41.5 36.7 32.5 21.5 17 17 A A H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.863 110.0 49.2 -62.6 -40.9 37.7 36.2 21.9 18 18 A D H X S+ 0 0 87 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.899 108.8 53.0 -64.7 -43.7 34.0 37.1 21.9 19 19 A F H X S+ 0 0 49 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.899 106.0 52.3 -62.4 -41.5 33.3 34.5 24.6 20 20 A I H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.934 107.9 53.3 -59.2 -42.7 36.1 35.9 26.8 21 21 A G H X S+ 0 0 11 -4,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.921 108.2 50.2 -57.0 -44.4 34.5 39.3 26.5 22 22 A K H < S+ 0 0 155 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.896 108.4 50.8 -63.0 -44.4 31.1 37.9 27.6 23 23 A T H < S+ 0 0 53 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.882 115.0 44.8 -62.7 -36.2 32.6 36.2 30.7 24 24 A L H >< S- 0 0 17 -4,-2.1 3,-1.6 -5,-0.2 -1,-0.2 0.684 86.2-179.2 -81.2 -24.2 34.2 39.5 31.7 25 25 A G G >< - 0 0 37 -4,-1.6 3,-1.6 1,-0.3 -1,-0.2 -0.246 67.0 -1.7 62.0-135.6 31.3 41.8 31.0 26 26 A A G 3 S+ 0 0 95 1,-0.3 -1,-0.3 -4,-0.1 -2,-0.1 0.612 121.7 74.6 -64.0 -14.5 31.9 45.5 31.7 27 27 A K G < S+ 0 0 82 -3,-1.6 -25,-1.9 -6,-0.1 2,-0.4 0.577 94.5 59.3 -76.3 -10.9 35.5 44.9 32.9 28 28 A A B < S-a 2 0A 14 -3,-1.6 -25,-0.2 -7,-0.2 2,-0.2 -0.919 75.8-129.4-123.4 150.8 36.7 44.3 29.3 29 29 A D - 0 0 60 -27,-2.5 3,-0.1 -2,-0.4 -25,-0.1 -0.497 49.7 -82.4 -85.6 160.4 36.7 46.2 26.0 30 30 A A - 0 0 75 -2,-0.2 -26,-0.4 1,-0.1 -1,-0.1 -0.337 61.6 -89.0 -61.7 143.0 35.4 44.6 22.9 31 31 A P - 0 0 33 0, 0.0 2,-0.4 0, 0.0 -26,-0.2 -0.237 42.8-149.2 -56.7 147.0 37.9 42.3 21.3 32 32 A I E -c 5 0A 54 -28,-2.5 -26,-2.3 -3,-0.1 2,-0.4 -0.978 9.7-131.8-124.9 129.2 40.2 44.0 18.8 33 33 A D E > -c 6 0A 34 -2,-0.4 3,-2.1 -28,-0.2 -26,-0.2 -0.678 18.9-133.2 -79.9 130.7 41.8 42.3 15.7 34 34 A V G > S+ 0 0 3 -28,-3.1 3,-1.6 -2,-0.4 -1,-0.1 0.762 105.4 66.9 -52.9 -31.1 45.5 43.1 15.6 35 35 A D G 3 S+ 0 0 112 -29,-0.3 -1,-0.3 1,-0.3 -28,-0.1 0.770 98.8 54.9 -62.3 -24.6 45.1 43.9 11.9 36 36 A D G < S+ 0 0 118 -3,-2.1 2,-0.8 2,-0.0 -1,-0.3 0.471 83.3 106.0 -88.7 -5.4 43.0 46.8 13.1 37 37 A V < + 0 0 9 -3,-1.6 -3,-0.0 1,-0.2 -1,-0.0 -0.729 33.0 166.0 -85.7 116.3 45.6 48.2 15.4 38 38 A T S S+ 0 0 130 -2,-0.8 -1,-0.2 1,-0.3 -2,-0.0 0.955 73.6 44.3 -84.9 -64.4 47.3 51.4 14.1 39 39 A D > - 0 0 94 1,-0.1 3,-1.5 2,-0.0 -1,-0.3 -0.733 63.8-166.3 -88.0 110.4 49.0 52.5 17.3 40 40 A P G > S+ 0 0 7 0, 0.0 3,-1.2 0, 0.0 4,-0.2 0.564 83.1 77.5 -70.8 -11.9 50.7 49.6 19.1 41 41 A Q G > S+ 0 0 59 1,-0.3 3,-1.9 2,-0.2 4,-0.2 0.695 74.5 78.4 -71.2 -18.6 51.0 51.8 22.2 42 42 A A G X S+ 0 0 31 -3,-1.5 3,-2.2 1,-0.3 -1,-0.3 0.792 76.6 73.6 -56.9 -32.3 47.3 51.1 22.8 43 43 A L G X S+ 0 0 1 -3,-1.2 3,-0.6 1,-0.3 -1,-0.3 0.747 91.1 58.4 -53.1 -30.3 48.3 47.8 24.2 44 44 A K G < S+ 0 0 95 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.527 81.6 81.9 -79.5 -10.5 49.6 49.6 27.3 45 45 A D G < S+ 0 0 126 -3,-2.2 2,-0.3 -4,-0.2 -1,-0.2 0.274 84.8 78.0 -80.6 14.3 46.2 51.3 28.2 46 46 A Y < - 0 0 26 -3,-0.6 -44,-0.2 1,-0.1 3,-0.1 -0.819 68.8-143.9-124.3 163.1 45.1 48.1 30.0 47 47 A D S S+ 0 0 95 -46,-3.4 2,-0.3 1,-0.3 -45,-0.2 0.689 92.9 11.2 -92.5 -23.4 45.7 46.3 33.2 48 48 A L E -b 2 0A 0 -47,-0.7 -45,-2.7 37,-0.1 2,-0.4 -0.951 67.6-152.3-156.5 141.5 45.5 42.8 31.7 49 49 A L E -bd 3 87A 0 37,-1.6 39,-2.7 -2,-0.3 2,-0.5 -0.994 3.9-157.3-123.2 133.1 45.6 41.6 28.1 50 50 A F E -bd 4 88A 0 -47,-2.7 -45,-2.9 -2,-0.4 2,-0.4 -0.939 20.9-168.2-102.1 125.0 44.0 38.4 26.8 51 51 A L E -bd 5 89A 0 37,-2.5 39,-2.9 -2,-0.5 2,-0.4 -0.976 4.8-173.7-118.7 129.8 45.9 37.5 23.5 52 52 A G E +bd 6 90A 0 -47,-2.5 -45,-0.8 -2,-0.4 39,-0.2 -0.957 11.4 155.2-131.6 149.2 44.6 34.9 21.1 53 53 A A E - d 0 91A 1 37,-1.4 39,-1.0 -2,-0.4 -45,-0.1 -0.940 29.0-133.2-163.3 145.3 45.8 33.2 17.9 54 54 A P E - d 0 92A 10 0, 0.0 2,-0.5 0, 0.0 39,-0.2 -0.278 28.2-117.2 -86.0 177.9 45.5 30.0 15.9 55 55 A T + 0 0 29 37,-0.8 10,-0.3 1,-0.1 3,-0.1 -0.986 45.5 149.7-120.7 118.2 48.4 28.0 14.5 56 56 A W + 0 0 119 8,-2.0 2,-1.2 -2,-0.5 9,-0.2 0.637 56.2 69.7-121.6 -31.0 48.5 27.8 10.6 57 57 A N S > S- 0 0 71 7,-2.1 3,-1.8 3,-0.1 -1,-0.1 -0.683 81.2-145.0 -97.7 80.7 52.2 27.6 9.5 58 58 A T T 3 S- 0 0 74 -2,-1.2 43,-0.0 1,-0.3 7,-0.0 -0.187 73.6 -1.6 -50.1 127.3 53.1 24.1 10.8 59 59 A G T 3 S+ 0 0 44 1,-0.2 -1,-0.3 42,-0.1 5,-0.1 0.315 90.0 148.7 72.5 1.7 56.6 23.7 12.1 60 60 A A < - 0 0 29 -3,-1.8 -1,-0.2 1,-0.1 3,-0.1 -0.346 46.4-144.2 -68.0 146.4 57.7 27.3 11.3 61 61 A D S S+ 0 0 121 1,-0.2 2,-0.3 2,-0.1 3,-0.2 0.877 85.1 10.3 -75.4 -42.9 60.3 28.8 13.6 62 62 A T S S+ 0 0 64 1,-0.2 -1,-0.2 2,-0.0 8,-0.1 -0.883 117.4 38.1-132.9 165.5 58.6 32.2 13.4 63 63 A E + 0 0 100 -2,-0.3 -1,-0.2 -3,-0.1 -3,-0.1 0.973 65.1 157.3 56.3 59.9 55.3 33.6 12.0 64 64 A R + 0 0 12 1,-0.2 -7,-2.1 -3,-0.2 -8,-2.0 0.654 55.0 65.5 -89.2 -19.3 53.4 30.5 13.2 65 65 A S S S- 0 0 2 -10,-0.3 -1,-0.2 -9,-0.2 3,-0.1 0.789 83.1-143.2 -78.2 -31.6 49.9 32.0 13.3 66 66 A G + 0 0 29 1,-0.3 2,-0.2 -10,-0.1 -11,-0.1 0.819 69.8 98.1 70.2 29.0 49.3 32.7 9.6 67 67 A T S > S- 0 0 18 -13,-0.1 3,-1.9 -60,-0.1 -1,-0.3 -0.715 100.0 -75.5-133.7-176.8 47.5 35.8 10.8 68 68 A S T >> S+ 0 0 33 -60,-0.3 4,-2.2 1,-0.3 3,-0.9 0.633 119.2 76.6 -58.6 -16.8 48.1 39.6 11.2 69 69 A W H 3> S+ 0 0 2 1,-0.2 4,-2.9 2,-0.2 -1,-0.3 0.843 81.8 68.5 -61.6 -35.4 50.1 38.6 14.4 70 70 A D H <4 S+ 0 0 14 -3,-1.9 4,-0.4 1,-0.2 -1,-0.2 0.786 109.9 31.6 -56.0 -36.5 52.9 37.5 12.1 71 71 A E H X> S+ 0 0 105 -3,-0.9 4,-2.6 -4,-0.3 3,-0.6 0.864 117.7 56.4 -84.7 -47.8 53.7 41.1 11.0 72 72 A F H 3X>S+ 0 0 2 -4,-2.2 5,-2.5 1,-0.2 4,-1.7 0.868 100.7 57.2 -52.9 -47.9 52.6 42.7 14.3 73 73 A L H 3<5S+ 0 0 3 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.1 0.820 119.6 27.7 -55.5 -40.7 55.0 40.7 16.5 74 74 A Y H <45S+ 0 0 96 -3,-0.6 -1,-0.2 -4,-0.4 -2,-0.2 0.737 127.9 35.7 -98.2 -28.7 58.2 41.8 14.6 75 75 A D H <5S+ 0 0 99 -4,-2.6 -3,-0.2 3,-0.1 -2,-0.2 0.832 130.7 18.0 -92.8 -37.1 57.4 45.2 13.1 76 76 A K T ><5S+ 0 0 47 -4,-1.7 3,-2.0 -5,-0.5 -3,-0.2 0.832 110.9 61.8-104.1 -48.8 55.2 46.8 15.8 77 77 A L G > + 0 0 1 34,-2.0 3,-2.3 -2,-0.9 37,-0.2 -0.018 7.3 171.3-103.8 28.0 55.3 46.4 28.5 83 83 A K T 3 S- 0 0 157 1,-0.3 35,-0.2 33,-0.1 34,-0.1 -0.172 72.0 -11.7 -48.6 126.1 57.1 46.3 31.8 84 84 A D T 3 S+ 0 0 117 33,-1.8 -1,-0.3 1,-0.2 34,-0.2 0.337 91.6 141.5 64.7 4.9 55.1 44.3 34.3 85 85 A L < - 0 0 18 -3,-2.3 34,-3.0 32,-0.1 2,-0.3 -0.637 49.9-129.0 -78.9 128.2 51.9 44.1 32.3 86 86 A P E - e 0 119A 20 0, 0.0 -37,-1.6 0, 0.0 2,-0.4 -0.555 26.0-172.7 -76.1 133.3 50.2 40.7 32.6 87 87 A V E -de 49 120A 0 32,-1.7 34,-2.5 -2,-0.3 2,-0.5 -0.997 9.3-161.7-130.0 136.6 49.3 38.9 29.4 88 88 A A E -de 50 121A 0 -39,-2.7 -37,-2.5 -2,-0.4 2,-0.4 -0.990 14.2-151.3-120.1 121.8 47.3 35.7 29.2 89 89 A I E -d 51 0A 1 32,-0.6 56,-2.9 -2,-0.5 2,-0.4 -0.777 13.8-176.4-105.8 132.3 47.5 33.7 25.9 90 90 A F E -df 52 145A 0 -39,-2.9 -37,-1.4 -2,-0.4 2,-0.4 -0.958 10.7-172.1-118.3 140.2 44.9 31.5 24.4 91 91 A G E -df 53 146A 0 54,-2.5 56,-2.5 -2,-0.4 2,-0.3 -0.993 14.5-143.0-138.0 149.8 45.6 29.6 21.2 92 92 A L E +df 54 147A 9 -39,-1.0 -37,-0.8 -2,-0.4 2,-0.3 -0.797 36.1 133.1-107.7 145.5 43.5 27.4 18.8 93 93 A G E - f 0 148A 16 54,-2.1 57,-0.6 -2,-0.3 56,-0.6 -0.881 51.0 -97.5-165.1-163.2 44.8 24.3 17.1 94 94 A D > - 0 0 32 -2,-0.3 4,-1.9 54,-0.1 7,-0.2 -0.921 17.9-171.8-144.1 104.1 44.0 20.7 16.2 95 95 A A T 4 S+ 0 0 4 -2,-0.4 37,-0.2 2,-0.2 7,-0.1 0.695 90.1 49.8 -70.0 -22.4 45.5 17.9 18.4 96 96 A E T 4 S+ 0 0 138 2,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.900 117.2 36.4 -84.0 -43.6 44.3 15.3 15.9 97 97 A G T 4 S+ 0 0 41 1,-0.2 -2,-0.2 2,-0.1 3,-0.1 0.774 131.3 29.6 -76.9 -29.7 45.7 16.8 12.7 98 98 A Y >< + 0 0 109 -4,-1.9 3,-1.6 1,-0.1 -1,-0.2 -0.512 64.7 158.1-135.0 63.7 48.9 18.2 14.3 99 99 A P T 3 S+ 0 0 50 0, 0.0 34,-2.5 0, 0.0 33,-2.1 0.729 82.1 42.2 -60.1 -27.2 49.8 15.9 17.2 100 100 A D T 3 S+ 0 0 78 32,-0.2 -5,-0.1 1,-0.2 31,-0.0 0.314 120.9 40.4-100.9 0.5 53.4 17.0 17.1 101 101 A N S X S+ 0 0 40 -3,-1.6 3,-1.3 -7,-0.2 2,-0.4 -0.086 75.1 167.5-137.8 32.4 52.7 20.8 16.6 102 102 A F T 3 S- 0 0 1 31,-1.6 34,-0.4 -3,-0.3 -7,-0.1 -0.448 75.5 -25.2 -64.5 114.9 49.8 21.4 18.9 103 103 A C T > S+ 0 0 2 -2,-0.4 3,-1.6 -48,-0.1 4,-0.4 0.837 78.9 165.0 50.2 44.6 49.1 25.1 19.3 104 104 A D T X> + 0 0 2 -3,-1.3 4,-0.9 1,-0.3 3,-0.6 0.714 63.0 72.2 -59.1 -24.8 52.8 26.0 18.5 105 105 A A H 3> S+ 0 0 1 1,-0.2 4,-2.1 -41,-0.2 -1,-0.3 0.770 81.8 71.6 -66.3 -23.9 51.9 29.7 18.0 106 106 A I H <> S+ 0 0 2 -3,-1.6 4,-2.7 1,-0.2 -1,-0.2 0.909 95.1 52.3 -56.6 -45.0 51.3 30.2 21.8 107 107 A E H <> S+ 0 0 34 -3,-0.6 4,-3.0 -4,-0.4 -1,-0.2 0.896 107.6 52.0 -58.1 -41.7 55.1 29.9 22.4 108 108 A E H X S+ 0 0 9 -4,-0.9 4,-2.6 2,-0.2 5,-0.2 0.956 112.1 43.9 -62.6 -46.2 55.8 32.6 19.8 109 109 A I H X S+ 0 0 2 -4,-2.1 4,-2.2 2,-0.2 5,-0.3 0.925 114.3 52.3 -62.9 -43.2 53.4 35.1 21.3 110 110 A H H X S+ 0 0 18 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.948 112.4 43.7 -55.3 -54.0 54.6 34.2 24.8 111 111 A D H X S+ 0 0 60 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.886 113.2 50.3 -63.0 -46.1 58.3 34.8 23.9 112 112 A C H X S+ 0 0 18 -4,-2.6 4,-0.6 -5,-0.2 -1,-0.2 0.871 114.6 43.3 -61.0 -43.0 57.7 38.0 21.9 113 113 A F H ><>S+ 0 0 0 -4,-2.2 5,-1.9 -5,-0.2 3,-0.9 0.902 110.3 56.3 -69.9 -39.7 55.7 39.7 24.7 114 114 A A H ><5S+ 0 0 40 -4,-2.5 3,-1.8 -5,-0.3 -2,-0.2 0.833 101.2 58.8 -58.4 -36.6 58.1 38.5 27.4 115 115 A K H 3<5S+ 0 0 166 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.783 101.7 54.6 -65.3 -26.1 60.9 40.2 25.5 116 116 A Q T <<5S- 0 0 27 -3,-0.9 -34,-2.0 -4,-0.6 -1,-0.3 0.425 128.0 -98.8 -88.2 -1.8 59.0 43.5 25.9 117 117 A G T < 5S+ 0 0 33 -3,-1.8 -33,-1.8 1,-0.3 -3,-0.2 0.388 73.7 147.8 99.2 -1.2 58.8 43.0 29.7 118 118 A A < - 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