==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN 17-MAR-10 3M8F . COMPND 2 MOLECULE: PUTATIVE DNA-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS THURINGIENSIS; . AUTHOR M.A.SCHUMACHER,L.NI . 195 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11402.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 154 79.0 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 . 30 15.4 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 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 . 14 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 43.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 3 1 2 0 0 0 0 2 1 0 1 0 0 0 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 2 0 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 5 A H 0 0 82 0, 0.0 104,-2.9 0, 0.0 105,-0.8 0.000 360.0 360.0 360.0 86.3 5.0 6.2 -5.6 2 6 A F E -A 104 0A 136 102,-0.2 2,-0.3 103,-0.1 102,-0.2 -0.665 360.0-165.8 -97.8 155.3 4.0 8.6 -2.9 3 7 A Y E -A 103 0A 49 100,-1.9 100,-2.6 -2,-0.2 2,-0.6 -0.963 11.8-145.7-141.6 127.8 4.1 8.1 0.8 4 8 A T E -A 102 0A 88 -2,-0.3 2,-0.3 98,-0.2 98,-0.3 -0.837 25.5-175.7-110.2 121.3 2.3 10.4 3.2 5 9 A L E -A 101 0A 23 96,-3.6 96,-2.4 -2,-0.6 2,-1.4 -0.830 36.7-114.6-127.7 139.5 4.0 10.9 6.5 6 10 A N E > -A 100 0A 52 -2,-0.3 3,-1.5 94,-0.2 4,-0.5 -0.603 30.6-170.7 -72.9 92.3 3.6 12.6 9.9 7 11 A I T >> S+ 0 0 0 92,-1.4 4,-2.4 -2,-1.4 3,-1.3 0.810 71.5 80.1 -50.8 -38.2 6.5 15.2 9.7 8 12 A A H 3> S+ 0 0 17 91,-1.0 4,-0.8 1,-0.3 -1,-0.3 0.699 91.4 50.0 -46.7 -31.8 6.1 16.1 13.4 9 13 A E H <> S+ 0 0 98 -3,-1.5 4,-1.8 2,-0.2 -1,-0.3 0.763 109.8 47.3 -84.3 -30.0 8.1 13.1 14.5 10 14 A I H <> S+ 0 0 8 -3,-1.3 4,-3.1 -4,-0.5 5,-0.4 0.924 110.0 54.6 -71.4 -48.0 11.1 13.5 12.2 11 15 A A H X S+ 0 0 0 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.806 108.0 51.1 -53.3 -34.4 11.1 17.2 13.3 12 16 A E H < S+ 0 0 113 -4,-0.8 4,-0.4 -5,-0.3 -1,-0.2 0.950 111.3 46.9 -64.3 -50.5 11.3 15.8 16.8 13 17 A R H >< S+ 0 0 20 -4,-1.8 3,-2.0 2,-0.2 4,-0.2 0.951 114.4 44.5 -59.6 -55.7 14.3 13.6 15.9 14 18 A I H >< S+ 0 0 0 -4,-3.1 3,-2.3 146,-0.4 7,-0.6 0.900 108.5 60.3 -53.3 -42.3 16.2 16.2 14.1 15 19 A G T 3< S+ 0 0 35 -4,-1.5 -1,-0.3 -5,-0.4 -2,-0.2 0.590 102.4 52.6 -65.0 -12.4 15.4 18.5 16.9 16 20 A N T < S+ 0 0 133 -3,-2.0 2,-0.8 -4,-0.4 -1,-0.3 0.342 92.3 86.7 -98.5 2.3 17.2 16.1 19.2 17 21 A D <> - 0 0 54 -3,-2.3 4,-2.7 -4,-0.2 5,-0.2 -0.907 64.5-160.7-108.5 103.4 20.3 16.2 17.0 18 22 A D H > S+ 0 0 114 -2,-0.8 4,-1.3 1,-0.2 -1,-0.2 0.927 91.4 40.9 -41.6 -60.7 22.5 19.0 18.0 19 23 A C H > S+ 0 0 25 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.895 115.7 49.3 -63.2 -45.8 24.4 19.1 14.8 20 24 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 3,-0.4 0.913 105.5 56.4 -61.3 -48.5 21.4 18.5 12.4 21 25 A Y H X S+ 0 0 96 -4,-2.7 4,-2.4 -7,-0.6 -1,-0.2 0.878 107.7 49.0 -50.7 -44.0 19.2 21.2 14.0 22 26 A Q H X S+ 0 0 65 -4,-1.3 4,-1.5 -5,-0.2 -1,-0.2 0.816 110.0 50.5 -67.6 -34.4 21.8 23.9 13.4 23 27 A V H X S+ 0 0 1 -4,-1.1 4,-0.6 -3,-0.4 -1,-0.2 0.830 112.5 46.2 -76.7 -36.6 22.4 23.0 9.7 24 28 A L H >< S+ 0 0 0 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.982 112.6 51.1 -62.3 -56.3 18.7 23.0 9.0 25 29 A M H >< S+ 0 0 52 -4,-2.4 3,-2.4 1,-0.3 -2,-0.2 0.735 92.3 75.2 -58.0 -30.2 18.3 26.4 10.8 26 30 A A H 3< S+ 0 0 13 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.1 0.909 85.5 65.0 -45.9 -45.7 21.1 28.0 8.9 27 31 A F T << S+ 0 0 1 -3,-1.4 8,-2.6 -4,-0.6 2,-0.7 0.472 87.0 85.4 -64.5 0.5 18.9 28.3 5.8 28 32 A I B < S-B 34 0B 37 -3,-2.4 6,-0.2 6,-0.3 -1,-0.1 -0.901 71.2-149.7-108.0 106.6 16.6 30.7 7.8 29 33 A N > - 0 0 39 4,-2.3 3,-1.8 -2,-0.7 -2,-0.0 -0.149 36.1 -98.2 -61.0 166.4 17.7 34.4 7.7 30 34 A E T 3 S+ 0 0 205 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.787 122.3 69.7 -62.4 -25.3 16.9 36.6 10.7 31 35 A N T 3 S- 0 0 125 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.282 117.0-113.4 -72.4 9.5 13.8 37.8 8.7 32 36 A G S < S+ 0 0 56 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.409 80.2 124.0 72.7 -3.4 12.3 34.4 9.3 33 37 A E - 0 0 121 1,-0.1 -4,-2.3 -5,-0.0 -1,-0.3 -0.630 66.0-109.6 -88.3 147.3 12.6 33.7 5.5 34 38 A A B -B 28 0B 57 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.3 -0.289 37.0-164.2 -65.9 156.5 14.4 30.8 3.9 35 39 A Q - 0 0 69 -8,-2.6 2,-0.2 42,-0.0 44,-0.1 -0.995 20.4-108.8-146.9 153.3 17.7 31.4 2.0 36 40 A M + 0 0 120 -2,-0.3 2,-0.3 42,-0.1 42,-0.2 -0.501 38.3 173.6 -77.2 150.0 20.0 29.8 -0.4 37 41 A L E -C 77 0C 12 40,-2.5 40,-4.0 -2,-0.2 2,-0.2 -0.988 26.1-136.3-151.6 146.5 23.5 28.6 0.7 38 42 A N E > -C 76 0C 45 -2,-0.3 4,-1.8 38,-0.3 5,-0.2 -0.609 41.5-100.9 -92.6 169.7 26.4 26.7 -0.7 39 43 A K H > S+ 0 0 30 36,-0.5 4,-2.5 -2,-0.2 5,-0.1 0.895 120.6 54.3 -56.5 -44.0 28.1 24.1 1.5 40 44 A T H > S+ 0 0 55 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.930 107.4 48.5 -55.5 -53.3 31.0 26.5 2.4 41 45 A A H >> S+ 0 0 20 1,-0.2 4,-2.2 2,-0.2 3,-0.5 0.894 112.1 48.8 -59.0 -44.4 28.8 29.3 3.7 42 46 A V H 3X S+ 0 0 0 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.964 106.1 58.0 -55.9 -50.7 26.8 26.9 5.9 43 47 A A H 3< S+ 0 0 10 -4,-2.5 5,-0.4 1,-0.2 -1,-0.2 0.770 109.7 46.4 -51.3 -28.8 30.1 25.5 7.2 44 48 A E H << S+ 0 0 133 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.906 102.7 59.8 -83.6 -46.7 30.8 29.1 8.3 45 49 A M H < S+ 0 0 104 -4,-2.2 2,-0.5 2,-0.1 -2,-0.2 0.752 106.0 53.9 -49.1 -31.9 27.5 30.0 10.0 46 50 A I S < S- 0 0 11 -4,-1.3 2,-1.4 2,-0.1 7,-0.1 -0.918 81.0-134.2-114.2 127.5 27.9 27.1 12.5 47 51 A Q + 0 0 192 -2,-0.5 2,-0.3 2,-0.0 -3,-0.1 -0.727 66.0 108.9 -81.6 94.6 30.8 26.5 14.7 48 52 A L S S- 0 0 61 -2,-1.4 -2,-0.1 -5,-0.4 5,-0.1 -0.943 83.0 -62.2-157.7 155.2 31.3 22.8 14.1 49 53 A S > - 0 0 61 -2,-0.3 4,-2.3 1,-0.1 3,-0.4 -0.132 44.5-136.8 -39.0 111.2 33.8 20.6 12.3 50 54 A K H > S+ 0 0 99 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.847 103.7 57.0 -42.0 -47.0 33.6 21.5 8.6 51 55 A P H > S+ 0 0 92 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.952 108.1 45.1 -46.6 -57.5 33.7 17.8 7.7 52 56 A T H > S+ 0 0 61 -3,-0.4 4,-2.1 1,-0.2 -2,-0.2 0.880 112.5 51.8 -60.3 -40.1 30.6 17.0 9.8 53 57 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.863 111.1 47.3 -65.1 -36.4 28.7 20.1 8.5 54 58 A F H X S+ 0 0 61 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.934 112.0 50.9 -67.1 -44.6 29.5 18.9 4.9 55 59 A A H X S+ 0 0 56 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.845 110.9 49.0 -59.3 -36.8 28.3 15.4 5.8 56 60 A T H X S+ 0 0 6 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.930 108.7 50.6 -72.9 -47.7 25.1 16.8 7.2 57 61 A V H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.912 109.3 56.2 -51.2 -43.9 24.3 19.0 4.2 58 62 A N H X S+ 0 0 76 -4,-2.4 4,-1.9 2,-0.2 3,-0.3 0.948 110.2 40.0 -57.8 -53.6 24.9 15.8 2.1 59 63 A W H X S+ 0 0 20 -4,-1.9 4,-3.6 1,-0.2 5,-0.3 0.911 108.9 61.5 -64.7 -40.2 22.3 13.6 3.9 60 64 A F H X>S+ 0 0 0 -4,-2.6 5,-3.0 2,-0.2 6,-1.0 0.877 106.0 49.6 -48.4 -39.7 19.9 16.6 4.1 61 65 A Y H ><5S+ 0 0 81 -4,-1.7 3,-2.0 -3,-0.3 -2,-0.2 1.000 112.8 44.3 -59.9 -72.3 20.1 16.4 0.3 62 66 A C H 3<5S+ 0 0 7 -4,-1.9 -2,-0.2 1,-0.3 50,-0.2 0.885 110.6 54.3 -24.3 -70.2 19.4 12.7 0.2 63 67 A A H 3<5S- 0 0 1 -4,-3.6 -1,-0.3 1,-0.1 -2,-0.2 0.719 118.0-113.8 -51.0 -25.7 16.6 12.9 2.7 64 68 A G T <<5S+ 0 0 11 -3,-2.0 19,-0.4 -4,-1.0 18,-0.4 0.628 81.4 122.4 98.0 21.4 15.0 15.6 0.5 65 69 A Y S -D 74 0C 80 3,-2.6 3,-1.5 -2,-0.5 2,-0.8 -0.903 53.7 -68.2-120.1 105.9 25.0 27.9 -10.5 72 76 A G T 3 S- 0 0 82 -2,-0.6 -2,-0.0 1,-0.3 3,-0.0 -0.391 119.6 -11.0 52.7 -98.7 27.8 28.6 -13.0 73 77 A R T 3 S+ 0 0 246 -2,-0.8 -1,-0.3 -3,-0.0 2,-0.2 0.803 126.8 51.2 -99.4 -36.5 30.6 26.7 -11.3 74 78 A S E < S- D 0 71C 58 -3,-1.5 -3,-2.6 -4,-0.0 2,-0.4 -0.492 77.1-108.1-108.0 171.7 29.4 25.7 -7.9 75 79 A K E - D 0 70C 79 -5,-0.2 -36,-0.5 -2,-0.2 2,-0.4 -0.872 28.9-165.0-104.3 130.7 26.4 24.0 -6.2 76 80 A I E -CD 38 69C 28 -7,-2.2 -7,-2.5 -2,-0.4 2,-0.4 -0.942 6.6-148.9-121.2 134.6 23.9 26.1 -4.2 77 81 A Y E +CD 37 68C 5 -40,-4.0 -40,-2.5 -2,-0.4 2,-0.3 -0.825 16.1 174.1-111.6 139.8 21.2 24.7 -1.8 78 82 A T E - D 0 67C 50 -11,-2.4 -11,-2.0 -2,-0.4 2,-0.2 -0.886 41.7 -87.5-128.5 166.3 17.8 25.8 -0.7 79 83 A L E - D 0 66C 14 -2,-0.3 -13,-0.3 -13,-0.3 -14,-0.1 -0.506 38.3-132.4 -73.1 141.6 15.1 24.2 1.5 80 84 A S > - 0 0 9 -15,-3.0 4,-2.4 -2,-0.2 5,-0.2 -0.222 36.8 -95.6 -72.2 177.4 12.6 21.8 -0.1 81 85 A D H > S+ 0 0 120 2,-0.2 4,-1.4 1,-0.2 -1,-0.1 0.818 134.5 51.8 -63.4 -29.2 8.9 22.2 0.6 82 86 A L H > S+ 0 0 10 -18,-0.4 4,-2.5 2,-0.2 5,-0.2 0.916 105.2 51.7 -70.0 -50.7 9.7 19.5 3.1 83 87 A G H > S+ 0 0 0 -18,-0.4 4,-2.1 -19,-0.4 -2,-0.2 0.928 111.1 49.2 -51.4 -47.8 12.6 21.5 4.6 84 88 A V H X S+ 0 0 61 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.887 109.3 52.2 -59.0 -41.7 10.3 24.5 5.0 85 89 A E H X S+ 0 0 63 -4,-1.4 4,-1.0 2,-0.2 -1,-0.2 0.890 108.2 50.3 -66.0 -39.9 7.7 22.3 6.7 86 90 A I H >X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 3,-0.7 0.906 110.8 49.1 -61.2 -45.0 10.2 20.9 9.2 87 91 A V H 3X S+ 0 0 16 -4,-2.1 4,-3.5 1,-0.2 -2,-0.2 0.896 104.4 61.9 -59.6 -38.5 11.2 24.5 10.0 88 92 A E H 3X S+ 0 0 77 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.752 101.4 51.2 -61.6 -28.7 7.5 25.2 10.3 89 93 A C H -A 2 0A 50 -102,-0.2 4,-1.2 -2,-0.2 -102,-0.2 -0.902 22.4-165.3 -86.0 119.4 7.9 11.3 -3.5 105 11 B I H > S+ 0 0 0 -104,-2.9 4,-2.9 -2,-0.7 -1,-0.2 0.872 85.1 59.5 -76.5 -34.0 9.5 7.9 -2.7 106 12 B A H > S+ 0 0 38 -105,-0.8 4,-2.2 1,-0.2 5,-0.2 0.907 106.0 48.1 -53.2 -49.2 10.9 7.6 -6.2 107 13 B E H > S+ 0 0 84 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.836 113.3 46.5 -64.4 -37.6 12.9 10.8 -5.7 108 14 B I H X S+ 0 0 8 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.890 110.7 54.1 -73.5 -40.4 14.3 9.8 -2.3 109 15 B A H X S+ 0 0 0 -4,-2.9 4,-4.0 2,-0.2 5,-0.2 0.965 107.9 47.2 -55.6 -57.2 15.2 6.3 -3.6 110 16 B E H X S+ 0 0 104 -4,-2.2 4,-1.2 1,-0.3 -1,-0.2 0.856 112.3 51.9 -56.6 -37.4 17.3 7.7 -6.6 111 17 B R H < S+ 0 0 30 -4,-1.2 -1,-0.3 2,-0.2 -2,-0.2 0.903 114.9 41.0 -64.2 -44.6 19.0 10.1 -4.2 112 18 B I H >< S+ 0 0 0 -4,-2.4 3,-2.6 1,-0.2 7,-0.7 0.917 107.8 61.7 -68.8 -44.4 19.9 7.2 -1.8 113 19 B G H 3< S+ 0 0 38 -4,-4.0 -1,-0.2 1,-0.3 -2,-0.2 0.780 99.7 58.1 -51.3 -30.6 20.7 4.9 -4.8 114 20 B N T 3< S+ 0 0 147 -4,-1.2 2,-0.4 -5,-0.2 -1,-0.3 0.161 93.9 74.2 -89.6 18.6 23.5 7.5 -5.6 115 21 B D <> - 0 0 51 -3,-2.6 4,-2.2 1,-0.1 5,-0.2 -0.939 66.9-159.0-129.8 109.4 25.1 7.1 -2.2 116 22 B D H > S+ 0 0 104 -2,-0.4 4,-1.7 1,-0.2 5,-0.2 0.915 91.9 45.5 -55.0 -49.6 27.0 3.8 -1.7 117 23 B C H > S+ 0 0 13 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.918 113.0 49.1 -61.2 -47.5 27.0 3.9 2.0 118 24 B A H > S+ 0 0 0 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.959 109.6 51.2 -57.8 -56.3 23.2 4.8 2.4 119 25 B Y H X S+ 0 0 87 -4,-2.2 4,-3.1 -7,-0.7 -1,-0.2 0.878 112.9 45.0 -45.8 -51.6 22.0 2.2 -0.0 120 26 B Q H X S+ 0 0 63 -4,-1.7 4,-2.2 -5,-0.2 -1,-0.2 0.890 112.4 50.9 -66.2 -42.6 23.9 -0.6 1.7 121 27 B V H < S+ 0 0 0 -4,-2.3 4,-0.4 2,-0.2 -2,-0.2 0.931 113.8 46.2 -60.5 -47.4 22.8 0.5 5.2 122 28 B L H >< S+ 0 0 0 -4,-3.2 3,-2.2 1,-0.2 -2,-0.2 0.995 113.4 47.3 -55.5 -62.6 19.3 0.6 4.0 123 29 B M H >< S+ 0 0 49 -4,-3.1 3,-2.3 1,-0.3 -2,-0.2 0.724 93.0 78.4 -59.4 -24.9 19.4 -2.8 2.3 124 30 B A T 3< S+ 0 0 14 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.702 85.4 64.0 -54.3 -20.4 21.1 -4.5 5.3 125 31 B F T < S+ 0 0 0 -3,-2.2 8,-3.4 -4,-0.4 2,-0.5 0.438 87.7 80.6 -88.1 1.4 17.6 -4.6 7.0 126 32 B I B < S-E 132 0D 38 -3,-2.3 6,-0.2 6,-0.3 5,-0.1 -0.936 76.4-145.0-106.2 127.2 16.3 -7.0 4.4 127 33 B N > - 0 0 43 4,-3.4 3,-1.8 -2,-0.5 -2,-0.1 -0.105 32.8 -86.9 -84.0-175.9 17.3 -10.6 4.9 128 34 B E T 3 S+ 0 0 200 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.910 128.9 52.0 -56.4 -44.4 18.1 -13.4 2.5 129 35 B N T 3 S- 0 0 127 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.303 119.5-109.8 -77.1 7.4 14.4 -14.3 2.2 130 36 B G S < S+ 0 0 51 -3,-1.8 2,-0.2 1,-0.3 -2,-0.1 0.330 78.0 130.5 80.2 -9.6 13.5 -10.7 1.4 131 37 B E - 0 0 126 -5,-0.1 -4,-3.4 1,-0.1 -1,-0.3 -0.495 64.2-108.1 -73.9 147.3 11.8 -10.2 4.8 132 38 B A B +E 126 0D 62 -6,-0.2 -6,-0.3 -2,-0.2 2,-0.2 -0.560 43.8 178.9 -77.1 137.4 12.7 -7.2 6.9 133 39 B Q - 0 0 61 -8,-3.4 44,-0.6 -2,-0.3 2,-0.4 -0.570 22.4-106.9-128.3-169.4 14.7 -7.8 10.0 134 40 B M E +F 176 0E 100 -2,-0.2 2,-0.3 42,-0.1 42,-0.2 -0.956 30.9 166.1-132.3 146.8 16.3 -6.0 12.9 135 41 B L E -F 175 0E 13 40,-2.1 40,-3.6 -2,-0.4 2,-0.2 -0.948 28.6-123.8-149.8 158.9 19.9 -5.1 13.8 136 42 B N > - 0 0 55 -2,-0.3 4,-1.8 38,-0.3 5,-0.2 -0.524 47.3 -90.3 -95.4 176.7 21.9 -2.9 16.2 137 43 B K H > S+ 0 0 68 36,-0.4 4,-2.4 1,-0.2 5,-0.1 0.889 125.9 52.4 -50.2 -45.7 24.5 -0.4 15.0 138 44 B T H > S+ 0 0 73 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.894 106.0 50.7 -62.1 -48.8 27.3 -3.1 15.3 139 45 B A H > S+ 0 0 23 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.877 111.1 49.4 -60.7 -40.1 25.6 -5.7 13.1 140 46 B V H >X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 3,-0.8 0.984 109.4 52.2 -59.2 -55.3 24.9 -3.2 10.4 141 47 B A H 3< S+ 0 0 3 -4,-2.4 5,-0.5 1,-0.3 -2,-0.2 0.813 108.5 53.1 -46.8 -38.8 28.6 -2.1 10.5 142 48 B E H 3< S+ 0 0 146 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.851 108.4 46.5 -71.6 -37.2 29.6 -5.8 10.2 143 49 B M H << S+ 0 0 112 -4,-1.7 2,-0.4 -3,-0.8 -2,-0.2 0.877 102.0 74.5 -75.4 -36.0 27.5 -6.5 7.0 144 50 B I S < S- 0 0 11 -4,-2.2 2,-1.4 -5,-0.2 7,-0.1 -0.643 78.1-140.9 -79.3 128.4 28.7 -3.3 5.3 145 51 B Q + 0 0 185 -2,-0.4 2,-0.3 2,-0.0 -1,-0.1 -0.350 69.1 104.5 -82.4 53.1 32.3 -3.4 4.0 146 52 B L S S- 0 0 57 -2,-1.4 5,-0.2 -5,-0.5 -2,-0.1 -0.979 85.6 -67.6-139.7 149.7 32.8 0.2 5.1 147 53 B S > - 0 0 67 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.010 43.4-133.2 -29.5 115.5 34.5 2.3 7.8 148 54 B K H > S+ 0 0 107 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.879 109.5 53.2 -47.4 -49.4 32.6 1.6 11.1 149 55 B P H > S+ 0 0 91 0, 0.0 4,-2.1 0, 0.0 3,-0.3 0.963 108.3 50.1 -40.4 -62.1 32.5 5.4 11.7 150 56 B T H > S+ 0 0 60 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.889 111.2 48.3 -47.8 -48.6 31.0 5.9 8.2 151 57 B V H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.876 109.2 54.1 -64.8 -36.2 28.3 3.2 8.9 152 58 B F H X S+ 0 0 65 -4,-2.2 4,-2.4 -3,-0.3 -2,-0.2 0.905 104.9 51.7 -66.7 -43.4 27.5 4.8 12.3 153 59 B A H X S+ 0 0 54 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.854 112.9 47.5 -56.7 -38.3 26.9 8.3 10.8 154 60 B T H X S+ 0 0 7 -4,-1.4 4,-3.2 2,-0.2 5,-0.3 0.935 109.7 50.0 -73.5 -50.1 24.5 6.8 8.3 155 61 B V H X S+ 0 0 1 -4,-2.6 4,-1.1 2,-0.2 -2,-0.2 0.888 112.6 51.8 -55.7 -38.2 22.6 4.7 10.8 156 62 B N H >X S+ 0 0 78 -4,-2.4 4,-1.8 -5,-0.2 3,-1.3 0.996 114.4 39.0 -57.4 -62.6 22.4 7.9 12.9 157 63 B W H 3X S+ 0 0 18 -4,-2.9 4,-3.0 1,-0.3 6,-0.2 0.787 108.2 61.9 -67.4 -27.1 20.9 10.0 10.1 158 64 B F H 3X>S+ 0 0 0 -4,-3.2 5,-2.0 2,-0.2 6,-1.1 0.841 107.0 49.0 -57.8 -34.1 18.7 7.1 8.8 159 65 B Y H <<5S+ 0 0 75 -3,-1.3 3,-0.5 -4,-1.1 -2,-0.2 0.941 111.6 46.3 -72.2 -49.8 17.1 7.4 12.2 160 66 B C H <5S+ 0 0 9 -4,-1.8 -146,-0.4 1,-0.2 -2,-0.2 0.865 109.8 54.7 -52.5 -44.4 16.7 11.2 11.9 161 67 B A H <5S- 0 0 2 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.788 115.4-118.0 -62.9 -31.8 15.3 10.9 8.4 162 68 B G T <5S+ 0 0 8 -4,-0.9 19,-0.4 -3,-0.5 18,-0.3 0.494 80.0 121.5 101.6 11.2 12.7 8.5 9.8 163 69 B Y S -G 172 0E 88 3,-0.7 2,-1.8 -2,-0.1 3,-0.5 -0.807 57.9 -50.9-157.7 115.1 15.7 -4.4 24.5 170 76 B G T 3 S- 0 0 89 1,-0.3 3,-0.1 -2,-0.2 -2,-0.1 -0.368 125.8 -24.4 62.7 -84.6 17.5 -5.7 27.6 171 77 B R T 3 S+ 0 0 240 -2,-1.8 -1,-0.3 1,-0.1 2,-0.2 -0.325 122.8 90.2-150.2 57.2 20.7 -3.6 27.2 172 78 B S E < - G 0 169E 44 -3,-0.5 -3,-0.7 2,-0.0 2,-0.6 -0.797 63.1-143.4-162.4 111.3 20.6 -3.0 23.5 173 79 B K E - G 0 168E 98 -2,-0.2 -36,-0.4 -5,-0.2 2,-0.4 -0.677 33.3-166.3 -70.5 117.4 19.1 -0.2 21.3 174 80 B I E - G 0 167E 21 -7,-2.8 -7,-3.9 -2,-0.6 2,-0.3 -0.879 7.6-141.1-113.6 144.2 18.0 -2.2 18.2 175 81 B Y E +FG 135 166E 8 -40,-3.6 -40,-2.1 -2,-0.4 2,-0.3 -0.837 20.5 171.0-111.4 145.7 16.9 -0.8 14.9 176 82 B T E -FG 134 165E 43 -11,-1.8 -11,-3.3 -2,-0.3 -42,-0.1 -0.971 42.7 -86.1-143.8 152.1 14.2 -1.8 12.4 177 83 B L E - G 0 164E 17 -44,-0.6 -13,-0.3 -2,-0.3 2,-0.1 -0.376 37.2-139.8 -60.1 135.2 12.7 -0.2 9.3 178 84 B S > - 0 0 7 -15,-2.7 4,-2.0 -16,-0.1 5,-0.2 -0.364 37.8 -95.2 -71.2 172.3 10.0 2.3 9.9 179 85 B D H > S+ 0 0 115 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.886 130.5 54.3 -57.1 -43.3 7.1 2.1 7.4 180 86 B L H > S+ 0 0 2 -18,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.903 105.6 52.6 -51.7 -46.5 8.9 4.8 5.3 181 87 B G H > S+ 0 0 0 -19,-0.4 4,-2.1 -18,-0.4 -2,-0.2 0.915 108.9 49.4 -62.0 -42.7 12.0 2.7 5.3 182 88 B V H X S+ 0 0 49 -4,-2.0 4,-3.0 2,-0.2 -1,-0.2 0.847 107.6 55.8 -63.1 -38.0 10.0 -0.2 3.9 183 89 B E H X S+ 0 0 46 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.972 107.0 49.4 -52.9 -53.9 8.6 2.2 1.4 184 90 B I H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 3,-0.5 0.872 115.0 43.3 -58.9 -41.3 12.1 3.0 0.2 185 91 B V H >X S+ 0 0 10 -4,-2.1 4,-3.1 1,-0.2 3,-1.1 0.984 108.0 56.9 -65.3 -56.4 13.1 -0.7 -0.1 186 92 B E H 3< S+ 0 0 87 -4,-3.0 4,-0.4 1,-0.3 -1,-0.2 0.580 108.7 52.2 -57.9 -5.6 9.8 -1.8 -1.8 187 93 B C H 3X S+ 0 0 8 -4,-0.7 4,-1.8 -3,-0.5 -1,-0.3 0.806 110.0 43.2 -94.2 -41.9 10.8 0.9 -4.3 188 94 B F H S+ 0 0 94 -4,-0.4 4,-2.8 -5,-0.3 -1,-0.2 0.857 108.1 51.4 -69.7 -40.4 10.5 -2.7 -7.8 191 97 B K H X S+ 0 0 85 -4,-1.8 4,-0.5 2,-0.2 -1,-0.2 0.883 116.3 43.0 -63.6 -40.5 13.2 -1.0 -10.0 192 98 B A H >X S+ 0 0 31 -4,-2.5 4,-1.4 2,-0.2 3,-0.7 0.913 112.4 54.9 -66.0 -45.2 15.2 -4.2 -9.8 193 99 B M H 3< S+ 0 0 114 -4,-2.7 3,-0.3 -5,-0.3 -2,-0.2 0.921 109.2 45.4 -53.2 -51.9 12.0 -6.3 -10.4 194 100 B E H 3< S+ 0 0 160 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.647 105.5 66.4 -68.7 -17.5 11.1 -4.5 -13.6 195 101 B M H << 0 0 143 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.937 360.0 360.0 -70.5 -49.3 14.7 -4.8 -14.7 196 102 B R < 0 0 239 -4,-1.4 0, 0.0 -3,-0.3 0, 0.0 -0.404 360.0 360.0 -85.9 360.0 14.9 -8.6 -15.1