==== 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 TRANSCRIPTION REGULATOR 02-MAY-05 1ZK8 . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR, TETR FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS ATCC 14579; . AUTHOR B.NOCEK,M.ZHOU,D.HOLZLE,A.JOACHIMIAK,MIDWEST CENTER FOR STRU . 353 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17275.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 281 79.6 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 . 7 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 224 63.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.7 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 3 0 2 0 0 1 0 0 0 2 1 1 3 0 0 1 0 0 3 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 6 A I 0 0 181 0, 0.0 2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 91.4 12.3 31.0 55.3 2 7 A G - 0 0 63 1,-0.1 2,-0.0 0, 0.0 0, 0.0 -0.463 360.0 -87.5 -65.6 147.1 9.7 28.6 53.7 3 8 A L + 0 0 43 -2,-0.1 2,-0.3 4,-0.1 -1,-0.1 -0.298 57.0 169.5 -61.4 138.4 10.3 28.2 49.9 4 9 A T > - 0 0 66 1,-0.1 4,-1.9 -3,-0.1 5,-0.1 -0.917 48.9-104.6-141.8 167.4 8.6 30.7 47.6 5 10 A L H > S+ 0 0 63 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.918 119.4 54.0 -56.1 -48.0 8.6 31.9 44.0 6 11 A Q H > S+ 0 0 89 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.857 108.6 47.9 -61.7 -36.3 10.6 35.0 44.9 7 12 A K H > S+ 0 0 72 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.911 110.8 51.7 -69.2 -41.1 13.4 32.9 46.6 8 13 A I H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.934 112.1 47.3 -58.0 -45.8 13.5 30.6 43.5 9 14 A V H X S+ 0 0 3 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.914 111.0 49.7 -63.5 -46.0 13.9 33.6 41.3 10 15 A E H X S+ 0 0 78 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.870 111.7 49.8 -60.9 -39.1 16.6 35.2 43.5 11 16 A T H X S+ 0 0 13 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.934 109.2 51.2 -61.8 -49.5 18.5 31.8 43.4 12 17 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.899 108.3 54.1 -52.8 -44.1 18.1 31.7 39.6 13 18 A A H X S+ 0 0 7 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.907 108.9 46.5 -56.9 -47.1 19.6 35.3 39.5 14 19 A E H X S+ 0 0 138 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.897 114.1 48.1 -66.5 -41.0 22.7 34.4 41.5 15 20 A I H X>S+ 0 0 16 -4,-2.3 4,-3.5 2,-0.2 5,-0.5 0.942 113.2 48.3 -60.5 -50.1 23.2 31.3 39.3 16 21 A A H X5S+ 0 0 1 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.897 112.3 47.8 -59.1 -45.9 22.8 33.3 36.1 17 22 A D H <5S+ 0 0 43 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.836 120.1 39.2 -64.7 -34.4 25.2 36.1 37.3 18 23 A A H <5S+ 0 0 75 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.938 137.6 9.4 -80.4 -51.1 27.8 33.5 38.3 19 24 A N H <5S- 0 0 107 -4,-3.5 -3,-0.2 1,-0.2 -2,-0.2 0.448 110.6 -93.4-117.2 -5.8 27.5 30.9 35.5 20 25 A G ><< - 0 0 21 -4,-2.2 3,-1.9 -5,-0.5 4,-0.3 -0.019 40.9 -82.3 101.2 150.5 25.2 32.4 32.8 21 26 A V G > S+ 0 0 18 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.792 125.3 66.8 -56.7 -28.4 21.5 32.1 32.2 22 27 A Q G 3 S+ 0 0 139 1,-0.3 -1,-0.3 -6,-0.1 -2,-0.1 0.697 91.8 61.2 -66.1 -21.2 22.2 28.7 30.5 23 28 A E G < S+ 0 0 103 -3,-1.9 2,-0.8 -8,-0.1 -1,-0.3 0.543 80.8 100.0 -83.7 -9.9 23.3 27.3 33.8 24 29 A V < + 0 0 0 -3,-1.6 2,-0.3 -4,-0.3 27,-0.1 -0.721 49.2 142.7 -79.2 109.5 19.8 28.0 35.2 25 30 A T > - 0 0 53 -2,-0.8 4,-2.7 1,-0.1 5,-0.2 -0.924 66.0-106.1-137.9 163.4 17.9 24.7 35.2 26 31 A L H > S+ 0 0 34 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.896 122.9 51.3 -54.0 -40.2 15.4 22.9 37.4 27 32 A A H > S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.875 111.3 44.5 -66.5 -44.2 18.3 20.6 38.5 28 33 A S H > S+ 0 0 22 2,-0.2 4,-2.0 3,-0.2 5,-0.2 0.883 115.3 49.9 -67.0 -39.2 20.7 23.4 39.3 29 34 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.968 112.4 46.5 -61.7 -52.7 18.0 25.3 41.2 30 35 A A H X>S+ 0 0 10 -4,-2.8 5,-2.1 1,-0.2 4,-0.7 0.870 114.0 48.5 -55.5 -42.5 17.0 22.2 43.2 31 36 A Q H <5S+ 0 0 149 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.817 112.6 45.7 -75.1 -33.4 20.6 21.4 44.0 32 37 A T H <5S+ 0 0 73 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.854 113.7 49.6 -76.1 -34.2 21.6 24.9 45.2 33 38 A L H <5S- 0 0 39 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.610 106.2-131.2 -75.5 -13.6 18.4 25.2 47.3 34 39 A G T <5S+ 0 0 71 -4,-0.7 2,-0.2 1,-0.3 -3,-0.2 0.827 74.5 104.0 65.4 34.4 19.2 21.8 48.8 35 40 A V S > - 0 0 179 -2,-0.2 3,-2.1 -3,-0.1 4,-0.6 -0.811 28.0-100.3-120.6 170.9 14.1 18.5 45.4 37 42 A S H 3> S+ 0 0 52 1,-0.3 4,-0.7 -2,-0.3 3,-0.1 0.546 112.8 52.7 -64.0 -27.1 12.4 18.9 42.1 38 43 A P H 34 S+ 0 0 80 0, 0.0 4,-0.3 0, 0.0 -1,-0.3 0.741 102.7 63.8 -75.0 -21.3 8.7 18.4 42.9 39 44 A S H X4 S+ 0 0 43 -3,-2.1 3,-0.8 1,-0.2 4,-0.2 0.815 97.8 54.8 -65.8 -33.0 9.1 21.0 45.6 40 45 A L H >X S+ 0 0 1 -4,-0.6 4,-2.4 1,-0.2 3,-1.8 0.836 96.9 66.5 -68.0 -32.2 9.8 23.6 42.9 41 46 A Y T 3< S+ 0 0 123 -4,-0.7 -1,-0.2 1,-0.3 -2,-0.2 0.596 86.2 68.4 -68.6 -13.6 6.6 22.7 41.1 42 47 A N T <4 S+ 0 0 132 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.708 117.7 23.8 -71.3 -19.6 4.5 24.1 44.0 43 48 A H T <4 S+ 0 0 70 -3,-1.8 2,-0.4 1,-0.2 -2,-0.2 0.640 125.2 41.4-119.6 -29.0 5.8 27.5 43.0 44 49 A V < - 0 0 3 -4,-2.4 -1,-0.2 1,-0.1 3,-0.1 -0.971 60.3-141.9-130.4 146.9 6.7 27.3 39.3 45 50 A K S S- 0 0 182 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.756 74.5 -69.6 -70.6 -26.6 5.2 25.7 36.2 46 51 A G S > S- 0 0 13 -6,-0.1 4,-2.0 1,-0.1 -1,-0.3 -0.956 71.3 -45.9 155.9-167.9 8.7 24.7 35.0 47 52 A L H > S+ 0 0 46 -2,-0.3 4,-3.6 1,-0.2 5,-0.2 0.860 129.0 54.5 -68.3 -39.4 11.8 26.2 33.5 48 53 A Q H > S+ 0 0 109 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.932 110.3 49.8 -57.0 -41.8 10.1 28.5 31.0 49 54 A D H > S+ 0 0 38 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.909 111.3 48.2 -63.5 -42.6 8.2 29.9 34.0 50 55 A V H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.960 112.6 48.8 -58.6 -52.2 11.5 30.3 35.9 51 56 A R H X S+ 0 0 48 -4,-3.6 4,-2.5 1,-0.2 -2,-0.2 0.904 111.7 49.5 -55.7 -44.8 13.0 32.1 32.9 52 57 A K H X S+ 0 0 26 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.936 113.1 45.0 -59.6 -50.0 10.0 34.4 32.5 53 58 A N H X S+ 0 0 31 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.847 112.8 52.3 -66.1 -32.6 10.0 35.4 36.2 54 59 A L H X S+ 0 0 4 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.907 108.4 50.4 -66.0 -45.5 13.8 35.9 36.1 55 60 A G H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.901 112.0 47.5 -57.8 -44.8 13.4 38.2 33.1 56 61 A I H X S+ 0 0 17 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.930 112.1 49.9 -62.0 -47.3 10.7 40.2 34.9 57 62 A Y H X S+ 0 0 60 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.892 112.6 47.0 -58.4 -42.8 12.9 40.4 38.0 58 63 A G H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.898 112.5 48.7 -69.0 -40.6 15.9 41.6 36.1 59 64 A I H X S+ 0 0 16 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.914 112.5 49.0 -63.8 -43.2 14.0 44.2 34.1 60 65 A K H X S+ 0 0 119 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.906 111.4 49.4 -64.9 -41.8 12.5 45.5 37.3 61 66 A K H X S+ 0 0 66 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.912 113.5 46.2 -63.0 -44.1 15.9 45.6 39.0 62 67 A L H X S+ 0 0 3 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.952 110.8 53.0 -62.9 -48.6 17.3 47.5 36.0 63 68 A H H X S+ 0 0 40 -4,-3.0 4,-3.0 1,-0.2 -2,-0.2 0.905 107.3 52.3 -49.5 -49.9 14.3 49.9 35.9 64 69 A N H X S+ 0 0 96 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.890 108.6 49.2 -53.6 -49.6 14.8 50.7 39.6 65 70 A R H X S+ 0 0 146 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.845 114.9 46.2 -58.9 -38.7 18.5 51.6 39.1 66 71 A L H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.909 110.9 50.3 -73.8 -42.3 17.6 53.8 36.1 67 72 A E H X S+ 0 0 73 -4,-3.0 4,-0.9 1,-0.2 -2,-0.2 0.945 113.3 47.1 -60.4 -47.6 14.6 55.5 37.9 68 73 A E H >< S+ 0 0 120 -4,-2.5 3,-0.7 1,-0.2 -1,-0.2 0.908 111.1 52.0 -57.7 -46.7 16.9 56.3 40.9 69 74 A A H 3< S+ 0 0 19 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.842 112.9 44.1 -57.7 -39.6 19.7 57.6 38.6 70 75 A A H >< S+ 0 0 11 -4,-2.0 3,-2.2 11,-0.1 -1,-0.2 0.591 81.3 129.2 -85.4 -12.4 17.4 60.0 36.8 71 76 A E T << S- 0 0 124 -4,-0.9 3,-0.1 -3,-0.7 -3,-0.0 -0.214 86.4 -5.3 -56.1 126.7 15.6 61.4 39.9 72 77 A D T 3 S+ 0 0 180 1,-0.2 2,-0.4 6,-0.0 -1,-0.3 0.716 110.4 114.8 58.2 25.2 15.5 65.2 39.9 73 78 A K < - 0 0 88 -3,-2.2 2,-0.3 4,-0.1 -1,-0.2 -0.936 45.1-168.6-117.3 146.3 17.7 65.3 36.8 74 79 A R >> - 0 0 143 -2,-0.4 3,-1.1 -3,-0.1 4,-0.9 -0.916 47.6 -23.2-127.6 160.4 16.7 66.7 33.4 75 80 A X H 3> S+ 0 0 54 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 -0.113 128.8 8.5 51.4-123.4 18.1 66.7 29.9 76 81 A D H 3> S+ 0 0 37 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.854 131.5 52.0 -61.5 -43.2 21.9 66.1 29.8 77 82 A E H <> S+ 0 0 114 -3,-1.1 4,-2.1 2,-0.2 -1,-0.2 0.904 114.0 44.7 -58.3 -43.6 22.3 65.3 33.5 78 83 A A H X S+ 0 0 0 -4,-0.9 4,-3.3 2,-0.2 5,-0.2 0.928 111.8 51.7 -66.6 -48.5 19.5 62.7 33.2 79 84 A I H X S+ 0 0 2 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.926 113.6 44.5 -56.5 -45.6 20.9 61.2 29.9 80 85 A H H X S+ 0 0 40 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.905 115.4 46.4 -66.9 -42.7 24.4 60.8 31.4 81 86 A A H X S+ 0 0 21 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.899 113.5 50.4 -65.8 -40.4 23.1 59.3 34.7 82 87 A L H X S+ 0 0 1 -4,-3.3 4,-2.4 2,-0.2 -2,-0.2 0.955 112.6 44.9 -62.1 -50.4 20.7 57.0 32.8 83 88 A G H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 5,-0.2 0.913 113.8 49.6 -61.2 -45.1 23.5 55.6 30.5 84 89 A E H X S+ 0 0 58 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.2 0.941 111.9 48.5 -58.4 -48.8 26.0 55.2 33.3 85 90 A A H X S+ 0 0 16 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.846 110.2 52.7 -60.3 -39.8 23.4 53.3 35.4 86 91 A Y H X S+ 0 0 12 -4,-2.4 4,-1.8 2,-0.2 3,-0.3 0.975 113.5 41.0 -60.0 -56.9 22.5 51.1 32.5 87 92 A V H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.896 112.3 55.7 -61.4 -41.4 26.1 50.0 31.8 88 93 A A H X S+ 0 0 40 -4,-2.8 4,-1.8 -5,-0.2 -1,-0.2 0.845 106.3 52.2 -57.4 -37.2 26.8 49.7 35.6 89 94 A F H X S+ 0 0 6 -4,-1.7 4,-3.4 -3,-0.3 -1,-0.2 0.924 108.9 49.1 -64.3 -45.1 23.9 47.3 35.9 90 95 A V H < S+ 0 0 3 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.907 110.7 51.2 -61.2 -43.2 25.3 45.1 33.0 91 96 A R H < S+ 0 0 89 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.872 119.5 36.0 -59.6 -39.1 28.8 45.1 34.7 92 97 A K H < S+ 0 0 150 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.824 129.4 30.8 -86.9 -34.9 27.3 44.0 38.0 93 98 A H X + 0 0 31 -4,-3.4 4,-2.4 -5,-0.2 5,-0.2 -0.483 63.9 156.0-124.6 64.5 24.6 41.7 36.7 94 99 A P H > S+ 0 0 45 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.888 80.4 40.1 -59.5 -42.8 25.7 40.1 33.4 95 100 A G H > S+ 0 0 3 2,-0.2 4,-1.7 1,-0.2 -78,-0.2 0.832 114.8 51.3 -76.8 -35.2 23.4 37.0 33.6 96 101 A L H > S+ 0 0 1 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.877 110.6 49.9 -65.6 -39.2 20.4 38.9 35.0 97 102 A Y H >< S+ 0 0 9 -4,-2.4 3,-1.1 2,-0.2 4,-0.3 0.934 107.6 53.0 -65.1 -46.0 20.7 41.4 32.1 98 103 A E H >< S+ 0 0 97 -4,-2.0 3,-1.8 1,-0.2 -2,-0.2 0.899 103.0 60.9 -50.6 -42.3 20.9 38.6 29.6 99 104 A A H >< S+ 0 0 11 -4,-1.7 3,-1.5 1,-0.3 -1,-0.2 0.758 89.3 69.8 -58.3 -29.4 17.6 37.2 31.2 100 105 A T T << S+ 0 0 18 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.588 87.2 67.5 -68.9 -10.2 15.7 40.4 30.3 101 106 A F T < + 0 0 31 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.432 67.2 133.0 -91.6 -0.7 15.9 39.5 26.6 102 107 A L < - 0 0 43 -3,-1.5 2,-1.7 -51,-0.2 6,-0.2 -0.239 65.8-120.3 -49.7 129.3 13.6 36.4 26.9 103 108 A R + 0 0 180 4,-0.1 2,-0.3 5,-0.0 -1,-0.1 -0.567 69.0 121.3 -77.2 88.4 11.0 36.5 24.1 104 109 A D > - 0 0 42 -2,-1.7 4,-2.7 1,-0.1 5,-0.2 -0.983 65.5-129.8-152.4 139.0 7.8 36.7 26.3 105 110 A E H > S+ 0 0 139 -2,-0.3 4,-3.0 1,-0.2 5,-0.1 0.832 109.1 52.0 -62.5 -37.1 5.0 39.2 26.6 106 111 A E H > S+ 0 0 90 2,-0.2 4,-2.0 3,-0.2 -1,-0.2 0.901 112.1 46.5 -66.2 -41.6 5.2 39.5 30.4 107 112 A V H > S+ 0 0 3 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.949 116.1 45.0 -62.1 -51.4 9.0 40.2 30.2 108 113 A R H >X S+ 0 0 140 -4,-2.7 3,-0.9 1,-0.2 4,-0.5 0.941 111.6 54.0 -54.7 -49.6 8.5 42.8 27.3 109 114 A K H >< S+ 0 0 147 -4,-3.0 3,-1.3 1,-0.3 4,-0.4 0.883 106.3 50.6 -56.8 -42.9 5.6 44.3 29.2 110 115 A A H >< S+ 0 0 25 -4,-2.0 3,-0.5 1,-0.2 -1,-0.3 0.740 105.1 59.3 -70.0 -20.4 7.7 44.8 32.3 111 116 A G H XX S+ 0 0 13 -4,-1.1 4,-1.5 -3,-0.9 3,-0.6 0.519 82.0 83.4 -82.6 -6.8 10.4 46.5 30.1 112 117 A D H S+ 0 0 19 -3,-0.5 4,-1.6 -4,-0.4 -1,-0.2 0.824 102.7 47.5 -60.6 -33.5 8.6 51.2 32.1 114 119 A I H <> S+ 0 0 10 -3,-0.6 4,-2.4 -4,-0.2 -1,-0.2 0.914 111.8 48.4 -73.1 -45.3 12.2 51.7 30.9 115 120 A V H X S+ 0 0 26 -4,-1.5 4,-2.3 1,-0.2 -2,-0.2 0.874 111.8 51.8 -62.1 -35.4 11.1 52.8 27.4 116 121 A K H X S+ 0 0 147 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.886 109.0 49.2 -68.5 -42.9 8.6 55.2 29.1 117 122 A L H X S+ 0 0 7 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.921 113.2 46.5 -59.8 -47.7 11.3 56.7 31.3 118 123 A C H X S+ 0 0 3 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.903 111.3 52.0 -62.6 -43.2 13.7 57.2 28.3 119 124 A L H X S+ 0 0 34 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.887 106.7 53.7 -60.4 -42.8 10.9 58.7 26.2 120 125 A Q H < S+ 0 0 121 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.836 112.3 43.6 -61.9 -38.0 10.0 61.2 29.0 121 126 A V H >< S+ 0 0 3 -4,-1.6 3,-1.2 2,-0.2 4,-0.4 0.901 112.7 51.9 -73.1 -40.7 13.6 62.4 29.1 122 127 A L H ><>S+ 0 0 0 -4,-2.4 5,-1.0 1,-0.3 3,-1.0 0.797 101.5 61.4 -70.8 -27.3 14.0 62.5 25.3 123 128 A Q G ><5S+ 0 0 93 -4,-2.0 3,-1.6 1,-0.2 -1,-0.3 0.708 89.5 71.1 -68.3 -20.1 10.8 64.6 25.1 124 129 A Q G < 5S+ 0 0 48 -3,-1.2 -1,-0.2 -4,-0.4 -2,-0.2 0.760 91.4 58.9 -66.8 -24.9 12.6 67.3 27.2 125 130 A Y G < 5S- 0 0 33 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.316 130.0-100.7 -81.5 7.2 14.7 67.9 24.1 126 131 A G T < 5S+ 0 0 53 -3,-1.6 2,-0.4 1,-0.3 -3,-0.2 0.747 72.8 151.6 77.9 24.6 11.4 68.7 22.3 127 132 A L < - 0 0 20 -5,-1.0 2,-0.4 -8,-0.1 -1,-0.3 -0.752 28.0-156.6 -89.4 137.0 11.2 65.3 20.6 128 133 A E >> - 0 0 159 -2,-0.4 3,-0.9 -6,-0.0 4,-0.6 -0.931 33.3 -54.5-125.7 133.4 7.7 64.2 19.8 129 134 A G H 3> S+ 0 0 42 -2,-0.4 4,-1.7 1,-0.2 3,-0.2 -0.172 120.3 16.5 57.8-118.0 5.8 60.9 19.2 130 135 A E H 3> S+ 0 0 132 1,-0.2 4,-2.1 2,-0.2 3,-0.3 0.929 130.1 46.8 -58.3 -54.5 7.3 58.8 16.4 131 136 A N H <> S+ 0 0 81 -3,-0.9 4,-1.6 1,-0.2 -1,-0.2 0.773 111.3 53.1 -60.8 -28.6 10.7 60.5 16.2 132 137 A A H X S+ 0 0 0 -4,-0.6 4,-1.2 2,-0.2 -1,-0.2 0.846 108.3 51.8 -72.0 -34.6 11.0 60.4 20.1 133 138 A L H X S+ 0 0 42 -4,-1.7 4,-1.4 -3,-0.3 -2,-0.2 0.869 106.1 52.2 -69.3 -40.9 10.3 56.7 19.8 134 139 A H H X S+ 0 0 11 -4,-2.1 4,-1.6 1,-0.2 3,-0.2 0.911 107.9 54.1 -58.9 -42.4 13.1 56.3 17.2 135 140 A A H X S+ 0 0 6 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.789 100.9 58.1 -63.6 -31.2 15.4 58.0 19.7 136 141 A T H X S+ 0 0 1 -4,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.910 106.1 49.8 -63.8 -41.2 14.5 55.6 22.5 137 142 A R H X S+ 0 0 4 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.877 110.3 51.3 -61.5 -41.7 15.8 52.8 20.2 138 143 A G H X S+ 0 0 2 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.885 109.9 47.6 -62.2 -43.6 19.0 54.7 19.6 139 144 A F H X S+ 0 0 4 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.911 113.4 47.8 -67.2 -43.2 19.6 55.3 23.3 140 145 A R H X S+ 0 0 43 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.876 111.0 52.5 -63.1 -38.1 19.0 51.6 24.1 141 146 A S H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.904 109.2 49.1 -63.9 -41.5 21.3 50.6 21.2 142 147 A I H X S+ 0 0 1 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.948 116.3 41.6 -63.1 -48.6 24.1 52.9 22.6 143 148 A C H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 5,-0.2 0.893 118.6 44.2 -68.4 -45.2 23.9 51.5 26.1 144 149 A H H X S+ 0 0 7 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.901 116.0 47.7 -65.3 -44.0 23.4 47.9 25.1 145 150 A G H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.3 5,-0.2 0.922 113.7 45.9 -65.8 -48.2 26.2 48.0 22.5 146 151 A F H X S+ 0 0 1 -4,-2.6 4,-2.4 -5,-0.3 -2,-0.2 0.943 117.5 43.1 -58.6 -52.0 28.7 49.7 24.7 147 152 A A H X S+ 0 0 2 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.911 114.2 51.1 -61.7 -45.2 28.1 47.4 27.7 148 153 A S H X S+ 0 0 13 -4,-2.6 4,-1.3 -5,-0.2 -1,-0.2 0.873 112.8 45.1 -60.6 -43.2 28.0 44.3 25.5 149 154 A I H X>S+ 0 0 2 -4,-2.2 5,-2.8 2,-0.2 4,-0.6 0.911 112.8 51.1 -67.2 -44.2 31.3 45.1 23.8 150 155 A E H ><5S+ 0 0 50 -4,-2.4 3,-1.0 1,-0.2 -2,-0.2 0.926 110.0 50.4 -57.0 -47.7 33.0 46.0 27.1 151 156 A Q H 3<5S+ 0 0 71 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.800 109.3 49.8 -59.7 -35.8 31.8 42.7 28.7 152 157 A Q H 3<5S- 0 0 62 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.549 116.3-115.8 -82.0 -8.0 33.2 40.7 25.7 153 158 A G T <<5S+ 0 0 28 -3,-1.0 -3,-0.2 -4,-0.6 -2,-0.1 0.723 70.7 139.5 78.1 28.0 36.5 42.5 26.1 154 159 A G < + 0 0 14 -5,-2.8 2,-1.0 -6,-0.1 -4,-0.2 0.409 42.2 87.7 -88.0 0.0 36.2 44.2 22.7 155 160 A F + 0 0 23 -6,-0.3 -1,-0.1 -5,-0.2 4,-0.1 -0.727 45.4 158.3 -98.7 83.5 37.5 47.6 23.6 156 161 A G + 0 0 74 -2,-1.0 -1,-0.2 2,-0.1 -2,-0.1 0.731 35.1 108.5 -81.0 -25.6 41.3 47.2 23.2 157 162 A L S S- 0 0 49 -3,-0.2 2,-2.2 1,-0.1 -2,-0.0 -0.205 80.9-117.4 -53.8 142.0 42.2 50.9 22.8 158 163 A P S S+ 0 0 132 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.298 74.6 126.7 -82.2 54.1 44.1 52.3 25.8 159 164 A L S S- 0 0 16 -2,-2.2 2,-0.4 -4,-0.1 3,-0.0 -0.875 71.4-102.4-110.4 145.7 41.3 54.8 26.3 160 165 A D > - 0 0 91 -2,-0.4 4,-2.4 1,-0.1 5,-0.1 -0.543 25.7-148.2 -67.1 121.9 39.4 55.3 29.5 161 166 A L H > S+ 0 0 52 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 0.857 95.8 55.3 -62.9 -41.6 36.0 53.5 29.2 162 167 A D H > S+ 0 0 84 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.886 111.4 46.3 -56.4 -42.7 34.1 56.0 31.5 163 168 A I H > S+ 0 0 88 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.965 111.3 50.5 -65.1 -52.2 35.3 58.8 29.1 164 169 A S H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.870 109.8 50.7 -53.3 -44.0 34.4 56.9 25.9 165 170 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.923 115.1 41.8 -62.3 -43.6 30.9 56.1 27.1 166 171 A H H X S+ 0 0 38 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.807 109.8 56.3 -81.9 -27.8 30.1 59.7 28.0 167 172 A V H X S+ 0 0 22 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.913 110.0 47.9 -60.8 -47.2 31.7 61.1 24.9 168 173 A L H X S+ 0 0 3 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.943 111.5 50.1 -56.5 -48.5 29.3 58.9 23.0 169 174 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.932 109.9 51.0 -56.7 -43.9 26.5 60.1 25.2 170 175 A E H X S+ 0 0 97 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.883 110.6 48.9 -57.4 -42.6 27.6 63.8 24.5 171 176 A T H X S+ 0 0 17 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.932 111.4 48.4 -67.9 -47.9 27.6 63.1 20.8 172 177 A F H X S+ 0 0 3 -4,-2.6 4,-1.0 2,-0.2 -2,-0.2 0.934 112.6 49.1 -51.6 -52.9 24.1 61.5 20.8 173 178 A I H >X S+ 0 0 3 -4,-2.7 4,-2.1 1,-0.2 3,-0.9 0.932 110.1 50.7 -57.6 -47.6 22.8 64.5 22.9 174 179 A K H 3< S+ 0 0 86 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.875 107.6 55.0 -56.7 -38.5 24.3 67.0 20.5 175 180 A G H 3< S+ 0 0 8 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.689 108.8 47.0 -71.3 -21.7 22.7 65.2 17.6 176 181 A L H << 0 0 24 -4,-1.0 -1,-0.2 -3,-0.9 -2,-0.2 0.880 360.0 360.0 -76.9 -43.8 19.2 65.5 19.2 177 182 A R < 0 0 163 -4,-2.1 -52,-0.0 -5,-0.1 -51,-0.0 0.021 360.0 360.0 -68.3 360.0 19.7 69.2 20.0 178 !* 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 0.0 179 8 B L 0 0 69 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 123.1 40.7 20.0 1.1 180 9 B T > - 0 0 67 1,-0.1 4,-1.8 39,-0.0 5,-0.1 -0.905 360.0-105.4-132.3 165.0 42.3 23.2 2.5 181 10 B L H > S+ 0 0 63 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.862 121.5 57.4 -53.0 -37.5 42.0 25.2 5.7 182 11 B Q H > S+ 0 0 94 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.909 105.2 47.4 -63.4 -45.7 39.8 27.6 3.7 183 12 B K H > S+ 0 0 102 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.883 112.1 51.1 -60.9 -41.9 37.3 25.0 2.6 184 13 B I H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.939 112.5 45.9 -60.8 -47.9 37.0 23.8 6.2 185 14 B V H X S+ 0 0 3 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.859 110.6 52.0 -66.2 -39.5 36.5 27.3 7.4 186 15 B E H X S+ 0 0 89 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.852 111.2 48.8 -65.4 -37.7 33.8 28.1 4.7 187 16 B T H X S+ 0 0 21 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.899 108.2 53.2 -63.3 -44.8 32.0 25.0 5.7 188 17 B A H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.899 107.3 54.7 -57.8 -38.9 32.2 25.9 9.4 189 18 B A H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.901 108.4 45.3 -62.5 -45.8 30.6 29.3 8.4 190 19 B E H X S+ 0 0 126 -4,-1.6 4,-2.1 2,-0.2 5,-0.3 0.908 114.6 48.5 -67.5 -40.3 27.6 27.7 6.7 191 20 B I H X S+ 0 0 13 -4,-2.4 4,-3.1 1,-0.2 5,-0.5 0.941 111.8 51.1 -59.4 -47.5 27.0 25.3 9.5 192 21 B A H X S+ 0 0 2 -4,-2.7 4,-1.6 -5,-0.2 -2,-0.2 0.870 112.6 43.7 -61.0 -44.8 27.3 28.2 12.0 193 22 B D H < S+ 0 0 32 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.907 121.7 38.1 -68.2 -44.7 24.8 30.5 10.3 194 23 B A H < S+ 0 0 76 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.903 135.3 16.2 -73.4 -42.0 22.2 27.8 9.6 195 24 B N H < S- 0 0 97 -4,-3.1 -3,-0.2 -5,-0.3 -2,-0.2 0.536 113.7 -86.2-116.8 -8.4 22.5 25.8 12.8 196 25 B G >< - 0 0 18 -4,-1.6 3,-1.7 -5,-0.5 -1,-0.2 0.034 35.9 -98.4 104.2 142.1 24.3 27.8 15.5 197 26 B V G > S+ 0 0 17 1,-0.3 3,-2.0 2,-0.2 -5,-0.1 0.832 121.4 65.7 -64.0 -31.0 28.1 28.1 16.0 198 27 B Q G 3 S+ 0 0 129 1,-0.3 -1,-0.3 -6,-0.1 -2,-0.1 0.657 91.4 66.1 -64.3 -14.6 27.8 25.5 18.8 199 28 B E G < S+ 0 0 103 -3,-1.7 2,-0.7 -7,-0.1 -1,-0.3 0.489 74.0 107.5 -83.8 -7.8 26.8 23.0 16.1 200 29 B V < + 0 0 1 -3,-2.0 2,-0.3 -4,-0.2 27,-0.1 -0.661 43.6 151.2 -75.1 114.0 30.3 23.3 14.5 201 30 B T > - 0 0 59 -2,-0.7 4,-2.7 1,-0.1 5,-0.2 -0.940 57.9-113.8-133.6 160.8 32.1 20.0 15.3 202 31 B L H > S+ 0 0 26 -2,-0.3 4,-2.8 2,-0.2 5,-0.2 0.880 119.4 52.0 -59.7 -39.5 34.9 18.0 13.4 203 32 B A H > S+ 0 0 68 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.949 110.7 46.3 -61.5 -49.6 32.3 15.2 12.8 204 33 B S H > S+ 0 0 12 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.923 114.8 48.2 -62.1 -41.3 29.8 17.6 11.4 205 34 B L H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.927 115.2 43.6 -60.2 -48.6 32.5 19.3 9.2 206 35 B A H X>S+ 0 0 6 -4,-2.8 5,-2.5 2,-0.2 4,-0.5 0.928 114.2 51.0 -62.3 -47.1 33.8 15.9 8.0 207 36 B Q H ><5S+ 0 0 143 -4,-3.2 3,-0.9 -5,-0.2 -2,-0.2 0.936 114.0 44.5 -53.9 -49.0 30.3 14.6 7.4 208 37 B T H 3<5S+ 0 0 77 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.849 115.5 45.1 -68.4 -38.7 29.4 17.8 5.4 209 38 B L H 3<5S- 0 0 54 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.420 110.0-124.8 -83.1 0.3 32.6 17.8 3.3 210 39 B G T <<5 + 0 0 69 -3,-0.9 2,-0.3 -4,-0.5 -3,-0.2 0.909 68.6 123.5 53.1 48.1 32.1 14.1 2.8 211 40 B V S - 0 0 188 -2,-0.3 3,-1.4 1,-0.1 4,-0.4 -0.657 36.7-127.5 -74.9 133.4 37.1 11.2 6.9 213 42 B S G >> S+ 0 0 54 -2,-0.3 3,-1.7 1,-0.3 4,-0.6 0.772 100.7 67.2 -56.8 -36.1 37.7 13.3 10.0 214 43 B P G >4 S+ 0 0 61 0, 0.0 3,-1.2 0, 0.0 -1,-0.3 0.851 92.3 63.6 -55.5 -30.2 41.4 12.4 10.6 215 44 B S G X4 S+ 0 0 30 -3,-1.4 3,-1.5 1,-0.3 4,-0.3 0.753 87.7 70.6 -67.7 -21.3 42.3 14.3 7.3 216 45 B L G X> S+ 0 0 0 -3,-1.7 3,-2.2 -4,-0.4 4,-2.1 0.865 86.1 68.6 -59.0 -33.8 41.0 17.5 9.0 217 46 B Y G << S+ 0 0 127 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.525 82.0 70.6 -69.9 -8.2 44.1 17.4 11.2 218 47 B N G <4 S+ 0 0 131 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.697 118.3 22.2 -70.4 -17.9 46.4 18.1 8.2 219 48 B H T <4 S+ 0 0 64 -3,-2.2 2,-0.3 -4,-0.3 -2,-0.2 0.694 126.8 35.7-120.8 -33.8 44.8 21.6 8.4 220 49 B V < - 0 0 3 -4,-2.1 -1,-0.2 1,-0.1 3,-0.1 -0.887 59.9-141.5-125.8 155.3 43.4 22.2 11.9 221 50 B K S S- 0 0 185 1,-0.4 2,-0.3 -2,-0.3 -4,-0.1 0.556 73.8 -65.0 -90.4 -6.9 44.6 21.1 15.4 222 51 B G S > S- 0 0 11 -6,-0.1 4,-2.1 1,-0.1 -1,-0.4 -0.943 74.0 -44.0 146.8-171.1 41.1 20.5 16.6 223 52 B L H > S+ 0 0 47 -2,-0.3 4,-2.6 1,-0.2 5,-0.1 0.858 128.7 51.7 -65.5 -41.0 37.8 22.2 17.3 224 53 B Q H > S+ 0 0 102 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.887 110.1 51.1 -59.7 -40.9 39.1 25.2 19.2 225 54 B D H > S+ 0 0 30 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.888 108.9 51.6 -63.9 -39.4 41.5 25.8 16.2 226 55 B V H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.942 109.2 50.0 -60.4 -48.1 38.5 25.6 13.9 227 56 B R H X S+ 0 0 87 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.879 110.0 51.4 -58.7 -41.4 36.7 28.2 16.1 228 57 B K H X S+ 0 0 28 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.964 112.8 44.0 -58.1 -53.2 39.7 30.5 16.0 229 58 B N H X S+ 0 0 28 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.873 111.2 54.3 -63.7 -38.3 40.0 30.4 12.2 230 59 B L H X S+ 0 0 1 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.868 108.1 51.0 -59.7 -40.8 36.2 30.8 11.8 231 60 B G H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.901 111.6 46.2 -63.4 -43.2 36.4 34.0 13.9 232 61 B I H X S+ 0 0 28 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.896 113.5 49.5 -65.5 -41.7 39.3 35.4 11.8 233 62 B Y H X S+ 0 0 39 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.887 111.0 50.9 -63.9 -38.6 37.3 34.5 8.6 234 63 B G H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.926 110.6 46.1 -67.3 -45.2 34.2 36.1 10.0 235 64 B I H X S+ 0 0 23 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.834 112.2 51.6 -73.0 -31.1 35.8 39.4 10.9 236 65 B K H X S+ 0 0 129 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.871 109.8 49.7 -68.4 -38.5 37.6 39.6 7.5 237 66 B K H X S+ 0 0 45 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.895 111.7 48.5 -67.6 -41.2 34.3 39.0 5.7 238 67 B L H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.954 110.7 51.2 -56.7 -52.5 32.7 41.8 7.8 239 68 B H H X S+ 0 0 47 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.887 108.7 52.0 -52.5 -44.0 35.7 44.1 7.0 240 69 B N H X S+ 0 0 92 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.897 109.2 48.6 -60.7 -45.8 35.3 43.3 3.2 241 70 B R H X S+ 0 0 84 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.908 113.3 48.4 -58.3 -44.0 31.6 44.2 3.4 242 71 B L H X S+ 0 0 1 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.892 111.3 48.5 -66.7 -43.4 32.4 47.5 5.2 243 72 B E H X S+ 0 0 81 -4,-2.8 4,-0.7 2,-0.2 -1,-0.2 0.895 113.3 49.0 -59.9 -43.0 35.2 48.4 2.7 244 73 B E H >< S+ 0 0 125 -4,-2.2 3,-0.9 -5,-0.2 -2,-0.2 0.943 111.9 47.9 -61.5 -50.1 32.8 47.7 -0.2 245 74 B A H 3< S+ 0 0 18 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.846 115.1 44.5 -59.5 -40.8 30.0 49.8 1.3 246 75 B A H >< S+ 0 0 9 -4,-2.0 3,-2.0 -5,-0.2 -1,-0.2 0.518 82.5 129.7 -85.2 -5.8 32.2 52.8 2.1 247 76 B E T << S- 0 0 138 -3,-0.9 3,-0.1 -4,-0.7 -3,-0.1 -0.300 85.0 -5.3 -62.2 127.0 34.0 52.7 -1.3 248 77 B D T 3 S+ 0 0 169 1,-0.2 2,-0.4 -2,-0.1 -1,-0.3 0.737 109.6 115.2 57.0 28.1 34.1 56.1 -3.0 249 78 B K < - 0 0 88 -3,-2.0 2,-0.3 4,-0.0 -1,-0.2 -0.933 46.9-162.5-117.4 149.3 31.8 57.6 -0.2 250 79 B R >> - 0 0 164 -2,-0.4 4,-1.5 -3,-0.1 3,-1.0 -0.863 47.3 -29.9-122.4 162.7 32.9 60.3 2.2 251 80 B X H 3> S+ 0 0 28 -2,-0.3 4,-2.8 46,-0.2 5,-0.2 0.078 126.3 13.7 41.7-120.5 31.5 61.5 5.6 252 81 B D H 3> S+ 0 0 33 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.843 131.2 47.5 -59.1 -43.3 27.8 61.1 6.0 253 82 B E H <> S+ 0 0 135 -3,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.888 113.4 49.3 -66.4 -41.0 27.2 58.8 3.1 254 83 B A H X S+ 0 0 0 -4,-1.5 4,-2.9 2,-0.2 -2,-0.2 0.946 111.1 49.1 -61.6 -49.5 30.1 56.6 4.2 255 84 B I H X S+ 0 0 1 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.943 113.4 47.2 -57.0 -48.7 28.9 56.4 7.8 256 85 B H H X S+ 0 0 23 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.898 114.1 46.4 -58.6 -43.2 25.4 55.5 6.7 257 86 B A H X S+ 0 0 11 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.879 112.7 50.8 -71.7 -35.1 26.6 52.9 4.3 258 87 B L H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.947 113.3 43.9 -62.5 -51.4 29.0 51.5 6.9 259 88 B G H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 5,-0.2 0.922 114.2 50.7 -59.8 -45.4 26.3 51.2 9.6 260 89 B E H X S+ 0 0 130 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.931 113.2 45.1 -59.4 -47.3 23.8 49.7 7.1 261 90 B A H X S+ 0 0 18 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.854 109.9 55.8 -67.1 -35.1 26.3 47.1 5.9 262 91 B Y H X S+ 0 0 18 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.960 112.1 41.7 -57.5 -52.3 27.3 46.2 9.5 263 92 B V H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.874 112.1 55.0 -67.6 -37.5 23.7 45.5 10.5 264 93 B A H X S+ 0 0 34 -4,-2.4 4,-2.2 1,-0.2 5,-0.3 0.906 106.6 52.6 -62.2 -39.8 23.1 43.6 7.2 265 94 B F H X S+ 0 0 4 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.906 109.8 46.9 -59.6 -45.2 26.1 41.4 7.9 266 95 B V H < S+ 0 0 4 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.876 111.3 53.7 -66.1 -40.5 24.7 40.5 11.4 267 96 B R H < S+ 0 0 105 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.903 119.4 30.9 -59.0 -46.5 21.3 39.8 9.9 268 97 B K H < S+ 0 0 135 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.743 127.3 39.4 -90.5 -21.9 22.5 37.3 7.3 269 98 B H X + 0 0 25 -4,-2.4 4,-2.4 -5,-0.3 5,-0.2 -0.512 61.2 151.5-124.0 64.0 25.5 35.8 9.1 270 99 B P H > S+ 0 0 48 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.877 78.0 44.5 -62.3 -36.9 24.5 35.4 12.8 271 100 B G H > S+ 0 0 3 2,-0.2 4,-1.8 1,-0.2 -78,-0.1 0.900 113.9 48.0 -75.7 -43.8 26.8 32.4 13.4 272 101 B L H > S+ 0 0 1 -83,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.904 113.8 49.0 -57.5 -44.7 29.8 33.9 11.7 273 102 B Y H >< S+ 0 0 9 -4,-2.4 3,-1.3 1,-0.2 4,-0.3 0.952 108.9 52.0 -62.6 -48.4 29.2 37.2 13.6 274 103 B E H >< S+ 0 0 106 -4,-2.4 3,-1.4 1,-0.3 -1,-0.2 0.860 104.1 59.3 -53.6 -37.8 29.0 35.4 16.9 275 104 B A H >< S+ 0 0 10 -4,-1.8 3,-1.5 1,-0.3 -1,-0.3 0.733 90.4 69.4 -65.5 -24.9 32.3 33.6 16.1 276 105 B T T << S+ 0 0 16 -3,-1.3 -1,-0.3 -4,-0.8 -2,-0.2 0.606 89.9 65.7 -68.8 -11.6 34.2 37.0 15.9 277 106 B F T < + 0 0 38 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.274 67.0 133.0 -99.0 9.8 33.7 37.3 19.6 278 107 B L < - 0 0 42 -3,-1.5 2,-2.6 -51,-0.2 6,-0.2 -0.433 68.1-120.1 -54.6 127.9 35.9 34.4 20.5 279 108 B R S S+ 0 0 168 -2,-0.2 2,-0.4 4,-0.1 -1,-0.1 -0.418 71.8 125.5 -73.5 68.8 38.3 35.6 23.3 280 109 B D > - 0 0 39 -2,-2.6 4,-2.4 1,-0.1 3,-0.3 -0.999 63.0-136.7-136.8 134.0 41.4 34.9 21.2 281 110 B E H > S+ 0 0 123 -2,-0.4 4,-2.2 1,-0.2 5,-0.1 0.766 104.9 51.7 -67.1 -29.5 44.1 37.4 20.4 282 111 B E H > S+ 0 0 102 2,-0.2 4,-1.4 3,-0.1 -1,-0.2 0.838 109.8 50.2 -71.4 -37.8 44.4 36.4 16.7 283 112 B V H > S+ 0 0 3 -3,-0.3 4,-0.6 2,-0.2 3,-0.4 0.964 112.6 48.1 -61.9 -50.8 40.6 36.9 16.3 284 113 B R H >< S+ 0 0 68 -4,-2.4 3,-1.8 1,-0.2 -2,-0.2 0.935 110.6 49.8 -53.2 -52.9 40.9 40.3 17.9 285 114 B K H >< S+ 0 0 104 -4,-2.2 3,-1.4 1,-0.3 -1,-0.2 0.748 100.1 63.9 -62.9 -30.0 43.8 41.4 15.8 286 115 B A H 3< S+ 0 0 26 -4,-1.4 3,-0.4 -3,-0.4 -1,-0.3 0.668 95.6 62.3 -69.3 -15.7 42.1 40.4 12.5 287 116 B G T XX S+ 0 0 11 -3,-1.8 4,-1.3 -4,-0.6 3,-1.1 0.440 75.3 94.6 -83.5 -3.0 39.5 43.1 13.3 288 117 B D H <> S+ 0 0 83 -3,-1.4 4,-2.1 1,-0.3 -1,-0.2 0.811 74.7 61.8 -62.1 -35.7 42.1 45.9 13.2 289 118 B G H 3> S+ 0 0 21 -3,-0.4 4,-1.7 -4,-0.2 -1,-0.3 0.783 103.2 52.9 -58.6 -28.7 41.3 46.7 9.5 290 119 B I H <> S+ 0 0 12 -3,-1.1 4,-2.3 2,-0.2 -2,-0.2 0.917 107.8 47.8 -74.3 -47.5 37.8 47.6 10.7 291 120 B V H X S+ 0 0 32 -4,-1.3 4,-2.3 1,-0.2 -2,-0.2 0.873 113.7 50.1 -55.9 -40.1 39.0 50.0 13.4 292 121 B K H X S+ 0 0 149 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.880 109.4 49.3 -67.8 -43.6 41.3 51.7 10.8 293 122 B L H X S+ 0 0 7 -4,-1.7 4,-2.1 2,-0.2 5,-0.2 0.955 113.8 46.3 -61.0 -51.3 38.6 52.1 8.2 294 123 B C H X S+ 0 0 3 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.904 112.9 49.4 -53.1 -48.4 36.2 53.7 10.8 295 124 B L H X S+ 0 0 36 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.912 109.5 52.6 -62.7 -43.4 39.0 56.0 12.1 296 125 B Q H < S+ 0 0 108 -4,-2.6 4,-0.5 1,-0.2 -1,-0.2 0.875 113.0 43.1 -57.7 -45.0 39.9 57.0 8.5 297 126 B V H >< S+ 0 0 4 -4,-2.1 3,-0.8 1,-0.2 -46,-0.2 0.879 114.0 52.4 -67.6 -38.5 36.2 58.0 7.8 298 127 B L H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.797 96.9 64.7 -73.5 -27.5 35.9 59.7 11.2 299 128 B Q G >< S+ 0 0 112 -4,-2.0 3,-1.6 1,-0.3 -1,-0.2 0.731 87.1 72.6 -66.8 -20.1 39.0 61.9 10.7 300 129 B Q G < S+ 0 0 53 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.663 87.5 65.7 -64.6 -16.1 37.1 63.5 7.8 301 130 B Y G < S- 0 0 24 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.526 106.2-128.6 -86.3 -5.6 35.0 65.1 10.6 302 131 B G < - 0 0 69 -3,-1.6 2,-0.2 1,-0.1 -3,-0.1 0.978 39.6-176.0 60.0 67.1 38.0 67.2 11.9 303 132 B L - 0 0 53 -5,-0.2 2,-0.2 -4,-0.1 -1,-0.1 -0.589 21.9-109.4-104.4 155.8 37.9 66.2 15.6 304 133 B E > - 0 0 158 -2,-0.2 3,-2.7 3,-0.1 4,-0.3 -0.487 63.6 -43.2 -85.9 150.4 39.9 67.3 18.6 305 134 B G T 3 S- 0 0 79 1,-0.3 3,-0.3 -2,-0.2 4,-0.1 0.004 125.5 -8.5 41.8-114.2 42.4 65.3 20.7 306 135 B E T >> S+ 0 0 106 1,-0.2 4,-2.0 2,-0.1 3,-0.8 0.364 104.5 106.1 -92.5 3.0 41.3 61.7 21.3 307 136 B N H <> S+ 0 0 69 -3,-2.7 4,-1.8 1,-0.3 -1,-0.2 0.772 75.8 55.4 -61.3 -29.1 37.7 62.3 19.9 308 137 B A H 3> S+ 0 0 7 -3,-0.3 4,-1.0 -4,-0.3 -1,-0.3 0.878 110.3 47.3 -62.1 -40.8 38.5 60.4 16.7 309 138 B L H <> S+ 0 0 60 -3,-0.8 4,-1.0 2,-0.2 -2,-0.2 0.851 111.7 47.8 -72.5 -38.8 39.4 57.4 18.9 310 139 B H H X S+ 0 0 11 -4,-2.0 4,-2.5 1,-0.2 3,-0.2 0.874 106.5 61.2 -67.2 -35.2 36.4 57.6 21.2 311 140 B A H X S+ 0 0 6 -4,-1.8 4,-3.1 -5,-0.3 -2,-0.2 0.794 97.4 55.5 -65.0 -32.9 34.2 57.9 18.0 312 141 B T H X S+ 0 0 0 -4,-1.0 4,-2.5 2,-0.2 -1,-0.2 0.882 110.0 46.5 -64.5 -40.0 35.3 54.5 16.7 313 142 B R H X S+ 0 0 3 -4,-1.0 4,-2.5 -3,-0.2 -2,-0.2 0.931 114.1 50.3 -64.6 -43.7 34.1 53.0 20.0 314 143 B G H X S+ 0 0 2 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.913 111.8 45.2 -54.8 -53.1 31.0 55.0 19.6 315 144 B F H X S+ 0 0 3 -4,-3.1 4,-2.2 1,-0.2 5,-0.2 0.932 114.9 47.9 -61.7 -47.5 30.4 53.9 16.1 316 145 B R H X S+ 0 0 52 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.878 111.0 52.3 -58.9 -39.6 31.1 50.2 16.9 317 146 B S H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.887 109.5 49.5 -63.7 -40.4 28.8 50.5 20.0 318 147 B I H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.951 115.0 42.0 -64.5 -50.7 25.9 51.8 17.9 319 148 B C H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.909 119.9 41.6 -66.6 -49.3 26.2 49.1 15.2 320 149 B H H X S+ 0 0 10 -4,-2.5 4,-2.8 -5,-0.2 5,-0.3 0.944 116.0 52.4 -62.1 -47.2 26.7 46.2 17.5 321 150 B G H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.3 5,-0.2 0.929 113.5 40.7 -53.0 -55.2 24.0 47.6 19.9 322 151 B F H X S+ 0 0 1 -4,-2.8 4,-2.3 -5,-0.2 5,-0.2 0.944 117.8 47.4 -59.3 -50.6 21.3 48.0 17.2 323 152 B A H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.887 112.9 49.6 -62.7 -37.6 22.1 44.7 15.5 324 153 B S H X S+ 0 0 9 -4,-2.8 4,-1.7 -5,-0.2 -1,-0.2 0.915 111.8 45.4 -71.3 -42.6 22.2 42.8 18.8 325 154 B I H <>S+ 0 0 0 -4,-2.1 5,-2.4 -5,-0.3 4,-0.4 0.952 114.8 49.5 -61.8 -48.0 18.9 44.1 20.2 326 155 B E H ><5S+ 0 0 32 -4,-2.3 3,-1.3 1,-0.2 -2,-0.2 0.913 109.6 51.2 -56.7 -49.0 17.2 43.5 16.8 327 156 B Q H 3<5S+ 0 0 89 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.845 111.1 48.3 -56.6 -38.3 18.6 39.9 16.6 328 157 B Q T 3<5S- 0 0 54 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.394 117.2-111.3 -89.0 3.2 17.3 39.1 20.1 329 158 B G T < 5S+ 0 0 35 -3,-1.3 -3,-0.2 -4,-0.4 -2,-0.1 0.618 75.1 134.5 82.8 15.0 13.8 40.5 19.4 330 159 B G < + 0 0 20 -5,-2.4 2,-1.1 -6,-0.2 3,-0.2 0.491 48.5 82.5 -78.4 -6.5 14.1 43.5 21.7 331 160 B F + 0 0 20 -6,-0.4 -1,-0.2 -5,-0.2 -2,-0.1 -0.710 51.7 158.1 -97.7 80.7 12.7 46.1 19.3 332 161 B G + 0 0 56 -2,-1.1 -1,-0.2 -224,-0.1 -2,-0.1 0.737 34.1 106.1 -74.9 -26.9 9.1 45.4 19.9 333 162 B L S S- 0 0 58 -3,-0.2 -2,-0.0 1,-0.1 0, 0.0 -0.205 78.6-120.7 -59.0 146.8 7.7 48.8 18.7 334 163 B P S S+ 0 0 125 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.658 74.1 120.5 -60.7 -17.4 5.8 48.7 15.3 335 164 B L S S- 0 0 25 1,-0.1 2,-0.1 2,-0.1 -4,-0.0 -0.083 76.6 -96.4 -59.4 145.6 8.3 51.2 13.8 336 165 B D > - 0 0 85 1,-0.1 4,-2.0 2,-0.0 -1,-0.1 -0.382 27.8-149.4 -62.7 129.3 10.4 50.3 10.7 337 166 B L H > S+ 0 0 48 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.835 94.3 56.0 -73.5 -34.3 13.8 49.1 11.8 338 167 B D H > S+ 0 0 93 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.909 109.9 47.4 -65.5 -40.6 15.7 50.4 8.7 339 168 B I H > S+ 0 0 90 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.934 110.5 52.7 -58.9 -49.9 14.3 53.9 9.5 340 169 B S H X S+ 0 0 2 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.902 109.6 48.1 -54.1 -46.6 15.3 53.5 13.1 341 170 B L H X S+ 0 0 7 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.945 111.6 49.8 -60.7 -48.8 18.9 52.6 12.2 342 171 B H H X S+ 0 0 104 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.904 111.0 50.1 -54.0 -44.8 19.1 55.6 9.7 343 172 B V H X S+ 0 0 26 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.892 111.1 48.9 -61.9 -44.5 17.8 57.9 12.5 344 173 B L H X S+ 0 0 4 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.923 113.0 46.6 -61.9 -47.0 20.4 56.6 15.0 345 174 B L H X S+ 0 0 2 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.902 112.4 50.4 -64.1 -40.0 23.3 57.1 12.5 346 175 B E H X S+ 0 0 50 -4,-2.4 4,-3.3 -5,-0.2 5,-0.2 0.919 108.7 51.4 -64.5 -43.5 22.1 60.6 11.5 347 176 B T H X S+ 0 0 15 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.881 111.1 48.4 -57.0 -42.3 21.9 61.6 15.2 348 177 B F H X S+ 0 0 4 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.969 113.3 47.4 -61.8 -52.7 25.5 60.4 15.6 349 178 B I H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 3,-0.5 0.912 110.4 51.7 -56.5 -48.9 26.6 62.2 12.5 350 179 B K H X S+ 0 0 115 -4,-3.3 4,-1.5 1,-0.3 -1,-0.2 0.898 109.3 50.5 -56.1 -44.7 24.9 65.5 13.6 351 180 B G H < S+ 0 0 6 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.780 109.6 51.5 -62.9 -29.6 26.6 65.2 17.0 352 181 B L H < S+ 0 0 36 -4,-1.5 -2,-0.2 -3,-0.5 -1,-0.2 0.858 106.2 52.9 -73.9 -36.3 30.0 64.8 15.2 353 182 B R H < 0 0 129 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.752 360.0 360.0 -72.9 -30.2 29.4 67.9 13.0 354 183 B E < 0 0 161 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 -0.290 360.0 360.0 175.0 360.0 28.7 69.8 16.2