==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 11-AUG-08 3E4G . COMPND 2 MOLECULE: ATP SYNTHASE SUBUNIT S, MITOCHONDRIAL; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR R.M.STROUD,J.K.LEE,G.I.BELOGRUDOV . 176 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9321.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 127 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 4.5 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 . 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 . 14 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 25.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 2 1 1 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 4 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 0 A S > 0 0 97 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 167.3 5.2 -7.6 -12.0 2 1 A F H > + 0 0 129 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.905 360.0 54.0 -61.0 -43.5 2.7 -8.4 -9.3 3 2 A W H > S+ 0 0 175 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.890 107.6 50.7 -65.3 -38.2 5.4 -9.6 -6.9 4 3 A E H > S+ 0 0 134 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.930 112.2 46.8 -60.7 -46.2 7.3 -6.3 -7.4 5 4 A W H X S+ 0 0 141 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.925 111.2 52.2 -59.9 -45.9 4.2 -4.3 -6.6 6 5 A L H X S+ 0 0 38 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.927 110.7 46.5 -60.8 -46.4 3.5 -6.5 -3.6 7 6 A N H X S+ 0 0 28 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.909 112.6 51.9 -61.7 -40.2 7.0 -6.0 -2.1 8 7 A A H X S+ 0 0 51 -4,-2.3 4,-2.1 1,-0.2 3,-0.4 0.928 110.0 46.2 -63.5 -45.1 6.7 -2.3 -2.7 9 8 A V H < S+ 0 0 62 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.798 107.6 58.1 -71.8 -27.9 3.4 -1.9 -1.0 10 9 A F H < S+ 0 0 74 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.827 116.8 36.2 -60.4 -35.5 4.7 -4.0 2.0 11 10 A N H < S+ 0 0 1 -4,-1.3 -2,-0.2 -3,-0.4 69,-0.2 0.729 89.6 111.7 -88.9 -27.8 7.4 -1.4 2.3 12 11 A K < - 0 0 137 -4,-2.1 2,-0.2 -5,-0.1 65,-0.1 -0.246 67.6-121.6 -62.5 135.9 5.7 1.8 1.4 13 12 A V - 0 0 17 63,-0.2 2,-0.7 1,-0.0 -1,-0.1 -0.498 13.1-154.1 -72.8 134.5 5.2 4.3 4.3 14 13 A D > - 0 0 90 -2,-0.2 4,-1.8 1,-0.1 3,-0.3 -0.935 7.3-168.7-105.3 101.9 1.6 5.4 5.2 15 14 A H H > S+ 0 0 132 -2,-0.7 4,-2.1 1,-0.2 5,-0.1 0.765 84.5 60.8 -66.7 -25.6 2.2 8.8 6.7 16 15 A D H > S+ 0 0 90 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.898 103.7 50.8 -63.7 -39.1 -1.4 8.9 8.0 17 16 A R H >>S+ 0 0 89 -3,-0.3 4,-2.8 2,-0.2 5,-0.6 0.928 107.7 51.0 -66.5 -43.9 -0.6 5.8 9.9 18 17 A I H X5S+ 0 0 37 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.932 111.5 50.1 -55.3 -41.9 2.5 7.4 11.5 19 18 A R H <5S+ 0 0 163 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.880 114.8 43.8 -62.6 -43.2 0.3 10.5 12.4 20 19 A D H <5S+ 0 0 89 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.889 132.4 13.6 -74.5 -42.9 -2.3 8.2 14.0 21 20 A V H <5S- 0 0 26 -4,-2.8 38,-0.5 1,-0.1 4,-0.4 0.478 106.7-110.3-119.7 -5.7 -0.2 5.8 16.0 22 21 A G X< - 0 0 10 -4,-1.9 4,-2.4 -5,-0.6 5,-0.2 0.058 36.2 -74.4 91.2 159.3 3.2 7.3 16.1 23 22 A P H > S+ 0 0 34 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.863 124.7 53.3 -57.9 -44.9 6.5 6.3 14.4 24 23 A D H > S+ 0 0 4 1,-0.2 4,-2.0 2,-0.2 -2,-0.1 0.914 113.2 42.1 -63.7 -43.5 7.3 3.3 16.7 25 24 A R H > S+ 0 0 52 -4,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.921 115.7 49.5 -67.1 -44.5 4.0 1.6 16.2 26 25 A A H X S+ 0 0 3 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.909 113.8 46.3 -62.3 -41.2 3.9 2.3 12.4 27 26 A A H X S+ 0 0 0 -4,-2.7 4,-2.9 -5,-0.2 -1,-0.2 0.859 109.2 54.8 -68.7 -35.9 7.5 0.9 12.1 28 27 A S H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.2 5,-0.3 0.911 108.8 48.5 -60.4 -43.0 6.7 -2.1 14.2 29 28 A E H X S+ 0 0 8 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.921 112.5 48.7 -62.2 -48.3 3.8 -2.9 11.8 30 29 A W H X S+ 0 0 0 -4,-2.1 4,-1.6 -5,-0.2 -2,-0.2 0.957 114.0 45.9 -54.9 -51.7 6.1 -2.4 8.8 31 30 A L H <>S+ 0 0 2 -4,-2.9 5,-2.9 1,-0.2 3,-0.3 0.956 115.8 43.4 -63.1 -49.1 8.8 -4.7 10.2 32 31 A L H ><5S+ 0 0 14 -4,-2.7 3,-1.9 1,-0.2 18,-0.2 0.916 111.7 52.7 -69.9 -35.9 6.5 -7.5 11.3 33 32 A R H 3<5S+ 0 0 74 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.820 110.1 52.3 -65.3 -26.0 4.4 -7.5 8.1 34 33 A C T 3<5S- 0 0 4 -4,-1.6 38,-2.1 -3,-0.3 39,-0.4 0.233 128.1 -98.0 -92.5 14.4 7.8 -7.8 6.2 35 34 A G T < 5S+ 0 0 43 -3,-1.9 34,-0.5 1,-0.3 -3,-0.2 0.732 85.5 119.9 79.4 21.5 8.9 -10.8 8.3 36 35 A A < - 0 0 3 -5,-2.9 2,-0.3 32,-0.2 -1,-0.3 -0.578 51.1-137.6-104.8 176.5 11.1 -8.9 10.8 37 36 A M E -A 67 0A 69 30,-2.0 30,-2.6 -2,-0.2 2,-0.3 -0.933 11.4-161.6-132.3 154.2 10.8 -8.7 14.6 38 37 A V E -AB 66 47A 0 9,-1.4 9,-3.5 -2,-0.3 2,-0.4 -0.959 5.9-154.8-133.5 157.3 11.2 -5.9 17.1 39 38 A R E -A 65 0A 30 26,-2.5 25,-2.8 -2,-0.3 26,-2.1 -1.000 19.0-136.4-132.8 130.4 11.8 -5.6 20.8 40 39 A Y E > -A 63 0A 2 5,-0.4 3,-2.2 -2,-0.4 23,-0.2 -0.533 30.4 -91.7 -85.9 149.8 10.7 -2.6 22.9 41 40 A H T 3 S+ 0 0 61 21,-3.0 21,-0.3 1,-0.3 -1,-0.1 -0.338 114.6 23.2 -50.1 135.6 12.7 -0.8 25.6 42 41 A G T 3 S+ 0 0 84 1,-0.2 2,-0.4 19,-0.1 -1,-0.3 0.386 103.8 102.0 84.1 -1.3 11.8 -2.3 28.9 43 42 A Q < - 0 0 55 -3,-2.2 -1,-0.2 1,-0.1 0, 0.0 -0.936 51.2-164.8-120.7 139.6 10.7 -5.7 27.5 44 43 A Q S S+ 0 0 186 -2,-0.4 2,-0.2 -3,-0.1 -1,-0.1 0.817 71.8 75.6 -81.5 -35.8 12.5 -9.0 27.4 45 44 A R S S- 0 0 126 1,-0.1 -5,-0.4 -6,-0.0 2,-0.3 -0.519 77.0-125.7 -85.9 148.2 10.3 -10.7 24.9 46 45 A W - 0 0 76 -2,-0.2 2,-0.7 -7,-0.1 -7,-0.2 -0.632 14.1-122.8 -87.3 149.0 10.2 -10.0 21.2 47 46 A Q B +B 38 0A 6 -9,-3.5 -9,-1.4 -2,-0.3 3,-0.1 -0.821 47.5 149.5 -84.8 114.9 7.3 -9.0 19.0 48 47 A K + 0 0 133 -2,-0.7 2,-0.5 1,-0.2 -1,-0.2 0.625 51.9 64.1-125.6 -15.0 7.2 -11.6 16.3 49 48 A D > - 0 0 69 1,-0.1 3,-2.2 -14,-0.0 4,-0.3 -0.947 68.1-146.9-114.5 122.3 3.5 -11.9 15.3 50 49 A Y G > S+ 0 0 96 -2,-0.5 3,-1.5 1,-0.3 -1,-0.1 0.856 98.4 57.1 -49.7 -43.5 1.9 -8.9 13.7 51 50 A N G 3 S+ 0 0 131 1,-0.3 -1,-0.3 -3,-0.1 0, 0.0 0.594 102.9 55.6 -71.4 -12.6 -1.5 -9.7 15.3 52 51 A H G < S+ 0 0 130 -3,-2.2 -1,-0.3 2,-0.0 -2,-0.2 0.280 73.0 125.9-101.5 7.4 -0.0 -9.6 18.8 53 52 A L S < S- 0 0 8 -3,-1.5 3,-0.1 -4,-0.3 2,-0.1 -0.332 73.6 -94.7 -58.3 149.2 1.5 -6.2 18.7 54 53 A P - 0 0 30 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.324 29.1-168.8 -69.7 148.9 0.3 -4.1 21.7 55 54 A T + 0 0 136 -3,-0.1 -2,-0.0 -2,-0.1 -30,-0.0 0.830 53.4 123.8 -98.8 -44.0 -2.8 -1.8 21.1 56 55 A G - 0 0 37 2,-0.1 3,-0.1 -3,-0.1 -3,-0.0 0.742 65.3 -14.7 23.5-174.6 -2.0 -0.2 24.5 57 56 A P S > S- 0 0 87 0, 0.0 3,-2.0 0, 0.0 4,-0.4 -0.279 86.5 -87.5 -65.1 146.3 -1.4 3.3 25.3 58 57 A L T 3 S- 0 0 133 1,-0.3 -36,-0.1 2,-0.1 -2,-0.1 -0.168 100.5 -16.1 -54.2 120.5 -0.6 5.6 22.4 59 58 A D T 3 S+ 0 0 64 -38,-0.5 -1,-0.3 -3,-0.1 -35,-0.1 0.609 95.2 127.1 61.3 25.7 3.0 5.8 21.5 60 59 A K < + 0 0 129 -3,-2.0 2,-0.3 2,-0.0 -2,-0.1 0.924 51.2 72.8 -75.6 -46.9 4.2 4.2 24.7 61 60 A Y - 0 0 69 -4,-0.4 2,-0.5 -21,-0.1 -37,-0.1 -0.555 65.2-164.5 -80.1 128.7 6.4 1.3 23.4 62 61 A K - 0 0 44 -2,-0.3 -21,-3.0 -21,-0.3 2,-0.2 -0.956 23.1-115.9-119.8 127.3 9.7 2.4 21.8 63 62 A I E +A 40 0A 0 -2,-0.5 -23,-0.3 -23,-0.2 23,-0.2 -0.450 37.1 165.9 -62.7 126.9 11.8 0.1 19.6 64 63 A Q E + 0 0 36 -25,-2.8 24,-2.5 1,-0.3 25,-1.8 0.707 66.3 21.9-101.5 -41.7 15.1 -0.8 21.1 65 64 A A E -Ac 39 89A 2 -26,-2.1 -26,-2.5 23,-0.2 2,-0.4 -0.987 58.7-161.4-136.3 146.2 16.2 -3.7 18.8 66 65 A I E -Ac 38 90A 7 23,-2.1 25,-2.2 -2,-0.4 2,-0.5 -0.986 2.8-172.9-125.9 134.1 15.3 -4.9 15.4 67 66 A D E +Ac 37 91A 40 -30,-2.6 -30,-2.0 -2,-0.4 2,-0.9 -0.907 5.8 179.7-129.5 96.9 15.9 -8.4 14.1 68 67 A A E + c 0 92A 0 23,-3.1 25,-3.0 -2,-0.5 2,-0.5 -0.868 13.7 162.7-101.1 95.1 15.1 -8.7 10.3 69 68 A T E S- c 0 93A 39 -2,-0.9 25,-0.2 -34,-0.5 3,-0.1 -0.968 71.5 -3.9-115.0 130.5 15.9 -12.2 9.3 70 69 A D S S+ 0 0 98 23,-2.2 2,-0.3 -2,-0.5 -1,-0.2 0.940 101.6 152.5 54.5 49.9 14.5 -13.7 6.1 71 70 A S - 0 0 6 22,-0.4 26,-0.5 23,-0.3 25,-0.4 -0.783 53.3-140.4-115.2 153.9 12.6 -10.3 5.7 72 71 A C + 0 0 24 -38,-2.1 -37,-0.1 -2,-0.3 -61,-0.1 0.232 53.5 137.5 -98.8 17.4 11.4 -8.4 2.6 73 72 A I + 0 0 0 -39,-0.4 24,-0.3 -42,-0.1 2,-0.3 -0.263 25.9 158.8 -62.4 146.6 12.4 -5.0 3.9 74 73 A M > - 0 0 40 -67,-0.1 3,-2.7 24,-0.1 4,-0.2 -0.963 42.7 -39.7-163.5 153.8 14.0 -2.7 1.3 75 74 A S G > S+ 0 0 46 1,-0.3 3,-2.0 -2,-0.3 4,-0.2 0.048 123.7 23.3 38.9-114.9 14.8 0.8 0.3 76 75 A I G > S+ 0 0 66 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.686 107.6 78.6 -68.6 -10.2 12.1 3.3 1.0 77 76 A G G X S+ 0 0 0 -3,-2.7 3,-2.2 1,-0.3 -1,-0.3 0.877 84.1 67.3 -56.5 -32.3 10.6 0.9 3.7 78 77 A F G X S+ 0 0 5 -3,-2.0 3,-2.2 1,-0.3 -1,-0.3 0.639 75.2 82.6 -67.7 -10.2 13.4 2.3 5.8 79 78 A D G X S+ 0 0 56 -3,-1.8 3,-1.6 1,-0.3 -1,-0.3 0.737 77.2 71.4 -61.7 -19.9 11.7 5.7 5.7 80 79 A H G < S+ 0 0 6 -3,-2.2 3,-0.4 -4,-0.3 -1,-0.3 0.661 87.9 65.0 -62.5 -17.6 9.7 4.2 8.6 81 80 A M G X S+ 0 0 2 -3,-2.2 3,-1.4 1,-0.2 -1,-0.2 0.579 77.1 90.7 -76.3 -18.0 12.9 4.6 10.6 82 81 A E T < S+ 0 0 117 -3,-1.6 29,-0.2 1,-0.3 -1,-0.2 0.790 89.5 38.7 -57.7 -37.8 12.8 8.4 10.4 83 82 A G T 3 S+ 0 0 18 -3,-0.4 2,-0.4 -4,-0.2 -1,-0.3 0.349 86.8 113.3 -93.5 -0.3 10.8 9.2 13.5 84 83 A L < + 0 0 0 -3,-1.4 3,-0.1 -61,-0.1 -22,-0.0 -0.654 37.0 178.8 -83.8 128.6 12.4 6.5 15.8 85 84 A Q S S+ 0 0 100 -2,-0.4 -1,-0.1 1,-0.1 -23,-0.0 0.627 70.5 41.6-102.5 -14.3 14.4 8.0 18.7 86 85 A Y + 0 0 116 -23,-0.2 2,-0.5 29,-0.0 -1,-0.1 0.140 65.7 138.1-129.7 19.0 15.7 5.0 20.7 87 86 A V + 0 0 0 1,-0.2 -23,-0.2 -6,-0.1 -22,-0.2 -0.573 13.2 160.6 -75.1 121.6 16.9 2.2 18.3 88 87 A E + 0 0 53 -24,-2.5 29,-2.3 -2,-0.5 30,-2.3 0.670 57.1 41.2-111.2 -26.9 20.1 0.8 19.6 89 88 A K E +cd 65 118A 80 -25,-1.8 -23,-2.1 28,-0.2 2,-0.4 -0.997 54.8 177.1-132.9 130.1 20.4 -2.6 17.9 90 89 A I E -cd 66 119A 5 28,-2.0 30,-2.2 -2,-0.4 2,-0.5 -0.992 4.6-173.9-133.2 129.4 19.7 -3.7 14.3 91 90 A R E -cd 67 120A 66 -25,-2.2 -23,-3.1 -2,-0.4 2,-0.5 -0.989 1.3-173.8-117.9 128.2 20.3 -7.2 12.8 92 91 A L E +cd 68 121A 1 28,-2.8 30,-2.8 -2,-0.5 2,-0.4 -0.988 16.8 167.3-118.9 111.8 19.8 -7.7 9.0 93 92 A C E -cd 69 122A 7 -25,-3.0 -23,-2.2 -2,-0.5 -22,-0.4 -0.992 65.5 -9.5-134.6 124.0 20.2 -11.4 8.2 94 93 A K S S+ 0 0 83 28,-2.5 2,-0.9 -2,-0.4 -23,-0.3 0.926 78.9 156.6 54.2 45.9 19.2 -13.1 4.9 95 94 A C > - 0 0 0 27,-0.3 3,-1.0 -25,-0.2 -1,-0.2 -0.845 20.1-174.2 -99.8 91.2 17.5 -9.8 3.8 96 95 A H T 3 S+ 0 0 116 -2,-0.9 -1,-0.1 -25,-0.4 -24,-0.1 0.670 75.8 50.6 -71.1 -15.6 17.7 -10.6 0.1 97 96 A Y T 3 S+ 0 0 98 -26,-0.5 -1,-0.3 -24,-0.3 -22,-0.2 0.553 82.6 110.0 -97.7 -12.8 16.4 -7.3 -1.1 98 97 A I < + 0 0 0 -3,-1.0 28,-0.4 -24,-0.1 2,-0.3 -0.384 43.7 173.2 -60.1 144.3 18.7 -5.0 1.0 99 98 A E >> - 0 0 105 27,-0.1 4,-1.5 26,-0.1 3,-1.2 -0.866 50.1 -85.9-140.2 177.8 21.3 -3.1 -1.0 100 99 A D H 3> S+ 0 0 17 26,-0.3 4,-2.7 -2,-0.3 5,-0.2 0.848 124.4 61.3 -53.6 -39.1 23.9 -0.4 -0.4 101 100 A G H 3> S+ 0 0 33 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.827 100.5 53.7 -63.5 -29.1 21.3 2.3 -0.9 102 101 A C H <> S+ 0 0 4 -3,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.916 111.1 45.3 -66.1 -46.2 19.3 0.9 2.1 103 102 A L H X S+ 0 0 0 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.895 112.7 51.7 -65.9 -38.7 22.4 1.2 4.3 104 103 A E H X S+ 0 0 64 -4,-2.7 4,-1.3 2,-0.2 -2,-0.2 0.944 109.4 49.7 -60.6 -50.6 23.1 4.7 2.9 105 104 A R H >< S+ 0 0 95 -4,-2.5 3,-0.5 1,-0.2 4,-0.3 0.930 113.3 46.3 -56.0 -45.8 19.5 5.7 3.7 106 105 A L H >< S+ 0 0 1 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.920 108.1 56.3 -59.9 -45.3 19.8 4.4 7.3 107 106 A S H 3< S+ 0 0 2 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.734 103.3 55.8 -63.1 -26.8 23.2 6.0 7.8 108 107 A Q T << S+ 0 0 119 -4,-1.3 2,-0.8 -3,-0.5 -1,-0.3 0.453 78.6 102.6 -85.8 -5.0 21.8 9.5 7.0 109 108 A L X> - 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