==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 19-DEC-12 4IHY . COMPND 2 MOLECULE: DNA-BINDING PROTEIN FIS; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.P.HANCOCK,D.CASCIO,R.C.JOHNSON . 189 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11540.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 142 75.1 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 . 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 . 13 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 47.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.2 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 0 2 0 2 0 0 0 1 1 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 . 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 0 168 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -63.5 5.9 16.4 -12.6 2 9 A D - 0 0 63 1,-0.1 3,-0.1 17,-0.0 16,-0.0 -0.788 360.0-169.1 -96.8 142.4 2.3 15.9 -11.5 3 10 A V S S+ 0 0 61 -2,-0.4 2,-0.7 1,-0.2 -1,-0.1 0.639 73.9 63.7-106.4 -18.3 -0.3 14.9 -14.1 4 11 A L S S+ 0 0 2 141,-0.1 16,-2.4 125,-0.0 17,-0.4 -0.878 71.0 143.2-112.3 99.3 -3.5 15.3 -12.0 5 12 A T E -A 19 0A 18 -2,-0.7 2,-0.3 121,-0.4 124,-0.2 -0.844 33.0-150.5-133.1 164.4 -3.8 19.0 -11.1 6 13 A V E -A 18 0A 6 12,-2.4 12,-2.2 -2,-0.3 2,-0.5 -0.884 28.5 -99.7-133.6 167.8 -6.5 21.6 -10.6 7 14 A S E -A 17 0A 47 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.755 37.0-178.5-101.6 133.0 -6.7 25.3 -11.0 8 15 A T E -A 16 0A 26 8,-2.9 8,-2.2 -2,-0.5 2,-0.4 -0.846 14.0-148.5-121.6 154.9 -6.4 27.6 -8.0 9 16 A V E -A 15 0A 67 -2,-0.3 6,-0.2 6,-0.2 2,-0.2 -0.996 10.8-159.4-125.0 139.1 -6.5 31.4 -7.6 10 17 A N > - 0 0 60 4,-1.6 3,-1.7 -2,-0.4 4,-0.1 -0.504 42.3 -85.3-103.0 175.6 -4.7 33.5 -4.9 11 18 A S T 3 S+ 0 0 121 1,-0.3 2,-0.4 -2,-0.2 -1,-0.0 0.879 126.0 57.9 -45.8 -48.3 -5.4 37.0 -3.6 12 19 A Q T 3 S- 0 0 148 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.092 116.4-112.4 -76.4 27.6 -3.3 38.6 -6.4 13 20 A D < + 0 0 126 -3,-1.7 2,-0.3 -2,-0.4 -2,-0.1 0.610 68.5 146.1 50.4 17.1 -5.7 36.9 -9.0 14 21 A Q - 0 0 110 -4,-0.1 -4,-1.6 1,-0.0 2,-0.5 -0.615 43.8-138.4 -77.5 139.4 -2.9 34.7 -10.3 15 22 A V E +A 9 0A 100 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.885 30.7 168.5-101.3 134.2 -4.0 31.2 -11.4 16 23 A T E -A 8 0A 65 -8,-2.2 -8,-2.9 -2,-0.5 2,-0.3 -0.968 31.4-112.4-143.9 150.6 -1.8 28.3 -10.4 17 24 A Q E -A 7 0A 81 -2,-0.3 -10,-0.2 -10,-0.2 -12,-0.0 -0.674 26.4-176.2 -89.1 142.3 -2.0 24.5 -10.4 18 25 A K E -A 6 0A 64 -12,-2.2 -12,-2.4 -2,-0.3 5,-0.1 -0.983 36.7 -97.2-129.0 149.3 -2.3 22.3 -7.3 19 26 A P E >> -A 5 0A 24 0, 0.0 3,-1.2 0, 0.0 4,-0.9 -0.329 25.9-125.0 -65.5 145.5 -2.3 18.6 -7.2 20 27 A L H >> S+ 0 0 1 -16,-2.4 4,-2.4 1,-0.2 3,-0.8 0.862 110.0 68.0 -50.1 -39.4 -5.7 16.9 -7.0 21 28 A R H 3> S+ 0 0 62 -17,-0.4 4,-2.5 1,-0.3 -1,-0.2 0.873 95.7 55.6 -53.4 -36.3 -4.5 15.0 -3.9 22 29 A D H <> S+ 0 0 78 -3,-1.2 4,-2.1 2,-0.2 -1,-0.3 0.844 107.0 49.1 -63.1 -39.5 -4.4 18.4 -2.1 23 30 A S H + 0 0 78 1,-0.1 4,-1.6 132,-0.1 131,-0.2 -0.629 64.1 155.1-129.3 77.6 -17.7 3.7 5.4 43 50 A L H > S+ 0 0 0 129,-2.6 4,-2.6 -2,-0.4 5,-0.2 0.787 73.4 56.7 -77.6 -28.3 -15.3 6.4 4.4 44 51 A Y H > S+ 0 0 30 129,-2.4 4,-2.7 128,-0.2 5,-0.2 0.950 109.4 43.1 -70.0 -49.6 -13.6 4.4 1.7 45 52 A E H > S+ 0 0 79 128,-0.7 4,-2.8 2,-0.2 5,-0.3 0.882 113.1 57.4 -60.7 -36.4 -16.7 3.7 -0.2 46 53 A L H X S+ 0 0 44 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.985 112.2 37.0 -55.8 -63.1 -17.7 7.3 0.3 47 54 A V H X S+ 0 0 1 -4,-2.6 4,-1.0 1,-0.2 5,-0.2 0.918 116.8 53.4 -57.1 -46.3 -14.6 8.8 -1.2 48 55 A L H >X S+ 0 0 22 -4,-2.7 4,-2.8 1,-0.3 3,-0.8 0.902 109.6 46.6 -58.4 -46.4 -14.4 6.1 -3.9 49 56 A A H 3X S+ 0 0 22 -4,-2.8 4,-1.1 1,-0.3 -1,-0.3 0.808 111.8 54.3 -64.3 -31.0 -18.0 6.7 -5.0 50 57 A E H 3< S+ 0 0 4 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.698 116.7 35.6 -74.2 -18.6 -17.2 10.4 -5.0 51 58 A V H S+ 0 0 5 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.726 115.4 56.5 -76.8 -15.5 -16.6 11.9 -12.3 55 62 A L H X S+ 0 0 1 -4,-0.8 4,-1.4 -3,-0.3 3,-0.2 0.956 112.0 39.9 -72.9 -51.8 -13.9 9.5 -13.6 56 63 A L H X S+ 0 0 1 -4,-3.2 4,-1.9 1,-0.2 3,-0.3 0.918 114.1 57.0 -58.1 -44.4 -16.4 7.3 -15.5 57 64 A D H X S+ 0 0 66 -4,-2.2 4,-0.7 -5,-0.4 -1,-0.2 0.850 109.3 43.7 -56.3 -39.6 -18.2 10.5 -16.6 58 65 A M H X S+ 0 0 11 -4,-1.4 4,-1.5 -3,-0.2 -1,-0.2 0.697 114.7 47.1 -84.3 -22.9 -15.1 12.1 -18.2 59 66 A V H X S+ 0 0 0 -4,-1.4 4,-1.6 -3,-0.3 6,-0.3 0.682 110.1 52.3 -93.0 -17.7 -13.9 9.0 -20.0 60 67 A M H <>S+ 0 0 37 -4,-1.9 5,-0.9 -5,-0.2 -2,-0.2 0.743 113.8 45.7 -79.5 -24.3 -17.3 8.2 -21.4 61 68 A Q H ><5S+ 0 0 128 -4,-0.7 3,-1.3 -5,-0.3 -2,-0.2 0.920 114.3 48.2 -77.3 -44.6 -17.4 11.7 -22.6 62 69 A Y H 3<5S+ 0 0 90 -4,-1.5 -2,-0.2 1,-0.3 -3,-0.2 0.840 114.3 43.3 -68.5 -36.1 -13.9 11.5 -24.0 63 70 A T T ><5S- 0 0 5 -4,-1.6 3,-2.4 3,-0.1 -1,-0.3 0.224 109.6-123.8 -93.7 13.7 -14.3 8.2 -25.8 64 71 A R T < 5S- 0 0 235 -3,-1.3 -3,-0.2 1,-0.3 -4,-0.1 0.669 75.6 -43.2 53.5 23.1 -17.7 9.4 -27.1 65 72 A G T 3 - 0 0 71 -3,-2.4 4,-2.4 1,-0.2 -1,-0.2 -0.494 30.1-172.7 -69.3 101.3 -17.0 3.7 -26.6 67 74 A Q H > S+ 0 0 53 -2,-1.0 4,-2.5 1,-0.2 -1,-0.2 0.769 81.9 56.5 -66.0 -25.5 -16.8 1.4 -23.6 68 75 A T H > S+ 0 0 73 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.940 110.6 40.8 -73.9 -46.3 -14.0 -0.5 -25.1 69 76 A R H > S+ 0 0 125 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.932 116.2 53.0 -65.2 -45.8 -11.6 2.5 -25.6 70 77 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.969 108.4 47.8 -51.1 -60.8 -12.7 3.8 -22.2 71 78 A A H X>S+ 0 0 5 -4,-2.5 5,-1.7 1,-0.2 4,-1.5 0.849 112.0 52.6 -52.4 -34.3 -11.9 0.5 -20.4 72 79 A L H <5S+ 0 0 121 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.918 108.7 47.2 -70.0 -43.8 -8.5 0.5 -22.2 73 80 A M H <5S+ 0 0 13 -4,-2.5 69,-2.9 -3,-0.3 70,-0.2 0.907 114.6 47.7 -60.4 -43.8 -7.6 4.0 -21.1 74 81 A M H <5S- 0 0 2 -4,-2.6 69,-1.4 67,-0.2 70,-0.6 0.790 105.9-132.1 -71.7 -25.3 -8.6 3.2 -17.6 75 82 A G T <5 + 0 0 50 -4,-1.5 2,-0.3 1,-0.3 -3,-0.2 0.778 65.7 117.1 79.0 27.1 -6.6 -0.1 -17.7 76 83 A I S - 0 0 107 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.423 31.3-127.7 -71.4 136.8 -11.6 -5.0 -17.6 78 85 A R H > S+ 0 0 145 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.859 113.7 49.6 -48.8 -40.7 -14.5 -4.2 -20.0 79 86 A G H > S+ 0 0 34 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.932 107.5 53.6 -65.8 -47.1 -16.8 -6.2 -17.7 80 87 A T H > S+ 0 0 54 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.907 109.0 49.8 -48.4 -48.8 -15.5 -4.3 -14.6 81 88 A L H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.875 108.1 52.3 -63.6 -39.2 -16.4 -1.1 -16.4 82 89 A R H X S+ 0 0 133 -4,-2.0 4,-2.5 -5,-0.2 3,-0.2 0.978 109.8 50.4 -55.6 -54.2 -19.8 -2.4 -17.2 83 90 A K H X S+ 0 0 149 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.869 110.4 48.5 -47.7 -50.6 -20.2 -3.2 -13.5 84 91 A K H X S+ 0 0 36 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.856 111.5 49.7 -65.3 -37.5 -19.1 0.3 -12.4 85 92 A L H <>S+ 0 0 4 -4,-2.2 5,-1.8 -3,-0.2 -1,-0.2 0.886 111.0 48.3 -70.1 -38.8 -21.5 2.0 -14.8 86 93 A K H ><5S+ 0 0 132 -4,-2.5 3,-1.4 1,-0.2 -2,-0.2 0.934 107.9 59.0 -63.5 -42.8 -24.4 -0.1 -13.7 87 94 A K H 3<5S+ 0 0 107 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.811 113.7 34.0 -53.9 -41.1 -23.4 0.8 -10.1 88 95 A Y T 3<5S- 0 0 36 -4,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.239 110.5-121.8-103.6 12.3 -23.8 4.5 -10.6 89 96 A G T < 5 + 0 0 53 -3,-1.4 2,-1.0 1,-0.2 -3,-0.2 0.761 65.6 140.4 56.2 28.8 -26.6 4.1 -13.0 90 97 A M < 0 0 58 -5,-1.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.814 360.0 360.0 -98.0 87.7 -24.9 5.9 -15.9 91 98 A N 0 0 128 -2,-1.0 -1,-0.2 -3,-0.1 -5,-0.1 0.082 360.0 360.0 178.3 360.0 -26.1 3.5 -18.6 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 0 229 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -35.4 -35.0 20.8 11.7 94 2 B F - 0 0 196 3,-0.0 2,-0.2 0, 0.0 3,-0.0 -0.822 360.0-155.2-102.8 111.8 -32.7 18.8 9.3 95 3 B E - 0 0 188 -2,-0.7 2,-0.2 1,-0.1 0, 0.0 -0.554 32.6-101.1 -78.5 146.5 -31.8 20.4 6.0 96 4 B Q - 0 0 172 -2,-0.2 2,-0.4 1,-0.0 -1,-0.1 -0.465 33.8-171.6 -71.2 137.8 -30.8 18.0 3.3 97 5 B R - 0 0 141 -2,-0.2 5,-0.1 -3,-0.0 2,-0.0 -0.946 16.6-150.5-129.0 108.3 -27.1 17.6 2.6 98 6 B V >> - 0 0 71 -2,-0.4 3,-2.3 1,-0.1 4,-0.6 -0.290 27.0-100.8 -84.9 168.3 -26.5 15.5 -0.5 99 7 B N H >> S+ 0 0 107 1,-0.3 3,-0.9 2,-0.2 4,-0.8 0.822 120.7 56.9 -57.3 -38.4 -23.6 13.2 -1.3 100 8 B S H 34 S+ 0 0 36 1,-0.2 19,-0.3 2,-0.1 -1,-0.3 0.642 108.2 51.9 -65.5 -11.5 -21.9 15.7 -3.5 101 9 B D H <4 S+ 0 0 51 -3,-2.3 -1,-0.2 17,-0.1 -2,-0.2 0.538 91.0 73.7-106.6 -7.2 -21.9 18.1 -0.5 102 10 B V H << S+ 0 0 28 -3,-0.9 2,-0.7 -4,-0.6 -2,-0.1 0.920 103.4 37.6 -68.1 -49.7 -20.4 15.8 2.1 103 11 B L S < S+ 0 0 1 -4,-0.8 16,-2.1 -57,-0.1 17,-0.3 -0.904 88.7 164.3-105.0 106.1 -16.8 16.0 0.7 104 12 B T E -B 118 0B 3 -2,-0.7 2,-0.3 -77,-0.4 -74,-0.2 -0.838 29.1-148.4-129.3 164.7 -16.3 19.6 -0.5 105 13 B V E -B 117 0B 8 12,-2.5 12,-2.7 -2,-0.3 2,-0.7 -0.956 28.7-109.6-130.4 140.8 -13.6 22.1 -1.5 106 14 B S E +B 116 0B 56 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.632 40.3 179.2 -77.2 116.2 -13.5 25.9 -1.2 107 15 B T E -B 115 0B 43 8,-3.0 8,-2.4 -2,-0.7 2,-0.4 -0.733 22.0-136.0-106.9 162.4 -13.8 27.7 -4.5 108 16 B V E -B 114 0B 70 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.978 25.0-155.7-118.8 128.4 -13.8 31.4 -5.3 109 17 B N > - 0 0 48 4,-1.7 3,-2.5 -2,-0.4 4,-0.1 -0.286 39.2 -74.9 -98.8-176.0 -16.4 32.8 -7.8 110 18 B S T 3 S+ 0 0 107 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.296 130.6 44.3 -58.9 8.8 -16.9 35.8 -10.1 111 19 B Q T 3 S- 0 0 127 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.135 115.9-105.9-138.6 16.1 -17.6 38.0 -7.1 112 20 B D S < S+ 0 0 122 -3,-2.5 2,-0.5 1,-0.2 -2,-0.1 0.909 73.5 143.2 49.8 44.5 -14.8 36.9 -4.7 113 21 B Q - 0 0 118 -4,-0.1 -4,-1.7 2,-0.0 2,-0.4 -0.966 49.4-130.0-108.0 129.5 -17.3 35.0 -2.6 114 22 B V E +B 108 0B 102 -2,-0.5 2,-0.3 -6,-0.2 -6,-0.2 -0.664 33.7 172.1 -85.6 131.9 -16.1 31.8 -1.1 115 23 B T E -B 107 0B 45 -8,-2.4 -8,-3.0 -2,-0.4 2,-0.5 -0.978 32.8-117.6-139.3 147.5 -18.3 28.7 -1.7 116 24 B Q E -B 106 0B 65 -2,-0.3 -10,-0.2 -10,-0.2 -12,-0.0 -0.765 33.1-176.0 -87.5 126.4 -18.0 25.0 -1.1 117 25 B K E -B 105 0B 77 -12,-2.7 -12,-2.5 -2,-0.5 5,-0.1 -0.956 33.7 -84.5-126.1 144.3 -18.2 22.8 -4.2 118 26 B P E > -B 104 0B 20 0, 0.0 4,-1.0 0, 0.0 3,-0.4 0.119 23.4-129.9 -40.7 147.5 -18.2 19.0 -4.5 119 27 B L H > S+ 0 0 0 -16,-2.1 4,-2.5 -19,-0.3 3,-0.3 0.848 108.9 71.0 -64.4 -33.7 -15.0 17.0 -4.6 120 28 B R H > S+ 0 0 50 -17,-0.3 4,-3.0 1,-0.2 -1,-0.2 0.890 96.0 50.9 -42.1 -49.4 -16.6 15.4 -7.7 121 29 B D H > S+ 0 0 79 -3,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.853 105.7 53.2 -68.2 -39.0 -15.9 18.7 -9.5 122 30 B S H X S+ 0 0 14 -4,-1.0 4,-2.5 -3,-0.3 -1,-0.2 0.940 112.6 44.9 -57.3 -50.8 -12.3 18.9 -8.4 123 31 B V H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.975 111.4 54.6 -54.3 -54.4 -11.7 15.4 -9.8 124 32 B K H X S+ 0 0 80 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.881 111.3 43.9 -44.7 -50.5 -13.7 16.4 -13.0 125 33 B Q H X S+ 0 0 73 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.908 108.3 56.4 -68.0 -42.9 -11.5 19.4 -13.6 126 34 B A H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -121,-0.4 0.904 113.0 43.7 -54.5 -40.6 -8.2 17.5 -13.0 127 35 B L H X S+ 0 0 1 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.912 109.4 54.3 -71.0 -45.3 -9.3 15.1 -15.7 128 36 B K H X S+ 0 0 135 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.918 113.9 43.8 -54.6 -43.2 -10.5 17.7 -18.1 129 37 B N H X S+ 0 0 50 -4,-2.7 4,-1.3 -124,-0.2 -1,-0.2 0.858 110.6 54.2 -68.8 -37.9 -7.1 19.4 -17.8 130 38 B Y H < S+ 0 0 31 -4,-1.7 -2,-0.2 -5,-0.3 -1,-0.2 0.862 114.4 42.6 -64.0 -35.7 -5.3 16.0 -18.1 131 39 B F H >< S+ 0 0 20 -4,-2.6 3,-2.0 1,-0.2 -2,-0.2 0.980 113.2 48.7 -71.2 -63.0 -7.2 15.3 -21.3 132 40 B A H 3< S+ 0 0 82 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.713 111.6 53.1 -51.8 -21.4 -6.8 18.8 -22.9 133 41 B Q T 3< S+ 0 0 132 -4,-1.3 2,-0.6 -5,-0.2 -1,-0.3 -0.036 87.3 99.6-105.1 32.1 -3.1 18.6 -22.0 134 42 B L < - 0 0 17 -3,-2.0 2,-0.7 2,-0.1 -1,-0.1 -0.820 57.3-162.7-124.7 87.7 -2.7 15.3 -23.8 135 43 B N - 0 0 157 -2,-0.6 -3,-0.0 1,-0.2 -4,-0.0 -0.858 60.8 -76.5-111.6 94.9 -1.2 15.6 -27.3 136 44 B G S S+ 0 0 59 -2,-0.7 -1,-0.2 1,-0.2 -2,-0.1 -0.864 82.3 123.5-158.5 29.6 -2.1 13.0 -28.0 137 45 B Q - 0 0 115 1,-0.2 -1,-0.2 0, 0.0 2,-0.1 0.064 61.2 -81.0 -69.4 175.4 -0.9 9.5 -27.2 138 46 B D - 0 0 137 2,-0.0 2,-0.4 1,-0.0 -1,-0.2 -0.364 34.0-142.4 -77.2 157.4 -2.8 6.6 -25.7 139 47 B V + 0 0 11 -2,-0.1 -64,-0.2 1,-0.1 3,-0.0 -0.943 18.0 177.4-117.2 142.0 -3.3 6.2 -21.9 140 48 B N S S+ 0 0 113 -2,-0.4 -66,-0.1 -66,-0.1 -67,-0.1 0.343 74.6 35.4-126.3 7.0 -3.2 2.7 -20.3 141 49 B D > + 0 0 65 -68,-0.1 4,-2.2 2,-0.1 -67,-0.2 -0.005 58.4 137.0-156.4 37.7 -3.7 3.3 -16.6 142 50 B L H > S+ 0 0 0 -69,-2.9 4,-2.6 1,-0.2 5,-0.3 0.881 78.7 53.2 -59.3 -37.1 -6.1 6.2 -15.9 143 51 B Y H > S+ 0 0 35 -69,-1.4 4,-3.0 -70,-0.2 -1,-0.2 0.962 110.9 41.7 -67.1 -52.3 -7.8 4.3 -13.2 144 52 B E H > S+ 0 0 87 -70,-0.6 4,-2.5 2,-0.2 5,-0.3 0.854 114.1 56.9 -63.5 -32.0 -4.7 3.4 -11.1 145 53 B L H X S+ 0 0 48 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.982 113.9 35.3 -59.3 -60.7 -3.5 6.9 -11.7 146 54 B V H X S+ 0 0 3 -4,-2.6 4,-1.5 1,-0.2 5,-0.2 0.925 116.3 57.3 -58.0 -46.1 -6.5 8.6 -10.3 147 55 B L H X S+ 0 0 24 -4,-3.0 4,-2.8 -5,-0.3 3,-0.3 0.874 109.2 42.9 -58.5 -43.6 -6.9 5.9 -7.7 148 56 B A H X S+ 0 0 19 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.901 110.8 56.6 -69.0 -40.2 -3.4 6.4 -6.2 149 57 B E H < S+ 0 0 18 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.760 116.6 36.4 -62.1 -24.4 -3.8 10.1 -6.4 150 58 B V H X S+ 0 0 6 -4,-1.5 4,-1.5 -3,-0.3 -2,-0.2 0.797 114.0 53.4 -99.9 -35.5 -6.9 9.8 -4.2 151 59 B E H X S+ 0 0 4 -4,-2.8 4,-2.8 -5,-0.2 5,-0.3 0.922 100.1 63.0 -62.6 -46.8 -5.9 6.9 -1.9 152 60 B Q H X S+ 0 0 77 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.915 110.5 36.5 -45.8 -52.9 -2.6 8.6 -0.8 153 61 B P H > S+ 0 0 6 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.836 114.9 54.9 -75.5 -29.9 -4.4 11.6 0.9 154 62 B L H X S+ 0 0 1 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.872 111.8 45.3 -64.5 -39.3 -7.3 9.5 2.2 155 63 B L H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.878 112.9 52.1 -69.9 -38.0 -4.8 7.2 3.9 156 64 B D H X S+ 0 0 54 -4,-1.8 4,-2.1 -5,-0.3 -2,-0.2 0.966 111.6 43.6 -64.1 -54.0 -2.9 10.3 5.2 157 65 B M H X S+ 0 0 7 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.865 112.0 53.3 -62.2 -40.3 -5.9 12.0 6.8 158 66 B V H X S+ 0 0 0 -4,-1.7 4,-1.3 -5,-0.2 -1,-0.2 0.936 109.3 47.8 -63.1 -45.9 -7.3 8.9 8.3 159 67 B M H <>S+ 0 0 26 -4,-1.9 5,-2.5 2,-0.2 3,-0.3 0.896 111.2 50.9 -61.3 -42.9 -4.0 8.0 10.1 160 68 B Q H ><5S+ 0 0 116 -4,-2.1 3,-1.1 1,-0.2 -1,-0.2 0.939 111.9 49.3 -56.8 -43.0 -3.6 11.6 11.4 161 69 B Y H 3<5S+ 0 0 72 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.681 113.3 43.7 -72.6 -21.6 -7.2 11.3 12.7 162 70 B T T ><5S- 0 0 0 -4,-1.3 3,-2.2 -3,-0.3 -1,-0.3 0.215 110.3-119.8-106.6 14.8 -6.7 8.0 14.5 163 71 B R T < 5S- 0 0 204 -3,-1.1 -3,-0.2 1,-0.3 -2,-0.1 0.902 77.8 -45.1 45.6 51.1 -3.4 9.1 15.9 164 72 B G T 3 - 0 0 62 -3,-2.2 4,-1.8 -6,-0.3 -1,-0.2 -0.459 29.0-172.6 -72.8 114.1 -4.2 3.6 15.0 166 74 B Q H > S+ 0 0 52 -2,-0.5 4,-2.4 2,-0.2 5,-0.2 0.760 80.6 55.3 -79.2 -25.4 -4.7 1.1 12.2 167 75 B T H > S+ 0 0 78 2,-0.2 4,-1.8 3,-0.2 -1,-0.2 0.950 113.0 40.3 -71.9 -47.7 -7.6 -0.8 13.7 168 76 B R H > S+ 0 0 95 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.905 116.3 53.4 -66.1 -43.6 -9.8 2.3 14.1 169 77 B A H >X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 3,-0.8 0.986 110.9 43.1 -52.0 -66.3 -8.6 3.6 10.8 170 78 B A H 3X>S+ 0 0 4 -4,-2.4 5,-1.8 1,-0.3 4,-1.4 0.820 113.3 56.2 -54.0 -31.4 -9.5 0.4 8.9 171 79 B L H 3<5S+ 0 0 121 -4,-1.8 -1,-0.3 2,-0.2 -2,-0.2 0.884 110.6 40.5 -70.1 -40.2 -12.8 0.3 10.8 172 80 B M H <<5S+ 0 0 16 -4,-2.3 -129,-2.6 -3,-0.8 -128,-0.2 0.799 112.5 54.2 -82.9 -27.6 -13.9 3.8 9.8 173 81 B M H <5S- 0 0 1 -4,-2.5 -129,-2.4 -5,-0.2 -128,-0.7 0.833 109.8-127.7 -70.1 -28.0 -12.7 3.4 6.2 174 82 B G T <5 + 0 0 38 -4,-1.4 2,-0.3 -5,-0.3 -3,-0.2 0.717 67.1 117.7 90.1 23.9 -14.8 0.3 6.1 175 83 B I S > - 0 0 116 -2,-0.3 4,-1.8 1,-0.1 3,-0.6 -0.308 37.5-123.3 -58.6 136.0 -10.3 -5.1 6.3 177 85 B R H 3> S+ 0 0 142 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.802 110.1 58.1 -51.3 -30.5 -7.4 -4.2 8.6 178 86 B G H 3> S+ 0 0 35 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.911 105.4 45.9 -70.5 -43.7 -5.1 -6.3 6.4 179 87 B T H <> S+ 0 0 46 -3,-0.6 4,-2.9 2,-0.2 -1,-0.2 0.820 108.2 57.6 -71.1 -29.2 -5.8 -4.5 3.2 180 88 B L H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.904 107.7 48.5 -63.1 -39.7 -5.4 -1.2 5.0 181 89 B R H X S+ 0 0 133 -4,-1.8 4,-2.6 -5,-0.2 -2,-0.2 0.958 111.0 51.1 -62.2 -47.7 -1.9 -2.5 5.8 182 90 B K H X S+ 0 0 161 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.914 111.6 45.3 -51.9 -54.1 -1.5 -3.4 2.2 183 91 B K H X S+ 0 0 44 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.921 112.6 52.2 -57.5 -47.0 -2.5 0.1 0.9 184 92 B L H <>S+ 0 0 2 -4,-2.4 5,-2.8 2,-0.2 4,-0.3 0.891 111.2 46.1 -57.8 -44.1 -0.3 1.7 3.5 185 93 B K H ><5S+ 0 0 164 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.950 109.0 57.0 -61.8 -49.3 2.8 -0.4 2.5 186 94 B K H 3<5S+ 0 0 100 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.776 112.1 41.1 -52.1 -31.9 2.0 0.4 -1.2 187 95 B Y T 3<5S- 0 0 34 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.382 112.6-114.7-103.6 7.5 2.2 4.1 -0.5 188 96 B G T < 5 + 0 0 59 -3,-1.8 2,-1.4 -4,-0.3 -3,-0.2 0.764 62.6 151.4 69.6 27.2 5.2 4.0 1.8 189 97 B M < 0 0 47 -5,-2.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.609 360.0 360.0 -97.4 74.9 3.1 5.2 4.7 190 98 B N 0 0 151 -2,-1.4 -5,-0.0 -3,-0.1 0, 0.0 -0.792 360.0 360.0-143.4 360.0 5.0 3.6 7.6