==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-OCT-08 2W0S . COMPND 2 MOLECULE: THYMIDYLATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: VACCINIA VIRUS COPENHAGEN; . AUTHOR C.CAILLAT,D.TOPALIS,L.A.AGROFOGLIO,S.POCHET,J.BALZARINI, . 406 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18324.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 312 76.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 33 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 161 39.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 2 0 0 0 2 2 4 2 0 2 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 PARALLEL BRIDGES PER LADDER . 2 2 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 . 2 0 0 2 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 S 0 0 143 0, 0.0 194,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 47.6 -14.3 17.6 -19.3 2 3 A R - 0 0 25 194,-0.4 81,-0.2 1,-0.2 192,-0.1 -0.065 360.0 -87.0 -66.3 178.2 -14.7 15.2 -16.4 3 4 A G - 0 0 2 79,-1.8 2,-0.4 83,-0.4 84,-0.2 -0.359 49.3-104.5 -72.9 168.3 -16.1 11.8 -16.6 4 5 A A - 0 0 0 81,-0.2 84,-3.0 -2,-0.1 2,-0.9 -0.797 17.9-133.2 -99.0 142.6 -19.9 11.4 -16.4 5 6 A L E -a 88 0A 0 -2,-0.4 117,-2.8 115,-0.2 118,-1.1 -0.836 30.9-177.8 -93.0 104.1 -21.6 10.0 -13.3 6 7 A I E -ab 89 123A 0 82,-3.2 84,-2.9 -2,-0.9 2,-0.5 -0.896 4.8-166.8-109.3 121.9 -24.1 7.5 -14.6 7 8 A V E -ab 90 124A 0 116,-2.4 118,-2.6 -2,-0.5 2,-0.5 -0.899 10.1-151.7-113.6 133.4 -26.4 5.7 -12.2 8 9 A F E +ab 91 125A 0 82,-3.4 84,-2.5 -2,-0.5 2,-0.3 -0.871 23.3 170.6 -98.5 127.1 -28.6 2.6 -12.8 9 10 A E E + b 0 126A 0 116,-2.6 118,-2.4 -2,-0.5 2,-0.2 -0.844 14.4 110.5-127.1 169.6 -31.8 2.3 -10.7 10 11 A G E - b 0 127A 0 -2,-0.3 118,-0.1 116,-0.2 3,-0.1 -0.828 63.5 -57.8 149.7 172.7 -34.9 -0.0 -10.7 11 12 A L S > S- 0 0 2 116,-0.6 3,-1.2 -2,-0.2 5,-0.3 -0.105 72.0 -74.0 -67.5 174.4 -36.5 -2.8 -8.7 12 13 A D T 3 S+ 0 0 29 1,-0.2 124,-0.2 131,-0.1 -1,-0.2 -0.487 121.7 20.2 -66.3 144.8 -34.7 -6.0 -7.8 13 14 A K T 3 S+ 0 0 77 -2,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.646 82.3 124.6 69.3 15.0 -34.4 -8.4 -10.8 14 15 A S S < S- 0 0 6 -3,-1.2 -2,-0.1 115,-0.1 -1,-0.1 0.432 81.5-118.9 -80.1 -1.9 -35.0 -5.4 -13.2 15 16 A G > + 0 0 27 118,-0.1 4,-2.0 -4,-0.1 5,-0.2 0.644 67.3 143.6 75.8 20.3 -31.7 -6.6 -14.7 16 17 A K H > S+ 0 0 14 -5,-0.3 4,-1.8 1,-0.2 5,-0.1 0.787 71.8 59.8 -63.7 -24.9 -29.7 -3.4 -14.1 17 18 A T H > S+ 0 0 54 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.951 104.8 48.8 -64.2 -47.7 -26.6 -5.7 -13.4 18 19 A T H > S+ 0 0 74 1,-0.2 4,-2.0 2,-0.2 3,-0.3 0.963 111.5 48.7 -49.4 -58.4 -26.9 -7.1 -16.9 19 20 A Q H X S+ 0 0 3 -4,-2.0 4,-2.1 1,-0.3 -1,-0.2 0.824 108.1 54.7 -57.1 -34.0 -27.2 -3.7 -18.5 20 21 A C H X S+ 0 0 1 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.3 0.895 105.3 54.3 -64.0 -40.4 -24.1 -2.6 -16.5 21 22 A M H X S+ 0 0 35 -4,-2.2 4,-1.4 -3,-0.3 -2,-0.2 0.908 105.8 52.7 -59.0 -44.9 -22.3 -5.5 -17.9 22 23 A N H >X S+ 0 0 26 -4,-2.0 4,-2.7 1,-0.2 3,-1.1 0.973 108.0 48.8 -53.7 -58.1 -23.2 -4.3 -21.5 23 24 A I H 3X S+ 0 0 1 -4,-2.1 4,-0.7 1,-0.3 -1,-0.2 0.880 109.1 54.4 -52.7 -37.5 -21.8 -0.8 -20.9 24 25 A M H 3< S+ 0 0 26 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.812 114.3 40.3 -69.0 -28.4 -18.6 -2.3 -19.5 25 26 A E H << S+ 0 0 87 -4,-1.4 -1,-0.2 -3,-1.1 -2,-0.2 0.786 111.9 56.8 -86.9 -30.8 -18.1 -4.3 -22.6 26 27 A S H < S+ 0 0 21 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.526 107.1 51.8 -78.1 -7.3 -19.2 -1.6 -25.0 27 28 A I S < S- 0 0 12 -4,-0.7 2,-0.2 -5,-0.2 218,-0.1 -0.974 93.7 -95.7-138.8 144.0 -16.7 1.0 -23.8 28 29 A P > - 0 0 46 0, 0.0 3,-1.5 0, 0.0 4,-0.3 -0.396 29.9-139.4 -64.2 130.5 -12.9 0.9 -23.4 29 30 A A T 3 S+ 0 0 5 1,-0.3 3,-0.4 2,-0.2 209,-0.1 0.581 93.2 74.2 -70.7 -13.5 -12.0 0.2 -19.8 30 31 A N T 3 S+ 0 0 27 1,-0.2 -1,-0.3 3,-0.0 3,-0.0 0.576 108.1 35.6 -73.7 -2.3 -9.2 2.7 -19.5 31 32 A T S < S+ 0 0 68 -3,-1.5 56,-2.7 55,-0.1 2,-0.3 0.377 111.8 62.2-128.4 -3.7 -11.9 5.4 -19.3 32 33 A I E -c 87 0A 2 -3,-0.4 2,-0.4 -4,-0.3 56,-0.2 -0.945 55.3-162.0-135.9 150.2 -14.7 3.8 -17.4 33 34 A K E -c 88 0A 11 54,-2.2 56,-2.5 -2,-0.3 2,-0.5 -0.986 12.7-141.5-139.7 127.5 -15.3 2.4 -13.9 34 35 A Y E -c 89 0A 37 -2,-0.4 2,-0.5 54,-0.2 56,-0.2 -0.753 18.5-176.0 -94.1 128.2 -17.9 0.0 -12.5 35 36 A L E -c 90 0A 0 54,-3.0 56,-2.2 -2,-0.5 2,-0.3 -0.946 6.0-163.1-127.6 111.4 -19.3 0.6 -9.0 36 37 A N E -c 91 0A 38 -2,-0.5 197,-0.1 54,-0.2 56,-0.1 -0.723 20.3-121.4 -90.8 138.1 -21.9 -1.7 -7.3 37 38 A F S S+ 0 0 3 54,-1.7 2,-0.1 -2,-0.3 56,-0.0 -0.996 91.9 41.5-123.2 139.3 -23.9 -0.7 -4.3 38 39 A P S S- 0 0 21 0, 0.0 2,-1.5 0, 0.0 -1,-0.2 0.476 79.4-148.3 -79.7 158.3 -24.1 -1.8 -1.7 39 40 A Q > - 0 0 10 1,-0.2 3,-1.2 -2,-0.1 6,-0.2 -0.704 17.8-173.4 -90.1 85.7 -20.4 -2.4 -1.5 40 41 A R T 3 + 0 0 74 -2,-1.5 9,-0.2 1,-0.2 -1,-0.2 0.474 68.8 72.9 -69.5 -1.5 -20.7 -5.6 0.6 41 42 A S T 3 S+ 0 0 13 4,-0.2 -1,-0.2 190,-0.1 5,-0.1 0.840 83.0 79.7 -82.6 -31.9 -17.0 -5.9 1.2 42 43 A T S <> S- 0 0 12 -3,-1.2 4,-2.5 189,-0.1 5,-0.2 0.227 97.9 -93.6 -66.9-172.2 -16.6 -3.0 3.7 43 44 A V H > S+ 0 0 112 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.926 131.7 39.0 -72.5 -43.5 -17.4 -2.8 7.4 44 45 A T H > S+ 0 0 19 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.718 114.3 59.8 -76.6 -21.1 -20.8 -1.5 6.7 45 46 A G H > S+ 0 0 0 2,-0.2 4,-3.1 -6,-0.2 -2,-0.2 0.944 101.8 48.4 -67.9 -51.4 -21.0 -3.8 3.8 46 47 A K H X S+ 0 0 133 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.885 113.5 49.4 -62.6 -35.8 -20.6 -7.1 5.7 47 48 A M H X S+ 0 0 64 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.939 109.6 49.9 -66.5 -47.5 -23.2 -5.9 8.1 48 49 A I H X S+ 0 0 2 -4,-2.1 4,-2.2 1,-0.2 5,-0.2 0.911 109.0 54.7 -55.5 -40.3 -25.5 -5.0 5.2 49 50 A D H X S+ 0 0 53 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.927 104.9 51.9 -58.8 -44.9 -24.8 -8.5 3.9 50 51 A D H <>S+ 0 0 38 -4,-2.0 5,-2.7 1,-0.2 6,-0.5 0.883 111.8 48.0 -59.8 -38.3 -25.9 -10.1 7.2 51 52 A Y H ><5S+ 0 0 17 -4,-1.9 3,-1.0 3,-0.2 -1,-0.2 0.879 111.7 46.4 -72.9 -41.1 -29.2 -8.2 7.1 52 53 A L H 3<5S+ 0 0 11 -4,-2.2 90,-1.7 1,-0.2 -1,-0.2 0.819 113.1 50.7 -71.2 -32.9 -30.1 -9.0 3.5 53 54 A T T 3<5S- 0 0 45 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.185 114.1-117.7 -90.2 13.5 -29.3 -12.7 4.0 54 55 A R T < 5S+ 0 0 147 -3,-1.0 -3,-0.2 2,-0.2 -4,-0.1 0.744 82.0 117.3 61.6 28.9 -31.5 -12.9 7.2 55 56 A K S > - 0 0 98 -2,-0.3 4,-2.2 1,-0.1 3,-0.7 -0.331 40.1-120.5 -50.2 146.8 -33.4 -1.2 13.7 60 61 A D H 3> S+ 0 0 91 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.893 121.2 57.4 -56.1 -34.5 -35.0 0.3 10.7 61 62 A H H 3> S+ 0 0 138 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.808 105.3 47.5 -63.5 -32.1 -33.0 3.2 11.9 62 63 A I H <> S+ 0 0 65 -3,-0.7 4,-1.6 2,-0.2 -1,-0.2 0.869 111.0 48.4 -84.0 -34.5 -29.8 1.3 11.8 63 64 A V H X S+ 0 0 2 -4,-2.2 4,-2.1 1,-0.2 5,-0.3 0.930 105.3 58.5 -74.2 -40.8 -30.2 -0.1 8.3 64 65 A N H X S+ 0 0 33 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.892 113.7 39.2 -52.8 -41.4 -31.1 3.2 6.8 65 66 A L H X S+ 0 0 94 -4,-1.0 4,-2.7 2,-0.2 -1,-0.2 0.720 106.9 62.0 -88.0 -20.5 -27.8 4.7 7.9 66 67 A L H X S+ 0 0 16 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.938 108.3 45.6 -61.8 -45.2 -25.7 1.6 7.2 67 68 A F H X S+ 0 0 35 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.901 114.8 47.4 -63.3 -45.9 -26.6 2.0 3.5 68 69 A C H >X S+ 0 0 9 -4,-1.4 4,-2.2 -5,-0.3 3,-1.5 0.984 113.5 45.8 -59.5 -59.6 -26.0 5.7 3.6 69 70 A A H 3X S+ 0 0 42 -4,-2.7 4,-1.8 1,-0.3 -2,-0.2 0.864 106.2 62.8 -53.2 -36.7 -22.6 5.4 5.3 70 71 A N H 3< S+ 0 0 0 -4,-2.3 4,-0.3 -5,-0.2 -1,-0.3 0.847 107.1 44.0 -55.6 -35.4 -21.9 2.6 2.9 71 72 A R H X< S+ 0 0 8 -3,-1.5 3,-2.5 -4,-1.2 4,-0.5 0.959 106.0 59.0 -75.7 -49.5 -22.1 5.2 0.1 72 73 A W H >X S+ 0 0 108 -4,-2.2 3,-1.1 1,-0.3 4,-0.6 0.787 91.0 69.5 -53.1 -33.7 -20.2 8.0 1.8 73 74 A E T 3< S+ 0 0 93 -4,-1.8 4,-0.4 1,-0.2 -1,-0.3 0.864 109.6 38.3 -46.6 -33.9 -17.0 5.8 2.1 74 75 A F T <> S+ 0 0 11 -3,-2.5 4,-3.0 -4,-0.3 -1,-0.2 0.446 85.8 94.1-105.6 -2.7 -16.9 6.1 -1.6 75 76 A A H <> S+ 0 0 13 -3,-1.1 4,-2.0 -4,-0.5 5,-0.2 0.879 90.1 49.6 -58.4 -38.1 -17.9 9.8 -2.1 76 77 A S H X S+ 0 0 76 -4,-0.6 4,-2.7 -3,-0.2 -1,-0.2 0.970 112.0 48.0 -60.2 -53.7 -14.3 10.8 -2.2 77 78 A F H > S+ 0 0 31 -4,-0.4 4,-2.3 2,-0.2 5,-0.2 0.885 110.8 50.9 -54.1 -45.7 -13.4 8.1 -4.7 78 79 A I H X S+ 0 0 2 -4,-3.0 4,-2.4 2,-0.2 5,-0.2 0.991 111.6 46.5 -57.4 -63.4 -16.3 9.0 -7.0 79 80 A Q H X S+ 0 0 62 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.887 112.3 51.5 -39.7 -54.4 -15.4 12.7 -7.0 80 81 A E H X S+ 0 0 99 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.916 110.4 48.0 -56.3 -46.7 -11.7 11.9 -7.7 81 82 A Q H <>S+ 0 0 35 -4,-2.3 5,-2.6 2,-0.2 -1,-0.2 0.939 110.1 50.4 -62.1 -49.0 -12.4 9.6 -10.6 82 83 A L H ><5S+ 0 0 0 -4,-2.4 3,-2.0 1,-0.2 -79,-1.8 0.952 111.8 47.9 -56.8 -50.3 -14.7 12.0 -12.4 83 84 A E H 3<5S+ 0 0 129 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.901 106.4 58.5 -56.1 -40.6 -12.2 14.8 -12.1 84 85 A Q T 3<5S- 0 0 121 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.318 125.5-105.5 -71.6 8.4 -9.5 12.4 -13.4 85 86 A G T < 5S+ 0 0 35 -3,-2.0 2,-0.4 1,-0.3 -3,-0.2 0.501 76.6 137.0 82.3 3.6 -11.7 12.0 -16.5 86 87 A I < - 0 0 35 -5,-2.6 -83,-0.4 -6,-0.2 2,-0.3 -0.698 49.4-134.1 -84.3 133.6 -13.1 8.5 -15.7 87 88 A T E - c 0 32A 4 -56,-2.7 -54,-2.2 -2,-0.4 2,-0.5 -0.682 18.2-137.0 -86.8 139.9 -16.8 7.9 -16.2 88 89 A L E -ac 5 33A 0 -84,-3.0 -82,-3.2 -2,-0.3 2,-0.6 -0.863 14.9-168.5-106.2 127.8 -18.7 6.2 -13.5 89 90 A I E -ac 6 34A 0 -56,-2.5 -54,-3.0 -2,-0.5 2,-0.5 -0.955 19.3-170.0-111.8 112.0 -21.2 3.4 -14.0 90 91 A V E -ac 7 35A 0 -84,-2.9 -82,-3.4 -2,-0.6 2,-0.6 -0.907 21.7-149.1-120.3 117.8 -23.0 2.8 -10.8 91 92 A D E S-ac 8 36A 1 -56,-2.2 -54,-1.7 -2,-0.5 -82,-0.1 -0.737 78.3 -15.2 -79.9 115.5 -25.4 0.0 -9.8 92 93 A R S S+ 0 0 29 -84,-2.5 2,-0.2 -2,-0.6 -83,-0.1 0.536 74.8 167.4 60.0 149.3 -27.9 1.6 -7.3 93 94 A Y >> - 0 0 1 -86,-0.1 4,-1.6 -56,-0.0 3,-0.8 -0.745 54.9 -26.4-160.5-156.9 -27.3 4.9 -5.5 94 95 A A H 3> S+ 0 0 0 1,-0.2 4,-2.2 -2,-0.2 5,-0.2 0.840 130.3 54.8 -36.4 -46.2 -28.9 7.6 -3.3 95 96 A F H 3> S+ 0 0 3 1,-0.3 4,-2.7 2,-0.2 5,-0.4 0.877 99.8 56.8 -68.7 -38.1 -32.3 6.8 -4.8 96 97 A S H <> S+ 0 0 10 -3,-0.8 4,-1.7 2,-0.2 5,-0.3 0.924 110.9 50.0 -52.1 -42.1 -32.1 3.1 -3.9 97 98 A G H X S+ 0 0 11 -4,-1.6 4,-3.0 2,-0.2 5,-0.3 0.978 114.1 38.6 -58.4 -64.0 -31.6 4.5 -0.4 98 99 A V H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.877 117.3 49.3 -59.8 -43.5 -34.6 6.9 -0.2 99 100 A A H X S+ 0 0 0 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.886 117.3 40.0 -68.1 -38.7 -37.0 4.7 -2.1 100 101 A Y H X S+ 0 0 19 -4,-1.7 4,-1.0 -5,-0.4 -2,-0.2 0.890 118.3 46.9 -78.6 -39.9 -36.4 1.6 -0.1 101 102 A A H <>S+ 0 0 8 -4,-3.0 5,-1.8 -5,-0.3 3,-0.5 0.928 115.7 46.5 -63.9 -43.6 -36.1 3.5 3.2 102 103 A A H ><5S+ 0 0 8 -4,-2.9 3,-1.6 -5,-0.3 -2,-0.2 0.818 104.9 59.5 -69.4 -33.6 -39.3 5.5 2.4 103 104 A A H 3<5S+ 0 0 18 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.801 101.3 57.7 -62.6 -30.6 -41.2 2.3 1.3 104 105 A K T 3<5S- 0 0 53 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.114 133.6 -89.4 -85.9 16.7 -40.5 1.1 4.9 105 106 A G T < 5S+ 0 0 72 -3,-1.6 -3,-0.2 1,-0.3 -2,-0.1 0.532 82.1 138.5 91.1 6.1 -42.3 4.1 6.3 106 107 A A < - 0 0 34 -5,-1.8 2,-0.4 -6,-0.1 -1,-0.3 -0.421 63.0 -90.7 -82.1 162.5 -39.5 6.6 6.6 107 108 A S > - 0 0 53 1,-0.1 4,-2.7 -2,-0.1 5,-0.2 -0.615 26.9-149.9 -75.7 124.1 -39.7 10.2 5.8 108 109 A M H > S+ 0 0 23 -2,-0.4 4,-1.5 2,-0.2 -1,-0.1 0.825 98.2 48.0 -60.9 -38.9 -38.8 10.9 2.1 109 110 A T H > S+ 0 0 106 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.850 114.3 47.8 -73.2 -33.4 -37.4 14.4 2.9 110 111 A L H > S+ 0 0 84 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.890 108.4 52.4 -72.1 -41.7 -35.4 13.0 5.8 111 112 A S H X S+ 0 0 5 -4,-2.7 4,-1.0 1,-0.2 3,-0.3 0.913 110.5 51.7 -58.5 -39.1 -34.0 10.1 3.8 112 113 A K H >X S+ 0 0 32 -4,-1.5 4,-1.9 1,-0.2 3,-1.2 0.964 99.5 61.1 -65.7 -52.3 -32.9 12.7 1.3 113 114 A S H 3< S+ 0 0 58 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.827 101.5 54.4 -39.6 -43.6 -31.2 14.9 3.8 114 115 A Y H 3< S+ 0 0 111 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.862 112.8 41.5 -65.9 -36.5 -28.8 12.1 4.6 115 116 A E H X< S+ 0 0 7 -3,-1.2 3,-2.4 -4,-1.0 -1,-0.2 0.711 87.9 119.2 -76.8 -22.3 -27.8 11.7 0.9 116 117 A S T 3< S+ 0 0 41 -4,-1.9 86,-0.2 1,-0.3 87,-0.1 -0.239 71.2 33.6 -54.5 114.6 -27.7 15.4 0.5 117 118 A G T 3 S+ 0 0 24 84,-1.6 -1,-0.3 1,-0.4 3,-0.1 0.019 84.2 123.9 128.0 -27.1 -24.1 16.3 -0.5 118 119 A L S < S- 0 0 2 -3,-2.4 83,-4.2 82,-0.2 -1,-0.4 -0.177 77.9 -74.4 -60.9 157.1 -23.1 13.3 -2.5 119 120 A P E -E 200 0B 11 0, 0.0 81,-0.3 0, 0.0 -1,-0.2 -0.293 54.9-122.1 -46.4 131.0 -21.8 13.6 -6.1 120 121 A K E -E 199 0B 56 79,-3.4 79,-0.6 -3,-0.1 -115,-0.2 -0.739 21.2-123.5 -93.5 125.6 -24.8 14.4 -8.4 121 122 A P - 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