==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 10-FEB-11 3QOQ . COMPND 2 MOLECULE: ALGINATE AND MOTILITY REGULATOR Z; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR E.E.PRYOR JR.,D.J.WOZNIAK,T.HOLLIS . 191 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12137.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 144 75.4 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 . 15 7.9 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 . 10 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 49.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.1 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 0 0 0 0 0 4 0 0 0 2 2 0 0 0 0 0 0 0 0 0 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 10 A T 0 0 185 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -39.5 70.5 -14.8 -19.9 2 11 A Y + 0 0 75 4,-0.0 59,-0.1 3,-0.0 2,-0.1 -0.661 360.0 150.3-126.0 76.1 69.7 -17.4 -22.6 3 12 A S > - 0 0 52 -2,-0.4 4,-1.6 4,-0.0 3,-0.1 -0.153 63.8 -89.7 -88.7-171.2 68.5 -20.6 -21.0 4 13 A S T 4 S+ 0 0 81 1,-0.2 55,-0.1 2,-0.2 -1,-0.0 0.732 128.3 53.8 -76.2 -22.7 66.1 -23.2 -22.4 5 14 A R T 4 S+ 0 0 207 1,-0.2 -1,-0.2 53,-0.0 -3,-0.0 0.709 113.1 44.5 -80.7 -19.5 63.1 -21.3 -20.9 6 15 A T T 4 S+ 0 0 75 -3,-0.1 -2,-0.2 2,-0.1 -1,-0.2 0.779 91.5 111.8 -88.3 -32.1 64.3 -18.2 -22.7 7 16 A A S < S- 0 0 12 -4,-1.6 2,-0.9 1,-0.2 -3,-0.1 0.100 80.9 -93.9 -51.1 154.4 65.1 -19.8 -26.0 8 17 A D E -A 59 0A 46 51,-0.9 51,-1.1 52,-0.1 -1,-0.2 -0.581 41.7-154.6 -78.3 103.0 63.0 -19.1 -29.2 9 18 A K E -A 58 0A 102 -2,-0.9 2,-0.3 49,-0.2 49,-0.2 -0.445 13.7-178.3 -75.2 147.9 60.3 -21.7 -29.6 10 19 A F E -A 57 0A 36 47,-0.6 47,-2.3 -2,-0.1 2,-0.4 -0.870 23.1-134.4-151.6 116.9 58.9 -22.5 -33.0 11 20 A V E -A 56 0A 53 -2,-0.3 2,-0.7 45,-0.3 45,-0.3 -0.559 18.0-159.5 -72.6 120.6 56.1 -25.0 -33.8 12 21 A V E -A 55 0A 2 43,-2.3 43,-1.3 -2,-0.4 2,-1.3 -0.898 9.7-145.8-104.7 109.1 57.0 -27.2 -36.8 13 22 A R E -A 54 0A 126 -2,-0.7 41,-0.2 41,-0.2 40,-0.1 -0.594 24.4-151.5 -77.0 96.8 53.9 -28.7 -38.3 14 23 A L - 0 0 6 39,-1.3 39,-0.2 -2,-1.3 3,-0.1 -0.462 9.3-119.2 -76.7 138.6 55.3 -32.1 -39.4 15 24 A P >> - 0 0 56 0, 0.0 3,-1.7 0, 0.0 4,-0.7 -0.165 58.9 -58.0 -58.0 164.3 53.9 -34.1 -42.4 16 25 A E T 34 S- 0 0 195 1,-0.3 0, 0.0 2,-0.1 0, 0.0 -0.216 118.7 -9.4 -53.4 131.9 52.5 -37.5 -41.8 17 26 A G T 3> S+ 0 0 52 1,-0.2 4,-0.8 -3,-0.1 -1,-0.3 0.521 100.5 110.6 58.7 9.1 54.9 -40.0 -40.1 18 27 A X H <> S+ 0 0 9 -3,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.808 74.8 57.4 -78.4 -32.8 57.9 -37.6 -40.5 19 28 A R H X S+ 0 0 90 -4,-0.7 4,-2.6 2,-0.2 3,-0.3 0.959 105.2 49.3 -57.6 -52.9 57.9 -37.1 -36.8 20 29 A E H > S+ 0 0 87 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.816 108.8 55.8 -56.1 -30.8 58.3 -40.9 -36.3 21 30 A Q H X S+ 0 0 92 -4,-0.8 4,-1.4 2,-0.2 -1,-0.2 0.889 107.7 45.8 -71.7 -41.7 61.1 -40.7 -38.8 22 31 A I H X S+ 0 0 2 -4,-2.1 4,-3.4 -3,-0.3 -2,-0.2 0.936 109.7 57.6 -61.1 -46.8 63.0 -38.0 -36.8 23 32 A A H X S+ 0 0 10 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.915 104.5 49.2 -50.6 -54.2 62.5 -40.1 -33.7 24 33 A E H X S+ 0 0 102 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.883 115.2 45.0 -55.9 -41.7 64.1 -43.2 -35.0 25 34 A V H X S+ 0 0 20 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.933 111.0 53.8 -66.6 -46.3 67.1 -41.1 -36.1 26 35 A A H <>S+ 0 0 5 -4,-3.4 5,-2.1 1,-0.2 4,-0.3 0.910 108.8 48.2 -55.8 -48.7 67.2 -39.2 -32.8 27 36 A R H ><5S+ 0 0 150 -4,-2.7 3,-1.6 1,-0.2 -1,-0.2 0.940 111.6 49.5 -55.4 -52.7 67.4 -42.4 -30.7 28 37 A S H 3<5S+ 0 0 66 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.796 112.5 47.1 -61.7 -32.1 70.2 -43.9 -32.9 29 38 A H T 3<5S- 0 0 56 -4,-2.0 -1,-0.3 2,-0.2 -2,-0.2 0.394 111.3-123.7 -91.6 2.5 72.3 -40.7 -32.6 30 39 A H T < 5 + 0 0 44 -3,-1.6 2,-0.3 -4,-0.3 -3,-0.2 0.843 68.5 117.3 60.1 40.8 71.7 -40.6 -28.9 31 40 A R < - 0 0 35 -5,-2.1 -1,-0.2 -6,-0.1 -2,-0.2 -0.959 68.2 -98.0-135.3 156.6 70.2 -37.1 -28.8 32 41 A S > - 0 0 66 -2,-0.3 4,-2.1 94,-0.2 5,-0.1 -0.134 40.2-109.3 -60.5 163.8 66.9 -35.5 -27.8 33 42 A X H > S+ 0 0 47 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.896 120.1 54.1 -66.8 -38.5 64.5 -34.7 -30.6 34 43 A N H > S+ 0 0 34 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.981 110.5 44.7 -53.8 -60.3 65.1 -31.0 -30.1 35 44 A S H > S+ 0 0 31 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.832 110.5 57.2 -54.3 -36.6 68.9 -31.5 -30.5 36 45 A E H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.983 109.7 42.5 -57.5 -58.9 68.2 -33.7 -33.5 37 46 A I H X S+ 0 0 3 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.925 116.4 49.1 -52.1 -53.4 66.3 -31.0 -35.4 38 47 A I H X S+ 0 0 9 -4,-2.7 4,-3.2 1,-0.2 5,-0.3 0.939 109.0 51.7 -52.1 -55.4 68.8 -28.4 -34.4 39 48 A A H X S+ 0 0 14 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.871 113.5 44.5 -53.0 -42.6 71.8 -30.5 -35.5 40 49 A R H X S+ 0 0 15 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.917 115.3 46.6 -71.5 -45.1 70.3 -31.1 -38.9 41 50 A L H X S+ 0 0 1 -4,-2.7 4,-3.1 2,-0.2 5,-0.2 0.976 111.5 51.8 -57.3 -57.6 69.2 -27.5 -39.5 42 51 A E H X S+ 0 0 77 -4,-3.2 4,-2.1 1,-0.2 -1,-0.2 0.862 113.5 44.6 -45.1 -46.4 72.6 -26.2 -38.4 43 52 A Q H X S+ 0 0 106 -4,-1.7 4,-1.5 -5,-0.3 -1,-0.2 0.901 112.3 50.9 -70.7 -41.7 74.3 -28.5 -40.8 44 53 A S H X S+ 0 0 3 -4,-2.6 4,-1.0 1,-0.2 -2,-0.2 0.875 111.6 49.5 -62.5 -39.7 71.9 -27.7 -43.7 45 54 A L H >X S+ 0 0 17 -4,-3.1 4,-1.1 1,-0.2 3,-0.6 0.938 109.3 50.4 -61.2 -50.1 72.4 -24.0 -43.1 46 55 A L H 3< S+ 0 0 117 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.731 100.9 63.7 -66.4 -24.8 76.2 -24.3 -43.1 47 56 A Q H >< S+ 0 0 82 -4,-1.5 3,-0.7 1,-0.2 -1,-0.2 0.892 106.3 43.9 -64.4 -41.3 76.2 -26.2 -46.4 48 57 A E H << S+ 0 0 116 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.733 109.9 58.2 -73.1 -25.0 74.8 -23.2 -48.2 49 58 A G T 3< 0 0 71 -4,-1.1 -1,-0.2 0, 0.0 -2,-0.2 0.457 360.0 360.0 -86.5 -3.3 77.2 -20.9 -46.4 50 59 A A < 0 0 128 -3,-0.7 -3,-0.1 -4,-0.4 -2,-0.0 0.176 360.0 360.0-129.1 360.0 80.3 -22.6 -47.7 51 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 52 16 B A 0 0 119 0, 0.0 2,-0.1 0, 0.0 -36,-0.1 0.000 360.0 360.0 360.0 134.9 49.0 -33.0 -38.7 53 17 B D - 0 0 72 -39,-0.2 -39,-1.3 -40,-0.1 2,-0.3 -0.351 360.0-151.7 -74.7 156.6 51.1 -33.3 -35.5 54 18 B K E -A 13 0A 114 -41,-0.2 2,-0.4 -2,-0.1 -41,-0.2 -0.876 10.7-154.8-130.8 158.5 53.5 -30.5 -34.5 55 19 B F E -A 12 0A 33 -43,-1.3 -43,-2.3 -2,-0.3 2,-0.5 -0.954 15.3-141.4-138.0 114.3 56.7 -30.2 -32.5 56 20 B V E -A 11 0A 73 -2,-0.4 2,-0.6 -45,-0.3 -45,-0.3 -0.665 22.9-153.0 -78.2 123.4 57.7 -27.0 -30.8 57 21 B V E -A 10 0A 2 -47,-2.3 -47,-0.6 -2,-0.5 2,-0.4 -0.886 9.8-144.1-106.9 114.0 61.4 -26.5 -31.3 58 22 B R E -A 9 0A 103 -2,-0.6 -49,-0.2 -49,-0.2 -20,-0.1 -0.650 30.5-155.5 -67.7 124.9 63.6 -24.6 -28.8 59 23 B L E -A 8 0A 5 -51,-1.1 -51,-0.9 -2,-0.4 -25,-0.0 -0.830 10.1-114.0-113.1 147.0 66.1 -22.9 -31.0 60 24 B P > - 0 0 50 0, 0.0 4,-0.9 0, 0.0 -52,-0.1 -0.148 46.4 -81.9 -71.4 172.6 69.6 -21.5 -30.3 61 25 B E T 4 S+ 0 0 133 1,-0.2 4,-0.3 2,-0.1 3,-0.3 0.857 119.9 31.8 -38.7 -67.3 70.6 -17.9 -30.3 62 26 B G T >> S+ 0 0 48 1,-0.2 4,-1.5 2,-0.1 3,-0.8 0.873 102.2 72.1 -67.8 -44.1 71.2 -17.2 -34.0 63 27 B X H 3> S+ 0 0 15 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.784 80.0 73.7 -48.0 -47.6 68.7 -19.5 -35.8 64 28 B R H 3X S+ 0 0 100 -4,-0.9 4,-0.8 -3,-0.3 -1,-0.2 0.833 113.3 22.9 -34.0 -63.7 65.5 -17.6 -35.0 65 29 B E H X> S+ 0 0 109 -3,-0.8 4,-2.0 -4,-0.3 3,-1.6 0.966 119.7 59.6 -71.5 -55.0 66.1 -14.8 -37.4 66 30 B Q H 3X S+ 0 0 94 -4,-1.5 4,-1.3 1,-0.3 -2,-0.2 0.750 103.0 55.1 -45.8 -31.9 68.5 -16.6 -39.8 67 31 B I H 3X S+ 0 0 4 -4,-3.2 4,-1.1 -5,-0.2 -1,-0.3 0.863 107.7 47.9 -73.1 -36.0 65.8 -19.1 -40.5 68 32 B A H <>S+ 0 0 2 -4,-1.1 5,-1.8 2,-0.2 3,-0.6 0.939 107.0 41.9 -62.7 -50.5 62.5 -18.5 -46.0 72 36 B R H ><5S+ 0 0 132 -4,-2.0 3,-2.1 1,-0.2 -2,-0.2 0.941 112.5 53.8 -62.8 -47.3 61.7 -15.2 -47.8 73 37 B S H 3<5S+ 0 0 78 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.647 113.0 45.6 -63.4 -15.0 64.6 -15.5 -50.2 74 38 B H T <<5S- 0 0 75 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.370 111.6-125.9-104.6 0.1 63.2 -18.9 -51.0 75 39 B H T < 5S+ 0 0 175 -3,-2.1 2,-0.3 -4,-0.2 -3,-0.2 0.934 73.5 102.4 51.6 56.6 59.6 -17.6 -51.3 76 40 B R S - 0 0 68 -2,-0.3 4,-1.8 -3,-0.1 5,-0.1 -0.197 38.8-107.9 -71.5 165.6 57.0 -19.9 -45.1 78 42 B X H >> S+ 0 0 65 1,-0.2 4,-2.7 2,-0.2 3,-0.6 0.954 122.5 49.1 -58.1 -54.5 59.3 -20.7 -42.2 79 43 B N H 3> S+ 0 0 36 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.789 110.2 54.0 -54.3 -30.4 57.6 -24.0 -41.5 80 44 B S H 3> S+ 0 0 48 2,-0.2 4,-1.4 3,-0.1 -1,-0.3 0.844 110.5 46.3 -71.8 -35.6 58.0 -24.7 -45.2 81 45 B E H < S+ 0 0 121 -4,-1.4 3,-1.0 1,-0.2 -1,-0.2 0.826 98.5 61.4 -74.7 -33.7 67.6 -38.1 -47.4 92 56 B Q H >< S+ 0 0 88 -4,-1.8 3,-1.2 -3,-0.3 -1,-0.2 0.817 97.3 61.1 -56.9 -33.2 71.4 -37.7 -46.8 93 57 B E T 3< S+ 0 0 96 -4,-1.0 -1,-0.2 1,-0.3 -2,-0.2 0.756 85.0 76.2 -65.8 -27.6 71.1 -40.6 -44.4 94 58 B G T < 0 0 73 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.450 360.0 360.0 -64.8 -0.4 69.8 -42.9 -47.2 95 59 B A < 0 0 128 -3,-1.2 -3,-0.0 -4,-0.1 0, 0.0 -0.423 360.0 360.0 -69.9 360.0 73.5 -43.1 -48.4 96 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 97 10 C T 0 0 182 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 164.5 61.9 -50.3 -15.1 98 11 C Y + 0 0 75 4,-0.1 58,-0.1 3,-0.0 2,-0.1 -0.740 360.0 151.2-121.0 82.3 65.0 -48.8 -16.6 99 12 C S > - 0 0 54 -2,-0.6 4,-1.2 56,-0.0 3,-0.4 -0.103 63.0 -89.3 -88.4-167.1 65.1 -45.0 -16.6 100 13 C S T 4 S+ 0 0 86 1,-0.2 3,-0.1 2,-0.2 -1,-0.0 0.889 128.5 53.4 -72.5 -41.1 68.1 -42.6 -16.4 101 14 C R T 4 S+ 0 0 202 1,-0.2 -1,-0.2 52,-0.0 -3,-0.0 0.428 113.0 45.7 -75.9 2.9 67.9 -42.5 -12.6 102 15 C T T 4 S+ 0 0 71 -3,-0.4 -1,-0.2 2,-0.1 -2,-0.2 0.674 87.8 117.2-106.1 -31.2 68.0 -46.3 -12.6 103 16 C A S < S- 0 0 10 -4,-1.2 -3,-0.1 1,-0.1 53,-0.0 0.092 76.6 -92.1 -50.1 145.4 70.8 -46.9 -15.2 104 17 C D E -B 154 0B 52 50,-0.7 50,-2.6 49,-0.1 2,-0.5 -0.314 42.2-147.6 -54.6 132.7 74.1 -48.6 -14.3 105 18 C K E -B 153 0B 123 48,-0.2 2,-0.4 -3,-0.1 48,-0.2 -0.935 17.7-179.5-113.1 128.4 76.7 -46.1 -13.2 106 19 C F E -B 152 0B 31 46,-2.3 46,-3.3 -2,-0.5 2,-0.8 -0.995 23.6-137.3-125.1 127.1 80.4 -46.5 -13.8 107 20 C V E -B 151 0B 54 -2,-0.4 2,-0.5 44,-0.3 44,-0.2 -0.748 21.0-156.5 -86.8 108.9 82.9 -43.9 -12.6 108 21 C V E -B 150 0B 2 42,-2.3 42,-1.2 -2,-0.8 2,-0.8 -0.766 7.4-146.3 -89.3 123.1 85.4 -43.4 -15.5 109 22 C R E -B 149 0B 123 -2,-0.5 40,-0.2 40,-0.2 69,-0.1 -0.818 24.5-156.6 -84.5 109.7 88.8 -42.0 -14.5 110 23 C L E -B 148 0B 3 38,-2.7 38,-0.8 -2,-0.8 3,-0.1 -0.666 8.4-122.7 -92.9 145.2 89.8 -39.9 -17.4 111 24 C P > - 0 0 50 0, 0.0 3,-1.0 0, 0.0 4,-0.5 -0.050 58.2 -43.5 -70.4 179.7 93.4 -38.9 -18.4 112 25 C E T 3 S- 0 0 197 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.224 121.4 -14.5 -48.4 118.0 94.8 -35.4 -18.8 113 26 C G T 3> S+ 0 0 32 -3,-0.1 4,-1.8 1,-0.1 -1,-0.2 0.258 94.3 119.0 76.1 -11.9 92.4 -33.1 -20.7 114 27 C X H <> + 0 0 2 -3,-1.0 4,-2.7 1,-0.2 5,-0.2 0.825 69.6 63.5 -52.8 -35.6 90.1 -35.8 -22.1 115 28 C R H > S+ 0 0 79 -4,-0.5 4,-2.7 2,-0.2 -1,-0.2 0.956 106.4 39.2 -55.5 -58.2 87.2 -34.2 -20.2 116 29 C E H > S+ 0 0 105 1,-0.2 4,-2.5 -3,-0.2 -1,-0.2 0.856 114.8 55.9 -62.9 -36.7 87.3 -30.8 -22.0 117 30 C Q H X S+ 0 0 90 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.913 111.0 43.3 -60.3 -45.6 88.0 -32.7 -25.3 118 31 C I H X S+ 0 0 4 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.914 112.9 51.8 -67.7 -44.9 84.9 -34.8 -24.8 119 32 C A H X S+ 0 0 18 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.887 109.1 51.6 -58.9 -41.8 82.7 -31.8 -23.7 120 33 C E H X S+ 0 0 148 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.954 113.1 42.6 -61.0 -52.1 83.8 -29.9 -26.8 121 34 C V H X S+ 0 0 14 -4,-2.0 4,-1.0 2,-0.2 -1,-0.2 0.834 111.3 58.7 -64.7 -30.7 82.9 -32.7 -29.2 122 35 C A H ><>S+ 0 0 2 -4,-2.4 5,-1.4 2,-0.2 3,-0.7 0.953 110.5 40.0 -61.9 -52.4 79.7 -33.2 -27.2 123 36 C R H ><5S+ 0 0 192 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.901 109.8 61.4 -60.6 -42.9 78.5 -29.7 -27.7 124 37 C S H 3<5S+ 0 0 79 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.754 112.9 37.2 -54.3 -26.9 79.7 -29.9 -31.3 125 38 C H T <<5S- 0 0 54 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.303 114.2-113.4-110.3 7.3 77.2 -32.8 -31.8 126 39 C H T < 5S+ 0 0 41 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.987 75.3 121.1 55.0 65.2 74.4 -31.4 -29.6 127 40 C R < - 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