==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA-BINDING PROTEIN 12-AUG-91 4FIS . COMPND 2 MOLECULE: FACTOR FOR INVERSION STIMULATION (FIS); . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR H.S.YUAN,S.E.FINKEL,J.-A.FENG,R.C.JOHNSON,R.E.DICKERSON . 146 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8271.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 82.9 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 . 0 0.0 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 . 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 . 3 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 60.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 4.1 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 1 1 0 0 0 0 1 1 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 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 26 A P > 0 0 102 0, 0.0 4,-0.7 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0-174.2 12.0 18.5 55.2 2 27 A L H > + 0 0 22 1,-0.2 4,-1.3 2,-0.2 3,-0.3 0.752 360.0 71.1 -71.0 -28.5 10.6 16.4 52.4 3 28 A R H > S+ 0 0 83 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.920 98.1 50.5 -53.1 -40.7 14.2 15.6 51.0 4 29 A D H > S+ 0 0 61 -3,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.798 105.5 51.9 -74.5 -31.0 14.9 13.4 54.0 5 30 A S H X S+ 0 0 51 -4,-0.7 4,-2.2 -3,-0.3 -1,-0.2 0.782 110.8 49.5 -73.7 -28.6 11.8 11.3 53.8 6 31 A V H X S+ 0 0 1 -4,-1.3 4,-2.1 2,-0.2 5,-0.2 0.932 111.6 51.4 -69.0 -49.3 12.5 10.6 50.1 7 32 A K H X S+ 0 0 38 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.913 114.3 41.9 -53.2 -44.3 16.0 9.7 51.4 8 33 A Q H X S+ 0 0 101 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.887 108.3 57.9 -69.6 -41.3 14.5 7.3 54.0 9 34 A A H X S+ 0 0 31 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.873 112.1 43.2 -59.3 -37.6 11.9 5.8 51.7 10 35 A L H X S+ 0 0 6 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.900 109.5 55.2 -77.1 -40.1 14.7 4.8 49.4 11 36 A K H X S+ 0 0 103 -4,-2.0 4,-1.2 -5,-0.2 -2,-0.2 0.937 115.3 42.2 -51.4 -44.7 17.0 3.6 52.3 12 37 A N H X S+ 0 0 91 -4,-2.7 4,-0.6 2,-0.2 -2,-0.2 0.934 114.3 49.8 -68.6 -50.4 14.1 1.3 53.3 13 38 A Y H >< S+ 0 0 73 -4,-2.4 3,-2.4 1,-0.2 -2,-0.2 0.970 112.9 45.4 -54.1 -59.3 13.3 0.3 49.7 14 39 A F H >< S+ 0 0 16 -4,-2.7 3,-0.8 1,-0.3 4,-0.4 0.761 101.1 69.8 -59.1 -27.6 16.8 -0.7 48.8 15 40 A A H 3< S+ 0 0 78 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.683 103.1 45.2 -67.2 -12.7 17.1 -2.5 52.2 16 41 A Q T << S+ 0 0 130 -3,-2.4 -1,-0.3 -4,-0.6 -2,-0.1 -0.435 86.9 94.5-127.3 63.9 14.7 -5.1 50.7 17 42 A L X + 0 0 12 -3,-0.8 3,-2.1 -2,-0.1 -2,-0.1 0.788 39.3 153.8-112.8 -56.6 16.1 -5.7 47.4 18 43 A N T 3 S- 0 0 157 -4,-0.4 -2,-0.0 1,-0.3 -1,-0.0 -0.378 85.0 -10.2 59.7-124.5 18.4 -8.8 47.5 19 44 A G T 3 S+ 0 0 75 -2,-0.1 2,-0.7 2,-0.1 -1,-0.3 0.350 109.5 110.8 -87.8 5.3 18.5 -10.4 44.0 20 45 A Q < - 0 0 137 -3,-2.1 2,-0.3 2,-0.0 -4,-0.0 -0.763 57.1-157.8 -80.7 119.8 15.7 -8.2 42.8 21 46 A D - 0 0 114 -2,-0.7 2,-0.4 2,-0.0 -2,-0.1 -0.618 4.8-144.5 -84.6 155.8 17.1 -5.8 40.3 22 47 A V + 0 0 13 -2,-0.3 109,-0.2 1,-0.1 108,-0.1 -0.951 25.6 167.9-121.5 146.0 15.1 -2.6 39.7 23 48 A N S S+ 0 0 106 -2,-0.4 107,-0.1 107,-0.1 -1,-0.1 0.184 75.2 49.0-141.0 13.1 15.0 -1.0 36.3 24 49 A D > + 0 0 71 105,-0.2 4,-2.5 2,-0.1 106,-0.2 0.039 62.2 131.5-143.2 27.0 12.2 1.6 36.8 25 50 A L H > S+ 0 0 0 104,-2.0 4,-2.8 1,-0.2 5,-0.2 0.830 73.5 50.4 -58.4 -30.8 13.1 3.5 40.0 26 51 A Y H > S+ 0 0 35 104,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.969 114.6 41.8 -74.9 -49.4 12.7 7.0 38.6 27 52 A E H > S+ 0 0 95 103,-0.5 4,-2.3 2,-0.2 5,-0.2 0.865 114.3 54.7 -63.4 -39.8 9.2 6.4 37.2 28 53 A L H X S+ 0 0 67 -4,-2.5 4,-1.1 2,-0.2 -2,-0.2 0.951 113.5 40.6 -57.8 -55.9 8.4 4.4 40.4 29 54 A V H X S+ 0 0 10 -4,-2.8 4,-1.0 1,-0.2 -2,-0.2 0.829 113.8 55.3 -58.5 -37.4 9.4 7.4 42.6 30 55 A L H X S+ 0 0 18 -4,-2.3 4,-3.3 -5,-0.2 5,-0.4 0.895 104.9 50.4 -70.6 -43.1 7.7 9.9 40.2 31 56 A A H X S+ 0 0 26 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.890 110.2 51.9 -58.1 -39.3 4.2 8.3 40.2 32 57 A E H < S+ 0 0 41 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.720 121.2 33.7 -66.3 -28.5 4.4 8.3 44.1 33 58 A V H X S+ 0 0 4 -4,-1.0 4,-2.0 -3,-0.3 -2,-0.2 0.822 115.6 50.1 -97.3 -47.8 5.2 12.0 43.9 34 59 A E H X S+ 0 0 3 -4,-3.3 4,-2.6 1,-0.2 5,-0.3 0.843 106.2 59.6 -67.6 -25.2 3.3 13.4 40.9 35 60 A Q H X S+ 0 0 34 -4,-1.3 4,-2.2 -5,-0.4 -1,-0.2 0.980 109.1 38.1 -73.0 -55.4 0.1 11.8 42.1 36 61 A P H > S+ 0 0 3 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.890 118.4 54.0 -58.7 -31.0 -0.2 13.5 45.5 37 62 A L H X S+ 0 0 1 -4,-2.0 4,-2.8 1,-0.2 3,-0.3 0.993 111.4 42.6 -63.8 -58.3 1.1 16.8 43.9 38 63 A L H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.3 -1,-0.2 0.864 115.9 50.8 -52.0 -40.5 -1.5 16.8 41.1 39 64 A D H X S+ 0 0 58 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.3 0.886 113.5 42.9 -66.5 -43.3 -4.2 15.8 43.6 40 65 A M H X S+ 0 0 5 -4,-2.4 4,-2.1 -3,-0.3 -2,-0.2 0.869 110.7 52.5 -77.0 -36.3 -3.4 18.5 46.0 41 66 A V H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.955 115.4 46.4 -60.2 -48.1 -2.8 21.4 43.4 42 67 A M H X>S+ 0 0 15 -4,-2.0 5,-2.5 -5,-0.3 4,-0.5 0.820 108.0 52.8 -57.8 -42.3 -6.3 20.4 42.1 43 68 A Q H ><5S+ 0 0 123 -4,-1.8 3,-0.9 3,-0.2 -1,-0.2 0.977 115.6 45.4 -57.3 -44.2 -8.0 20.1 45.6 44 69 A Y H 3<5S+ 0 0 102 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.749 116.7 39.2 -65.2 -50.4 -6.7 23.7 46.1 45 70 A T H ><5S- 0 0 19 -4,-2.0 3,-1.2 -5,-0.2 -1,-0.3 0.434 109.6-125.1 -85.8 -0.4 -7.6 25.2 42.9 46 71 A R T <<5S- 0 0 235 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.913 71.9 -46.3 51.5 48.7 -10.9 23.2 43.1 47 72 A G T 3 - 0 0 79 -3,-1.2 4,-2.2 -6,-0.2 -1,-0.2 -0.473 30.5-170.5 -71.9 109.8 -9.4 24.6 37.7 49 74 A Q H > S+ 0 0 51 -2,-0.7 4,-2.7 1,-0.2 5,-0.2 0.811 81.3 55.4 -72.9 -33.2 -6.8 23.3 35.4 50 75 A T H > S+ 0 0 71 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.889 112.5 43.1 -66.6 -38.9 -5.6 26.7 34.1 51 76 A R H > S+ 0 0 92 2,-0.2 4,-2.3 3,-0.1 5,-0.2 0.914 114.3 49.5 -72.4 -44.9 -5.0 27.9 37.7 52 77 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.932 111.5 49.8 -62.2 -43.6 -3.3 24.6 38.8 53 78 A A H X>S+ 0 0 2 -4,-2.7 4,-1.8 1,-0.2 5,-1.7 0.959 111.8 47.2 -60.6 -48.0 -1.0 24.6 35.7 54 79 A L H <5S+ 0 0 94 -4,-1.9 3,-0.3 2,-0.2 -2,-0.2 0.935 112.4 51.5 -56.1 -42.0 0.1 28.3 36.3 55 80 A M H <5S+ 0 0 7 -4,-2.3 44,-2.6 1,-0.2 43,-0.7 0.883 113.9 44.5 -61.4 -38.8 0.7 27.4 40.0 56 81 A M H <5S- 0 0 1 -4,-2.0 44,-2.1 42,-0.2 45,-0.5 0.789 105.5-126.3 -80.0 -22.8 2.8 24.5 39.0 57 82 A G T <5S+ 0 0 53 -4,-1.8 2,-0.3 1,-0.3 -3,-0.2 0.893 70.3 127.0 73.8 43.5 4.8 26.3 36.3 58 83 A I S > - 0 0 117 -2,-0.3 4,-1.8 1,-0.1 3,-0.7 -0.677 33.6-120.5 -76.1 140.5 1.9 24.2 30.4 60 85 A R H 3> S+ 0 0 124 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.825 114.0 57.3 -53.9 -30.6 -1.9 23.3 30.8 61 86 A G H 3> S+ 0 0 45 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.942 108.1 48.0 -62.6 -41.7 -1.6 20.7 28.0 62 87 A T H <> S+ 0 0 63 -3,-0.7 4,-2.2 2,-0.2 -2,-0.2 0.848 107.6 54.9 -66.1 -37.9 1.1 19.1 30.1 63 88 A L H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.969 112.5 42.7 -58.1 -47.5 -1.1 19.3 33.2 64 89 A C H X S+ 0 0 49 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.908 110.4 55.6 -72.6 -33.3 -3.8 17.4 31.4 65 90 A K H X S+ 0 0 116 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.936 112.0 46.3 -61.4 -41.8 -1.3 14.8 29.8 66 91 A K H X S+ 0 0 32 -4,-2.2 4,-1.1 2,-0.2 -1,-0.2 0.873 109.8 51.8 -71.0 -38.0 -0.2 14.1 33.4 67 92 A L H ><>S+ 0 0 3 -4,-2.1 5,-1.3 2,-0.2 3,-0.6 0.951 112.7 46.3 -64.1 -43.2 -3.7 13.8 34.7 68 93 A K H ><5S+ 0 0 136 -4,-2.9 3,-3.1 1,-0.2 -2,-0.2 0.974 106.5 57.5 -57.0 -59.4 -4.5 11.4 32.0 69 94 A K H 3<5S+ 0 0 108 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.691 113.2 40.9 -45.6 -34.4 -1.4 9.3 32.5 70 95 A Y T <<5S- 0 0 36 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.275 111.9-115.9 -98.9 0.4 -2.3 8.8 36.1 71 96 A G T < 5S+ 0 0 65 -3,-3.1 -3,-0.2 -4,-0.5 -2,-0.1 0.446 79.8 115.9 84.1 -3.5 -6.1 8.2 35.6 72 97 A M < 0 0 50 -5,-1.3 -1,-0.3 -6,-0.2 -2,-0.2 -0.404 360.0 360.0 -92.2 168.7 -6.9 11.3 37.6 73 98 A N 0 0 156 -2,-0.1 -1,-0.1 -3,-0.1 -5,-0.1 0.322 360.0 360.0-154.0 360.0 -8.7 14.3 36.1 74 !* 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 75 26 B P >> 0 0 120 0, 0.0 3,-0.9 0, 0.0 4,-0.7 0.000 360.0 360.0 360.0-168.9 4.2 5.6 52.6 76 27 B L H >> + 0 0 18 1,-0.2 4,-1.5 2,-0.2 3,-1.5 0.888 360.0 64.3 -69.0 -32.2 6.0 8.4 50.7 77 28 B R H 3> S+ 0 0 83 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.847 98.5 57.2 -62.6 -24.7 2.9 9.8 48.9 78 29 B D H <> S+ 0 0 98 -3,-0.9 4,-2.4 1,-0.2 -1,-0.3 0.809 103.8 53.6 -70.0 -23.8 1.5 10.7 52.3 79 30 B S H < S+ 0 0 23 -4,-3.0 3,-2.1 2,-0.2 4,-0.4 0.958 102.0 59.9 -59.2 -51.0 -0.4 25.7 51.1 89 40 B A H >< S+ 0 0 84 -4,-1.9 3,-1.2 1,-0.3 -1,-0.2 0.911 104.1 49.8 -44.7 -50.0 -1.1 27.1 54.6 90 41 B Q H 3< S+ 0 0 97 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.747 89.9 89.4 -66.8 -14.8 1.9 29.4 54.6 91 42 B L T X< - 0 0 1 -3,-2.1 3,-2.5 -4,-0.7 -1,-0.3 0.748 61.2-174.5 -53.4 -36.5 0.6 30.7 51.2 92 43 B N T < S- 0 0 139 -3,-1.2 -1,-0.1 -4,-0.4 3,-0.1 0.794 73.7 -56.9 42.9 41.7 -1.6 33.5 52.5 93 44 B G T 3 S+ 0 0 75 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.637 99.7 133.9 65.8 18.4 -2.9 34.2 49.0 94 45 B Q < - 0 0 96 -3,-2.5 2,-0.3 1,-0.0 -1,-0.2 -0.676 59.5-114.3 -83.6 146.8 0.6 34.9 47.3 95 46 B D - 0 0 125 -2,-0.2 2,-0.3 -3,-0.1 -40,-0.0 -0.744 21.0-152.2 -98.1 148.6 0.7 33.1 43.9 96 47 B V + 0 0 5 -2,-0.3 -39,-0.2 1,-0.0 -40,-0.1 -0.773 17.6 174.5-101.8 137.3 3.1 30.4 43.3 97 48 B N S S+ 0 0 119 -2,-0.3 -41,-0.2 -41,-0.1 -42,-0.1 0.006 74.0 50.0-139.8 32.6 4.3 29.8 39.7 98 49 B D > + 0 0 75 -43,-0.7 4,-2.1 2,-0.1 3,-0.4 0.249 58.9 128.8-156.0 13.9 6.9 27.1 40.3 99 50 B L H > S+ 0 0 1 -44,-2.6 4,-2.1 1,-0.2 -43,-0.2 0.793 74.6 54.3 -53.9 -32.4 5.4 24.3 42.4 100 51 B Y H > S+ 0 0 43 -44,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.949 112.9 40.7 -74.3 -43.1 6.4 21.5 40.1 101 52 B E H > S+ 0 0 83 -45,-0.5 4,-2.5 -3,-0.4 3,-0.3 0.977 113.4 54.6 -68.0 -47.4 10.2 22.4 39.9 102 53 B L H X S+ 0 0 67 -4,-2.1 4,-1.2 1,-0.3 -1,-0.2 0.889 115.6 38.7 -49.4 -48.1 10.3 23.2 43.6 103 54 B V H X S+ 0 0 9 -4,-2.1 4,-0.8 -5,-0.2 -1,-0.3 0.784 114.4 54.5 -77.0 -26.4 8.8 19.7 44.4 104 55 B L H >X S+ 0 0 17 -4,-2.0 4,-3.2 -3,-0.3 3,-1.7 0.992 107.6 49.2 -70.0 -57.9 10.9 17.9 41.7 105 56 B A H 3X S+ 0 0 20 -4,-2.5 4,-1.6 1,-0.3 -2,-0.2 0.851 108.9 54.8 -41.6 -40.3 14.2 19.3 43.1 106 57 B E H 3< S+ 0 0 46 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.708 119.2 30.6 -76.2 -23.2 13.2 18.2 46.6 107 58 B V H S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.960 114.5 50.5 -60.0 -48.3 17.6 12.6 47.5 111 62 B L H X S+ 0 0 1 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.938 111.9 47.1 -46.2 -52.9 16.8 10.0 44.8 112 63 B L H X S+ 0 0 1 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.868 114.9 43.2 -63.8 -43.4 20.0 10.8 42.9 113 64 B D H X S+ 0 0 49 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.899 114.0 51.5 -72.7 -37.5 22.3 10.7 45.9 114 65 B M H X S+ 0 0 9 -4,-2.8 4,-1.7 -5,-0.2 -2,-0.2 0.857 112.1 46.1 -68.1 -37.8 20.7 7.5 47.3 115 66 B V H X S+ 0 0 0 -4,-2.3 4,-3.0 -5,-0.2 -1,-0.2 0.873 112.8 50.1 -69.2 -41.7 21.1 5.7 44.0 116 67 B M H <>S+ 0 0 25 -4,-1.8 5,-3.3 2,-0.2 6,-0.3 0.940 111.4 48.0 -58.8 -48.0 24.7 6.9 43.5 117 68 B Q H ><5S+ 0 0 113 -4,-2.3 3,-1.4 3,-0.2 -2,-0.2 0.969 114.1 48.3 -58.3 -49.3 25.7 5.7 47.0 118 69 B Y H 3<5S+ 0 0 99 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.922 113.3 44.0 -57.8 -50.8 24.0 2.4 46.4 119 70 B T T ><5S- 0 0 17 -4,-3.0 3,-2.1 -5,-0.1 -1,-0.3 0.278 116.8-116.7 -83.0 18.7 25.6 1.7 43.0 120 71 B R T < 5S- 0 0 237 -3,-1.4 -3,-0.2 1,-0.3 -2,-0.1 0.924 72.3 -49.9 48.2 49.8 28.9 2.9 44.6 121 72 B G T 3 - 0 0 75 -3,-2.1 4,-2.3 -6,-0.3 -1,-0.2 -0.571 31.8-167.5 -83.5 97.0 28.6 3.8 39.2 123 74 B Q H > S+ 0 0 37 -2,-1.3 4,-2.4 1,-0.2 -1,-0.2 0.883 83.3 46.0 -47.3 -49.4 26.7 6.0 36.8 124 75 B T H > S+ 0 0 63 2,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.898 110.6 52.1 -73.9 -34.6 25.7 3.3 34.3 125 76 B R H > S+ 0 0 118 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.903 114.6 47.0 -61.9 -36.0 24.6 0.8 37.0 126 77 B A H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 6,-0.3 0.792 107.9 53.0 -71.9 -34.4 22.5 3.7 38.3 127 78 B A H X>S+ 0 0 4 -4,-2.4 5,-2.0 -5,-0.2 4,-0.8 0.941 111.3 47.7 -68.7 -42.4 21.1 4.7 34.9 128 79 B L H <5S+ 0 0 97 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.866 112.7 47.8 -67.5 -37.5 19.9 1.1 34.4 129 80 B M H <5S+ 0 0 11 -4,-1.5 -104,-2.0 1,-0.2 -1,-0.2 0.833 115.0 46.2 -70.3 -33.7 18.4 0.9 38.0 130 81 B M H <5S- 0 0 2 -4,-1.7 -104,-1.3 -106,-0.2 -103,-0.5 0.656 110.1-125.5 -83.3 -9.0 16.6 4.2 37.5 131 82 B G T <5S+ 0 0 45 -4,-0.8 -3,-0.2 1,-0.3 2,-0.2 0.678 73.6 113.7 75.5 12.9 15.5 3.2 34.1 132 83 B I < - 0 0 28 -5,-2.0 -1,-0.3 -6,-0.3 -2,-0.2 -0.683 68.8-104.6-111.3 171.0 17.1 6.3 32.5 133 84 B N > - 0 0 113 -2,-0.2 4,-2.1 -3,-0.1 3,-0.2 -0.447 34.4-105.1 -89.9 172.0 20.0 6.6 30.1 134 85 B R H > S+ 0 0 128 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.904 118.0 55.9 -58.0 -44.8 23.4 7.8 31.1 135 86 B G H > S+ 0 0 37 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.834 107.2 47.9 -59.9 -42.0 23.0 11.2 29.5 136 87 B T H > S+ 0 0 49 2,-0.2 4,-2.9 -3,-0.2 5,-0.3 0.925 111.0 53.3 -64.2 -45.2 19.8 12.0 31.5 137 88 B L H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.911 112.2 43.9 -54.4 -44.5 21.6 10.9 34.6 138 89 B C H X S+ 0 0 28 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.913 111.3 54.5 -69.2 -36.4 24.3 13.2 33.8 139 90 B K H X S+ 0 0 137 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.971 115.5 39.0 -55.6 -55.4 21.8 16.0 32.9 140 91 B K H X S+ 0 0 23 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.865 111.3 56.4 -63.7 -40.3 20.1 15.6 36.3 141 92 B L H <>S+ 0 0 2 -4,-2.9 5,-3.5 -5,-0.3 6,-0.7 0.905 108.4 51.5 -60.7 -35.5 23.3 15.2 38.2 142 93 B K H ><5S+ 0 0 98 -4,-2.1 3,-2.6 3,-0.2 -2,-0.2 0.972 101.6 59.1 -66.0 -54.3 24.3 18.5 36.7 143 94 B K H 3<5S+ 0 0 113 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.788 115.0 34.9 -38.5 -44.2 21.1 20.4 37.8 144 95 B Y T 3<5S- 0 0 32 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.365 115.0-110.2-100.2 2.8 21.8 19.7 41.4 145 96 B G T < 5S+ 0 0 60 -3,-2.6 -3,-0.2 -4,-0.3 -2,-0.1 0.924 72.9 139.8 67.6 46.0 25.5 19.9 41.3 146 97 B M < 0 0 59 -5,-3.5 -4,-0.2 -6,-0.2 -5,-0.1 0.776 360.0 360.0 -90.2 -28.5 25.9 16.3 41.9 147 98 B N 0 0 136 -6,-0.7 -5,-0.2 -9,-0.1 -1,-0.1 -0.128 360.0 360.0-161.3 360.0 28.7 16.1 39.4