==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER AMINOACYL-TRNA SYNTHASE 06-JUL-92 1TYC . COMPND 2 MOLECULE: TYROSYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR K.A.BROWN,P.BRICK,P.DE MEESTER,D.M.BLOW . 317 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14615.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 218 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.6 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 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 133 42.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 1 0 1 0 2 2 1 1 1 1 2 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 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 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 15 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -84.5 -31.4 20.4 12.7 2 2 A D H > + 0 0 123 2,-0.2 4,-2.2 3,-0.2 5,-0.2 0.897 360.0 51.5 -85.6 -35.4 -33.5 22.2 10.0 3 3 A L H > S+ 0 0 26 1,-0.2 4,-2.3 2,-0.2 3,-0.3 0.974 115.9 42.4 -60.1 -52.1 -30.6 22.6 7.5 4 4 A L H > S+ 0 0 0 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.829 114.1 50.8 -59.7 -37.5 -29.9 18.9 7.9 5 5 A A H X S+ 0 0 41 -4,-1.4 4,-2.3 1,-0.2 -1,-0.3 0.802 110.4 51.5 -69.2 -32.2 -33.6 18.0 7.8 6 6 A E H X S+ 0 0 63 -4,-2.2 4,-2.2 -3,-0.3 -2,-0.2 0.921 108.5 48.8 -72.7 -42.0 -33.9 20.1 4.6 7 7 A L H X>S+ 0 0 1 -4,-2.3 5,-3.0 2,-0.2 4,-1.5 0.875 111.0 52.6 -62.4 -38.3 -31.0 18.4 2.9 8 8 A Q H ><5S+ 0 0 80 -4,-1.8 3,-1.0 -5,-0.2 -2,-0.2 0.979 108.2 49.1 -59.9 -54.8 -32.5 15.1 3.8 9 9 A W H 3<5S+ 0 0 72 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.868 113.4 48.1 -53.4 -42.6 -35.9 16.1 2.3 10 10 A R H 3<5S- 0 0 8 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.738 115.0-118.3 -70.3 -25.1 -34.0 17.2 -0.9 11 11 A G T <<5S+ 0 0 27 -4,-1.5 -3,-0.2 -3,-1.0 -2,-0.1 0.824 73.6 130.3 87.0 38.3 -32.1 13.9 -1.0 12 12 A L < + 0 0 0 -5,-3.0 2,-0.6 207,-0.1 -4,-0.2 0.347 49.0 83.0-102.8 4.4 -28.6 15.5 -0.6 13 13 A V + 0 0 20 -6,-0.4 206,-0.2 -5,-0.2 3,-0.1 -0.942 38.7 159.8-111.5 107.6 -27.4 13.2 2.2 14 14 A N S S- 0 0 77 204,-3.4 2,-0.3 -2,-0.6 205,-0.2 0.868 73.8 -11.4 -87.4 -57.0 -26.0 9.8 1.2 15 15 A Q E -A 218 0A 79 203,-0.9 203,-1.9 3,-0.0 -1,-0.4 -0.962 56.9-163.7-143.1 161.2 -24.1 9.1 4.3 16 16 A T E -A 217 0A 33 -2,-0.3 3,-0.3 201,-0.2 201,-0.2 -0.997 24.8-135.5-151.0 135.2 -23.0 10.8 7.5 17 17 A T S S- 0 0 50 199,-2.4 2,-0.2 -2,-0.3 -1,-0.1 0.905 98.3 -9.2 -60.3 -40.0 -20.4 9.9 10.1 18 18 A D > - 0 0 83 198,-0.3 4,-2.3 1,-0.1 -1,-0.3 -0.728 63.6-169.5-166.1 100.0 -22.8 10.8 13.0 19 19 A E H > S+ 0 0 67 -3,-0.3 4,-2.9 2,-0.2 5,-0.2 0.927 86.9 47.0 -62.1 -48.7 -26.0 12.5 12.2 20 20 A D H > S+ 0 0 71 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.859 114.1 48.2 -64.9 -38.0 -27.1 13.4 15.8 21 21 A G H > S+ 0 0 18 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.891 115.8 44.4 -68.5 -42.4 -23.6 14.8 16.7 22 22 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.856 111.9 51.4 -71.3 -41.3 -23.4 16.8 13.5 23 23 A R H X S+ 0 0 64 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.940 110.5 50.9 -59.3 -49.7 -27.0 18.1 13.8 24 24 A K H X S+ 0 0 116 -4,-2.0 4,-1.4 -5,-0.2 -2,-0.2 0.965 113.8 42.5 -48.6 -61.5 -26.2 19.2 17.3 25 25 A L H X S+ 0 0 11 -4,-2.0 4,-2.2 2,-0.2 3,-0.3 0.883 111.8 53.6 -56.4 -44.6 -23.0 21.1 16.3 26 26 A L H < S+ 0 0 11 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.904 112.2 47.4 -58.1 -41.6 -24.6 22.7 13.2 27 27 A N H < S+ 0 0 102 -4,-2.4 -1,-0.2 -3,-0.2 -2,-0.2 0.708 118.7 38.5 -72.6 -28.6 -27.4 24.0 15.6 28 28 A E H < S+ 0 0 114 -4,-1.4 2,-0.3 -3,-0.3 -2,-0.2 0.582 118.4 25.6-101.2 -16.9 -25.0 25.3 18.2 29 29 A E S < S- 0 0 95 -4,-2.2 2,-0.7 -5,-0.2 -1,-0.1 -0.958 77.5 -99.0-144.6 165.5 -22.1 26.8 16.2 30 30 A R - 0 0 71 -2,-0.3 2,-0.4 33,-0.1 33,-0.1 -0.761 51.2-149.9 -83.8 116.8 -20.9 28.4 12.9 31 31 A V - 0 0 4 -2,-0.7 33,-2.2 -5,-0.1 2,-0.6 -0.825 9.0-143.1 -96.1 134.0 -19.3 25.3 11.4 32 32 A T E +bc 64 186A 15 153,-0.6 155,-2.2 -2,-0.4 156,-1.1 -0.869 31.5 173.5 -93.7 124.1 -16.3 25.6 9.1 33 33 A L E -bc 65 188A 0 31,-2.1 33,-2.0 -2,-0.6 2,-0.3 -0.871 11.7-159.9-128.2 162.1 -16.8 22.9 6.4 34 34 A Y E -bc 66 189A 1 154,-1.3 156,-2.4 -2,-0.3 2,-0.3 -0.932 12.2-166.2-143.9 161.5 -14.8 22.1 3.2 35 35 A C E -b 67 0A 6 31,-1.7 33,-2.6 -2,-0.3 2,-0.3 -0.946 19.0-142.1-143.8 138.2 -15.1 20.4 -0.1 36 36 A G E -b 68 0A 32 154,-0.4 2,-0.4 -2,-0.3 33,-0.2 -0.755 12.5-170.9-103.7 147.4 -12.1 19.6 -2.4 37 37 A F E -b 69 0A 10 31,-3.2 33,-3.3 -2,-0.3 37,-0.1 -0.965 11.0-150.6-139.3 130.6 -12.1 19.7 -6.3 38 38 A D - 0 0 23 -2,-0.4 2,-0.9 31,-0.2 33,-0.1 -0.817 22.7-117.2-100.7 135.7 -9.2 18.4 -8.3 39 39 A P + 0 0 1 0, 0.0 59,-0.1 0, 0.0 3,-0.1 -0.574 52.1 148.4 -75.4 107.4 -8.3 19.9 -11.7 40 40 A T S S+ 0 0 79 -2,-0.9 2,-0.3 1,-0.2 54,-0.0 0.322 75.4 9.8-119.3 -0.6 -8.9 17.0 -14.0 41 41 A A S S- 0 0 17 53,-0.1 -1,-0.2 52,-0.1 60,-0.1 -0.852 88.5 -94.8-165.3 174.2 -9.8 19.4 -16.8 42 42 A D S S+ 0 0 46 -2,-0.3 2,-0.3 -3,-0.1 52,-0.0 0.282 106.6 37.4 -85.3 7.7 -9.8 23.1 -17.5 43 43 A S S S- 0 0 3 57,-0.1 -3,-0.1 198,-0.0 58,-0.1 -0.990 78.4-120.5-155.3 148.5 -13.4 23.4 -16.3 44 44 A L - 0 0 1 -2,-0.3 196,-1.5 56,-0.1 197,-0.4 -0.301 35.1-153.8 -75.5 171.9 -15.7 22.0 -13.7 45 45 A H B > -F 239 0B 55 194,-0.3 3,-2.3 195,-0.1 4,-0.3 -0.848 37.0 -81.4-140.8 178.6 -18.8 20.3 -15.1 46 46 A I T 3 S+ 0 0 5 192,-2.1 3,-0.5 1,-0.3 4,-0.5 0.604 119.6 75.1 -60.3 -12.5 -22.4 19.5 -13.9 47 47 A G T 3 S+ 0 0 43 1,-0.2 -1,-0.3 191,-0.2 3,-0.1 0.676 97.2 47.2 -71.8 -19.8 -20.9 16.6 -12.0 48 48 A H S <> S+ 0 0 34 -3,-2.3 4,-1.8 1,-0.1 -1,-0.2 0.536 88.2 88.9 -95.8 -12.4 -19.6 19.1 -9.5 49 49 A L H > S+ 0 0 0 -3,-0.5 4,-3.0 -4,-0.3 5,-0.3 0.827 81.2 55.4 -61.0 -42.3 -22.8 21.1 -9.1 50 50 A A H > S+ 0 0 7 -4,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.952 112.5 40.5 -56.7 -55.1 -24.4 19.1 -6.2 51 51 A P H > S+ 0 0 14 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.906 118.2 50.2 -59.4 -43.6 -21.5 19.4 -3.8 52 52 A I H X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 3,-0.4 0.947 114.1 41.5 -58.6 -56.3 -20.9 23.1 -4.9 53 53 A L H X S+ 0 0 0 -4,-3.0 4,-1.9 1,-0.3 -1,-0.2 0.828 110.7 59.5 -64.8 -32.8 -24.6 24.2 -4.4 54 54 A T H X S+ 0 0 0 -4,-2.6 4,-1.9 -5,-0.3 -1,-0.3 0.852 102.9 52.1 -65.4 -34.7 -24.6 22.1 -1.2 55 55 A M H X S+ 0 0 0 -4,-1.5 4,-3.0 -3,-0.4 -2,-0.2 0.923 108.8 51.0 -59.1 -48.0 -21.8 24.3 0.1 56 56 A R H X S+ 0 0 71 -4,-1.6 4,-2.6 2,-0.3 -2,-0.2 0.879 106.4 52.9 -54.6 -45.9 -23.8 27.3 -0.7 57 57 A R H X S+ 0 0 7 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.886 109.5 49.9 -63.1 -41.3 -26.8 25.9 1.2 58 58 A F H <>S+ 0 0 0 -4,-1.9 5,-1.9 1,-0.2 3,-0.4 0.943 110.7 50.3 -65.6 -43.8 -24.5 25.5 4.2 59 59 A Q H ><5S+ 0 0 13 -4,-3.0 3,-2.0 1,-0.2 -2,-0.2 0.900 106.9 53.1 -60.5 -43.8 -23.3 29.1 3.7 60 60 A Q H 3<5S+ 0 0 122 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.785 103.9 57.4 -59.5 -30.4 -27.0 30.5 3.6 61 61 A A T 3<5S- 0 0 53 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.280 131.3 -96.2 -84.1 7.1 -27.7 28.7 6.9 62 62 A G T < 5S+ 0 0 34 -3,-2.0 -3,-0.2 1,-0.3 2,-0.2 0.559 82.1 128.5 89.5 15.1 -24.8 30.7 8.4 63 63 A H < - 0 0 10 -5,-1.9 -1,-0.3 -33,-0.1 -31,-0.2 -0.588 58.3-113.2-101.3 159.9 -21.8 28.3 8.1 64 64 A R E -b 32 0A 41 -33,-2.2 -31,-2.1 -2,-0.2 2,-0.4 -0.847 27.6-154.9-103.9 115.2 -18.5 29.0 6.6 65 65 A P E -b 33 0A 0 0, 0.0 54,-1.5 0, 0.0 2,-0.5 -0.663 7.7-164.4 -91.7 137.6 -17.4 27.2 3.5 66 66 A I E -bd 34 119A 0 -33,-2.0 -31,-1.7 -2,-0.4 2,-0.6 -0.973 7.8-157.7-117.7 120.4 -13.9 26.5 2.3 67 67 A A E -bd 35 120A 0 52,-2.4 54,-3.0 -2,-0.5 2,-0.6 -0.915 13.7-154.2 -96.6 118.1 -13.6 25.4 -1.4 68 68 A L E -bd 36 121A 4 -33,-2.6 -31,-3.2 -2,-0.6 2,-0.6 -0.900 4.6-151.2-106.0 119.7 -10.3 23.5 -1.8 69 69 A V E -bd 37 122A 3 52,-4.1 2,-2.1 -2,-0.6 54,-1.6 -0.786 19.7-131.4 -87.4 123.5 -8.6 23.4 -5.2 70 70 A G > + 0 0 0 -33,-3.3 4,-2.2 -2,-0.6 5,-0.2 -0.327 49.2 149.0 -76.0 58.1 -6.6 20.2 -5.6 71 71 A G T 4 S+ 0 0 5 -2,-2.1 -1,-0.2 2,-0.2 27,-0.1 0.873 79.9 31.9 -58.9 -43.0 -3.3 21.7 -6.8 72 72 A A T >4 S+ 0 0 7 -3,-0.3 3,-1.9 2,-0.1 4,-0.2 0.940 122.6 44.9 -78.8 -60.2 -1.3 18.9 -5.1 73 73 A T G >> S+ 0 0 1 1,-0.3 4,-2.8 2,-0.2 3,-2.0 0.793 100.6 67.3 -59.0 -28.1 -3.7 15.9 -5.4 74 74 A G G 3< S+ 0 0 9 -4,-2.2 15,-0.5 1,-0.3 -1,-0.3 0.637 97.8 58.7 -68.1 -12.6 -4.6 16.7 -9.1 75 75 A L G <4 S+ 0 0 41 -3,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.423 115.5 31.8 -91.9 -5.8 -0.9 15.7 -9.6 76 76 A I T <4 S- 0 0 50 -3,-2.0 -2,-0.2 -4,-0.2 -3,-0.1 0.719 101.9-137.3-115.0 -54.5 -1.5 12.2 -8.0 77 77 A G < - 0 0 15 -4,-2.8 92,-0.2 92,-0.1 -3,-0.1 0.576 8.1-108.9 88.9 126.9 -5.1 11.4 -9.0 78 78 A D - 0 0 10 1,-0.1 89,-0.1 91,-0.1 88,-0.1 -0.699 13.0-158.8 -83.0 121.3 -8.0 9.8 -7.0 79 79 A P > + 0 0 4 0, 0.0 3,-2.4 0, 0.0 -1,-0.1 0.660 55.1 124.8 -72.0 -16.8 -9.0 6.2 -7.9 80 80 A S T 3 S- 0 0 3 1,-0.3 3,-0.1 3,-0.0 114,-0.1 -0.220 85.5 -2.0 -51.5 123.3 -12.4 6.9 -6.3 81 81 A G T 3 S+ 0 0 67 1,-0.2 2,-0.4 113,-0.1 -1,-0.3 0.615 108.9 112.8 69.3 13.4 -15.2 6.2 -8.7 82 82 A K < - 0 0 47 -3,-2.4 -1,-0.2 1,-0.1 4,-0.1 -0.959 52.4-162.7-116.1 130.3 -12.8 5.4 -11.5 83 83 A K S S+ 0 0 183 -2,-0.4 2,-0.3 -3,-0.1 -1,-0.1 0.639 76.0 49.8 -86.3 -18.8 -12.6 1.9 -12.8 84 84 A S S S- 0 0 75 -5,-0.1 -1,-0.1 78,-0.0 78,-0.1 -0.938 89.6-103.2-128.5 149.1 -9.2 2.5 -14.4 85 85 A E - 0 0 80 -2,-0.3 2,-0.2 76,-0.2 -2,-0.1 -0.346 44.6-138.1 -61.9 141.1 -5.9 4.0 -13.5 86 86 A R - 0 0 133 -9,-0.1 2,-0.3 -4,-0.1 80,-0.1 -0.664 15.2-102.7-105.3 163.1 -5.6 7.5 -14.9 87 87 A T - 0 0 122 -2,-0.2 2,-0.3 1,-0.1 -1,-0.0 -0.624 38.6-110.0 -87.0 145.6 -2.6 9.1 -16.7 88 88 A L - 0 0 111 -2,-0.3 2,-0.2 -11,-0.0 -13,-0.1 -0.634 29.6-142.8 -75.3 131.5 -0.6 11.6 -14.7 89 89 A N - 0 0 61 -15,-0.5 2,-0.1 -2,-0.3 -3,-0.0 -0.590 26.2-101.7 -93.4 158.7 -1.1 15.2 -15.9 90 90 A A > - 0 0 55 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.455 24.0-115.3 -79.4 157.8 1.9 17.6 -15.9 91 91 A K H > S+ 0 0 74 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.794 117.2 52.7 -56.2 -41.6 2.5 20.2 -13.2 92 92 A E H > S+ 0 0 69 2,-0.2 4,-2.1 3,-0.2 -1,-0.2 0.890 110.4 46.8 -63.8 -45.7 2.0 22.9 -15.9 93 93 A T H > S+ 0 0 53 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.982 116.8 42.4 -60.0 -57.2 -1.3 21.5 -17.0 94 94 A V H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.890 112.5 54.1 -56.9 -45.2 -2.6 21.1 -13.5 95 95 A E H X S+ 0 0 135 -4,-2.8 4,-0.9 1,-0.2 -1,-0.2 0.898 111.7 45.4 -57.6 -43.3 -1.3 24.5 -12.4 96 96 A A H X S+ 0 0 56 -4,-2.1 4,-0.9 -3,-0.3 -1,-0.2 0.845 113.5 48.9 -68.5 -41.1 -3.1 26.2 -15.4 97 97 A W H X S+ 0 0 56 -4,-2.3 4,-2.0 1,-0.2 3,-0.3 0.820 103.1 60.9 -70.7 -35.4 -6.3 24.3 -14.7 98 98 A S H X S+ 0 0 8 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.824 100.6 56.0 -60.0 -35.7 -6.3 25.1 -11.0 99 99 A A H X S+ 0 0 66 -4,-0.9 4,-1.0 -5,-0.2 -1,-0.2 0.868 110.8 42.7 -64.0 -41.3 -6.5 28.9 -11.9 100 100 A R H X S+ 0 0 92 -4,-0.9 4,-2.0 -3,-0.3 3,-0.3 0.932 113.0 51.3 -70.3 -49.8 -9.6 28.5 -13.9 101 101 A I H X S+ 0 0 2 -4,-2.0 4,-2.8 1,-0.3 -2,-0.2 0.885 105.5 57.4 -55.6 -43.8 -11.4 26.1 -11.5 102 102 A K H X S+ 0 0 118 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.3 0.915 107.1 50.0 -56.0 -45.4 -10.6 28.6 -8.7 103 103 A E H < S+ 0 0 67 -4,-1.0 4,-0.5 -3,-0.3 -2,-0.3 0.903 111.6 44.8 -64.7 -49.9 -12.6 31.2 -10.9 104 104 A Q H >< S+ 0 0 6 -4,-2.0 3,-0.8 1,-0.2 4,-0.5 0.807 110.3 56.5 -65.1 -33.9 -15.7 29.0 -11.4 105 105 A L H >< S+ 0 0 2 -4,-2.8 3,-1.9 1,-0.2 4,-0.4 0.972 99.4 59.8 -60.7 -52.8 -15.7 28.0 -7.8 106 106 A G G >< S+ 0 0 22 -4,-2.0 3,-0.5 1,-0.3 -1,-0.2 0.583 91.4 69.5 -46.5 -23.8 -15.9 31.6 -6.6 107 107 A R G < S+ 0 0 99 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.784 98.8 48.7 -65.4 -38.2 -19.2 32.3 -8.5 108 108 A F G < S+ 0 0 2 -3,-1.9 2,-0.3 -4,-0.5 -1,-0.2 0.509 105.3 67.9 -83.3 -13.3 -21.2 30.0 -6.2 109 109 A L S < S- 0 0 14 -3,-0.5 2,-0.6 -4,-0.4 -53,-0.0 -0.803 75.5-116.2-117.8 160.3 -20.0 31.4 -2.8 110 110 A D + 0 0 67 -2,-0.3 8,-2.8 6,-0.2 -3,-0.1 -0.769 28.0 167.1-101.5 122.5 -20.1 34.6 -0.8 111 111 A F S S+ 0 0 101 -2,-0.6 -1,-0.1 6,-0.3 -5,-0.0 0.585 74.1 62.8-101.7 -15.6 -17.0 36.6 -0.0 112 112 A E S S+ 0 0 89 4,-0.1 -1,-0.1 2,-0.1 -2,-0.0 0.674 74.6 104.3 -86.2 -25.8 -18.8 39.7 1.3 113 113 A A - 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