==== 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 3JRH . 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) . 11639.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 145 76.7 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 . 13 6.9 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 . 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 . 10 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 48.1 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 0 0 0 0 2 0 2 0 0 0 0 1 1 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 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 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 0 180 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -17.1 6.0 15.9 -13.1 2 9 A D - 0 0 79 1,-0.1 3,-0.1 17,-0.0 16,-0.0 -0.858 360.0-174.1-102.3 110.8 2.3 15.8 -11.8 3 10 A V S S+ 0 0 73 -2,-0.7 2,-0.7 1,-0.2 -1,-0.1 0.779 72.3 59.0 -72.5 -28.0 -0.2 14.7 -14.5 4 11 A L S S+ 0 0 4 141,-0.1 16,-2.4 125,-0.1 17,-0.3 -0.838 71.2 139.7-111.6 95.8 -3.4 15.3 -12.3 5 12 A T E -A 19 0A 13 -2,-0.7 2,-0.2 121,-0.4 124,-0.2 -0.945 34.7-145.7-138.5 158.7 -3.8 18.9 -11.1 6 13 A V E -A 18 0A 6 12,-2.6 12,-1.3 -2,-0.3 2,-0.5 -0.742 28.5-101.3-119.7 166.1 -6.4 21.5 -10.7 7 14 A S E -A 17 0A 53 -2,-0.2 2,-0.3 10,-0.2 10,-0.2 -0.766 33.5-174.7 -95.7 132.7 -6.4 25.3 -11.0 8 15 A T E -A 16 0A 35 8,-2.6 8,-2.4 -2,-0.5 2,-0.4 -0.894 12.1-149.7-117.0 153.3 -6.2 27.6 -8.0 9 16 A V E -A 15 0A 77 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.984 12.2-156.7-119.9 131.0 -6.4 31.4 -7.9 10 17 A N > - 0 0 61 4,-1.9 3,-1.6 -2,-0.4 6,-0.0 -0.382 39.3 -88.9 -93.8-178.8 -4.6 33.5 -5.2 11 18 A S T 3 S+ 0 0 118 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.769 124.7 58.8 -63.4 -30.6 -5.3 37.0 -3.9 12 19 A Q T 3 S- 0 0 142 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.172 119.0-108.8 -82.3 15.0 -3.2 38.6 -6.6 13 20 A D S < S+ 0 0 123 -3,-1.6 2,-0.4 1,-0.2 -2,-0.1 0.554 71.5 146.1 64.0 13.6 -5.4 37.0 -9.3 14 21 A Q - 0 0 97 1,-0.0 -4,-1.9 2,-0.0 2,-0.3 -0.663 39.9-145.2 -84.6 127.1 -2.5 34.6 -10.3 15 22 A V E +A 9 0A 95 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.686 25.5 169.5 -91.6 146.1 -3.7 31.1 -11.4 16 23 A T E -A 8 0A 69 -8,-2.4 -8,-2.6 -2,-0.3 -10,-0.0 -0.995 32.1-109.2-161.4 139.3 -1.6 28.2 -10.6 17 24 A Q E -A 7 0A 83 -2,-0.3 -10,-0.2 -10,-0.2 -12,-0.0 -0.288 28.6-173.8 -73.1 162.9 -1.8 24.4 -10.7 18 25 A K E -A 6 0A 50 -12,-1.3 -12,-2.6 -16,-0.0 5,-0.1 -0.959 34.3 -99.1-153.4 139.4 -2.1 22.2 -7.5 19 26 A P E >> -A 5 0A 25 0, 0.0 4,-0.8 0, 0.0 3,-0.8 -0.279 27.4-127.7 -67.7 147.1 -2.0 18.5 -7.3 20 27 A L H >> S+ 0 0 2 -16,-2.4 4,-1.9 1,-0.2 3,-0.6 0.871 106.2 68.8 -58.5 -38.0 -5.5 16.9 -7.0 21 28 A R H 3> S+ 0 0 61 -17,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.889 93.4 58.3 -48.9 -41.2 -4.3 15.0 -3.9 22 29 A D H <> S+ 0 0 76 -3,-0.8 4,-2.5 1,-0.2 -1,-0.2 0.895 104.7 50.6 -53.4 -46.6 -4.1 18.3 -2.0 23 30 A S H + 0 0 93 1,-0.1 4,-1.5 2,-0.1 131,-0.2 -0.442 64.6 151.4-138.4 66.9 -17.6 3.6 5.2 43 50 A L H > S+ 0 0 0 129,-2.2 4,-2.4 2,-0.2 130,-0.2 0.829 71.4 54.8 -70.8 -31.1 -15.2 6.3 4.4 44 51 A Y H > S+ 0 0 32 129,-1.4 4,-2.9 1,-0.2 5,-0.2 0.984 110.1 43.8 -67.1 -56.8 -13.5 4.3 1.6 45 52 A E H > S+ 0 0 80 128,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.783 111.8 58.7 -55.0 -31.3 -16.6 3.6 -0.4 46 53 A L H X S+ 0 0 33 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.981 111.5 36.6 -65.3 -54.7 -17.6 7.1 0.2 47 54 A V H X S+ 0 0 2 -4,-2.4 4,-1.4 2,-0.2 3,-0.3 0.938 113.9 56.2 -67.9 -47.0 -14.6 8.6 -1.4 48 55 A L H >X S+ 0 0 28 -4,-2.9 4,-2.8 1,-0.2 3,-1.2 0.936 107.9 50.7 -44.9 -51.7 -14.4 6.0 -4.1 49 56 A A H 3X S+ 0 0 21 -4,-2.1 4,-1.0 1,-0.3 -1,-0.2 0.865 108.2 52.7 -58.0 -35.2 -18.0 6.9 -5.1 50 57 A E H 3< S+ 0 0 4 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.741 118.2 35.7 -76.3 -18.0 -17.0 10.5 -5.2 51 58 A V H S+ 0 0 7 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.832 118.2 53.3 -64.1 -27.8 -16.5 11.9 -12.5 55 62 A L H X S+ 0 0 2 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.970 114.4 39.3 -63.4 -55.3 -13.9 9.5 -13.8 56 63 A L H X S+ 0 0 1 -4,-4.0 4,-2.2 1,-0.2 5,-0.3 0.959 115.0 54.1 -59.8 -49.3 -16.5 7.3 -15.6 57 64 A D H X S+ 0 0 53 -4,-3.5 4,-1.5 -5,-0.3 -1,-0.2 0.911 114.2 41.3 -52.8 -46.1 -18.4 10.4 -16.7 58 65 A M H X S+ 0 0 19 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.852 111.8 50.7 -78.1 -35.4 -15.3 12.0 -18.3 59 66 A V H X S+ 0 0 0 -4,-2.6 4,-3.7 2,-0.2 -1,-0.2 0.893 110.9 51.1 -70.9 -32.8 -13.7 8.9 -20.0 60 67 A M H <>S+ 0 0 37 -4,-2.2 5,-2.7 -5,-0.3 6,-0.3 0.917 110.2 50.2 -62.1 -42.9 -17.1 8.1 -21.6 61 68 A Q H ><5S+ 0 0 122 -4,-1.5 3,-1.6 -5,-0.3 -2,-0.2 0.977 115.7 42.7 -51.3 -55.7 -17.2 11.7 -22.8 62 69 A Y H 3<5S+ 0 0 96 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.934 116.0 45.0 -64.9 -49.9 -13.7 11.3 -24.2 63 70 A T T ><5S- 0 0 9 -4,-3.7 3,-2.2 -5,-0.1 -1,-0.3 0.276 110.9-122.5 -77.8 15.7 -14.2 7.9 -25.7 64 71 A R T < 5S- 0 0 227 -3,-1.6 -3,-0.2 1,-0.3 -2,-0.1 0.911 71.1 -49.7 36.0 61.8 -17.5 9.1 -27.1 65 72 A G T 3 - 0 0 72 -3,-2.2 4,-2.3 -6,-0.3 -1,-0.2 -0.617 30.0-172.5 -77.2 101.0 -17.2 3.6 -26.7 67 74 A Q H > S+ 0 0 59 -2,-1.1 4,-2.5 2,-0.2 -1,-0.2 0.862 80.5 56.7 -62.6 -40.2 -17.0 1.3 -23.7 68 75 A T H > S+ 0 0 76 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.966 111.2 43.8 -59.7 -50.2 -14.3 -0.9 -25.1 69 76 A R H >> S+ 0 0 125 1,-0.2 4,-2.8 2,-0.2 3,-0.7 0.928 112.3 51.9 -56.6 -52.4 -12.0 2.1 -25.6 70 77 A A H 3X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.3 5,-0.2 0.914 106.9 53.8 -53.2 -43.6 -12.8 3.5 -22.1 71 78 A A H 3X>S+ 0 0 3 -4,-2.5 5,-1.8 1,-0.2 4,-0.8 0.807 111.8 45.6 -65.2 -27.6 -12.0 0.2 -20.5 72 79 A L H <<5S+ 0 0 118 -4,-1.2 -1,-0.2 -3,-0.7 -2,-0.2 0.877 107.8 55.3 -82.0 -41.5 -8.6 0.2 -22.2 73 80 A M H <5S+ 0 0 14 -4,-2.8 69,-1.7 1,-0.2 -2,-0.2 0.876 116.1 39.4 -54.7 -40.7 -7.7 3.8 -21.4 74 81 A M H <5S- 0 0 3 -4,-2.0 69,-1.7 67,-0.2 70,-0.6 0.696 108.1-126.4 -84.9 -23.6 -8.3 3.0 -17.7 75 82 A G T <5 + 0 0 52 -4,-0.8 2,-0.3 1,-0.3 -3,-0.2 0.787 66.3 120.6 80.1 30.3 -6.7 -0.4 -17.8 76 83 A I S - 0 0 119 -2,-0.3 4,-2.0 1,-0.1 3,-0.3 -0.223 33.6-124.3 -54.6 139.7 -11.6 -5.3 -17.8 78 85 A R H > S+ 0 0 136 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.847 113.9 55.9 -50.6 -36.8 -14.4 -4.3 -20.1 79 86 A G H > S+ 0 0 35 1,-0.2 4,-2.1 2,-0.2 3,-0.4 0.929 103.4 52.8 -62.6 -46.2 -16.7 -6.3 -17.8 80 87 A T H > S+ 0 0 55 -3,-0.3 4,-2.5 1,-0.2 5,-0.2 0.918 104.2 56.8 -53.5 -46.8 -15.6 -4.3 -14.8 81 88 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.864 106.9 48.6 -55.7 -37.9 -16.5 -1.0 -16.6 82 89 A R H X S+ 0 0 130 -4,-1.3 4,-2.6 -3,-0.4 -1,-0.2 0.962 108.3 53.9 -69.2 -50.0 -20.0 -2.2 -17.2 83 90 A K H X S+ 0 0 139 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.924 111.9 45.2 -44.8 -56.0 -20.5 -3.2 -13.6 84 91 A K H X S+ 0 0 35 -4,-2.5 4,-1.7 1,-0.2 6,-0.2 0.916 109.3 53.7 -58.9 -48.7 -19.4 0.3 -12.4 85 92 A L H <>S+ 0 0 9 -4,-2.4 5,-3.9 1,-0.2 6,-0.8 0.902 112.7 45.8 -54.4 -40.2 -21.5 2.1 -14.9 86 93 A K H ><5S+ 0 0 116 -4,-2.6 3,-2.5 3,-0.2 -2,-0.2 0.923 104.1 62.9 -66.5 -43.4 -24.4 0.1 -13.6 87 94 A K H 3<5S+ 0 0 116 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.803 116.2 30.9 -51.4 -35.9 -23.3 0.8 -10.0 88 95 A Y T 3<5S- 0 0 43 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.132 112.8-117.4-109.6 16.7 -23.9 4.5 -10.6 89 96 A G T < 5S+ 0 0 47 -3,-2.5 -3,-0.2 -5,-0.2 -4,-0.1 0.851 70.1 138.9 48.1 40.4 -26.7 3.9 -13.0 90 97 A M < 0 0 73 -5,-3.9 -4,-0.2 -6,-0.2 -1,-0.1 0.461 360.0 360.0 -90.8 -2.8 -24.7 5.6 -15.8 91 98 A N 0 0 138 -6,-0.8 -9,-0.0 -9,-0.1 -5,-0.0 0.153 360.0 360.0 -69.4 360.0 -25.8 3.0 -18.4 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 0 211 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-177.4 -35.6 19.5 11.0 94 2 B F - 0 0 184 3,-0.0 2,-0.2 1,-0.0 3,-0.0 -0.789 360.0-124.0 -93.7 139.1 -32.2 18.8 9.4 95 3 B E - 0 0 187 -2,-0.4 2,-0.1 1,-0.1 -1,-0.0 -0.609 36.3 -98.9 -81.0 147.8 -31.6 20.3 6.0 96 4 B Q - 0 0 175 -2,-0.2 2,-0.5 1,-0.0 -1,-0.1 -0.451 31.3-163.3 -67.0 136.5 -30.6 17.7 3.4 97 5 B R - 0 0 152 -2,-0.1 5,-0.1 -3,-0.0 -1,-0.0 -0.957 17.6-144.5-118.9 108.9 -26.9 17.4 2.7 98 6 B V > - 0 0 59 -2,-0.5 3,-2.2 1,-0.1 4,-0.3 -0.300 24.4-107.0 -73.3 160.4 -26.6 15.6 -0.6 99 7 B N G >> S+ 0 0 113 1,-0.3 3,-1.7 2,-0.2 4,-0.6 0.864 117.5 63.8 -58.0 -39.2 -23.7 13.2 -1.1 100 8 B S G 34 S+ 0 0 30 1,-0.2 19,-0.4 2,-0.1 -1,-0.3 0.670 103.4 51.7 -57.7 -14.4 -21.8 15.5 -3.4 101 9 B D G <4 S+ 0 0 61 -3,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.437 83.2 83.0-106.6 1.5 -21.6 18.0 -0.5 102 10 B V T <4 S+ 0 0 27 -3,-1.7 2,-0.5 -4,-0.3 -2,-0.1 0.882 101.5 36.3 -65.1 -39.1 -20.1 15.7 2.2 103 11 B L S < S+ 0 0 1 -4,-0.6 16,-2.4 -3,-0.1 17,-0.3 -0.951 83.9 159.5-117.3 113.4 -16.6 16.4 0.8 104 12 B T E -B 118 0B 7 -2,-0.5 2,-0.3 -77,-0.3 -74,-0.2 -0.863 28.3-145.1-137.0 169.7 -16.0 19.9 -0.6 105 13 B V E -B 117 0B 6 12,-2.9 12,-1.6 -2,-0.3 2,-0.3 -0.961 30.9-105.0-132.0 143.0 -13.3 22.4 -1.4 106 14 B S E +B 116 0B 59 -2,-0.3 2,-0.3 10,-0.2 10,-0.3 -0.550 44.4 176.4 -66.8 129.9 -13.2 26.2 -1.1 107 15 B T E -B 115 0B 34 8,-2.6 8,-2.0 -2,-0.3 2,-0.4 -0.834 25.1-130.9-122.6 168.2 -13.6 27.8 -4.5 108 16 B V E -B 114 0B 79 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.989 22.5-150.9-119.3 131.3 -13.8 31.5 -5.5 109 17 B N E >> -B 113 0B 60 4,-1.7 3,-1.8 -2,-0.4 4,-0.5 -0.389 41.7 -80.2 -96.6 175.3 -16.6 32.7 -7.8 110 18 B S T 34 S+ 0 0 119 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.441 127.6 56.1 -53.3 1.3 -16.7 35.5 -10.4 111 19 B Q T 34 S- 0 0 119 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 -0.038 116.5-103.5-124.7 30.3 -17.4 37.8 -7.4 112 20 B D T <4 S+ 0 0 140 -3,-1.8 2,-0.5 1,-0.2 -2,-0.1 0.900 78.2 143.5 52.1 37.3 -14.4 37.2 -5.1 113 21 B Q E < -B 109 0B 120 -4,-0.5 -4,-1.7 0, 0.0 2,-0.6 -0.947 50.8-133.7-117.6 119.9 -16.8 35.2 -3.0 114 22 B V E +B 108 0B 106 -2,-0.5 -6,-0.2 -6,-0.2 2,-0.2 -0.579 36.5 164.6 -76.2 116.2 -15.6 32.0 -1.3 115 23 B T E -B 107 0B 58 -8,-2.0 -8,-2.6 -2,-0.6 2,-0.5 -0.610 36.0-115.5-121.7-171.5 -18.1 29.2 -1.8 116 24 B Q E -B 106 0B 78 -10,-0.3 -10,-0.2 -2,-0.2 -2,-0.0 -0.896 29.0-173.3-141.0 92.5 -17.7 25.5 -1.4 117 25 B K E -B 105 0B 50 -12,-1.6 -12,-2.9 -2,-0.5 5,-0.1 -0.624 32.7 -91.7 -91.3 153.7 -17.9 23.2 -4.4 118 26 B P E > -B 104 0B 21 0, 0.0 4,-0.8 0, 0.0 3,-0.5 -0.090 24.8-122.5 -53.5 153.5 -18.0 19.3 -4.3 119 27 B L H >> S+ 0 0 0 -16,-2.4 4,-1.9 -19,-0.4 3,-0.6 0.843 108.8 70.5 -67.2 -34.6 -14.9 17.2 -4.5 120 28 B R H 3> S+ 0 0 56 -17,-0.3 4,-2.7 -20,-0.3 -1,-0.2 0.888 95.0 55.5 -44.6 -43.6 -16.4 15.5 -7.6 121 29 B D H 3> S+ 0 0 68 -3,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.867 102.7 54.1 -64.0 -38.7 -15.8 18.8 -9.5 122 30 B S H < S+ 0 0 66 -4,-2.3 3,-0.5 1,-0.2 -2,-0.2 0.947 117.4 42.7 -50.7 -54.1 -6.2 18.6 -23.0 133 41 B Q H 3< S+ 0 0 152 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.718 100.8 72.6 -64.3 -26.0 -2.5 18.2 -22.1 134 42 B L H >< S+ 0 0 17 -4,-1.4 3,-1.6 -3,-0.4 -1,-0.2 0.916 73.1 173.6 -59.3 -48.1 -2.6 14.5 -23.2 135 43 B N T << - 0 0 136 -4,-1.3 2,-0.3 -3,-0.5 3,-0.1 0.860 67.9 -24.7 42.2 79.9 -2.8 15.6 -26.8 136 44 B G T 3 S+ 0 0 76 1,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.009 98.8 129.7 88.1 -29.2 -2.5 12.4 -28.9 137 45 B Q < - 0 0 136 -3,-1.6 2,-0.3 -2,-0.3 -1,-0.2 -0.322 58.8-122.7 -65.3 139.3 -0.7 10.2 -26.4 138 46 B D - 0 0 146 -3,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.670 26.6-155.5 -82.1 139.2 -2.2 6.8 -25.8 139 47 B V + 0 0 19 -2,-0.3 -64,-0.1 1,-0.1 -65,-0.0 -0.874 25.2 164.5-113.4 145.0 -3.1 6.0 -22.1 140 48 B N S S+ 0 0 106 -2,-0.3 3,-0.2 -66,-0.1 -1,-0.1 0.517 71.6 50.4-130.6 -9.5 -3.4 2.6 -20.4 141 49 B D > + 0 0 77 1,-0.1 4,-2.3 2,-0.1 -67,-0.2 -0.224 60.5 130.2-133.4 36.8 -3.3 3.1 -16.7 142 50 B L H > S+ 0 0 0 -69,-1.7 4,-1.7 2,-0.2 -68,-0.2 0.820 73.1 50.2 -74.9 -32.4 -5.9 5.8 -16.0 143 51 B Y H > S+ 0 0 35 -69,-1.7 4,-3.0 2,-0.2 5,-0.3 0.974 114.8 42.3 -68.4 -55.0 -7.8 4.1 -13.2 144 52 B E H > S+ 0 0 85 -70,-0.6 4,-2.6 1,-0.2 5,-0.3 0.916 111.6 57.8 -59.1 -39.8 -4.7 3.2 -11.2 145 53 B L H X S+ 0 0 44 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.907 114.5 36.7 -54.6 -44.8 -3.4 6.7 -11.9 146 54 B V H X S+ 0 0 4 -4,-1.7 4,-1.2 -3,-0.3 3,-0.5 0.970 114.9 52.5 -72.8 -56.2 -6.4 8.3 -10.3 147 55 B L H X S+ 0 0 23 -4,-3.0 4,-3.2 1,-0.3 3,-0.3 0.821 110.2 50.2 -51.9 -39.7 -7.0 5.8 -7.5 148 56 B A H X S+ 0 0 25 -4,-2.6 4,-1.5 -5,-0.3 -1,-0.3 0.900 106.5 54.9 -66.9 -40.2 -3.4 6.3 -6.5 149 57 B E H < S+ 0 0 17 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.794 118.5 35.5 -64.1 -20.6 -3.8 10.0 -6.5 150 58 B V H X S+ 0 0 8 -4,-1.2 4,-1.7 -3,-0.3 -2,-0.2 0.867 110.6 55.6-104.8 -47.1 -6.7 9.7 -4.2 151 59 B E H X S+ 0 0 2 -4,-3.2 4,-2.7 1,-0.2 5,-0.3 0.851 100.6 63.0 -53.4 -39.6 -5.9 6.8 -1.8 152 60 B Q H X S+ 0 0 74 -4,-1.5 4,-2.7 -5,-0.2 -1,-0.2 0.969 108.7 37.1 -53.0 -62.6 -2.6 8.4 -0.8 153 61 B P H > S+ 0 0 7 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.790 116.4 54.4 -62.9 -32.8 -4.2 11.5 0.9 154 62 B L H X S+ 0 0 2 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.893 112.6 42.0 -61.4 -48.2 -7.1 9.5 2.2 155 63 B L H X S+ 0 0 2 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.918 114.1 53.3 -67.5 -42.4 -4.8 7.0 4.0 156 64 B D H X S+ 0 0 48 -4,-2.7 4,-1.9 -5,-0.3 3,-0.3 0.982 113.3 43.2 -54.5 -57.3 -2.6 9.9 5.1 157 65 B M H X S+ 0 0 13 -4,-2.8 4,-2.3 1,-0.2 3,-0.3 0.937 111.1 51.5 -61.3 -51.8 -5.5 11.6 6.6 158 66 B V H X S+ 0 0 1 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.844 109.2 51.7 -56.6 -36.8 -7.2 8.7 8.3 159 67 B M H <>S+ 0 0 30 -4,-2.2 5,-2.5 -3,-0.3 6,-0.3 0.907 107.5 52.7 -65.1 -41.6 -4.0 7.6 10.0 160 68 B Q H ><5S+ 0 0 113 -4,-1.9 3,-1.8 -3,-0.3 -2,-0.2 0.980 112.2 46.2 -54.9 -52.8 -3.6 11.1 11.4 161 69 B Y H 3<5S+ 0 0 72 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.915 113.4 47.2 -54.4 -48.5 -7.1 10.9 12.8 162 70 B T T ><5S- 0 0 1 -4,-2.9 3,-3.3 -5,-0.2 -1,-0.3 0.205 109.1-124.4 -82.3 21.1 -6.5 7.4 14.3 163 71 B R T < 5S- 0 0 208 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.811 76.8 -47.6 35.2 44.4 -3.2 8.6 15.8 164 72 B G T 3 - 0 0 70 -3,-3.3 4,-1.7 -6,-0.3 -1,-0.2 -0.642 29.7-171.1 -80.0 110.6 -4.1 3.1 15.0 166 74 B Q H > S+ 0 0 45 -2,-0.8 4,-2.4 2,-0.2 5,-0.2 0.808 79.3 59.4 -69.8 -33.9 -4.6 0.7 12.1 167 75 B T H > S+ 0 0 75 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.914 112.2 39.5 -66.9 -39.9 -7.5 -1.2 13.5 168 76 B R H > S+ 0 0 88 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.879 112.3 55.6 -75.3 -41.5 -9.7 1.9 13.8 169 77 B A H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.946 113.1 41.6 -57.1 -46.2 -8.5 3.3 10.5 170 78 B A H X>S+ 0 0 4 -4,-2.4 5,-2.2 1,-0.2 4,-0.9 0.844 114.1 54.3 -67.4 -33.1 -9.5 0.1 8.7 171 79 B L H <5S+ 0 0 114 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.886 111.1 43.4 -72.3 -38.8 -12.7 0.0 10.7 172 80 B M H <5S+ 0 0 15 -4,-3.0 -129,-2.2 1,-0.2 -2,-0.2 0.767 113.2 50.3 -82.3 -22.1 -13.6 3.5 9.7 173 81 B M H <5S- 0 0 2 -4,-1.9 -129,-1.4 -5,-0.2 -128,-0.6 0.662 109.4-126.1 -81.7 -14.5 -12.8 3.1 6.0 174 82 B G T <5 + 0 0 44 -4,-0.9 2,-0.3 1,-0.3 -3,-0.2 0.805 68.2 124.0 72.0 32.0 -14.8 -0.0 6.1 175 83 B I S > - 0 0 123 -2,-0.3 4,-1.7 1,-0.2 3,-0.9 -0.226 35.7-120.7 -50.9 143.0 -10.4 -5.3 6.1 177 85 B R H 3> S+ 0 0 129 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.736 113.5 57.2 -61.6 -21.2 -7.4 -4.5 8.4 178 86 B G H 3> S+ 0 0 38 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.847 103.0 51.2 -76.4 -36.1 -5.3 -6.6 6.0 179 87 B T H <> S+ 0 0 52 -3,-0.9 4,-2.7 2,-0.2 -2,-0.2 0.907 109.7 50.4 -67.7 -41.7 -6.2 -4.6 3.0 180 88 B L H X S+ 0 0 1 -4,-1.7 4,-3.1 2,-0.2 5,-0.3 0.955 107.6 52.5 -60.1 -52.3 -5.2 -1.3 4.8 181 89 B R H X S+ 0 0 136 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.917 111.1 49.2 -50.7 -44.7 -2.0 -2.7 5.8 182 90 B K H X S+ 0 0 155 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.913 110.0 48.5 -62.8 -47.5 -1.4 -3.6 2.2 183 91 B K H X S+ 0 0 37 -4,-2.7 4,-1.4 2,-0.2 -2,-0.2 0.930 110.7 52.3 -58.8 -44.9 -2.3 -0.1 0.8 184 92 B L H ><>S+ 0 0 0 -4,-3.1 5,-2.8 2,-0.2 3,-0.7 0.943 109.3 48.9 -57.7 -48.1 -0.1 1.5 3.4 185 93 B K H ><5S+ 0 0 170 -4,-2.3 3,-2.2 -5,-0.3 -2,-0.2 0.952 106.6 58.1 -52.6 -51.4 2.8 -0.7 2.2 186 94 B K H 3<5S+ 0 0 105 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.813 113.0 38.8 -43.3 -38.5 2.0 0.3 -1.3 187 95 B Y T <<5S- 0 0 34 -4,-1.4 -1,-0.3 -3,-0.7 -2,-0.2 0.083 111.8-112.1-112.1 22.4 2.5 3.9 -0.5 188 96 B G T < 5 + 0 0 67 -3,-2.2 2,-0.9 1,-0.2 -3,-0.2 0.857 64.5 152.4 49.3 41.3 5.5 3.6 1.8 189 97 B M < 0 0 51 -5,-2.8 -1,-0.2 -6,-0.2 -4,-0.1 -0.652 360.0 360.0-107.5 73.3 3.2 4.7 4.7 190 98 B N 0 0 160 -2,-0.9 0, 0.0 -3,-0.1 0, 0.0 -0.924 360.0 360.0 177.5 360.0 4.8 3.2 7.8