==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-OCT-04 1XTY . COMPND 2 MOLECULE: PEPTIDYL-TRNA HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR M.FROMANT,E.SCHMITT,Y.MECHULAM,C.LAZENNEC,P.PLATEAU,S.BLANQU . 480 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22727.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 342 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 14.8 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 . 25 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 175 36.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 1 0 0 3 0 0 0 4 4 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 PARALLEL BRIDGES PER LADDER . 1 3 0 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 M 0 0 144 0, 0.0 106,-2.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 138.6 2.5 12.5 44.0 2 2 A I E +A 106 0A 11 104,-0.2 2,-0.3 46,-0.1 50,-0.0 -0.785 360.0 175.4 -93.0 133.7 4.4 15.5 45.4 3 3 A K E -A 105 0A 44 102,-2.6 102,-1.9 -2,-0.4 2,-0.4 -0.960 29.2-136.6-140.8 158.8 6.6 17.3 42.8 4 4 A M E - b 0 56A 0 51,-2.0 53,-2.3 -2,-0.3 2,-0.4 -0.938 21.0-160.7-112.8 135.2 8.9 20.3 42.3 5 5 A V E -Ab 102 57A 1 97,-2.4 97,-2.7 -2,-0.4 2,-0.5 -0.961 4.5-165.6-119.6 135.0 8.6 22.3 39.1 6 6 A I E -Ab 101 58A 0 51,-2.4 53,-1.9 -2,-0.4 2,-0.6 -0.983 8.1-154.2-121.6 122.8 11.3 24.6 37.8 7 7 A V E -Ab 100 59A 0 93,-3.5 93,-2.4 -2,-0.5 2,-0.4 -0.867 12.8-162.5 -99.5 117.2 10.4 27.0 35.0 8 8 A V E -Ab 99 60A 3 51,-2.7 53,-2.1 -2,-0.6 2,-0.4 -0.805 19.0-120.6-103.7 140.2 13.4 28.1 32.9 9 9 A R E - b 0 61A 30 89,-2.3 3,-0.2 -2,-0.4 53,-0.2 -0.634 20.3-171.4 -78.4 128.9 13.5 31.1 30.5 10 10 A S S S+ 0 0 58 51,-3.2 52,-0.2 -2,-0.4 -1,-0.1 0.612 74.8 70.8 -94.8 -15.0 14.2 30.2 26.9 11 11 A D S S+ 0 0 80 50,-0.4 2,-0.3 2,-0.1 -1,-0.2 0.562 88.5 70.7 -81.1 -8.8 14.7 33.8 25.6 12 12 A I S S- 0 0 30 -3,-0.2 2,-0.7 86,-0.1 51,-0.0 -0.739 92.3-104.5-104.5 158.6 18.0 34.3 27.3 13 13 A K + 0 0 152 -2,-0.3 2,-0.4 0, 0.0 79,-0.3 -0.737 50.7 153.4 -89.8 115.6 21.3 32.6 26.3 14 14 A M - 0 0 20 -2,-0.7 2,-0.0 -4,-0.1 -2,-0.0 -0.986 33.2-139.1-142.7 128.8 22.4 29.8 28.6 15 15 A G > - 0 0 46 -2,-0.4 4,-2.9 1,-0.1 5,-0.2 -0.280 39.0 -98.8 -76.3 170.7 24.5 26.7 27.9 16 16 A K H > S+ 0 0 94 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.860 126.2 52.3 -61.3 -33.9 23.6 23.4 29.4 17 17 A G H > S+ 0 0 15 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.916 111.5 46.8 -65.9 -41.8 26.1 23.9 32.2 18 18 A K H > S+ 0 0 46 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.931 111.4 50.9 -63.9 -48.7 24.6 27.3 33.0 19 19 A I H X S+ 0 0 7 -4,-2.9 4,-2.6 1,-0.2 5,-0.3 0.907 108.0 52.9 -57.1 -44.6 21.1 25.9 32.9 20 20 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.901 109.3 48.9 -60.0 -41.9 22.0 23.1 35.3 21 21 A A H X S+ 0 0 22 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.922 112.2 48.0 -64.7 -43.6 23.5 25.6 37.8 22 22 A Q H X S+ 0 0 14 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.903 112.8 47.4 -63.9 -43.6 20.4 27.9 37.7 23 23 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.893 112.1 50.2 -65.7 -39.5 18.0 25.0 38.2 24 24 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.3 -1,-0.2 0.856 109.1 53.2 -65.6 -34.4 20.0 23.6 41.0 25 25 A H H X S+ 0 0 46 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.922 108.7 49.3 -65.4 -44.9 20.0 27.1 42.5 26 26 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.921 113.0 47.2 -61.0 -44.3 16.2 27.2 42.3 27 27 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.915 113.2 46.0 -66.0 -45.3 15.9 23.8 44.0 28 28 A V H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.916 111.2 52.3 -65.6 -43.3 18.3 24.5 46.8 29 29 A T H X S+ 0 0 42 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.905 110.8 49.0 -59.7 -41.0 16.8 27.9 47.6 30 30 A L H X S+ 0 0 0 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.970 112.7 46.2 -61.8 -54.1 13.3 26.3 47.8 31 31 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.914 115.4 45.8 -56.4 -47.2 14.4 23.5 50.1 32 32 A V H X S+ 0 0 19 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.891 110.8 53.0 -66.1 -37.7 16.3 25.8 52.4 33 33 A S H < S+ 0 0 46 -4,-2.2 4,-0.2 -5,-0.3 -1,-0.2 0.864 111.6 47.0 -65.4 -34.6 13.5 28.3 52.5 34 34 A I H >< S+ 0 0 0 -4,-2.1 3,-1.1 2,-0.2 5,-0.3 0.926 111.4 49.3 -72.0 -46.0 11.0 25.6 53.5 35 35 A I H 3< S+ 0 0 55 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.871 113.2 48.0 -60.8 -37.7 13.3 24.1 56.2 36 36 A N T 3< S+ 0 0 128 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.485 101.6 86.1 -82.3 -3.9 13.8 27.6 57.7 37 37 A S S < S- 0 0 25 -3,-1.1 -3,-0.1 -4,-0.2 -4,-0.0 -0.255 74.2-137.0 -87.9-179.5 10.1 28.4 57.6 38 38 A N + 0 0 150 -2,-0.1 2,-1.0 5,-0.0 3,-0.1 0.019 63.2 125.9-123.0 20.0 7.4 27.6 60.2 39 39 A N > - 0 0 50 -5,-0.3 4,-2.0 1,-0.2 5,-0.2 -0.734 42.0-168.6 -86.2 102.9 4.9 26.4 57.5 40 40 A L H > S+ 0 0 96 -2,-1.0 4,-2.1 1,-0.2 -1,-0.2 0.868 84.3 54.1 -59.9 -41.0 3.9 23.0 58.6 41 41 A R H > S+ 0 0 147 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.946 109.2 48.2 -60.7 -47.7 2.1 22.2 55.3 42 42 A W H > S+ 0 0 52 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.899 111.1 50.9 -59.2 -42.4 5.3 23.0 53.3 43 43 A K H X S+ 0 0 68 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.858 108.7 51.8 -65.2 -35.3 7.5 20.9 55.6 44 44 A E H X S+ 0 0 94 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.939 111.0 47.4 -66.4 -45.9 5.1 17.9 55.2 45 45 A W H X S+ 0 0 26 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.884 111.0 52.5 -62.0 -38.9 5.2 18.2 51.4 46 46 A L H X S+ 0 0 8 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.937 109.0 48.6 -63.4 -46.6 9.0 18.5 51.5 47 47 A N H X S+ 0 0 88 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.912 113.6 46.5 -59.5 -44.0 9.4 15.3 53.6 48 48 A E H X S+ 0 0 80 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.893 109.4 55.4 -64.8 -40.9 7.1 13.4 51.3 49 49 A W H <>S+ 0 0 0 -4,-2.4 5,-2.6 1,-0.2 3,-0.2 0.912 108.3 47.7 -59.0 -44.4 9.0 14.7 48.3 50 50 A L H ><5S+ 0 0 45 -4,-2.2 3,-1.5 1,-0.2 -1,-0.2 0.911 110.5 51.8 -64.3 -41.3 12.3 13.5 49.6 51 51 A H H 3<5S+ 0 0 163 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.760 107.3 55.0 -65.9 -24.5 10.7 10.1 50.4 52 52 A Q T 3<5S- 0 0 85 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.351 127.2 -95.2 -91.2 5.3 9.4 9.9 46.8 53 53 A G T < 5 - 0 0 43 -3,-1.5 -3,-0.2 1,-0.1 -2,-0.1 0.704 59.5 -80.9 90.8 19.8 12.8 10.4 45.2 54 54 A Q < - 0 0 14 -5,-2.6 -1,-0.1 -6,-0.2 -4,-0.1 0.875 57.9-155.0 53.7 46.4 12.7 14.2 44.7 55 55 A P - 0 0 36 0, 0.0 -51,-2.0 0, 0.0 2,-0.3 -0.262 15.2-171.9 -53.9 130.6 10.6 14.1 41.5 56 56 A K E -b 4 0A 39 -53,-0.2 2,-0.5 48,-0.0 -51,-0.2 -0.956 19.3-157.5-130.0 147.7 11.2 17.2 39.4 57 57 A I E -b 5 0A 36 -53,-2.3 -51,-2.4 -2,-0.3 2,-0.7 -0.986 9.3-161.7-124.7 118.7 9.6 18.7 36.3 58 58 A I E +b 6 0A 12 -2,-0.5 62,-2.8 -53,-0.2 2,-0.2 -0.882 21.5 165.0-106.3 107.2 11.7 21.1 34.2 59 59 A V E -bC 7 119A 4 -53,-1.9 -51,-2.7 -2,-0.7 2,-0.3 -0.616 21.2-135.7-113.2 174.1 9.6 23.2 31.9 60 60 A K E -bC 8 118A 81 58,-2.3 58,-0.5 -53,-0.2 2,-0.3 -0.903 12.9-170.3-134.5 161.6 10.3 26.3 29.9 61 61 A V E -b 9 0A 6 -53,-2.1 -51,-3.2 -2,-0.3 -50,-0.4 -0.960 22.3-138.1-142.7 152.7 8.8 29.7 28.9 62 62 A N S S+ 0 0 111 -2,-0.3 2,-0.3 -53,-0.2 -53,-0.1 0.132 78.2 48.5-104.6 22.3 10.0 32.2 26.4 63 63 A S S > S- 0 0 29 1,-0.1 4,-0.8 -51,-0.0 3,-0.4 -0.988 70.1-128.9-159.0 149.5 9.4 35.5 28.3 64 64 A L H >> S+ 0 0 59 -2,-0.3 4,-2.1 1,-0.2 3,-0.8 0.876 108.7 61.0 -63.8 -38.0 10.0 37.1 31.7 65 65 A D H 3> S+ 0 0 123 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.846 98.9 55.7 -59.6 -34.9 6.4 38.0 31.9 66 66 A E H 3> S+ 0 0 66 -3,-0.4 4,-1.3 2,-0.2 -1,-0.3 0.791 108.2 49.1 -69.6 -25.3 5.3 34.4 31.8 67 67 A I H S+ 0 0 0 -4,-2.4 5,-2.5 1,-0.2 -2,-0.2 0.911 113.4 49.5 -59.5 -44.4 2.2 30.4 43.3 75 75 A E H ><5S+ 0 0 90 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.915 108.4 51.1 -62.0 -46.8 2.2 33.2 45.8 76 76 A T H 3<5S+ 0 0 75 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.851 111.7 48.8 -61.1 -34.8 -1.6 33.7 45.8 77 77 A M T 3<5S- 0 0 62 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.289 114.6-119.2 -89.4 10.2 -2.0 30.0 46.4 78 78 A N T < 5 + 0 0 118 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.880 61.2 148.3 53.9 46.7 0.6 30.1 49.2 79 79 A L < - 0 0 3 -5,-2.5 -1,-0.2 -6,-0.1 2,-0.1 -0.772 55.5 -97.4-106.2 153.7 3.0 27.6 47.6 80 80 A P + 0 0 1 0, 0.0 23,-2.6 0, 0.0 2,-0.3 -0.478 52.3 169.5 -69.8 139.8 6.8 27.8 48.0 81 81 A F E -D 102 0A 77 21,-0.2 2,-0.4 -2,-0.1 21,-0.2 -0.991 22.1-159.3-150.5 155.3 8.5 29.6 45.2 82 82 A S E -D 101 0A 6 19,-2.1 19,-2.6 -2,-0.3 2,-0.7 -0.989 6.8-155.6-140.3 129.7 12.0 30.9 44.3 83 83 A I E -D 100 0A 67 -2,-0.4 2,-0.4 17,-0.2 17,-0.2 -0.922 20.3-155.0-105.7 114.8 12.9 33.5 41.7 84 84 A I E -D 99 0A 5 15,-2.4 14,-2.6 -2,-0.7 15,-1.0 -0.771 9.5-169.3 -96.3 131.9 16.5 33.1 40.7 85 85 A E E -D 97 0A 102 -2,-0.4 12,-0.2 12,-0.3 11,-0.1 -0.905 29.9-102.9-117.6 147.2 18.7 35.9 39.3 86 86 A D - 0 0 5 10,-2.6 9,-2.4 -2,-0.4 10,-0.1 -0.318 14.7-139.2 -67.1 147.7 22.1 35.5 37.6 87 87 A A - 0 0 73 7,-0.2 -1,-0.1 8,-0.1 6,-0.0 0.387 39.7-123.8 -86.8 2.6 25.2 36.4 39.6 88 88 A G S S+ 0 0 24 5,-0.3 -2,-0.0 8,-0.1 5,-0.0 0.801 70.2 132.4 60.5 34.6 26.6 38.0 36.5 89 89 A K S S+ 0 0 189 4,-0.1 2,-0.2 0, 0.0 -1,-0.1 0.723 72.9 22.8 -86.5 -22.5 29.8 36.0 36.4 90 90 A T S S- 0 0 71 2,-0.2 -4,-0.0 3,-0.0 0, 0.0 -0.439 120.3 -42.3-124.6-162.5 29.4 35.1 32.7 91 91 A Q S S+ 0 0 127 -2,-0.2 -77,-0.1 2,-0.1 0, 0.0 0.821 108.7 82.3 -27.2 -68.9 27.6 36.6 29.6 92 92 A L S S- 0 0 22 -79,-0.3 -2,-0.2 1,-0.1 3,-0.1 -0.051 87.4-112.0 -47.3 143.5 24.3 37.4 31.4 93 93 A E > - 0 0 143 1,-0.1 3,-1.7 -4,-0.1 -5,-0.3 -0.555 40.3 -98.4 -77.9 141.8 24.1 40.6 33.3 94 94 A P T 3 S+ 0 0 82 0, 0.0 -7,-0.2 0, 0.0 3,-0.1 -0.346 110.0 35.3 -61.6 140.3 23.8 40.2 37.1 95 95 A G T 3 S+ 0 0 33 -9,-2.4 2,-0.3 1,-0.3 -8,-0.1 0.236 79.7 140.0 100.7 -13.3 20.2 40.5 38.3 96 96 A T < - 0 0 35 -3,-1.7 -10,-2.6 -10,-0.1 2,-0.4 -0.498 56.1-125.1 -67.6 122.7 18.8 38.8 35.2 97 97 A I E + D 0 85A 23 -2,-0.3 -12,-0.3 -12,-0.2 3,-0.1 -0.568 35.6 171.7 -71.4 124.0 15.9 36.5 36.2 98 98 A T E - 0 0 0 -14,-2.6 -89,-2.3 -2,-0.4 2,-0.3 0.732 54.1 -10.8-106.0 -31.2 16.7 33.0 34.8 99 99 A C E -AD 8 84A 0 -15,-1.0 -15,-2.4 -91,-0.2 2,-0.4 -0.991 50.1-129.2-164.5 169.3 14.1 30.7 36.3 100 100 A L E -AD 7 83A 0 -93,-2.4 -93,-3.5 -2,-0.3 2,-0.4 -0.994 16.1-156.9-130.1 127.3 11.4 30.1 38.8 101 101 A G E -AD 6 82A 0 -19,-2.6 -19,-2.1 -2,-0.4 2,-0.4 -0.836 10.5-172.1-103.9 144.6 11.1 27.2 41.2 102 102 A I E -AD 5 81A 0 -97,-2.7 -97,-2.4 -2,-0.4 -21,-0.2 -0.998 31.9 -53.9-137.5 132.7 7.7 26.0 42.6 103 103 A G E - 0 0 0 -23,-2.6 -99,-0.2 -2,-0.4 2,-0.2 -0.613 24.4-123.8 99.7-158.7 7.1 23.5 45.4 104 104 A P E S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 -100,-0.2 0.464 75.3 124.6 -66.1 151.7 7.5 20.8 46.3 105 105 A A E -A 3 0A 0 -102,-1.9 -102,-2.6 -3,-0.2 5,-0.1 -0.969 69.3 -48.4-167.2 167.8 3.7 20.3 46.4 106 106 A P E >> -A 2 0A 42 0, 0.0 4,-2.6 0, 0.0 3,-0.7 -0.212 52.9-132.3 -47.4 127.9 0.9 18.1 45.1 107 107 A E H 3> S+ 0 0 42 -106,-2.6 4,-2.4 1,-0.3 -105,-0.1 0.812 105.8 52.1 -57.9 -32.7 1.4 17.8 41.4 108 108 A N H 3> S+ 0 0 129 -107,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.818 110.3 50.0 -72.6 -28.6 -2.2 18.6 40.5 109 109 A L H X4 S+ 0 0 61 -3,-0.7 3,-0.6 2,-0.2 -2,-0.2 0.932 114.2 43.7 -72.5 -44.7 -1.9 21.7 42.7 110 110 A V H >X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.2 3,-1.6 0.849 107.0 61.6 -67.9 -33.3 1.3 22.7 40.9 111 111 A D H 3X S+ 0 0 58 -4,-2.4 4,-2.1 1,-0.3 -1,-0.2 0.767 86.7 71.8 -64.4 -25.0 -0.3 21.8 37.5 112 112 A S H << S+ 0 0 58 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.433 113.1 31.1 -70.3 6.4 -3.0 24.5 38.2 113 113 A I H <4 S+ 0 0 4 -3,-1.6 -2,-0.2 -5,-0.0 -1,-0.2 0.622 136.7 17.1-126.7 -45.7 0.0 26.7 37.5 114 114 A T H >< S+ 0 0 7 -4,-2.0 3,-1.5 1,-0.1 -3,-0.2 0.167 81.5 114.1-122.2 18.3 2.4 25.0 35.0 115 115 A G T 3< S+ 0 0 51 -4,-2.1 -1,-0.1 1,-0.3 -4,-0.1 0.591 77.8 56.2 -67.1 -7.5 0.3 22.3 33.4 116 116 A D T 3 S+ 0 0 115 -5,-0.1 2,-0.3 -3,-0.1 -1,-0.3 0.238 85.1 106.2-108.2 12.8 0.5 24.0 30.1 117 117 A L < - 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0 0 0 -23,-2.6 -99,-0.2 -2,-0.4 2,-0.2 -0.616 23.9-125.3 102.0-162.2 26.9 27.6 78.6 467 104 D P E S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 -100,-0.2 0.476 75.8 135.3 -60.8 145.1 26.3 24.9 77.8 468 105 D A E -M 366 0D 0 -102,-2.1 -102,-2.8 -3,-0.2 5,-0.1 -0.969 62.4 -60.2-159.2 163.8 29.9 24.8 76.6 469 106 D P E >> -M 365 0D 36 0, 0.0 4,-2.2 0, 0.0 3,-1.1 -0.222 52.6-117.9 -51.9 138.1 32.9 22.5 76.7 470 107 D E H 3> S+ 0 0 55 -106,-2.8 4,-3.1 1,-0.3 5,-0.2 0.847 111.5 52.9 -45.8 -46.7 34.0 21.8 80.3 471 108 D N H 3> S+ 0 0 126 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.809 109.5 48.5 -64.9 -30.4 37.4 23.4 79.9 472 109 D L H <4 S+ 0 0 59 -3,-1.1 4,-0.5 2,-0.2 3,-0.2 0.938 115.7 43.3 -73.7 -47.2 36.0 26.6 78.5 473 110 D V H >X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 3,-1.4 0.925 113.6 51.4 -63.5 -44.8 33.4 26.9 81.3 474 111 D D H 3X S+ 0 0 56 -4,-3.1 4,-2.3 1,-0.3 -1,-0.2 0.745 96.6 67.2 -66.4 -23.6 36.0 26.0 84.0 475 112 D S H 3< S+ 0 0 57 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.753 112.9 35.4 -67.6 -18.6 38.4 28.6 82.7 476 113 D I H <4 S+ 0 0 0 -3,-1.4 -2,-0.2 -4,-0.5 -1,-0.2 0.834 137.0 15.3 -99.8 -42.4 35.8 31.0 84.0 477 114 D T H >< S+ 0 0 5 -4,-2.1 3,-2.6 1,-0.1 -3,-0.2 0.430 86.5 108.0-116.6 0.2 34.3 29.4 87.1 478 115 D G T 3< S+ 0 0 55 -4,-2.3 -1,-0.1 1,-0.3 -3,-0.1 0.662 81.7 54.4 -53.8 -18.4 36.8 26.6 88.0 479 116 D D T 3 S+ 0 0 118 -5,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.415 89.0 101.9 -96.2 -0.3 37.9 28.6 91.1 480 117 D L S < S- 0 0 24 -3,-2.6 2,-0.2 1,-0.1 -56,-0.1 -0.587 71.9-116.7 -90.8 149.0 34.5 29.1 92.5 481 118 D K E -O 423 0D 160 -58,-0.5 -58,-2.4 -2,-0.2 -1,-0.1 -0.535 33.3-105.3 -81.9 145.7 32.9 27.2 95.5 482 119 D L E O 422 0D 122 -60,-0.2 -60,-0.3 -2,-0.2 -1,-0.1 -0.327 360.0 360.0 -67.2 149.5 29.9 25.0 95.0 483 120 D L 0 0 44 -62,-2.6 -62,-0.1 -225,-0.0 -1,-0.1 -0.430 360.0 360.0 -79.7 360.0 26.6 26.3 96.3