==== 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 TRANSCRIPTION REGULATOR 26-JUL-07 2QQ9 . COMPND 2 MOLECULE: DIPHTHERIA TOXIN REPRESSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM DIPHTHERIAE; . AUTHOR J.A.D'AQUINO,J.R.LATTIMER,A.DENNINGER,K.E.D'AQUINO,D.RINGE . 212 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12525.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 150 70.8 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 . 28 13.2 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 . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 9 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 40.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.8 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 1 0 2 0 1 1 0 1 0 0 0 0 1 0 0 0 0 1 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 . 3 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 3 A D > 0 0 177 0, 0.0 4,-1.6 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -52.5 -10.1 16.4 15.5 2 4 A L H > + 0 0 123 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.766 360.0 52.9 -68.3 -41.1 -11.6 14.6 12.5 3 5 A V H > S+ 0 0 105 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.941 111.1 45.6 -61.9 -50.6 -14.8 16.6 11.8 4 6 A A H > S+ 0 0 40 -3,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.845 112.7 53.1 -59.8 -39.8 -13.2 20.1 11.7 5 7 A T H X S+ 0 0 44 -4,-1.6 4,-2.5 2,-0.2 3,-0.2 0.954 109.2 47.2 -60.1 -55.7 -10.4 18.7 9.5 6 8 A T H X S+ 0 0 22 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.954 112.4 50.6 -51.4 -51.9 -12.9 17.2 7.0 7 9 A E H X S+ 0 0 25 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.862 109.0 51.6 -56.5 -35.2 -14.8 20.5 6.9 8 10 A M H X S+ 0 0 30 -4,-1.6 4,-2.7 -3,-0.2 -1,-0.2 0.949 109.7 48.6 -71.5 -43.9 -11.6 22.4 6.2 9 11 A Y H X S+ 0 0 5 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.944 114.8 47.4 -56.9 -47.3 -10.7 20.1 3.3 10 12 A L H X S+ 0 0 0 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.929 111.9 47.0 -60.9 -48.2 -14.2 20.6 2.0 11 13 A R H X S+ 0 0 6 -4,-2.9 4,-3.2 -5,-0.2 -1,-0.2 0.922 112.0 53.2 -64.5 -38.0 -14.3 24.4 2.4 12 14 A T H X S+ 0 0 1 -4,-2.7 4,-2.6 -5,-0.2 -2,-0.2 0.939 109.6 46.1 -61.0 -49.1 -10.8 24.5 0.7 13 15 A I H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.952 113.3 51.1 -55.8 -46.9 -12.1 22.5 -2.4 14 16 A Y H X S+ 0 0 31 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.950 111.3 49.1 -52.2 -50.2 -15.1 24.8 -2.4 15 17 A E H X S+ 0 0 28 -4,-3.2 4,-1.9 2,-0.2 -1,-0.2 0.894 107.8 51.4 -56.6 -52.1 -12.8 27.8 -2.4 16 18 A L H X>S+ 0 0 4 -4,-2.6 5,-2.7 1,-0.2 4,-0.8 0.930 110.2 50.5 -58.1 -43.2 -10.5 26.6 -5.1 17 19 A E H ><5S+ 0 0 62 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.908 108.9 51.1 -57.7 -42.6 -13.6 26.0 -7.4 18 20 A E H 3<5S+ 0 0 79 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.821 112.2 48.0 -65.9 -31.8 -14.9 29.6 -6.6 19 21 A E H 3<5S- 0 0 102 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.564 117.5-115.3 -84.0 -9.6 -11.4 30.8 -7.6 20 22 A G T <<5 + 0 0 59 -3,-0.9 2,-0.4 -4,-0.8 -3,-0.2 0.591 69.6 138.1 86.1 12.5 -11.4 28.7 -10.8 21 23 A V < - 0 0 47 -5,-2.7 -1,-0.3 -6,-0.2 -2,-0.1 -0.752 62.9-109.8 -95.8 137.5 -8.4 26.6 -9.7 22 24 A T - 0 0 71 -2,-0.4 2,-2.0 1,-0.1 5,-0.1 -0.509 34.9-117.3 -64.8 123.3 -8.5 22.8 -10.3 23 25 A P + 0 0 16 0, 0.0 37,-1.9 0, 0.0 2,-0.3 -0.465 50.9 167.7 -70.5 81.5 -9.0 21.1 -6.8 24 26 A L B >> -A 59 0A 52 -2,-2.0 4,-1.9 35,-0.2 3,-0.5 -0.761 45.1-124.8 -95.8 145.2 -5.6 19.3 -6.7 25 27 A R H 3> S+ 0 0 76 33,-0.5 4,-3.0 -2,-0.3 5,-0.2 0.855 113.0 53.5 -59.0 -33.2 -4.3 17.6 -3.6 26 28 A A H 3> S+ 0 0 70 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.834 108.1 51.8 -73.6 -29.3 -1.0 19.6 -3.8 27 29 A R H <> S+ 0 0 95 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.836 112.5 44.9 -71.5 -36.4 -3.1 22.8 -4.0 28 30 A I H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.914 112.6 50.8 -70.5 -46.6 -5.0 21.8 -0.9 29 31 A A H X>S+ 0 0 7 -4,-3.0 5,-2.4 1,-0.2 4,-0.7 0.969 113.8 46.0 -53.5 -51.8 -1.8 20.8 0.9 30 32 A E H ><5S+ 0 0 154 -4,-2.6 3,-0.8 1,-0.2 -1,-0.2 0.928 114.3 46.7 -61.9 -47.4 -0.2 24.1 0.0 31 33 A R H 3<5S+ 0 0 95 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.900 118.6 39.7 -65.0 -42.8 -3.3 26.2 1.1 32 34 A L H 3<5S- 0 0 33 -4,-2.7 -1,-0.3 2,-0.1 -2,-0.2 0.411 109.0-123.3 -80.9 -0.8 -3.8 24.4 4.4 33 35 A E T <<5 + 0 0 173 -3,-0.8 2,-0.3 -4,-0.7 -3,-0.2 0.958 68.1 134.4 54.5 47.0 -0.1 24.3 5.0 34 36 A Q < - 0 0 90 -5,-2.4 -1,-0.2 -6,-0.2 -2,-0.1 -0.901 61.6 -96.5-122.2 155.2 -0.3 20.5 5.3 35 37 A S > - 0 0 52 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.406 26.2-123.3 -71.9 152.2 1.9 17.9 3.8 36 38 A G H > S+ 0 0 36 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.927 114.8 49.2 -53.6 -54.4 0.9 16.1 0.5 37 39 A P H > S+ 0 0 85 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.957 111.8 49.7 -51.8 -48.2 1.1 12.7 2.1 38 40 A T H > S+ 0 0 48 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.901 111.6 47.7 -57.0 -47.9 -1.0 14.0 5.1 39 41 A V H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.916 107.9 55.5 -61.1 -43.2 -3.6 15.4 2.7 40 42 A S H X S+ 0 0 48 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.912 107.1 52.2 -57.4 -39.9 -3.6 12.1 0.7 41 43 A Q H X S+ 0 0 100 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.929 112.6 42.5 -61.8 -48.3 -4.4 10.3 4.0 42 44 A T H X S+ 0 0 11 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.935 113.4 52.1 -66.2 -48.6 -7.4 12.6 4.8 43 45 A V H X S+ 0 0 2 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.895 106.7 54.8 -54.2 -41.8 -8.7 12.6 1.2 44 46 A A H X S+ 0 0 48 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.917 110.3 45.2 -57.4 -47.9 -8.6 8.7 1.3 45 47 A R H X S+ 0 0 122 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.903 111.0 54.1 -58.0 -46.1 -10.8 8.7 4.4 46 48 A M H <>S+ 0 0 2 -4,-3.0 5,-2.7 2,-0.2 6,-0.7 0.846 108.2 48.9 -61.5 -36.6 -13.1 11.3 2.7 47 49 A E H ><5S+ 0 0 91 -4,-2.5 3,-1.6 3,-0.2 -1,-0.2 0.911 110.7 50.9 -62.0 -49.2 -13.5 9.0 -0.3 48 50 A R H 3<5S+ 0 0 179 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.849 109.0 51.5 -54.1 -39.0 -14.3 6.2 2.1 49 51 A D T 3<5S- 0 0 77 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.351 116.9-115.2 -80.5 1.1 -16.9 8.5 3.8 50 52 A G T < 5S+ 0 0 38 -3,-1.6 16,-0.5 2,-0.2 15,-0.2 0.661 84.2 114.9 74.8 17.9 -18.5 9.3 0.4 51 53 A L S - 0 0 16 4,-2.7 3,-2.8 -2,-0.9 0, 0.0 -0.170 27.4 -99.4 -71.0 168.1 -11.1 11.7 -10.8 56 58 A S T 3 S+ 0 0 127 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.697 126.7 56.9 -65.8 -19.5 -8.6 10.0 -13.2 57 59 A D T 3 S- 0 0 89 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.337 120.3-111.5 -91.4 0.2 -7.0 13.4 -13.6 58 60 A R S < S+ 0 0 175 -3,-2.8 -33,-0.5 1,-0.3 -2,-0.1 0.354 74.0 133.5 84.5 -1.4 -6.4 13.6 -9.8 59 61 A S B -A 24 0A 18 -35,-0.1 -4,-2.7 -5,-0.1 2,-0.6 -0.434 58.8-118.7 -73.8 156.1 -8.8 16.4 -9.2 60 62 A L E -B 54 0B 2 -37,-1.9 2,-0.7 -6,-0.2 -6,-0.2 -0.888 23.2-163.4-102.7 116.8 -11.2 16.1 -6.3 61 63 A Q E -B 53 0B 104 -8,-3.3 -8,-2.1 -2,-0.6 2,-0.2 -0.922 18.0-135.8-100.4 112.5 -14.9 16.0 -7.2 62 64 A M E -B 52 0B 13 -2,-0.7 -10,-0.3 -10,-0.2 -11,-0.1 -0.442 18.5-131.3 -64.3 130.9 -17.1 16.7 -4.2 63 65 A T > - 0 0 29 -12,-1.3 4,-3.1 -2,-0.2 5,-0.3 -0.326 33.9 -95.1 -68.8 164.7 -20.0 14.3 -4.1 64 66 A P H > S+ 0 0 107 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.956 129.5 45.5 -51.2 -51.9 -23.5 15.9 -3.5 65 67 A T H > S+ 0 0 101 -15,-0.2 4,-2.3 2,-0.2 5,-0.2 0.921 114.1 50.0 -53.7 -44.7 -23.3 15.1 0.3 66 68 A G H > S+ 0 0 0 -16,-0.5 4,-3.2 1,-0.2 -1,-0.2 0.942 112.1 47.5 -57.9 -44.6 -19.6 16.5 0.3 67 69 A R H X S+ 0 0 48 -4,-3.1 4,-3.1 2,-0.2 -2,-0.2 0.892 108.5 53.7 -66.9 -42.6 -20.7 19.6 -1.6 68 70 A T H X S+ 0 0 95 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.942 113.7 43.7 -54.2 -49.4 -23.7 20.2 0.8 69 71 A L H X S+ 0 0 56 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.921 113.1 51.1 -63.5 -48.2 -21.3 20.0 3.8 70 72 A A H X S+ 0 0 0 -4,-3.2 4,-2.8 1,-0.2 -2,-0.2 0.927 110.7 49.5 -51.1 -50.7 -18.7 22.2 2.0 71 73 A T H X S+ 0 0 24 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.894 110.9 50.1 -57.8 -43.5 -21.5 24.8 1.2 72 74 A A H X S+ 0 0 16 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.906 110.8 47.2 -61.3 -46.0 -22.6 24.8 4.9 73 75 A V H X S+ 0 0 1 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.927 113.0 49.7 -63.0 -47.4 -19.1 25.3 6.3 74 76 A M H X S+ 0 0 0 -4,-2.8 4,-2.9 -5,-0.2 -2,-0.2 0.930 111.5 50.2 -57.8 -41.6 -18.5 28.1 3.8 75 77 A R H X S+ 0 0 10 -4,-2.5 4,-3.2 2,-0.2 5,-0.2 0.959 113.0 44.0 -61.6 -54.9 -21.9 29.7 4.9 76 78 A K H X S+ 0 0 21 -4,-3.0 4,-3.0 2,-0.2 5,-0.2 0.910 114.0 53.2 -55.6 -42.8 -21.0 29.5 8.6 77 79 A H H X S+ 0 0 4 -4,-2.8 4,-2.2 -5,-0.2 -2,-0.2 0.969 113.3 40.3 -60.1 -56.7 -17.6 30.8 7.8 78 80 A R H X S+ 0 0 7 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.872 115.5 50.9 -62.8 -39.4 -18.8 33.8 5.9 79 81 A L H X S+ 0 0 0 -4,-3.2 4,-2.6 2,-0.2 -1,-0.2 0.902 110.0 51.5 -61.8 -40.0 -21.7 34.5 8.4 80 82 A A H X S+ 0 0 0 -4,-3.0 4,-2.8 -5,-0.2 -2,-0.2 0.914 109.0 50.6 -62.8 -40.8 -19.1 34.4 11.3 81 83 A E H X S+ 0 0 4 -4,-2.2 4,-2.5 -5,-0.2 5,-0.3 0.952 110.7 48.8 -61.9 -50.5 -17.0 36.9 9.4 82 84 A R H X S+ 0 0 44 -4,-2.6 4,-2.9 1,-0.2 5,-0.4 0.913 112.5 48.2 -48.6 -53.4 -20.0 39.2 9.0 83 85 A L H X>S+ 0 0 30 -4,-2.6 5,-2.1 1,-0.2 4,-1.7 0.916 113.0 48.3 -55.4 -47.2 -20.8 38.8 12.7 84 86 A L H <>S+ 0 0 3 -4,-2.8 6,-2.5 3,-0.2 5,-1.0 0.856 121.0 34.6 -66.3 -40.9 -17.2 39.5 13.7 85 87 A T H <5S+ 0 0 41 -4,-2.5 -2,-0.2 4,-0.2 -3,-0.2 0.957 123.5 38.8 -76.7 -56.3 -16.8 42.6 11.5 86 88 A D H <5S+ 0 0 62 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.814 133.3 12.5 -69.0 -39.8 -20.3 44.2 11.6 87 89 A I T <5S+ 0 0 95 -4,-1.7 -3,-0.2 -5,-0.4 -4,-0.1 0.828 131.6 40.3-109.2 -53.6 -21.3 43.7 15.2 88 90 A I T > - 0 0 91 1,-0.2 3,-2.5 -2,-0.1 4,-0.6 -0.210 38.7-125.2 -48.8 130.2 -9.9 44.2 13.6 92 94 A I H 3> S+ 0 0 75 1,-0.3 4,-0.6 2,-0.2 3,-0.5 0.732 107.6 64.6 -56.9 -31.0 -10.4 43.1 10.0 93 95 A N H 34 S+ 0 0 128 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.595 108.2 41.2 -67.3 -10.6 -7.0 41.5 9.9 94 96 A K H <> S+ 0 0 118 -3,-2.5 4,-2.1 2,-0.1 -1,-0.2 0.467 91.8 87.9-110.1 -10.6 -8.1 39.0 12.5 95 97 A V H X S+ 0 0 0 -4,-0.6 4,-2.9 -3,-0.5 5,-0.2 0.925 86.5 48.4 -62.9 -49.6 -11.6 38.3 11.2 96 98 A H H X S+ 0 0 64 -4,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.924 112.0 48.7 -54.9 -47.4 -10.7 35.4 8.8 97 99 A D H > S+ 0 0 94 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.918 112.3 48.7 -67.0 -40.5 -8.6 33.5 11.3 98 100 A E H >X S+ 0 0 49 -4,-2.1 4,-2.2 1,-0.2 3,-1.1 0.969 112.7 47.1 -62.6 -44.7 -11.3 33.8 14.0 99 101 A A H 3X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.3 -1,-0.2 0.736 100.2 68.8 -67.9 -22.1 -14.0 32.6 11.6 100 102 A D H 3< S+ 0 0 43 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.852 110.8 34.5 -64.9 -34.3 -11.6 29.8 10.5 101 103 A R H X< S+ 0 0 138 -4,-1.2 3,-1.4 -3,-1.1 -2,-0.2 0.922 116.8 51.0 -83.4 -44.1 -12.3 28.4 14.0 102 104 A W H >X S+ 0 0 80 -4,-2.2 3,-1.7 1,-0.3 4,-1.3 0.765 93.1 74.5 -71.0 -27.9 -15.9 29.4 14.5 103 105 A E T 3< S+ 0 0 0 -4,-2.3 -1,-0.3 1,-0.2 -26,-0.2 0.754 95.2 53.0 -51.7 -24.5 -17.1 27.9 11.2 104 106 A H T <4 S+ 0 0 41 -3,-1.4 -1,-0.2 -4,-0.2 -2,-0.2 0.506 116.1 35.8 -94.8 -6.5 -16.7 24.4 12.8 105 107 A V T <4 S+ 0 0 124 -3,-1.7 2,-0.4 -4,-0.2 -2,-0.2 0.433 84.1 110.3-126.4 1.8 -18.8 25.1 15.9 106 108 A M < - 0 0 19 -4,-1.3 2,-0.1 1,-0.0 -30,-0.1 -0.632 60.3-138.6 -83.2 126.5 -21.6 27.4 14.7 107 109 A S > - 0 0 60 -2,-0.4 4,-1.9 1,-0.1 3,-0.2 -0.464 19.8-113.4 -80.0 161.7 -25.1 25.7 14.7 108 110 A D H > S+ 0 0 72 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.876 117.8 55.1 -56.0 -38.0 -27.6 26.1 11.9 109 111 A E H > S+ 0 0 100 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.889 104.5 51.9 -72.7 -33.5 -30.0 27.9 14.3 110 112 A V H > S+ 0 0 66 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.927 108.8 53.2 -62.9 -41.4 -27.3 30.4 15.2 111 113 A E H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.944 105.9 52.2 -55.3 -49.9 -26.9 31.0 11.5 112 114 A R H X S+ 0 0 85 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.888 109.5 49.4 -56.3 -42.8 -30.6 31.7 11.2 113 115 A R H X S+ 0 0 152 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.901 107.9 54.4 -60.8 -39.5 -30.4 34.2 14.0 114 116 A L H X S+ 0 0 16 -4,-2.3 4,-3.1 1,-0.2 -2,-0.2 0.876 104.6 53.6 -63.7 -38.0 -27.4 35.9 12.3 115 117 A V H < S+ 0 0 59 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.894 111.4 47.3 -64.9 -38.9 -29.5 36.3 9.1 116 118 A K H < S+ 0 0 162 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.894 119.9 37.5 -60.8 -45.5 -32.2 38.1 11.2 117 119 A V H < S+ 0 0 102 -4,-2.2 -2,-0.2 -5,-0.1 -3,-0.2 0.801 97.8 85.6 -85.5 -36.0 -29.7 40.4 13.0 118 120 A L S < S- 0 0 13 -4,-3.1 3,-0.2 -5,-0.2 -35,-0.1 -0.378 73.5-132.2 -73.2 152.8 -27.2 41.3 10.3 119 121 A K S S- 0 0 191 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.823 88.3 -2.4 -73.6 -36.2 -27.8 44.2 7.9 120 122 A D - 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