==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REPRESSOR 16-NOV-04 1Y0U . COMPND 2 MOLECULE: ARSENICAL RESISTANCE OPERON REPRESSOR, PUTATIVE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR Y.KIM,A.JOACHIMIAK,T.SKARINA,A.SAVCHENKO,A.EDWARDS,MIDWEST C . 177 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11662.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 139 78.5 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 . 10 5.6 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 . 2 1.1 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 . 5 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 101 57.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.4 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 0 2 0 2 0 0 0 0 0 0 0 0 0 0 1 0 0 1 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 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 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 -1 A G >> 0 0 32 0, 0.0 3,-1.2 0, 0.0 4,-0.6 0.000 360.0 360.0 360.0-145.3 -1.2 19.2 66.7 2 0 A H G >4 + 0 0 129 1,-0.3 3,-1.2 2,-0.2 4,-0.4 0.805 360.0 59.9 -58.8 -34.5 0.8 21.0 64.0 3 1 A X G >4 S+ 0 0 128 1,-0.3 3,-1.7 2,-0.2 -1,-0.3 0.879 96.3 62.1 -62.9 -34.5 3.9 18.8 64.4 4 2 A S G X> S+ 0 0 32 -3,-1.2 3,-1.8 1,-0.3 4,-0.6 0.749 85.3 75.9 -63.3 -22.9 1.9 15.7 63.4 5 3 A L H XX S+ 0 0 1 -3,-1.2 4,-2.2 -4,-0.6 3,-0.8 0.813 79.8 72.8 -56.3 -30.9 1.1 17.3 60.0 6 4 A E H <> S+ 0 0 82 -3,-1.7 4,-2.8 -4,-0.4 -1,-0.3 0.794 89.4 59.7 -57.7 -28.7 4.7 16.4 59.1 7 5 A E H <> S+ 0 0 124 -3,-1.8 4,-2.3 -4,-0.3 -1,-0.3 0.870 106.4 45.9 -62.1 -42.6 3.5 12.7 59.0 8 6 A W H - 0 0 37 -2,-0.4 4,-2.4 -3,-0.4 5,-0.2 -0.974 67.3-149.8-139.7 119.1 15.6 1.3 27.4 31 29 A P H > S+ 0 0 84 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.810 98.7 53.9 -66.0 -30.7 18.4 1.4 24.8 32 30 A V H > S+ 0 0 49 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.937 110.5 47.3 -65.3 -45.7 16.1 2.7 22.1 33 31 A R H > S+ 0 0 4 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.894 108.6 54.7 -62.1 -39.7 15.1 5.6 24.4 34 32 A R H X S+ 0 0 85 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.910 109.6 47.4 -58.6 -42.2 18.7 6.3 25.3 35 33 A K H X S+ 0 0 82 -4,-2.0 4,-3.0 2,-0.2 5,-0.2 0.906 107.7 55.0 -67.7 -39.8 19.5 6.6 21.6 36 34 A I H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.947 109.6 49.0 -53.5 -47.6 16.5 8.9 21.1 37 35 A L H X S+ 0 0 5 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.924 111.3 48.0 -58.7 -45.9 18.0 11.1 23.9 38 36 A R H X S+ 0 0 121 -4,-2.2 4,-1.0 2,-0.2 -1,-0.2 0.929 114.3 46.9 -62.4 -41.5 21.5 11.1 22.3 39 37 A X H <>S+ 0 0 11 -4,-3.0 5,-2.6 1,-0.2 3,-0.5 0.907 111.5 49.9 -68.7 -42.4 20.0 12.0 18.9 40 38 A L H ><5S+ 0 0 21 -4,-3.0 3,-1.5 -5,-0.2 -1,-0.2 0.898 107.9 54.5 -60.4 -39.9 17.7 14.8 20.2 41 39 A D H 3<5S+ 0 0 88 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.759 107.5 50.5 -68.3 -22.3 20.7 16.2 22.1 42 40 A K T 3<5S- 0 0 161 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.326 119.9-112.3 -92.3 1.7 22.6 16.4 18.7 43 41 A G T < 5 + 0 0 65 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.668 55.4 168.2 77.2 18.9 19.6 18.1 17.1 44 42 A R < - 0 0 106 -5,-2.6 -1,-0.2 -6,-0.1 2,-0.1 -0.337 37.0-110.8 -63.2 144.9 18.7 15.2 14.9 45 43 A S > - 0 0 59 1,-0.1 4,-2.2 34,-0.0 5,-0.2 -0.363 21.0-114.7 -72.5 157.1 15.3 15.5 13.1 46 44 A E H > S+ 0 0 63 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.879 117.8 57.5 -56.3 -38.0 12.4 13.3 14.1 47 45 A E H > S+ 0 0 127 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.920 107.4 45.9 -59.8 -46.0 12.6 11.8 10.5 48 46 A E H > S+ 0 0 68 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.884 111.7 52.2 -66.2 -37.6 16.2 10.8 11.0 49 47 A I H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.941 110.8 47.7 -60.4 -47.3 15.4 9.3 14.4 50 48 A X H X>S+ 0 0 52 -4,-2.8 5,-1.7 1,-0.2 4,-1.1 0.938 114.7 46.0 -61.1 -48.0 12.6 7.3 12.9 51 49 A Q H <5S+ 0 0 141 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.900 116.2 44.4 -57.6 -45.6 14.8 6.1 10.0 52 50 A T H <5S+ 0 0 68 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.803 122.8 35.1 -76.2 -31.1 17.7 5.2 12.3 53 51 A L H <5S- 0 0 31 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.434 104.9-122.5-102.2 -2.3 15.7 3.4 15.0 54 52 A S T <5 + 0 0 102 -4,-1.1 2,-0.4 1,-0.2 -3,-0.2 0.922 57.9 153.5 57.9 50.0 13.1 1.9 12.7 55 53 A L < - 0 0 17 -5,-1.7 -1,-0.2 -6,-0.2 -2,-0.1 -0.909 40.4-136.8-111.6 133.3 10.2 3.6 14.5 56 54 A S > - 0 0 56 -2,-0.4 4,-2.9 1,-0.1 5,-0.3 -0.367 37.6-101.0 -71.4 166.6 6.8 4.5 13.1 57 55 A K H > S+ 0 0 146 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.921 127.2 50.0 -53.7 -45.4 5.4 7.9 14.0 58 56 A K H > S+ 0 0 172 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.917 111.2 47.3 -61.3 -45.2 3.2 6.1 16.5 59 57 A Q H > S+ 0 0 95 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.891 114.5 46.0 -64.4 -43.1 6.1 4.2 18.1 60 58 A L H X S+ 0 0 2 -4,-2.9 4,-3.0 2,-0.2 5,-0.2 0.942 110.8 53.3 -64.1 -46.2 8.3 7.4 18.3 61 59 A D H X S+ 0 0 61 -4,-2.8 4,-2.4 -5,-0.3 -2,-0.2 0.896 108.5 50.9 -55.7 -42.2 5.4 9.3 19.7 62 60 A Y H X S+ 0 0 112 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.945 111.4 46.3 -59.7 -50.4 5.0 6.6 22.4 63 61 A H H X S+ 0 0 24 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.891 112.2 51.2 -61.0 -40.7 8.7 6.8 23.3 64 62 A L H X S+ 0 0 4 -4,-3.0 4,-2.7 2,-0.2 -1,-0.2 0.904 108.5 52.0 -62.0 -42.7 8.7 10.6 23.4 65 63 A K H X S+ 0 0 151 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.911 111.3 47.2 -59.5 -42.5 5.6 10.4 25.7 66 64 A V H X S+ 0 0 18 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.902 112.2 49.2 -65.9 -42.7 7.5 8.1 28.1 67 65 A L H <>S+ 0 0 0 -4,-2.5 5,-2.5 2,-0.2 6,-0.7 0.893 112.5 48.4 -63.8 -40.0 10.6 10.3 28.0 68 66 A E H ><5S+ 0 0 92 -4,-2.7 3,-1.7 1,-0.2 -2,-0.2 0.927 111.0 49.6 -66.2 -45.9 8.5 13.3 28.8 69 67 A A H 3<5S+ 0 0 39 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.777 109.2 53.9 -62.3 -27.5 6.7 11.5 31.6 70 68 A G T 3<5S- 0 0 0 -4,-1.6 -1,-0.3 -47,-0.2 -2,-0.2 0.124 116.9-114.3 -96.8 18.2 10.1 10.5 33.0 71 69 A F T < 5S+ 0 0 59 -3,-1.7 15,-0.4 2,-0.2 14,-0.3 0.595 84.5 116.8 69.9 17.5 11.4 14.1 33.0 72 70 A C S S-A 79 0A 88 3,-2.9 3,-1.9 -2,-0.4 2,-0.4 -0.955 72.2 -48.9-120.6 107.1 10.1 24.2 23.3 77 75 A G T 3 S- 0 0 70 -2,-0.5 -2,-0.0 1,-0.3 0, 0.0 -0.527 123.1 -21.1 66.3-120.9 8.0 25.1 20.3 78 76 A E T 3 S+ 0 0 181 -2,-0.4 2,-0.4 -3,-0.1 -1,-0.3 0.307 121.6 89.9-101.2 7.6 8.2 22.2 17.8 79 77 A R E < -A 76 0A 176 -3,-1.9 -3,-2.9 -34,-0.0 2,-0.5 -0.874 68.8-137.2-113.3 137.3 11.5 20.9 19.2 80 78 A W E -A 75 0A 28 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.820 24.4-159.9 -87.8 126.3 12.1 18.3 21.9 81 79 A V E -A 74 0A 62 -7,-3.4 -7,-2.3 -2,-0.5 2,-0.4 -0.896 17.1-123.3-112.1 133.4 14.9 19.4 24.2 82 80 A V E -A 73 0A 7 -2,-0.4 -9,-0.3 -9,-0.2 -10,-0.1 -0.628 30.8-142.4 -77.8 128.5 16.8 17.0 26.5 83 81 A T > - 0 0 15 -11,-2.2 4,-1.2 -2,-0.4 3,-0.1 -0.294 27.8 -99.8 -82.5 170.8 16.7 18.1 30.1 84 82 A D T >4 S+ 0 0 96 1,-0.2 3,-0.7 2,-0.2 10,-0.2 0.916 127.8 51.9 -55.0 -41.7 19.4 18.0 32.7 85 83 A A T 34 S+ 0 0 0 -14,-0.3 -1,-0.2 1,-0.2 -13,-0.2 0.866 109.0 51.0 -61.9 -36.1 17.7 14.8 34.0 86 84 A G T 34 S+ 0 0 1 -15,-0.4 2,-0.9 -14,-0.2 -1,-0.2 0.638 85.8 97.0 -77.6 -17.3 17.8 13.3 30.5 87 85 A K << + 0 0 87 -4,-1.2 2,-0.5 -3,-0.7 -49,-0.0 -0.672 54.6 179.4 -79.4 106.5 21.5 14.0 29.9 88 86 A I 0 0 60 -2,-0.9 -2,-0.0 -54,-0.1 -3,-0.0 -0.947 360.0 360.0-116.2 130.4 23.2 10.8 30.7 89 87 A V 0 0 201 -2,-0.5 -2,-0.0 0, 0.0 -1,-0.0 0.084 360.0 360.0 30.3 360.0 27.0 10.3 30.5 90 !* 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 91 -1 B G >> 0 0 23 0, 0.0 4,-1.7 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0-139.9 21.3 12.6 34.9 92 0 B H H 3> + 0 0 88 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.823 360.0 57.8 -65.1 -36.3 20.2 11.3 38.3 93 1 B X H 3> S+ 0 0 175 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.885 107.7 48.9 -62.0 -38.0 21.6 14.1 40.4 94 2 B S H <> S+ 0 0 32 -3,-0.5 4,-2.1 -10,-0.2 -1,-0.2 0.902 109.2 52.6 -67.3 -40.6 19.5 16.6 38.5 95 3 B L H X S+ 0 0 2 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.936 109.4 49.9 -56.6 -47.5 16.4 14.5 38.9 96 4 B E H X S+ 0 0 71 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.882 107.0 53.6 -62.2 -41.1 17.1 14.4 42.7 97 5 B E H X S+ 0 0 144 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.926 112.0 46.0 -58.7 -44.3 17.4 18.2 42.9 98 6 B W H X S+ 0 0 79 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.910 110.1 52.8 -63.5 -45.0 14.0 18.5 41.2 99 7 B I H X S+ 0 0 16 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.919 109.1 50.2 -59.4 -43.0 12.4 15.9 43.4 100 8 B K H X S+ 0 0 147 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.916 111.5 47.9 -59.5 -46.4 13.6 17.8 46.5 101 9 B A H X S+ 0 0 58 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.909 111.9 50.0 -63.9 -42.3 12.2 21.1 45.2 102 10 B D H X S+ 0 0 37 -4,-2.9 4,-2.8 2,-0.2 5,-0.3 0.925 108.4 52.9 -59.7 -43.1 8.9 19.4 44.3 103 11 B S H X S+ 0 0 39 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.898 109.7 48.4 -60.0 -42.0 8.7 17.9 47.8 104 12 B L H X S+ 0 0 107 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.891 111.3 51.4 -68.8 -37.2 9.2 21.3 49.4 105 13 B E H X S+ 0 0 107 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.938 112.0 43.8 -62.0 -49.0 6.6 22.8 47.1 106 14 B K H X S+ 0 0 42 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.833 111.4 56.1 -71.2 -27.2 3.9 20.2 48.0 107 15 B A H X S+ 0 0 13 -4,-2.0 4,-2.7 -5,-0.3 -1,-0.2 0.924 106.0 50.4 -64.7 -45.2 4.9 20.5 51.7 108 16 B D H X S+ 0 0 108 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.897 109.0 52.5 -60.6 -38.1 4.2 24.3 51.5 109 17 B E H X S+ 0 0 96 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.915 109.3 48.7 -62.3 -46.5 0.8 23.5 49.9 110 18 B Y H X S+ 0 0 37 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.922 110.6 51.4 -59.4 -45.0 -0.1 21.1 52.8 111 19 B H H X S+ 0 0 53 -4,-2.7 4,-3.1 1,-0.2 5,-0.2 0.908 107.5 53.0 -58.8 -42.1 1.0 23.8 55.3 112 20 B K H X S+ 0 0 159 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.927 112.7 43.8 -58.0 -45.4 -1.3 26.3 53.6 113 21 B R H X S+ 0 0 110 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.909 117.2 44.5 -69.6 -45.1 -4.3 24.0 53.8 114 22 B Y H X S+ 0 0 6 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.935 112.1 52.4 -63.2 -47.5 -3.6 22.9 57.4 115 23 B N H X S+ 0 0 79 -4,-3.1 4,-1.1 -5,-0.2 -2,-0.2 0.884 110.2 48.5 -61.0 -38.6 -2.9 26.5 58.5 116 24 B Y H < S+ 0 0 134 -4,-2.1 3,-0.4 -5,-0.2 -1,-0.2 0.921 110.6 52.5 -64.5 -43.4 -6.2 27.7 57.1 117 25 B A H < S+ 0 0 0 -4,-2.1 3,-0.3 1,-0.2 -2,-0.2 0.895 114.1 39.7 -60.8 -43.4 -8.1 24.9 58.8 118 26 B V H < S+ 0 0 20 -4,-2.4 2,-0.7 1,-0.2 -1,-0.2 0.632 95.9 79.1 -89.4 -9.8 -6.8 25.5 62.3 119 27 B T S < S+ 0 0 98 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.1 -0.254 77.0 82.5 -96.9 48.9 -6.8 29.3 62.3 120 28 B N > - 0 0 40 -2,-0.7 4,-2.1 -3,-0.3 5,-0.1 -0.941 68.9-147.3-147.3 122.4 -10.6 29.7 63.0 121 29 B P H > S+ 0 0 82 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.781 99.5 56.4 -68.5 -26.4 -11.9 29.3 66.5 122 30 B V H > S+ 0 0 55 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.946 109.9 46.5 -66.8 -44.7 -15.2 27.8 65.4 123 31 B R H > S+ 0 0 7 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.888 108.9 55.2 -61.5 -37.9 -13.2 25.1 63.7 124 32 B R H X S+ 0 0 88 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.926 109.8 46.4 -61.1 -41.8 -11.0 24.6 66.8 125 33 B K H X S+ 0 0 70 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.899 109.5 54.3 -66.9 -40.4 -14.1 24.0 68.8 126 34 B I H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.936 109.4 48.6 -55.8 -48.6 -15.5 21.6 66.2 127 35 B L H X S+ 0 0 5 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.914 110.6 49.8 -56.8 -46.2 -12.2 19.6 66.4 128 36 B R H X S+ 0 0 122 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.920 113.8 46.9 -62.2 -40.9 -12.4 19.5 70.3 129 37 B X H ><>S+ 0 0 10 -4,-2.7 5,-2.3 2,-0.2 3,-0.6 0.922 112.0 47.7 -68.3 -45.4 -16.0 18.3 70.1 130 38 B L H ><5S+ 0 0 15 -4,-2.9 3,-1.9 1,-0.2 -1,-0.2 0.915 109.1 55.5 -58.1 -43.9 -15.3 15.6 67.5 131 39 B D H 3<5S+ 0 0 79 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.757 106.5 51.6 -60.4 -28.4 -12.3 14.4 69.5 132 40 B K T <<5S- 0 0 132 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.304 123.8-105.4 -92.2 3.7 -14.7 14.0 72.5 133 41 B G T < 5 + 0 0 43 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.647 62.6 160.7 84.1 17.6 -17.1 11.9 70.5 134 42 B R < - 0 0 107 -5,-2.3 -1,-0.2 -6,-0.1 2,-0.1 -0.417 38.2-118.4 -70.0 145.6 -19.8 14.6 70.0 135 43 B S > - 0 0 43 1,-0.1 4,-2.2 -2,-0.1 5,-0.2 -0.400 21.5-112.6 -76.3 159.7 -22.3 14.0 67.2 136 44 B E H > S+ 0 0 38 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.888 120.9 56.2 -57.2 -36.7 -22.7 16.5 64.3 137 45 B E H > S+ 0 0 136 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.920 107.2 47.1 -62.5 -43.6 -26.1 17.3 65.7 138 46 B E H > S+ 0 0 76 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.878 112.0 51.3 -64.8 -37.8 -24.6 18.2 69.1 139 47 B I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.934 109.5 49.5 -65.8 -45.4 -22.0 20.3 67.3 140 48 B X H X>S+ 0 0 59 -4,-2.8 5,-2.0 1,-0.2 4,-0.7 0.911 116.2 42.8 -57.3 -45.2 -24.7 22.2 65.3 141 49 B Q H ><5S+ 0 0 140 -4,-2.2 3,-0.6 3,-0.2 -2,-0.2 0.939 116.4 46.0 -68.7 -47.1 -26.7 22.8 68.5 142 50 B T H 3<5S+ 0 0 78 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.866 123.0 34.7 -67.3 -38.8 -23.8 23.8 70.7 143 51 B L H 3<5S- 0 0 43 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.379 105.6-121.6 -97.9 4.9 -22.2 26.1 68.1 144 52 B S T <<5 + 0 0 110 -4,-0.7 2,-0.4 -3,-0.6 -3,-0.2 0.943 60.2 150.0 50.8 55.4 -25.4 27.5 66.5 145 53 B L < - 0 0 21 -5,-2.0 -1,-0.2 -6,-0.2 -2,-0.1 -0.931 45.2-130.5-116.0 140.8 -24.5 26.2 63.0 146 54 B S > - 0 0 50 -2,-0.4 4,-2.7 1,-0.1 5,-0.2 -0.376 34.3-108.3 -71.4 164.2 -26.7 25.0 60.2 147 55 B K H > S+ 0 0 109 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.894 122.6 56.1 -61.8 -38.1 -25.8 21.7 58.5 148 56 B K H > S+ 0 0 179 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.928 110.6 42.9 -59.1 -46.3 -24.6 23.8 55.5 149 57 B Q H > S+ 0 0 101 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.907 116.1 47.2 -67.3 -42.8 -22.2 25.8 57.7 150 58 B L H X S+ 0 0 2 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.941 110.5 52.7 -64.5 -44.5 -21.0 22.8 59.7 151 59 B D H X S+ 0 0 70 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.883 108.4 51.6 -58.4 -38.4 -20.5 20.8 56.4 152 60 B Y H X S+ 0 0 137 -4,-1.8 4,-2.2 -5,-0.2 -1,-0.2 0.937 110.2 47.2 -66.1 -45.7 -18.4 23.7 55.1 153 61 B H H X S+ 0 0 28 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.924 111.7 51.6 -57.0 -42.9 -16.2 23.7 58.1 154 62 B L H X S+ 0 0 2 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.889 107.2 53.3 -64.7 -38.8 -15.8 19.9 57.9 155 63 B K H X S+ 0 0 125 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.930 110.8 46.9 -55.7 -47.2 -14.8 20.3 54.2 156 64 B V H X S+ 0 0 11 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.918 112.4 49.2 -64.2 -43.8 -12.1 22.8 55.3 157 65 B L H <>S+ 0 0 0 -4,-2.7 5,-2.6 1,-0.2 6,-0.8 0.888 112.2 48.4 -64.5 -39.0 -10.9 20.5 58.1 158 66 B E H ><5S+ 0 0 92 -4,-2.6 3,-1.7 1,-0.2 -1,-0.2 0.925 110.4 50.9 -65.1 -44.5 -10.7 17.5 55.8 159 67 B A H 3<5S+ 0 0 39 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.761 110.8 50.9 -63.3 -26.1 -8.8 19.6 53.2 160 68 B G T 3<5S- 0 0 0 -4,-1.4 -1,-0.3 -47,-0.2 -2,-0.2 0.149 115.5-113.2-101.0 16.7 -6.4 20.6 55.9 161 69 B F T < 5S+ 0 0 20 -3,-1.7 14,-0.3 2,-0.2 15,-0.3 0.640 84.6 118.1 66.5 19.2 -5.7 17.0 57.2 162 70 B C S -B 169 0B 94 3,-3.3 3,-2.1 -2,-0.4 2,-0.3 -0.921 66.7 -56.6-125.8 107.3 -14.0 6.4 58.6 167 75 B G T 3 S- 0 0 62 -2,-0.5 -2,-0.0 1,-0.3 0, 0.0 -0.468 122.4 -16.0 58.1-121.1 -17.3 5.0 57.4 168 76 B E T 3 S+ 0 0 146 -2,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.491 123.3 88.6 -86.1 -5.8 -20.0 7.4 58.5 169 77 B R E < -B 166 0B 141 -3,-2.1 -3,-3.3 2,-0.0 2,-0.6 -0.772 68.1-138.4-109.4 137.3 -17.8 9.2 61.0 170 78 B W E -B 165 0B 36 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.826 28.5-160.7 -85.3 121.2 -15.4 12.2 60.9 171 79 B V E -B 164 0B 61 -7,-3.1 -7,-2.3 -2,-0.6 2,-0.4 -0.870 16.8-123.3-108.8 133.4 -12.3 11.2 62.9 172 80 B V E -B 163 0B 10 -2,-0.4 -9,-0.3 -9,-0.2 2,-0.1 -0.615 28.0-143.4 -77.6 127.4 -9.9 13.8 64.3 173 81 B T > - 0 0 11 -11,-2.1 3,-0.5 -2,-0.4 4,-0.5 -0.380 29.2-101.6 -80.3 169.6 -6.3 13.1 63.1 174 82 B D G > S+ 0 0 97 1,-0.2 3,-1.0 2,-0.2 -170,-0.3 0.871 126.6 57.6 -60.6 -31.8 -3.2 13.7 65.2 175 83 B A G 3 S+ 0 0 0 -14,-0.3 -1,-0.2 -171,-0.3 -13,-0.2 0.867 105.7 49.9 -64.0 -33.6 -2.7 16.9 63.2 176 84 B G G < S+ 0 0 2 -3,-0.5 2,-0.9 -15,-0.3 -1,-0.2 0.418 85.4 97.3 -86.2 0.6 -6.2 18.0 64.3 177 85 B K < 0 0 77 -3,-1.0 -173,-0.1 -4,-0.5 -1,-0.0 -0.821 360.0 360.0 -93.4 102.2 -5.6 17.4 68.0 178 86 B I 0 0 131 -2,-0.9 -1,-0.2 -54,-0.1 -176,-0.1 0.729 360.0 360.0-112.2 360.0 -4.6 20.8 69.3