==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 12-FEB-10 3LSR . COMPND 2 MOLECULE: DEST; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR D.J.MILLER,S.W.WHITE . 192 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10624.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 150 78.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 0 1 0 0 0 0 1 1 0 2 0 0 0 0 0 0 1 1 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 4 A P 0 0 150 0, 0.0 3,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-167.5 -8.1 19.3 21.3 2 5 A R + 0 0 210 1,-0.2 4,-0.1 2,-0.1 0, 0.0 -0.399 360.0 93.7-100.9 47.9 -11.3 18.7 23.3 3 6 A A > + 0 0 50 2,-0.1 4,-1.1 3,-0.1 -1,-0.2 -0.026 66.0 84.2-102.2 8.8 -12.2 22.3 22.8 4 7 A E H > S+ 0 0 46 -3,-0.4 4,-1.7 2,-0.2 -2,-0.1 0.710 84.6 55.0 -72.3 -28.0 -14.0 20.4 20.0 5 8 A Q H > S+ 0 0 130 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.853 101.7 55.2 -73.5 -34.9 -16.6 20.0 22.7 6 9 A K H > S+ 0 0 120 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.914 110.0 47.2 -59.8 -41.9 -16.7 23.7 23.2 7 10 A Q H X S+ 0 0 133 -4,-1.1 4,-2.1 1,-0.2 -2,-0.2 0.876 107.6 55.7 -66.8 -37.9 -17.5 24.0 19.5 8 11 A Q H X S+ 0 0 58 -4,-1.7 4,-1.0 1,-0.2 -1,-0.2 0.849 108.8 47.8 -64.7 -34.2 -20.1 21.3 19.8 9 12 A T H X S+ 0 0 47 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.854 108.5 54.0 -73.2 -36.1 -21.9 23.3 22.5 10 13 A R H X S+ 0 0 98 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.861 108.7 49.6 -64.2 -37.2 -21.6 26.5 20.4 11 14 A H H X S+ 0 0 102 -4,-2.1 4,-3.3 2,-0.2 5,-0.2 0.803 107.4 56.1 -71.4 -28.1 -23.3 24.6 17.6 12 15 A A H X S+ 0 0 32 -4,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.909 107.7 46.1 -69.6 -42.7 -26.0 23.4 20.0 13 16 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.947 117.4 45.9 -63.4 -46.3 -26.9 27.0 21.0 14 17 A M H X S+ 0 0 16 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.962 116.0 42.3 -61.6 -55.9 -26.9 27.9 17.4 15 18 A S H X S+ 0 0 26 -4,-3.3 4,-2.4 1,-0.2 -1,-0.2 0.860 113.8 56.6 -59.4 -34.8 -28.9 25.0 16.2 16 19 A A H X S+ 0 0 14 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.903 107.6 45.6 -64.0 -45.1 -31.2 25.4 19.3 17 20 A A H < S+ 0 0 0 -4,-2.5 4,-0.4 2,-0.2 -2,-0.2 0.938 114.2 48.1 -63.1 -50.5 -32.0 29.1 18.4 18 21 A R H >X S+ 0 0 11 -4,-2.3 3,-1.6 1,-0.2 4,-0.5 0.941 114.3 46.8 -51.4 -51.5 -32.8 28.3 14.7 19 22 A H H >< S+ 0 0 82 -4,-2.4 3,-1.3 1,-0.3 -1,-0.2 0.866 103.2 61.0 -66.4 -36.0 -34.9 25.3 15.7 20 23 A L T 3< S+ 0 0 46 -4,-2.1 3,-0.3 1,-0.2 -1,-0.3 0.588 102.0 57.7 -61.6 -10.2 -36.8 27.3 18.3 21 24 A M T X4 S+ 0 0 0 -3,-1.6 3,-1.9 -4,-0.4 -1,-0.2 0.673 75.1 91.2 -93.2 -22.5 -37.9 29.5 15.5 22 25 A E T << S+ 0 0 72 -3,-1.3 -1,-0.2 -4,-0.5 -2,-0.1 0.443 78.5 68.5 -58.5 4.1 -39.5 26.8 13.3 23 26 A S T 3 S- 0 0 89 -3,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.139 125.6 -90.2-111.5 19.7 -42.8 27.7 15.1 24 27 A G S < S+ 0 0 54 -3,-1.9 -2,-0.1 1,-0.3 2,-0.1 0.211 87.2 129.0 96.6 -15.6 -43.3 31.2 13.7 25 28 A R - 0 0 84 -5,-0.3 -1,-0.3 -4,-0.2 2,-0.2 -0.421 52.9-125.4 -75.3 148.6 -41.3 33.0 16.4 26 29 A G >> - 0 0 22 -2,-0.1 3,-2.1 -3,-0.1 4,-0.5 -0.639 18.3-114.9-100.1 154.3 -38.6 35.5 15.6 27 30 A F G >4 S+ 0 0 8 1,-0.3 3,-0.9 -2,-0.2 -1,-0.1 0.777 113.1 60.0 -55.6 -31.7 -35.0 35.6 16.8 28 31 A G G 34 S+ 0 0 75 1,-0.2 -1,-0.3 85,-0.1 25,-0.0 0.752 102.1 54.6 -69.2 -23.1 -35.5 38.9 18.7 29 32 A S G <4 S+ 0 0 68 -3,-2.1 2,-0.3 2,-0.1 -1,-0.2 0.577 84.4 102.7 -87.5 -11.1 -38.2 37.2 20.8 30 33 A L << - 0 0 9 -3,-0.9 2,-0.3 -4,-0.5 23,-0.1 -0.576 65.3-138.6 -77.1 131.9 -36.0 34.3 22.0 31 34 A S > - 0 0 50 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.647 15.4-126.0 -87.0 148.4 -34.6 34.6 25.5 32 35 A L H > S+ 0 0 31 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.857 111.9 56.1 -51.0 -39.6 -31.1 33.6 26.4 33 36 A R H > S+ 0 0 155 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.913 106.5 45.7 -66.9 -42.8 -32.6 31.3 29.0 34 37 A E H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.899 112.3 51.7 -72.4 -32.7 -34.8 29.4 26.7 35 38 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.945 112.9 44.6 -66.1 -49.8 -32.0 28.9 24.2 36 39 A T H X>S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-2.0 0.930 112.9 53.1 -57.5 -44.5 -29.7 27.6 26.9 37 40 A R H <5S+ 0 0 169 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.924 112.6 44.2 -54.6 -46.1 -32.6 25.4 28.2 38 41 A A H <5S+ 0 0 60 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.843 117.0 45.2 -69.1 -35.3 -33.0 24.0 24.7 39 42 A A H <5S- 0 0 27 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.660 115.1-109.6 -87.5 -19.5 -29.3 23.5 24.1 40 43 A G T <5S+ 0 0 63 -4,-2.4 2,-0.3 1,-0.4 -3,-0.2 0.828 75.2 112.5 96.8 34.0 -28.5 21.9 27.5 41 44 A I S - 0 0 108 -2,-0.3 3,-2.5 1,-0.1 4,-0.2 -0.561 47.4 -99.9 -81.0 147.5 -27.3 26.4 32.5 43 46 A P G > S+ 0 0 41 0, 0.0 3,-2.3 0, 0.0 4,-0.3 0.821 119.5 53.4 -42.5 -52.2 -28.0 30.1 31.6 44 47 A A G > S+ 0 0 68 1,-0.3 3,-1.0 2,-0.2 4,-0.1 0.664 94.2 74.4 -62.2 -14.0 -24.6 31.6 32.6 45 48 A G G X S+ 0 0 19 -3,-2.5 3,-0.7 1,-0.2 -1,-0.3 0.500 76.9 76.5 -77.2 -7.4 -22.9 29.1 30.4 46 49 A F G X> S+ 0 0 0 -3,-2.3 4,-2.4 -4,-0.2 3,-2.0 0.832 83.9 66.8 -62.1 -35.7 -24.1 31.0 27.3 47 50 A Y G <4 S+ 0 0 134 -3,-1.0 -1,-0.2 -4,-0.3 -2,-0.2 0.553 86.2 65.4 -74.9 -9.5 -21.3 33.5 28.1 48 51 A R G <4 S+ 0 0 196 -3,-0.7 -1,-0.3 -4,-0.1 -2,-0.1 0.580 116.9 29.3 -79.8 -11.7 -18.5 31.1 27.3 49 52 A H T <4 S+ 0 0 28 -3,-2.0 2,-0.3 1,-0.4 -2,-0.2 0.760 131.2 10.5-116.0 -41.5 -19.8 31.1 23.7 50 53 A F < - 0 0 13 -4,-2.4 -1,-0.4 1,-0.1 3,-0.1 -0.992 56.7-135.3-142.6 148.5 -21.3 34.6 23.1 51 54 A S S S- 0 0 82 -2,-0.3 2,-0.3 1,-0.2 -4,-0.1 0.791 87.6 -21.5 -72.0 -27.1 -21.4 37.9 25.0 52 55 A D S > S- 0 0 67 -6,-0.1 4,-1.3 1,-0.1 3,-0.4 -0.956 76.8 -81.3-167.3 178.0 -25.2 38.2 24.3 53 56 A M H > S+ 0 0 30 -2,-0.3 4,-2.9 1,-0.2 5,-0.1 0.850 119.9 61.0 -64.0 -37.2 -28.0 37.1 22.0 54 57 A D H > S+ 0 0 48 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.887 102.9 52.3 -53.8 -42.2 -27.2 39.6 19.3 55 58 A Q H > S+ 0 0 86 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.882 107.7 50.1 -68.8 -38.7 -23.8 38.0 18.9 56 59 A L H X S+ 0 0 0 -4,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.947 108.9 53.7 -59.4 -49.5 -25.5 34.6 18.5 57 60 A G H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 3,-0.4 0.917 107.6 50.9 -47.5 -47.7 -27.7 36.2 15.9 58 61 A L H X S+ 0 0 50 -4,-2.5 4,-2.1 1,-0.3 -1,-0.2 0.913 108.0 51.3 -61.6 -44.3 -24.6 37.4 14.0 59 62 A A H X S+ 0 0 17 -4,-2.1 4,-1.8 1,-0.2 -1,-0.3 0.778 106.3 56.0 -61.4 -28.5 -23.1 34.0 14.1 60 63 A L H X S+ 0 0 1 -4,-1.8 4,-2.2 -3,-0.4 -1,-0.2 0.880 105.7 50.9 -73.2 -35.9 -26.3 32.6 12.6 61 64 A V H X S+ 0 0 5 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.945 110.9 48.4 -61.4 -48.7 -26.1 35.1 9.6 62 65 A A H X S+ 0 0 59 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.878 110.2 52.8 -59.7 -38.7 -22.5 33.9 9.0 63 66 A E H X S+ 0 0 35 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.960 114.4 39.9 -64.3 -48.6 -23.6 30.3 9.1 64 67 A V H X S+ 0 0 0 -4,-2.2 4,-3.5 2,-0.2 5,-0.2 0.857 111.4 58.2 -69.6 -35.9 -26.3 30.7 6.6 65 68 A D H X S+ 0 0 20 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.962 106.8 48.8 -54.2 -55.0 -24.2 33.0 4.4 66 69 A E H X S+ 0 0 154 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.868 115.4 43.7 -53.2 -40.7 -21.6 30.3 4.1 67 70 A T H X S+ 0 0 26 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.885 113.2 51.0 -73.6 -39.8 -24.4 27.7 3.2 68 71 A F H X S+ 0 0 3 -4,-3.5 4,-2.1 1,-0.2 -2,-0.2 0.913 110.8 48.8 -64.0 -42.1 -26.1 30.1 0.8 69 72 A R H X S+ 0 0 74 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.826 107.1 55.3 -71.1 -33.1 -22.8 30.9 -1.0 70 73 A A H X S+ 0 0 39 -4,-1.4 4,-1.6 -5,-0.3 -1,-0.2 0.881 109.3 48.0 -65.4 -38.1 -22.0 27.2 -1.3 71 74 A T H X S+ 0 0 10 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.926 111.2 49.3 -64.8 -46.5 -25.3 26.6 -3.1 72 75 A L H X S+ 0 0 38 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.847 107.4 55.1 -66.4 -35.7 -24.8 29.6 -5.4 73 76 A R H X S+ 0 0 121 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.882 108.1 49.6 -59.5 -39.9 -21.3 28.3 -6.3 74 77 A A H X S+ 0 0 20 -4,-1.6 4,-0.7 2,-0.2 -2,-0.2 0.929 112.7 46.3 -63.8 -42.5 -23.0 25.0 -7.2 75 78 A V H >< S+ 0 0 30 -4,-2.3 3,-0.8 1,-0.2 4,-0.4 0.870 110.8 54.1 -63.3 -35.6 -25.5 26.9 -9.4 76 79 A R H >< S+ 0 0 59 -4,-2.5 3,-0.9 1,-0.2 4,-0.2 0.840 100.6 60.0 -69.3 -33.4 -22.5 28.9 -10.8 77 80 A R H 3< S+ 0 0 164 -4,-1.8 3,-0.3 1,-0.2 -1,-0.2 0.728 106.4 48.0 -66.3 -23.4 -20.9 25.6 -11.8 78 81 A N T X< S+ 0 0 38 -3,-0.8 3,-0.8 -4,-0.7 -1,-0.2 0.467 89.7 81.0 -94.4 -5.9 -23.9 24.8 -14.0 79 82 A E T < S+ 0 0 37 -3,-0.9 -1,-0.2 -4,-0.4 -2,-0.1 0.553 80.9 65.6 -82.2 -7.4 -24.2 28.1 -15.9 80 83 A F T 3 S+ 0 0 128 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.590 88.6 82.5 -90.3 -11.8 -21.4 27.3 -18.3 81 84 A E S < S- 0 0 116 -3,-0.8 2,-0.4 -4,-0.1 4,-0.1 -0.180 85.6-108.2 -76.7 179.8 -23.4 24.5 -19.9 82 85 A L + 0 0 99 1,-0.1 -2,-0.1 2,-0.1 -1,-0.1 -0.949 69.5 2.1-119.9 136.1 -26.1 25.2 -22.5 83 86 A G S S+ 0 0 61 -2,-0.4 -1,-0.1 1,-0.1 -2,-0.0 0.451 106.0 46.5 75.1 145.6 -29.9 24.9 -22.1 84 87 A G > + 0 0 47 1,-0.1 4,-2.2 3,-0.1 5,-0.3 0.669 64.8 144.1 66.0 17.1 -32.0 24.1 -19.1 85 88 A L H > + 0 0 73 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.903 69.0 46.5 -52.9 -46.1 -30.0 26.5 -17.0 86 89 A I H > S+ 0 0 29 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.978 112.8 46.2 -64.3 -58.8 -33.0 27.7 -15.0 87 90 A D H > S+ 0 0 78 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.874 113.4 49.7 -50.8 -46.8 -34.6 24.3 -14.2 88 91 A A H X S+ 0 0 22 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.924 114.4 43.7 -61.1 -45.9 -31.2 22.7 -13.2 89 92 A S H X S+ 0 0 28 -4,-1.9 4,-3.1 -5,-0.3 -2,-0.2 0.855 108.4 56.3 -74.3 -33.5 -30.3 25.6 -10.8 90 93 A V H X S+ 0 0 10 -4,-2.8 4,-2.8 2,-0.2 -1,-0.2 0.884 110.7 48.3 -59.5 -36.2 -33.8 25.8 -9.3 91 94 A R H X S+ 0 0 129 -4,-1.5 4,-2.1 -5,-0.3 -2,-0.2 0.918 110.6 47.9 -71.1 -45.7 -33.3 22.1 -8.5 92 95 A I H X S+ 0 0 29 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.933 115.6 47.4 -58.0 -46.3 -29.8 22.7 -7.0 93 96 A F H X S+ 0 0 26 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.948 110.2 49.6 -61.5 -53.1 -31.2 25.5 -5.0 94 97 A L H X S+ 0 0 36 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.820 109.8 53.1 -60.1 -32.1 -34.3 23.7 -3.7 95 98 A D H X S+ 0 0 100 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.949 108.0 49.6 -66.0 -46.1 -32.1 20.8 -2.6 96 99 A A H < S+ 0 0 15 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.882 112.3 47.7 -62.3 -39.2 -29.8 23.1 -0.6 97 100 A V H >< S+ 0 0 3 -4,-2.3 3,-1.8 2,-0.2 -1,-0.2 0.956 111.9 50.8 -62.2 -49.9 -32.8 24.7 1.1 98 101 A G H >< S+ 0 0 52 -4,-2.4 3,-1.0 1,-0.3 -2,-0.2 0.923 110.3 49.5 -50.2 -48.4 -34.3 21.2 1.8 99 102 A A T 3< S+ 0 0 78 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.495 124.0 30.2 -72.5 -6.7 -31.0 20.1 3.3 100 103 A N T X> S+ 0 0 50 -3,-1.8 4,-1.7 -4,-0.4 3,-0.8 -0.126 70.4 153.2-147.4 38.9 -30.8 23.2 5.5 101 104 A R H <> S+ 0 0 92 -3,-1.0 4,-2.3 1,-0.2 5,-0.1 0.844 73.1 48.8 -41.2 -56.0 -34.3 24.2 6.3 102 105 A S H 3> S+ 0 0 11 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.836 108.6 53.6 -65.8 -31.6 -33.7 25.9 9.7 103 106 A Q H <> S+ 0 0 20 -3,-0.8 4,-2.2 2,-0.2 -1,-0.2 0.970 114.4 40.5 -63.0 -52.7 -30.8 28.0 8.4 104 107 A F H X S+ 0 0 0 -4,-1.7 4,-3.1 1,-0.2 -2,-0.2 0.796 111.5 59.4 -66.6 -27.3 -32.8 29.4 5.5 105 108 A L H X S+ 0 0 6 -4,-2.3 4,-2.8 -5,-0.3 5,-0.3 0.961 105.8 47.5 -61.8 -49.3 -35.7 29.7 7.9 106 109 A F H X S+ 0 0 1 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.944 115.3 45.8 -55.9 -50.1 -33.6 32.0 10.1 107 110 A L H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.907 113.7 47.3 -59.5 -48.0 -32.6 34.0 7.0 108 111 A A H < S+ 0 0 11 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.897 117.1 43.8 -62.6 -39.8 -36.1 34.2 5.6 109 112 A R H X S+ 0 0 69 -4,-2.8 4,-0.6 -5,-0.2 3,-0.4 0.840 122.0 36.6 -76.1 -35.3 -37.5 35.2 9.0 110 113 A E H X S+ 0 0 4 -4,-2.6 4,-1.1 -5,-0.3 -1,-0.2 0.531 82.0 105.2 -94.7 -8.9 -34.8 37.8 9.9 111 114 A Q H < S- 0 0 55 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.1 0.690 111.2 -3.2 -50.8 -22.9 -34.2 39.2 6.4 112 115 A Y H 4 S+ 0 0 75 -3,-0.4 -1,-0.2 -4,-0.2 -2,-0.2 0.499 128.2 66.5-134.2 -24.1 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