==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA-BINDING PROTEIN 18-DEC-91 1FIA . COMPND 2 MOLECULE: FACTOR FOR INVERSION STIMULATION (FIS); . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.KOSTREWA,J.GRANZIN,H.-W.CHOE,J.LABAHN,W.SAENGER . 157 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8933.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 79.6 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 . 4 2.5 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 4 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 55.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.8 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 0 0 0 0 2 0 2 0 0 0 2 0 0 0 0 0 2 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 . 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 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 10 A V 0 0 87 0, 0.0 8,-0.2 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 142.7 16.7 -12.5 29.4 2 11 A L + 0 0 5 94,-0.3 7,-2.0 1,-0.2 2,-0.3 0.894 360.0 154.6 84.2 80.7 16.4 -8.9 28.5 3 12 A T B A 8 0A 51 93,-0.4 96,-0.2 5,-0.3 -1,-0.2 -0.953 360.0 360.0-136.2 150.9 19.9 -7.7 28.5 4 13 A V 0 0 53 3,-2.6 3,-1.9 -2,-0.3 88,-0.1 -0.973 360.0 360.0-135.4 360.0 21.8 -5.0 26.8 5 ! 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 6 24 A Q 0 0 210 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -32.3 25.6 -7.7 30.2 7 25 A K - 0 0 41 -3,-1.9 -3,-2.6 1,-0.1 5,-0.1 -0.815 360.0-109.9 -99.8 136.5 23.3 -5.4 32.1 8 26 A P B > -A 3 0A 37 0, 0.0 4,-0.7 0, 0.0 3,-0.5 -0.073 21.6-116.4 -59.4 159.2 19.6 -6.1 32.4 9 27 A L H >> S+ 0 0 2 -7,-2.0 4,-1.5 1,-0.2 3,-0.8 0.872 112.3 64.1 -65.8 -36.1 17.0 -4.0 30.7 10 28 A R H 3> S+ 0 0 121 -8,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.843 96.2 58.0 -58.1 -33.1 15.5 -2.9 34.0 11 29 A D H 3> S+ 0 0 60 -3,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.814 105.2 49.9 -66.7 -31.6 18.8 -1.1 34.9 12 30 A S H < S+ 0 0 40 -4,-1.8 3,-1.5 2,-0.2 4,-0.4 0.916 108.3 51.9 -65.7 -47.0 14.5 12.5 33.4 21 39 A F H >X S+ 0 0 19 -4,-2.9 3,-1.5 1,-0.3 4,-0.5 0.883 103.6 60.4 -59.3 -34.7 13.8 13.3 37.1 22 40 A A H 3< S+ 0 0 67 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.737 103.4 51.4 -64.1 -22.2 16.9 15.4 37.1 23 41 A Q T << S+ 0 0 121 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.440 88.7 85.2 -95.0 -1.8 15.4 17.5 34.3 24 42 A L T X4 + 0 0 6 -3,-1.5 3,-0.6 -4,-0.4 -2,-0.1 0.972 53.2 172.7 -62.7 -61.5 12.1 18.2 36.1 25 43 A N T 3< S- 0 0 134 -4,-0.5 3,-0.1 1,-0.3 -3,-0.1 0.936 83.6 -35.2 49.2 66.3 12.8 21.2 38.3 26 44 A G T 3 S+ 0 0 90 1,-0.3 2,-0.5 0, 0.0 -1,-0.3 0.618 107.3 136.2 69.6 6.5 9.4 22.1 39.7 27 45 A Q < - 0 0 122 -3,-0.6 -1,-0.3 1,-0.1 -2,-0.0 -0.777 52.5-126.3 -90.3 124.8 8.0 21.0 36.3 28 46 A D - 0 0 135 -2,-0.5 2,-0.3 -3,-0.1 -1,-0.1 -0.222 22.2-168.3 -71.7 161.8 4.9 18.9 36.7 29 47 A V + 0 0 7 1,-0.1 115,-0.2 2,-0.0 -5,-0.0 -0.970 21.0 158.3-150.1 128.6 4.2 15.5 35.2 30 48 A N S S+ 0 0 110 -2,-0.3 113,-0.1 113,-0.1 -1,-0.1 0.287 71.5 55.8-137.3 11.8 1.0 13.6 35.0 31 49 A D > + 0 0 79 111,-0.2 4,-2.4 2,-0.1 5,-0.2 -0.057 60.4 128.9-132.3 29.3 1.4 11.1 32.1 32 50 A L H > S+ 0 0 0 110,-1.9 4,-2.5 1,-0.2 5,-0.3 0.885 71.2 52.8 -56.1 -41.8 4.6 9.2 33.2 33 51 A Y H > S+ 0 0 32 110,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.968 114.4 40.0 -60.5 -54.1 3.1 5.7 32.8 34 52 A E H > S+ 0 0 107 109,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.861 112.8 56.9 -65.0 -33.4 1.9 6.2 29.3 35 53 A L H X S+ 0 0 47 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.934 111.1 42.0 -63.3 -46.1 5.0 8.1 28.4 36 54 A V H X S+ 0 0 2 -4,-2.5 4,-0.9 -5,-0.2 -2,-0.2 0.921 114.2 54.1 -67.4 -40.6 7.3 5.2 29.4 37 55 A L H >X S+ 0 0 20 -4,-2.5 4,-3.6 -5,-0.3 3,-0.9 0.908 104.1 52.4 -59.2 -46.3 4.9 2.8 27.8 38 56 A A H 3X S+ 0 0 25 -4,-2.5 4,-1.4 1,-0.3 -1,-0.2 0.903 108.1 53.9 -59.3 -38.3 5.0 4.5 24.5 39 57 A E H 3< S+ 0 0 26 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.706 118.8 33.1 -67.9 -23.0 8.7 4.3 24.6 40 58 A V H S+ 0 0 7 0, 0.0 4,-2.9 0, 0.0 -1,-0.2 0.861 115.5 56.4 -63.0 -36.0 10.1 -0.8 19.7 44 62 A L H X S+ 0 0 2 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.949 110.7 42.9 -60.4 -49.8 8.6 -4.1 21.0 45 63 A L H X S+ 0 0 2 -4,-2.9 4,-2.1 1,-0.2 5,-0.2 0.901 113.9 52.4 -64.6 -39.7 5.9 -4.1 18.4 46 64 A D H X S+ 0 0 64 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.933 111.4 45.2 -61.9 -45.6 8.3 -3.1 15.8 47 65 A M H X S+ 0 0 3 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.909 111.8 50.2 -66.3 -43.2 10.7 -5.9 16.6 48 66 A V H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.939 111.6 49.7 -61.1 -45.4 8.2 -8.6 16.9 49 67 A M H <>S+ 0 0 30 -4,-2.1 5,-3.4 2,-0.2 6,-0.3 0.868 111.6 48.4 -60.1 -40.6 6.6 -7.7 13.5 50 68 A Q H ><5S+ 0 0 127 -4,-1.9 3,-1.4 -5,-0.2 -1,-0.2 0.939 110.7 52.0 -65.5 -44.6 10.0 -7.7 11.9 51 69 A Y H 3<5S+ 0 0 108 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.888 115.9 38.1 -58.9 -42.2 10.7 -11.0 13.5 52 70 A T T ><5S- 0 0 2 -4,-2.3 3,-1.4 -5,-0.1 -1,-0.3 0.256 112.0-118.8 -94.0 10.3 7.5 -12.6 12.2 53 71 A R T < 5S- 0 0 233 -3,-1.4 -3,-0.2 1,-0.2 -4,-0.1 0.870 73.3 -48.3 55.1 42.7 7.8 -10.7 8.9 54 72 A G T 3 - 0 0 63 -3,-1.4 4,-1.9 -6,-0.3 -1,-0.2 -0.688 30.8-168.4 -79.1 110.5 2.5 -12.0 10.4 56 74 A Q H > S+ 0 0 41 -2,-0.8 4,-2.4 1,-0.2 5,-0.2 0.816 80.7 54.7 -70.5 -34.9 0.1 -10.7 13.0 57 75 A T H > S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.951 112.2 43.6 -63.8 -48.2 -1.2 -14.0 14.2 58 76 A R H > S+ 0 0 132 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.899 112.7 52.9 -63.1 -41.7 2.3 -15.2 14.9 59 77 A A H X S+ 0 0 0 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.920 110.2 48.0 -59.8 -46.4 3.3 -11.9 16.5 60 78 A A H X>S+ 0 0 3 -4,-2.4 5,-1.8 1,-0.2 4,-1.5 0.904 110.8 50.3 -63.5 -41.7 0.3 -12.0 18.8 61 79 A L H <5S+ 0 0 120 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.902 109.5 51.6 -63.3 -40.1 0.9 -15.6 19.9 62 80 A M H <5S+ 0 0 17 -4,-2.2 50,-2.2 1,-0.2 49,-0.3 0.813 113.7 44.6 -65.5 -31.5 4.6 -14.8 20.7 63 81 A M H <5S- 0 0 3 -4,-1.4 50,-1.3 48,-0.2 51,-0.6 0.667 107.9-123.3 -86.8 -18.5 3.5 -11.9 22.8 64 82 A G T <5S+ 0 0 49 -4,-1.5 2,-0.3 1,-0.3 -3,-0.2 0.731 73.6 112.6 82.1 24.2 0.8 -13.7 24.6 65 83 A I S - 0 0 102 -2,-0.3 4,-2.4 1,-0.1 3,-0.3 -0.512 30.2-115.4 -85.1 158.4 -4.8 -11.6 21.3 67 85 A R H > S+ 0 0 119 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.833 116.1 53.9 -52.9 -37.4 -4.7 -10.6 17.7 68 86 A G H > S+ 0 0 47 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.912 108.7 47.5 -66.5 -43.3 -7.3 -8.0 18.2 69 87 A T H > S+ 0 0 59 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.910 110.6 53.5 -65.5 -38.9 -5.3 -6.4 21.0 70 88 A L H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.963 109.5 46.4 -60.4 -50.1 -2.2 -6.5 18.9 71 89 A R H X S+ 0 0 119 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.891 109.9 56.0 -61.1 -33.0 -3.9 -4.7 16.0 72 90 A K H X S+ 0 0 164 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.889 108.0 47.4 -65.2 -39.5 -5.3 -2.2 18.5 73 91 A K H X S+ 0 0 37 -4,-2.3 4,-1.6 2,-0.2 6,-0.3 0.880 109.0 53.6 -71.0 -36.6 -1.8 -1.4 19.7 74 92 A L H <>S+ 0 0 7 -4,-2.2 5,-3.4 -5,-0.2 6,-0.3 0.918 111.4 46.7 -63.3 -40.0 -0.5 -1.0 16.2 75 93 A K H ><5S+ 0 0 153 -4,-2.1 3,-2.6 3,-0.2 5,-0.2 0.943 105.0 58.8 -65.9 -47.4 -3.2 1.4 15.5 76 94 A K H 3<5S+ 0 0 125 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.850 112.1 41.1 -49.5 -39.7 -2.7 3.4 18.6 77 95 A Y T 3<5S- 0 0 35 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.319 116.0-114.8 -94.4 9.2 0.9 4.0 17.5 78 96 A G T < 5S+ 0 0 57 -3,-2.6 -3,-0.2 1,-0.1 -2,-0.1 0.718 73.6 138.4 65.0 24.6 -0.1 4.6 14.0 79 97 A M < 0 0 50 -5,-3.4 -4,-0.2 -6,-0.3 -1,-0.1 0.048 360.0 360.0 -88.3 25.7 1.8 1.5 12.9 80 98 A N 0 0 183 -6,-0.3 -5,-0.2 -5,-0.2 -1,-0.2 0.803 360.0 360.0 103.3 360.0 -1.1 0.8 10.7 81 !* 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 82 10 B V 0 0 98 0, 0.0 2,-0.6 0, 0.0 -47,-0.0 0.000 360.0 360.0 360.0-179.5 12.2 11.9 25.9 83 11 B L - 0 0 1 -48,-0.1 6,-3.4 -47,-0.0 2,-0.5 -0.839 360.0-175.7-100.5 116.3 13.8 9.1 28.0 84 12 B T B B 88 0B 69 -2,-0.6 -65,-0.2 -68,-0.5 -64,-0.1 -0.944 360.0 360.0-119.0 126.3 17.6 9.0 27.7 85 13 B V 0 0 55 2,-3.1 -1,-0.1 -2,-0.5 -66,-0.0 0.813 360.0 360.0 -82.7 360.0 20.0 6.5 29.1 86 ! 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 87 25 B K 0 0 81 0, 0.0 -2,-3.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 125.7 20.6 7.0 23.8 88 26 B P B >> -B 84 0B 28 0, 0.0 3,-1.7 0, 0.0 4,-0.9 -0.221 360.0-116.9 -56.1 146.1 16.8 7.0 24.0 89 27 B L H >> S+ 0 0 2 -6,-3.4 4,-1.9 1,-0.3 3,-0.8 0.847 111.6 69.9 -55.7 -35.1 15.5 4.3 26.0 90 28 B R H 3> S+ 0 0 110 -7,-0.3 4,-2.0 1,-0.3 -1,-0.3 0.847 95.1 55.4 -56.6 -28.0 13.7 2.9 23.0 91 29 B D H <> S+ 0 0 76 -3,-1.7 4,-2.3 1,-0.2 -1,-0.3 0.873 104.0 52.2 -73.1 -32.2 17.0 2.0 21.6 92 30 B S H < S+ 0 0 21 -4,-3.2 3,-2.3 1,-0.2 4,-0.4 0.923 106.3 59.6 -58.2 -46.7 15.6 -13.1 19.6 102 40 B A H 3< S+ 0 0 72 -4,-3.1 3,-0.3 1,-0.3 -1,-0.2 0.836 103.7 52.5 -53.2 -35.0 19.2 -14.3 18.9 103 41 B Q T 3< S+ 0 0 139 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.184 86.8 89.7 -88.5 19.2 19.0 -16.7 21.8 104 42 B L X + 0 0 12 -3,-2.3 3,-0.8 3,-0.1 -1,-0.2 0.963 53.9 175.5 -77.4 -53.5 15.7 -18.2 20.5 105 43 B N T 3 S- 0 0 141 -4,-0.4 3,-0.1 -3,-0.3 -3,-0.1 0.894 82.7 -40.6 44.1 61.6 17.1 -21.0 18.3 106 44 B G T 3 S+ 0 0 77 1,-0.2 -1,-0.3 0, 0.0 2,-0.1 0.693 105.9 147.5 66.5 17.0 13.8 -22.6 17.3 107 45 B Q < - 0 0 120 -3,-0.8 2,-0.4 1,-0.1 -1,-0.2 -0.401 49.8-108.1 -83.0 164.4 12.6 -22.1 20.9 108 46 B D - 0 0 127 -3,-0.1 2,-0.4 -2,-0.1 -1,-0.1 -0.780 31.6-177.8 -95.4 132.2 9.0 -21.4 21.9 109 47 B V + 0 0 21 -2,-0.4 -45,-0.2 1,-0.1 -46,-0.0 -0.994 17.5 154.2-130.7 126.2 7.8 -18.0 23.2 110 48 B N S S+ 0 0 120 -2,-0.4 -47,-0.1 -47,-0.1 -1,-0.1 0.265 71.1 44.2-135.1 15.7 4.3 -17.2 24.4 111 49 B D > + 0 0 76 -49,-0.3 4,-2.1 2,-0.1 -48,-0.2 0.097 57.9 134.5-149.5 30.6 4.6 -14.3 26.9 112 50 B L H > S+ 0 0 0 -50,-2.2 4,-2.2 1,-0.2 5,-0.3 0.862 74.4 55.5 -51.9 -41.4 6.9 -11.8 25.4 113 51 B Y H > S+ 0 0 31 -50,-1.3 4,-2.6 1,-0.2 5,-0.2 0.980 110.8 42.3 -58.1 -56.1 4.6 -8.9 26.3 114 52 B E H > S+ 0 0 87 -51,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.842 112.8 56.2 -57.6 -35.6 4.3 -9.7 30.0 115 53 B L H X S+ 0 0 52 -4,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.897 111.7 40.0 -66.3 -43.4 8.0 -10.4 30.1 116 54 B V H X S+ 0 0 3 -4,-2.2 4,-0.9 -5,-0.2 5,-0.2 0.922 112.9 55.7 -72.5 -43.2 9.0 -7.0 28.7 117 55 B L H >X S+ 0 0 15 -4,-2.6 4,-3.2 -5,-0.3 3,-0.5 0.866 107.0 49.8 -56.1 -41.5 6.4 -5.2 30.8 118 56 B A H 3X S+ 0 0 22 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.887 106.1 56.0 -67.0 -38.5 7.7 -6.6 34.0 119 57 B E H 3< S+ 0 0 29 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.701 119.0 33.0 -66.7 -20.4 11.2 -5.6 33.2 120 58 B V H S+ 0 0 6 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.861 114.7 56.8 -61.3 -36.4 12.0 -0.0 37.9 124 62 B L H X S+ 0 0 2 -4,-1.7 4,-2.4 2,-0.2 5,-0.2 0.969 110.0 42.5 -59.1 -53.2 9.4 2.5 37.0 125 63 B L H X S+ 0 0 2 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.890 115.3 52.1 -61.5 -38.2 7.4 2.0 40.2 126 64 B D H X S+ 0 0 49 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.2 0.948 111.4 43.6 -64.0 -49.8 10.5 1.9 42.2 127 65 B M H X S+ 0 0 13 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.866 114.0 51.8 -64.5 -36.7 11.9 5.1 40.9 128 66 B V H X S+ 0 0 1 -4,-2.4 4,-2.8 -5,-0.3 -1,-0.2 0.926 108.7 49.9 -64.6 -47.7 8.6 6.9 41.2 129 67 B M H <>S+ 0 0 30 -4,-2.2 5,-3.9 -5,-0.2 6,-0.3 0.855 113.1 47.3 -59.6 -37.6 8.1 5.8 44.8 130 68 B Q H ><5S+ 0 0 112 -4,-1.8 3,-1.6 3,-0.2 -1,-0.2 0.921 111.2 50.9 -70.2 -45.8 11.6 7.0 45.7 131 69 B Y H 3<5S+ 0 0 77 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.899 114.6 42.2 -60.6 -40.1 11.0 10.3 43.9 132 70 B T T ><5S- 0 0 4 -4,-2.8 3,-1.6 -5,-0.1 -1,-0.3 0.274 114.0-118.7 -91.4 14.9 7.8 10.9 45.7 133 71 B R T < 5S- 0 0 217 -3,-1.6 -3,-0.2 1,-0.3 -4,-0.1 0.830 71.5 -51.8 54.5 38.4 9.3 9.7 49.0 134 72 B G T 3 - 0 0 83 -3,-1.6 4,-2.0 -6,-0.3 -1,-0.2 -0.706 34.6-164.0 -83.9 109.5 3.7 8.9 48.9 136 74 B Q H > S+ 0 0 26 -2,-0.8 4,-2.4 2,-0.2 -1,-0.2 0.808 84.7 50.5 -59.6 -40.6 1.3 6.8 46.8 137 75 B T H > S+ 0 0 64 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.924 111.1 48.0 -67.6 -46.2 -1.1 9.6 45.8 138 76 B R H > S+ 0 0 105 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.900 113.0 49.6 -60.7 -40.3 1.7 11.8 44.6 139 77 B A H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.894 110.3 50.3 -64.3 -44.0 3.1 8.8 42.7 140 78 B A H X>S+ 0 0 4 -4,-2.4 5,-2.0 1,-0.2 4,-1.4 0.916 111.1 48.9 -61.2 -42.8 -0.3 8.1 41.1 141 79 B L H <5S+ 0 0 115 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.892 111.1 49.2 -63.7 -43.7 -0.8 11.7 40.0 142 80 B M H <5S+ 0 0 11 -4,-2.1 -110,-1.9 1,-0.2 -1,-0.2 0.862 113.6 47.1 -64.1 -37.6 2.6 11.8 38.5 143 81 B M H <5S- 0 0 1 -4,-2.0 -110,-1.7 -112,-0.2 -109,-0.6 0.681 108.1-122.6 -79.6 -20.8 2.0 8.6 36.6 144 82 B G T <5S+ 0 0 50 -4,-1.4 2,-0.2 1,-0.3 -3,-0.2 0.696 75.7 106.0 86.0 19.3 -1.3 9.6 35.4 145 83 B I S - 0 0 103 -2,-0.2 4,-2.0 1,-0.1 3,-0.4 -0.573 33.1-109.3 -93.6 162.4 -5.3 6.2 39.9 147 85 B R H > S+ 0 0 95 1,-0.2 4,-2.2 -2,-0.2 5,-0.2 0.841 116.3 56.0 -52.8 -38.8 -4.2 5.1 43.3 148 86 B G H > S+ 0 0 47 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.907 107.0 48.2 -62.9 -42.3 -5.9 1.7 43.0 149 87 B T H > S+ 0 0 51 -3,-0.4 4,-2.3 2,-0.2 5,-0.2 0.914 110.4 52.4 -64.4 -41.6 -4.1 0.8 39.8 150 88 B L H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.923 110.1 48.1 -60.5 -44.4 -0.8 1.8 41.4 151 89 B R H X S+ 0 0 115 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.913 108.7 54.2 -63.2 -42.3 -1.5 -0.4 44.4 152 90 B K H X S+ 0 0 161 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.933 112.0 43.8 -58.9 -45.2 -2.4 -3.3 42.2 153 91 B K H X S+ 0 0 36 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.859 112.2 53.0 -68.2 -36.4 0.9 -3.0 40.3 154 92 B L H <>S+ 0 0 5 -4,-2.3 5,-3.6 -5,-0.2 6,-1.1 0.942 111.1 45.5 -63.7 -45.9 2.8 -2.6 43.5 155 93 B K H ><5S+ 0 0 147 -4,-2.7 3,-2.8 1,-0.2 -2,-0.2 0.967 107.1 62.1 -59.5 -48.4 1.3 -5.7 45.0 156 94 B K H 3<5S+ 0 0 106 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.788 109.2 38.2 -45.7 -41.0 2.0 -7.4 41.7 157 95 B Y T 3<5S- 0 0 36 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.185 117.1-111.2-100.7 18.3 5.8 -7.0 42.0 158 96 B G T < 5S+ 0 0 61 -3,-2.8 -3,-0.2 2,-0.2 -2,-0.1 0.860 84.4 125.9 56.5 38.7 5.6 -7.6 45.7 159 97 B M < 0 0 67 -5,-3.6 -4,-0.2 1,-0.3 -5,-0.1 0.627 360.0 360.0 -96.6 -16.9 6.5 -4.0 46.3 160 98 B N 0 0 122 -6,-1.1 -1,-0.3 -9,-0.1 -2,-0.2 -0.819 360.0 360.0-128.9 360.0 3.5 -3.7 48.5