==== 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 DNA BINDING PROTEIN/DNA 08-SEP-09 3JRB . COMPND 2 MOLECULE: DNA-BINDING PROTEIN FIS; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.STELLA,D.CASCIO,R.C.JOHNSON . 189 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11897.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 144 76.2 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 . 12 6.3 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 1.1 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 . 12 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 14.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 43.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.6 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 1 0 0 1 1 0 0 2 0 1 2 0 0 0 0 0 1 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 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 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 8 A S 0 0 178 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -68.0 -5.8 16.9 13.1 2 9 A D - 0 0 76 1,-0.1 3,-0.1 17,-0.0 16,-0.0 -0.925 360.0-168.3-109.8 130.2 -2.2 16.1 11.9 3 10 A V S S+ 0 0 75 -2,-0.5 2,-0.8 1,-0.2 -1,-0.1 0.717 75.5 64.7 -86.9 -24.8 0.4 15.1 14.4 4 11 A L S S+ 0 0 3 141,-0.1 16,-1.9 125,-0.0 17,-0.4 -0.836 71.8 139.9-110.0 100.5 3.4 15.4 12.2 5 12 A T E -A 19 0A 13 -2,-0.8 2,-0.4 121,-0.5 124,-0.2 -0.983 36.1-149.9-144.3 153.7 3.9 19.1 11.2 6 13 A V E -A 18 0A 7 12,-2.4 12,-0.8 -2,-0.3 120,-0.1 -0.919 28.4-109.1-124.5 147.8 6.6 21.8 10.7 7 14 A S E -A 17 0A 45 -2,-0.4 2,-0.3 10,-0.2 10,-0.2 -0.285 36.2-178.8 -71.7 156.3 6.4 25.5 11.2 8 15 A T E -A 16 0A 35 8,-1.2 8,-1.4 99,-0.0 2,-0.4 -0.936 18.2-137.7-146.5 166.4 6.4 27.8 8.2 9 16 A V E -A 15 0A 68 -2,-0.3 6,-0.2 6,-0.2 2,-0.2 -0.990 11.3-158.1-137.7 132.2 6.4 31.6 7.6 10 17 A N > - 0 0 72 4,-1.7 3,-1.1 -2,-0.4 4,-0.4 -0.512 42.1 -92.0 -99.7 165.5 4.4 33.4 5.0 11 18 A S T 3 S+ 0 0 120 1,-0.3 2,-0.9 -2,-0.2 -1,-0.0 0.856 122.5 64.1 -50.9 -43.1 5.2 36.9 3.7 12 19 A Q T 3 S- 0 0 149 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.095 120.6-106.7 -71.9 30.4 3.0 38.6 6.3 13 20 A D S < S+ 0 0 122 -3,-1.1 2,-0.6 -2,-0.9 -2,-0.2 0.703 70.7 150.5 48.5 30.8 5.3 37.2 9.0 14 21 A Q - 0 0 99 -4,-0.4 -4,-1.7 2,-0.0 2,-0.2 -0.785 38.7-146.8 -92.5 118.7 2.7 34.7 10.1 15 22 A V E +A 9 0A 101 -2,-0.6 2,-0.3 -6,-0.2 -6,-0.2 -0.608 30.0 168.9 -76.9 153.1 4.2 31.4 11.5 16 23 A T E -A 8 0A 53 -8,-1.4 -8,-1.2 -2,-0.2 2,-0.1 -0.966 31.0-111.7-172.3 138.9 1.9 28.6 10.7 17 24 A Q E +A 7 0A 82 -2,-0.3 -10,-0.2 -10,-0.2 -12,-0.0 -0.351 30.1 177.3 -85.5 161.3 1.9 24.7 10.8 18 25 A K E -A 6 0A 53 -12,-0.8 -12,-2.4 -2,-0.1 5,-0.1 -0.946 37.1 -89.2-162.9 147.7 2.0 22.3 7.8 19 26 A P E > -A 5 0A 25 0, 0.0 3,-0.5 0, 0.0 4,-0.4 -0.119 27.9-131.3 -63.3 157.3 2.1 18.6 7.3 20 27 A L T >> S+ 0 0 3 -16,-1.9 4,-1.9 1,-0.2 3,-1.7 0.829 106.3 68.2 -70.5 -34.6 5.6 17.0 7.1 21 28 A R H 3> S+ 0 0 64 -17,-0.4 4,-2.2 1,-0.3 -1,-0.2 0.800 90.9 63.4 -57.0 -26.0 4.5 15.2 4.1 22 29 A D H <> S+ 0 0 74 -3,-0.5 4,-1.8 2,-0.2 -1,-0.3 0.785 104.1 46.9 -70.1 -28.3 4.4 18.6 2.3 23 30 A S H <> S+ 0 0 1 -3,-1.7 4,-4.3 -4,-0.4 -2,-0.2 0.944 109.5 50.7 -73.4 -53.4 8.1 19.0 2.8 24 31 A V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 5,-0.3 0.937 110.4 53.1 -49.1 -43.5 9.0 15.5 1.6 25 32 A K H X S+ 0 0 72 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 0.971 113.4 41.3 -59.3 -52.7 6.9 16.3 -1.4 26 33 A Q H X S+ 0 0 67 -4,-1.8 4,-2.9 2,-0.2 -1,-0.2 0.904 108.8 61.1 -55.5 -50.8 8.8 19.5 -2.0 27 34 A A H X S+ 0 0 1 -4,-4.3 4,-1.6 2,-0.2 77,-0.4 0.928 113.2 36.2 -37.9 -67.3 12.1 17.7 -1.3 28 35 A L H >X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 3,-0.6 0.950 109.5 60.5 -54.4 -62.8 11.6 15.3 -4.1 29 36 A K H 3X S+ 0 0 131 -4,-2.6 4,-2.9 1,-0.3 5,-0.2 0.914 110.7 45.8 -28.0 -59.7 9.9 17.8 -6.6 30 37 A N H 3X S+ 0 0 53 -4,-2.9 4,-1.4 1,-0.2 -1,-0.3 0.866 108.5 54.5 -57.6 -43.2 13.1 19.6 -6.3 31 38 A Y H XX S+ 0 0 47 -4,-1.6 4,-1.5 -3,-0.6 3,-0.9 0.965 113.0 42.6 -54.0 -57.0 15.3 16.5 -6.7 32 39 A F H 3< S+ 0 0 21 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.947 107.1 60.2 -57.3 -54.7 13.7 15.6 -9.9 33 40 A A H 3< S+ 0 0 71 -4,-2.9 -1,-0.3 -5,-0.4 -2,-0.2 0.842 107.6 52.4 -33.3 -40.9 13.7 19.2 -11.1 34 41 A Q H << S+ 0 0 106 -4,-1.4 2,-0.2 -3,-0.9 -2,-0.2 0.997 95.6 60.6 -74.2 -70.5 17.4 18.8 -10.8 35 42 A L < - 0 0 26 -4,-1.5 5,-0.0 1,-0.2 -1,-0.0 -0.436 68.2-160.2 -58.4 119.9 18.5 15.8 -12.7 36 43 A N S S- 0 0 146 -2,-0.2 -1,-0.2 1,-0.1 -2,-0.0 0.991 76.7 -24.3 -59.2 -74.9 17.5 16.4 -16.3 37 44 A G S S+ 0 0 66 2,-0.1 2,-0.5 0, 0.0 -1,-0.1 0.189 90.4 136.4-129.6 18.5 17.6 12.8 -17.5 38 45 A Q - 0 0 125 1,-0.1 -3,-0.1 0, 0.0 0, 0.0 -0.581 60.0-112.3 -88.0 119.8 19.9 10.9 -15.3 39 46 A D - 0 0 158 -2,-0.5 2,-0.5 1,-0.1 -1,-0.1 -0.100 25.7-136.8 -47.1 141.4 18.5 7.5 -14.3 40 47 A V - 0 0 18 1,-0.2 3,-0.2 -3,-0.1 134,-0.2 -0.947 22.7-179.2-103.4 123.1 17.6 7.3 -10.6 41 48 A N + 0 0 104 -2,-0.5 2,-0.4 1,-0.2 -1,-0.2 0.946 66.3 17.4 -89.8 -55.4 18.7 4.0 -9.1 42 49 A D + 0 0 84 1,-0.2 131,-0.2 131,-0.1 -1,-0.2 -0.699 60.6 147.3-131.9 81.4 17.8 3.8 -5.4 43 50 A L S >> S+ 0 0 1 129,-1.3 4,-1.9 -2,-0.4 3,-0.5 0.807 73.3 50.7 -86.3 -32.1 15.2 6.3 -4.3 44 51 A Y H 3> S+ 0 0 27 129,-1.7 4,-2.3 1,-0.2 5,-0.3 0.990 110.2 45.6 -70.5 -58.3 13.5 4.2 -1.7 45 52 A E H 34 S+ 0 0 113 128,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.306 114.8 55.1 -73.7 11.9 16.5 3.1 0.3 46 53 A L H <> S+ 0 0 47 -3,-0.5 4,-1.4 127,-0.1 5,-0.2 0.795 108.5 40.1 -96.6 -65.1 17.7 6.7 0.1 47 54 A V H < S+ 0 0 2 -4,-1.9 4,-0.4 1,-0.3 3,-0.2 0.860 112.8 57.7 -56.8 -42.2 14.8 8.7 1.5 48 55 A L T >X S+ 0 0 28 -4,-2.3 3,-2.7 -5,-0.2 4,-2.7 0.974 107.0 48.5 -44.1 -58.2 14.3 6.0 4.2 49 56 A A H 3> S+ 0 0 23 1,-0.3 4,-1.0 -5,-0.3 -2,-0.2 0.742 109.0 52.6 -62.1 -26.5 17.9 6.7 5.2 50 57 A E H 3< S+ 0 0 8 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.413 117.2 39.5 -88.7 1.0 17.2 10.4 5.3 51 58 A V H <> S+ 0 0 5 -3,-2.7 4,-1.4 -4,-0.4 -2,-0.2 0.651 111.2 54.0-117.4 -23.3 14.2 9.8 7.6 52 59 A E H X S+ 0 0 5 -4,-2.7 4,-3.3 2,-0.2 5,-0.3 0.915 98.5 61.9 -73.1 -46.6 15.5 7.0 9.9 53 60 A Q H X S+ 0 0 50 -4,-1.0 4,-2.8 -5,-0.2 5,-0.1 0.896 111.9 38.8 -47.9 -45.7 18.7 8.9 11.1 54 61 A P H > S+ 0 0 8 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.931 114.6 52.1 -70.5 -47.1 16.5 11.7 12.6 55 62 A L H X S+ 0 0 2 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.891 118.3 40.0 -52.2 -42.6 13.8 9.3 13.9 56 63 A L H >X S+ 0 0 4 -4,-3.3 4,-0.9 2,-0.2 3,-0.7 0.993 113.2 51.0 -72.1 -62.9 16.5 7.3 15.6 57 64 A D H 3X S+ 0 0 67 -4,-2.8 4,-1.6 -5,-0.3 -2,-0.2 0.800 119.1 40.6 -41.8 -36.3 18.7 10.2 16.7 58 65 A M H 3X S+ 0 0 23 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.749 108.9 53.3 -91.6 -31.8 15.5 11.7 18.3 59 66 A V H << S+ 0 0 0 -4,-1.9 -1,-0.2 -3,-0.7 -2,-0.2 0.299 114.0 47.6 -89.4 6.1 13.6 8.8 19.9 60 67 A M H >X>S+ 0 0 39 -4,-0.9 3,-1.8 -3,-0.2 5,-1.4 0.684 106.4 54.5 -96.8 -51.0 16.9 8.0 21.6 61 68 A Q H ><5S+ 0 0 138 -4,-1.6 3,-0.8 -5,-0.4 -2,-0.2 0.892 110.7 49.9 -43.0 -40.7 17.4 11.6 22.7 62 69 A Y T 3<5S+ 0 0 97 -4,-1.5 -1,-0.3 1,-0.2 -3,-0.1 0.689 113.0 43.3 -76.8 -20.0 13.9 11.2 24.2 63 70 A T T X45S- 0 0 8 -3,-1.8 3,-1.0 -5,-0.0 -1,-0.2 0.252 109.1-114.8-108.1 10.9 14.6 7.9 26.1 64 71 A R T <<5S- 0 0 234 -3,-0.8 -3,-0.2 -4,-0.8 3,-0.1 0.764 76.2 -55.1 59.2 27.4 18.1 8.9 27.5 65 72 A G T 3 - 0 0 65 -3,-1.0 4,-2.6 -6,-0.3 -1,-0.2 -0.686 28.6-166.6 -85.7 91.8 17.4 3.3 26.6 67 74 A Q H > S+ 0 0 61 -2,-1.3 4,-1.7 1,-0.2 -1,-0.2 0.750 82.0 58.5 -48.4 -30.6 17.3 1.0 23.6 68 75 A T H > S+ 0 0 65 2,-0.2 4,-1.9 1,-0.1 3,-0.3 0.986 111.7 34.9 -71.8 -54.9 14.5 -1.0 25.2 69 76 A R H > S+ 0 0 116 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.937 111.8 65.7 -64.6 -45.8 11.9 1.8 25.6 70 77 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.890 106.5 41.0 -27.0 -61.0 13.3 3.3 22.3 71 78 A A H X>S+ 0 0 1 -4,-1.7 5,-1.5 -3,-0.3 4,-1.3 0.903 111.0 55.4 -64.5 -43.7 11.9 0.2 20.6 72 79 A L H <5S+ 0 0 114 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.873 109.9 48.2 -59.5 -39.0 8.6 0.1 22.5 73 80 A M H <5S+ 0 0 11 -4,-3.0 69,-2.3 1,-0.2 -1,-0.2 0.952 114.6 44.1 -63.2 -54.6 8.0 3.7 21.4 74 81 A M H <5S- 0 0 3 -4,-2.2 69,-0.8 -5,-0.3 70,-0.4 0.566 106.7-128.9 -69.1 -10.2 8.8 2.9 17.8 75 82 A G T <5S+ 0 0 48 -4,-1.3 2,-0.2 1,-0.2 -3,-0.2 0.734 70.2 112.0 68.5 20.0 6.8 -0.3 17.9 76 83 A I S - 0 0 107 -2,-0.2 4,-2.3 1,-0.1 5,-0.3 -0.437 27.4-128.6 -79.3 133.8 12.0 -5.1 17.8 78 85 A R H > S+ 0 0 162 -2,-0.2 4,-1.1 1,-0.2 -1,-0.1 0.761 112.7 47.5 -38.2 -34.4 14.8 -4.6 20.4 79 86 A G H >> S+ 0 0 36 2,-0.2 4,-1.9 1,-0.2 3,-1.2 0.984 107.0 49.4 -76.1 -64.3 17.0 -6.4 17.8 80 87 A T H 3> S+ 0 0 54 1,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.737 108.0 59.7 -51.2 -23.1 16.1 -4.7 14.6 81 88 A L H 3X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -1,-0.3 0.944 103.6 48.8 -68.0 -45.1 16.8 -1.4 16.6 82 89 A R H X>S+ 0 0 3 -4,-1.9 5,-1.1 2,-0.2 4,-1.0 0.971 110.0 47.4 -72.3 -56.9 21.7 1.7 14.8 86 93 A K H ><5S+ 0 0 153 -4,-3.0 3,-1.4 3,-0.2 -2,-0.2 0.912 106.8 60.6 -42.0 -51.7 24.6 -0.3 13.4 87 94 A K H 3<5S+ 0 0 118 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.850 118.9 26.1 -50.8 -46.1 23.4 0.7 9.8 88 95 A Y H <<5S- 0 0 40 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.344 116.6-115.1 -98.0 4.5 23.8 4.4 10.5 89 96 A G T <<5S+ 0 0 59 -3,-1.4 -3,-0.2 -4,-1.0 -2,-0.1 0.990 75.4 122.9 58.2 69.7 26.5 3.8 13.1 90 97 A M < 0 0 79 -5,-1.1 -4,-0.1 -8,-0.2 -5,-0.1 0.554 360.0 360.0-123.6 -18.2 24.9 5.0 16.3 91 98 A N 0 0 95 -9,-0.2 -5,-0.1 -8,-0.1 -8,-0.0 0.688 360.0 360.0 -81.2 360.0 24.9 2.1 18.8 92 !* 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 93 1 B M 0 0 240 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 177.5 35.5 20.2 -11.5 94 2 B F - 0 0 209 3,-0.0 2,-0.1 1,-0.0 3,-0.1 -0.773 360.0-141.1 -93.1 119.1 32.6 18.7 -9.5 95 3 B E - 0 0 187 -2,-0.7 2,-0.1 1,-0.1 -1,-0.0 -0.492 32.6 -99.8 -74.1 149.5 32.0 20.3 -6.2 96 4 B Q - 0 0 179 -2,-0.1 2,-0.4 1,-0.0 -1,-0.1 -0.440 32.3-164.4 -75.0 144.6 31.0 17.9 -3.5 97 5 B R - 0 0 160 -2,-0.1 5,-0.1 -3,-0.1 -1,-0.0 -0.951 11.8-146.7-131.0 113.0 27.4 17.5 -2.5 98 6 B V - 0 0 75 -2,-0.4 3,-0.4 1,-0.1 4,-0.2 -0.179 24.5-114.2 -76.3 170.0 26.7 15.7 0.8 99 7 B N S >> S+ 0 0 102 1,-0.3 3,-1.3 2,-0.2 4,-0.7 0.857 115.6 66.2 -78.1 -34.7 23.6 13.5 1.2 100 8 B S G >4 S+ 0 0 39 1,-0.2 3,-0.5 2,-0.2 19,-0.3 0.891 108.6 41.5 -37.5 -45.9 22.3 15.9 3.7 101 9 B D G 34 S+ 0 0 62 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.398 92.4 80.9 -99.5 3.1 22.0 18.3 0.8 102 10 B V G <4 S+ 0 0 36 -3,-1.3 2,-0.4 -4,-0.2 -1,-0.2 0.690 100.2 39.8 -79.6 -18.8 20.7 16.0 -1.9 103 11 B L S << S+ 0 0 1 -4,-0.7 16,-3.1 -3,-0.5 2,-0.3 -0.869 83.9 169.3-130.8 102.1 17.1 16.4 -0.5 104 12 B T E -B 118 0B 13 -2,-0.4 2,-0.4 -77,-0.4 -74,-0.2 -0.753 28.5-157.1-125.9 164.4 16.3 19.9 0.6 105 13 B V E -B 117 0B 12 12,-2.1 12,-0.9 -2,-0.3 -82,-0.1 -0.977 32.0-117.0-143.1 115.3 13.5 22.1 1.6 106 14 B S E +B 116 0B 48 -2,-0.4 2,-0.3 10,-0.2 10,-0.3 -0.214 36.9 179.0 -65.8 142.8 13.7 25.9 1.3 107 15 B T E -B 115 0B 42 8,-2.7 8,-1.9 6,-0.1 2,-0.3 -0.973 29.2-115.9-143.6 153.7 13.5 28.0 4.5 108 16 B V E -B 114 0B 59 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.690 37.9-154.4 -89.7 146.3 13.6 31.7 5.6 109 17 B N > - 0 0 50 4,-1.0 3,-1.2 -2,-0.3 -1,-0.0 -0.454 34.2 -79.0-117.9-174.9 16.6 32.7 7.8 110 18 B S T 3 S+ 0 0 110 1,-0.3 2,-0.2 2,-0.2 -2,-0.0 0.773 132.0 43.3 -58.3 -32.2 17.7 35.3 10.4 111 19 B Q T 3 S- 0 0 136 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 -0.455 123.2-104.6-105.0 54.1 18.3 37.9 7.7 112 20 B D S < S+ 0 0 108 -3,-1.2 2,-0.4 -2,-0.2 -2,-0.2 0.779 76.8 148.0 16.2 57.9 15.0 36.9 6.0 113 21 B Q - 0 0 125 -6,-0.0 2,-1.1 0, 0.0 -4,-1.0 -0.927 54.1-116.7-117.6 137.5 17.3 35.2 3.4 114 22 B V E +B 108 0B 105 -2,-0.4 -6,-0.2 -6,-0.2 2,-0.1 -0.614 41.7 172.9 -89.6 99.0 16.1 32.1 1.6 115 23 B T E -B 107 0B 51 -8,-1.9 -8,-2.7 -2,-1.1 2,-0.3 -0.313 28.7-127.7 -95.3-179.2 18.4 29.1 2.5 116 24 B Q E -B 106 0B 79 -10,-0.3 -10,-0.2 -2,-0.1 -2,-0.0 -0.689 27.1-175.0-139.5 78.8 18.0 25.4 1.7 117 25 B K E -B 105 0B 94 -12,-0.9 -12,-2.1 -2,-0.3 5,-0.1 -0.434 32.3 -91.0 -91.4 149.8 18.2 22.9 4.6 118 26 B P E >> -B 104 0B 23 0, 0.0 3,-1.3 0, 0.0 4,-0.7 -0.127 28.6-120.2 -50.1 146.2 18.1 19.1 4.4 119 27 B L H >> S+ 0 0 0 -16,-3.1 3,-2.2 -19,-0.3 4,-1.2 0.940 107.3 79.2 -49.9 -46.7 14.9 17.2 4.7 120 28 B R H 3> S+ 0 0 54 1,-0.3 4,-2.3 -17,-0.3 -1,-0.3 0.738 89.8 51.6 -24.7 -52.6 16.5 15.6 7.8 121 29 B D H <> S+ 0 0 47 -3,-1.3 4,-4.0 2,-0.2 5,-0.4 0.840 103.9 55.7 -68.9 -35.1 15.6 18.7 9.8 122 30 B S H X S+ 0 0 90 -4,-2.3 4,-1.7 -5,-0.4 3,-0.6 0.994 113.2 38.0 -63.3 -63.6 13.7 16.5 13.0 125 33 B Q H 3X S+ 0 0 83 -4,-4.0 4,-2.1 1,-0.2 -2,-0.2 0.814 111.8 62.6 -61.9 -29.6 11.6 19.5 13.9 126 34 B A H 3X S+ 0 0 0 -4,-3.2 4,-1.2 -5,-0.4 -121,-0.5 0.905 108.2 40.1 -60.2 -45.6 8.4 17.5 13.2 127 35 B L H < S+ 0 0 28 -4,-1.8 3,-1.3 -3,-0.3 -2,-0.2 0.933 111.4 56.8 -72.8 -50.0 6.9 15.4 21.6 132 40 B A H 3< S+ 0 0 68 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.935 112.1 37.8 -47.0 -65.0 6.3 18.9 22.8 133 41 B Q T 3< S+ 0 0 184 -4,-2.1 -1,-0.3 -5,-0.1 2,-0.2 0.416 110.6 79.0 -79.8 6.4 2.5 18.9 22.4 134 42 B L < + 0 0 18 -3,-1.3 2,-0.1 -5,-0.2 -3,-0.0 -0.659 58.2 177.1 -87.7 159.8 2.4 15.3 23.6 135 43 B N - 0 0 134 -2,-0.2 -3,-0.1 0, 0.0 -4,-0.0 -0.434 61.0 -24.0-166.4 112.0 2.7 14.4 27.3 136 44 B G S S+ 0 0 73 1,-0.3 3,-0.1 -2,-0.1 -2,-0.0 0.237 85.4 143.7 89.9 -11.2 2.6 11.0 29.0 137 45 B Q - 0 0 124 1,-0.1 2,-0.6 2,-0.0 -1,-0.3 -0.281 61.2-104.7 -67.9 144.0 0.6 9.1 26.3 138 46 B D - 0 0 136 1,-0.1 2,-0.6 2,-0.0 -1,-0.1 -0.583 40.2-175.1 -62.2 112.2 1.2 5.5 25.3 139 47 B V + 0 0 15 -2,-0.6 3,-0.3 1,-0.1 -64,-0.2 -0.863 19.6 153.0-118.7 91.7 3.0 5.9 22.0 140 48 B N + 0 0 84 -2,-0.6 -1,-0.1 1,-0.2 3,-0.1 0.372 66.3 45.2-103.4 5.0 3.5 2.3 20.7 141 49 B D > + 0 0 71 2,-0.1 4,-2.0 1,-0.1 -67,-0.2 -0.033 60.3 133.9-145.3 26.7 3.7 2.9 16.9 142 50 B L H > S+ 0 0 0 -69,-2.3 4,-1.8 -3,-0.3 -68,-0.2 0.793 72.3 55.1 -63.8 -33.2 6.0 5.9 16.2 143 51 B Y H > S+ 0 0 32 -69,-0.8 4,-2.9 2,-0.2 3,-0.2 0.985 109.3 45.0 -64.1 -57.3 7.9 4.2 13.4 144 52 B E H > S+ 0 0 96 -70,-0.4 4,-3.0 1,-0.2 5,-0.3 0.901 109.6 56.3 -55.5 -45.9 4.9 3.4 11.2 145 53 B L H < S+ 0 0 41 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.918 112.0 42.1 -53.0 -50.8 3.4 6.8 11.7 146 54 B V H >X S+ 0 0 9 -4,-1.8 3,-1.8 -3,-0.2 4,-1.1 0.953 115.5 52.0 -53.6 -55.1 6.6 8.5 10.4 147 55 B L H >X S+ 0 0 26 -4,-2.9 3,-2.8 1,-0.3 4,-2.8 0.952 106.2 50.1 -53.6 -62.9 6.8 5.9 7.6 148 56 B A H 3< S+ 0 0 20 -4,-3.0 4,-0.4 1,-0.3 -1,-0.3 0.590 109.4 56.3 -53.8 -10.5 3.3 6.3 6.4 149 57 B E H <4 S+ 0 0 11 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.714 115.9 34.4 -86.6 -22.3 4.1 10.1 6.3 150 58 B V H S+ 0 0 62 -4,-0.4 4,-3.2 -5,-0.3 3,-0.3 0.859 110.7 34.1 -38.5 -66.1 2.7 8.4 0.7 153 61 B P H > S+ 0 0 2 0, 0.0 4,-4.9 0, 0.0 5,-0.4 0.867 111.5 60.6 -62.9 -48.4 4.4 11.3 -1.1 154 62 B L H X S+ 0 0 2 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.910 116.6 36.1 -41.9 -48.2 7.4 9.4 -2.4 155 63 B L H X S+ 0 0 2 -4,-2.7 4,-2.5 -3,-0.3 5,-0.3 0.946 114.6 55.3 -71.0 -51.1 4.8 7.3 -4.1 156 64 B D H X S+ 0 0 56 -4,-3.2 4,-1.2 -5,-0.3 -2,-0.2 0.932 118.2 36.5 -43.3 -49.7 2.5 10.2 -4.9 157 65 B M H X S+ 0 0 17 -4,-4.9 4,-1.7 2,-0.2 -1,-0.2 0.887 113.0 53.7 -78.2 -42.4 5.5 11.9 -6.6 158 66 B V H X S+ 0 0 0 -4,-2.4 4,-0.8 -5,-0.4 3,-0.2 0.947 110.1 49.4 -61.9 -45.7 7.2 9.0 -8.2 159 67 B M H ><>S+ 0 0 27 -4,-2.5 5,-2.6 1,-0.2 3,-0.7 0.866 108.7 51.6 -57.9 -43.5 4.0 7.9 -10.0 160 68 B Q H ><5S+ 0 0 127 -4,-1.2 3,-0.9 -5,-0.3 -1,-0.2 0.862 109.4 52.8 -60.8 -35.3 3.3 11.4 -11.3 161 69 B Y H 3<5S+ 0 0 96 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.555 113.3 40.6 -78.6 -14.4 6.9 11.4 -12.7 162 70 B T T X<5S- 0 0 4 -4,-0.8 3,-2.2 -3,-0.7 -1,-0.2 0.126 110.4-122.9-113.4 17.9 6.5 8.1 -14.6 163 71 B R T < 5S- 0 0 198 -3,-0.9 -3,-0.2 1,-0.3 -4,-0.1 0.859 78.4 -40.6 35.7 53.4 2.9 9.2 -15.7 164 72 B G T 3 - 0 0 58 -3,-2.2 4,-1.8 -6,-0.3 3,-0.2 -0.526 25.4-177.2 -79.7 109.9 4.1 3.4 -15.1 166 74 B Q H > S+ 0 0 58 -2,-0.7 4,-3.2 1,-0.2 5,-0.4 0.973 76.0 62.7 -65.5 -57.1 4.7 1.0 -12.2 167 75 B T H > S+ 0 0 81 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.768 111.2 42.1 -45.5 -33.5 7.4 -1.1 -13.6 168 76 B R H > S+ 0 0 123 -3,-0.2 4,-4.7 2,-0.2 5,-0.3 0.963 110.8 51.4 -75.4 -58.7 9.6 2.0 -13.8 169 77 B A H X S+ 0 0 0 -4,-1.8 4,-3.9 1,-0.3 5,-0.2 0.917 112.9 49.1 -46.2 -47.7 8.8 3.5 -10.4 170 78 B A H <>S+ 0 0 3 -4,-3.2 5,-2.5 2,-0.2 4,-0.5 0.917 115.5 42.1 -58.0 -46.0 9.6 0.1 -8.9 171 79 B L H ><5S+ 0 0 123 -4,-1.3 3,-0.6 -5,-0.4 -2,-0.2 0.901 116.9 49.6 -68.6 -40.3 12.9 -0.1 -10.8 172 80 B M H 3<5S+ 0 0 19 -4,-4.7 -129,-1.3 1,-0.2 -2,-0.2 0.911 111.1 47.4 -65.8 -44.1 13.5 3.6 -10.0 173 81 B M T 3<5S- 0 0 1 -4,-3.9 -129,-1.7 -5,-0.3 -128,-0.6 0.584 111.7-121.6 -72.8 -5.9 12.8 3.2 -6.3 174 82 B G T < 5S+ 0 0 25 -3,-0.6 2,-0.3 -4,-0.5 -3,-0.2 0.947 72.2 117.4 59.5 51.9 15.0 0.1 -6.2 175 83 B I S - 0 0 119 -2,-0.3 4,-1.3 1,-0.1 5,-0.1 -0.159 33.3-127.0 -52.6 141.3 10.3 -5.3 -6.3 177 85 B R H > S+ 0 0 136 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.843 109.6 56.7 -63.3 -35.0 7.3 -4.6 -8.4 178 86 B G H > S+ 0 0 41 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.964 106.7 47.8 -57.8 -53.2 5.1 -6.8 -6.2 179 87 B T H > S+ 0 0 59 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.720 107.8 57.4 -66.2 -19.7 6.0 -4.8 -3.1 180 88 B L H X S+ 0 0 1 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.931 106.7 47.4 -70.5 -45.3 5.3 -1.6 -5.0 181 89 B R H X S+ 0 0 126 -4,-2.0 4,-2.4 1,-0.2 5,-0.3 0.944 109.6 55.4 -63.7 -41.8 1.8 -2.7 -5.7 182 90 B K H X S+ 0 0 111 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.945 109.9 44.4 -49.5 -57.1 1.5 -3.7 -2.1 183 91 B K H X S+ 0 0 25 -4,-1.9 4,-1.1 2,-0.2 -1,-0.2 0.871 112.7 52.2 -59.7 -40.9 2.4 -0.2 -0.9 184 92 B L H >X S+ 0 0 1 -4,-2.5 3,-2.7 1,-0.2 4,-0.6 0.995 107.1 50.7 -58.4 -66.7 0.1 1.5 -3.5 185 93 B K H >< S+ 0 0 166 -4,-2.4 3,-1.0 1,-0.3 -1,-0.2 0.783 104.8 61.9 -37.5 -40.6 -2.9 -0.6 -2.5 186 94 B K H 3< S+ 0 0 88 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.839 118.2 25.2 -56.1 -39.0 -2.1 0.4 1.2 187 95 B Y H << S- 0 0 40 -3,-2.7 2,-0.7 -4,-1.1 -1,-0.2 0.217 110.5-117.0-109.0 13.1 -2.7 4.1 0.4 188 96 B G << + 0 0 37 -3,-1.0 -1,-0.4 -4,-0.6 -2,-0.1 -0.786 65.9 138.2 77.7-118.3 -5.0 3.7 -2.6 189 97 B M 0 0 69 -2,-0.7 -4,-0.1 1,-0.2 -1,-0.1 0.575 360.0 360.0 55.2 9.1 -3.0 5.2 -5.5 190 98 B N 0 0 160 -6,-0.2 -1,-0.2 -5,-0.1 -5,-0.1 0.713 360.0 360.0 -65.2 360.0 -4.2 2.3 -7.8