==== 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 24-NOV-10 3PPB . COMPND 2 MOLECULE: PUTATIVE TETR FAMILY TRANSCRIPTION REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA LOIHICA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 376 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16155.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 293 77.9 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 . 4 1.1 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 . 9 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 236 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 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 2 2 2 2 0 2 0 0 4 0 0 2 0 0 2 2 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 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 7 A R 0 0 143 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -48.6 44.6 7.3 38.6 2 8 A T > - 0 0 88 1,-0.1 4,-2.1 4,-0.0 5,-0.1 -0.445 360.0-120.2 -78.0 154.5 44.7 3.5 38.0 3 9 A K H > S+ 0 0 126 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.940 115.0 49.2 -60.8 -48.9 41.6 1.9 36.2 4 10 A K H > S+ 0 0 92 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.872 111.7 49.8 -58.1 -40.3 40.9 -0.4 39.2 5 11 A Q H > S+ 0 0 82 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.859 107.6 52.7 -69.9 -38.9 41.2 2.6 41.7 6 12 A A H X S+ 0 0 24 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.891 112.3 47.0 -61.4 -40.4 38.8 4.8 39.6 7 13 A I H X S+ 0 0 0 -4,-1.9 4,-3.1 2,-0.2 -2,-0.2 0.955 114.0 46.2 -65.0 -52.6 36.2 1.9 39.7 8 14 A L H X S+ 0 0 31 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.917 116.3 44.8 -57.5 -48.3 36.7 1.3 43.5 9 15 A E H X S+ 0 0 110 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.833 116.5 45.5 -63.4 -41.6 36.5 5.1 44.3 10 16 A T H X S+ 0 0 25 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.902 112.6 51.5 -70.6 -43.7 33.4 5.6 42.0 11 17 A A H X S+ 0 0 0 -4,-3.1 4,-3.3 2,-0.2 5,-0.3 0.890 107.6 53.5 -57.6 -43.9 31.7 2.4 43.4 12 18 A L H X S+ 0 0 12 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.938 111.0 45.8 -57.7 -50.4 32.2 3.8 47.0 13 19 A Q H X S+ 0 0 57 -4,-1.7 4,-2.4 1,-0.2 3,-0.2 0.925 118.4 41.8 -57.2 -49.9 30.5 7.1 46.1 14 20 A L H X>S+ 0 0 8 -4,-2.4 4,-3.1 1,-0.2 5,-0.6 0.878 109.2 55.8 -72.0 -39.9 27.6 5.4 44.3 15 21 A F H <5S+ 0 0 0 -4,-3.3 4,-0.3 3,-0.2 -1,-0.2 0.773 115.0 42.8 -63.5 -24.3 27.0 2.5 46.9 16 22 A V H <5S+ 0 0 33 -4,-1.2 -2,-0.2 -5,-0.3 -1,-0.2 0.917 121.7 35.8 -85.6 -49.1 26.6 5.2 49.5 17 23 A S H <5S+ 0 0 75 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.801 138.1 16.6 -77.0 -29.0 24.4 7.8 47.6 18 24 A Q T <5S- 0 0 72 -4,-3.1 4,-0.3 -5,-0.2 -3,-0.2 0.399 104.0-120.8-122.7 -5.2 22.3 5.2 45.6 19 25 A G < - 0 0 23 -5,-0.6 4,-0.2 -4,-0.3 -1,-0.2 -0.015 32.5 -78.1 83.1 170.9 22.8 1.9 47.4 20 26 A F S > S+ 0 0 12 -5,-0.2 3,-0.8 2,-0.2 -1,-0.1 0.952 130.9 35.1 -72.7 -53.6 24.2 -1.4 46.1 21 27 A H T 3 S+ 0 0 89 1,-0.2 -1,-0.2 -6,-0.1 -2,-0.1 0.668 114.0 60.5 -77.3 -17.7 21.1 -2.6 44.2 22 28 A G T 3 S+ 0 0 24 -4,-0.3 2,-0.5 -7,-0.1 -1,-0.2 0.510 97.2 74.1 -82.4 -8.5 20.2 1.0 43.2 23 29 A T S < S- 0 0 1 -3,-0.8 2,-0.3 -4,-0.2 188,-0.0 -0.929 70.4-152.4-111.3 127.6 23.6 1.2 41.4 24 30 A S > - 0 0 50 -2,-0.5 4,-2.0 1,-0.1 5,-0.1 -0.676 24.6-124.0 -94.8 154.6 24.2 -0.5 38.1 25 31 A T H > S+ 0 0 33 -2,-0.3 4,-2.8 2,-0.2 5,-0.1 0.792 113.8 59.7 -61.3 -31.2 27.7 -1.6 36.8 26 32 A A H > S+ 0 0 46 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.932 105.7 46.7 -63.9 -46.4 27.1 0.6 33.7 27 33 A T H > S+ 0 0 26 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.918 113.4 49.2 -60.3 -46.1 26.8 3.7 35.9 28 34 A I H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.939 113.3 46.1 -58.7 -52.6 29.9 2.7 37.9 29 35 A A H X>S+ 0 0 1 -4,-2.8 5,-2.7 2,-0.2 4,-1.6 0.918 115.8 45.9 -56.0 -51.0 32.0 2.1 34.7 30 36 A R H <5S+ 0 0 156 -4,-2.7 3,-0.4 1,-0.2 -2,-0.2 0.929 113.7 47.0 -58.9 -53.5 30.7 5.4 33.1 31 37 A E H <5S+ 0 0 122 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.810 115.5 47.6 -61.7 -29.7 31.3 7.5 36.2 32 38 A A H <5S- 0 0 20 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.735 113.5-121.2 -80.8 -24.6 34.8 5.9 36.6 33 39 A G T <5S+ 0 0 65 -4,-1.6 2,-0.3 -3,-0.4 -3,-0.2 0.836 70.7 121.6 83.6 37.3 35.5 6.5 32.9 34 40 A V < - 0 0 22 -5,-2.7 -1,-0.3 -6,-0.1 -2,-0.1 -0.920 67.8-103.4-126.5 155.1 36.1 2.8 32.0 35 41 A A >> - 0 0 65 -2,-0.3 4,-1.5 1,-0.1 3,-0.9 -0.497 34.1-116.6 -72.8 146.9 34.4 0.4 29.5 36 42 A T H 3> S+ 0 0 74 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.838 117.3 60.1 -53.7 -34.4 32.0 -2.1 31.1 37 43 A G H 3> S+ 0 0 50 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.867 102.4 50.4 -60.0 -41.7 34.4 -4.8 29.9 38 44 A T H <> S+ 0 0 33 -3,-0.9 4,-1.5 1,-0.2 5,-0.2 0.853 107.8 54.2 -65.6 -38.5 37.3 -3.3 32.0 39 45 A L H X S+ 0 0 0 -4,-1.5 4,-2.4 1,-0.2 -2,-0.2 0.912 109.8 46.3 -61.6 -45.5 35.0 -3.3 35.1 40 46 A F H < S+ 0 0 82 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.745 105.0 62.2 -72.8 -22.9 34.2 -7.0 34.8 41 47 A H H < S+ 0 0 149 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.971 115.9 29.8 -63.4 -55.4 37.9 -7.9 34.2 42 48 A H H < S+ 0 0 63 -4,-1.5 -2,-0.2 1,-0.3 -1,-0.2 0.844 137.1 28.8 -72.6 -35.9 38.9 -6.6 37.7 43 49 A F < - 0 0 2 -4,-2.4 -1,-0.3 -5,-0.2 6,-0.1 -0.862 65.4-166.9-132.2 98.2 35.5 -7.4 39.3 44 50 A P S S+ 0 0 79 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.725 78.3 17.9 -58.3 -22.8 33.5 -10.4 37.7 45 51 A S S > S- 0 0 30 -6,-0.1 4,-1.6 1,-0.1 5,-0.1 -0.933 75.6-117.3-143.3 163.1 30.3 -9.3 39.6 46 52 A K H > S+ 0 0 35 -2,-0.3 4,-2.2 2,-0.2 5,-0.1 0.828 117.8 58.8 -68.3 -31.4 28.9 -6.3 41.4 47 53 A E H > S+ 0 0 101 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.903 105.0 47.8 -60.4 -48.2 29.0 -8.5 44.6 48 54 A Q H > S+ 0 0 82 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.870 110.2 52.7 -64.3 -38.8 32.8 -9.1 44.3 49 55 A L H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.928 111.1 46.6 -62.2 -45.6 33.3 -5.3 43.8 50 56 A L H X S+ 0 0 5 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.898 113.5 49.2 -61.6 -42.5 31.3 -4.6 47.0 51 57 A E H X S+ 0 0 45 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.903 112.9 46.0 -65.3 -42.2 33.3 -7.3 48.9 52 58 A Q H X S+ 0 0 98 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.886 115.3 47.1 -68.4 -40.1 36.7 -6.0 47.7 53 59 A L H X S+ 0 0 12 -4,-2.4 4,-2.8 -5,-0.2 5,-0.2 0.942 111.9 51.5 -62.7 -49.6 35.7 -2.4 48.5 54 60 A F H X S+ 0 0 1 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.923 113.6 42.1 -52.0 -54.9 34.4 -3.5 52.0 55 61 A L H X S+ 0 0 36 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.855 113.6 54.6 -65.2 -36.6 37.6 -5.4 52.9 56 62 A G H X S+ 0 0 32 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.925 111.1 42.5 -61.3 -50.3 39.7 -2.5 51.5 57 63 A V H X S+ 0 0 2 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.914 113.5 53.4 -65.9 -42.4 38.0 0.2 53.6 58 64 A K H X S+ 0 0 12 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.918 109.1 49.8 -57.3 -43.6 38.0 -2.1 56.7 59 65 A Q H X S+ 0 0 74 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.914 110.1 50.0 -62.9 -43.5 41.8 -2.5 56.2 60 66 A E H X S+ 0 0 82 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.906 112.8 47.3 -57.7 -46.8 42.3 1.3 55.9 61 67 A F H X S+ 0 0 16 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.933 113.6 46.9 -59.6 -50.1 40.3 1.8 59.2 62 68 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.914 113.7 48.8 -60.3 -44.8 42.3 -1.0 61.0 63 69 A D H X S+ 0 0 87 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.883 112.4 48.3 -62.1 -44.7 45.6 0.4 59.8 64 70 A A H X S+ 0 0 33 -4,-2.4 4,-0.9 2,-0.2 -2,-0.2 0.905 113.6 44.3 -65.4 -46.8 44.7 4.1 60.8 65 71 A I H < S+ 0 0 7 -4,-2.4 3,-0.3 2,-0.2 4,-0.2 0.890 116.3 46.7 -71.3 -35.5 43.5 3.2 64.4 66 72 A Q H >< S+ 0 0 89 -4,-2.1 3,-1.4 -5,-0.2 -2,-0.2 0.893 109.8 53.4 -72.2 -38.2 46.5 0.9 65.1 67 73 A A H 3< S+ 0 0 89 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.704 103.8 59.1 -66.9 -20.8 49.1 3.4 63.7 68 74 A S T 3< S+ 0 0 74 -4,-0.9 2,-0.5 -3,-0.3 -1,-0.3 0.482 96.0 78.1 -84.1 -7.6 47.6 6.1 66.1 69 75 A V < + 0 0 32 -3,-1.4 2,-0.6 -4,-0.2 -1,-0.1 -0.932 47.3 176.1-117.3 119.7 48.4 3.9 69.1 70 76 A S - 0 0 109 -2,-0.5 2,-0.1 8,-0.0 -3,-0.0 -0.977 34.2-135.5-116.2 104.6 51.8 3.5 70.8 71 77 A S - 0 0 71 -2,-0.6 4,-0.1 1,-0.1 -2,-0.0 -0.382 26.1-173.6 -66.3 141.7 51.2 1.3 73.9 72 78 A R - 0 0 87 2,-0.2 -1,-0.1 -2,-0.1 3,-0.1 0.277 63.7 -95.1-109.2 0.8 52.6 2.0 77.3 73 79 A G S S+ 0 0 66 1,-0.3 2,-0.7 2,-0.0 -2,-0.1 0.262 90.4 120.4 103.0 -8.9 51.2 -1.3 78.6 74 80 A D > - 0 0 81 1,-0.2 4,-2.2 2,-0.0 -1,-0.3 -0.814 48.0-159.7 -92.9 117.4 48.0 0.0 80.1 75 81 A L H > S+ 0 0 17 -2,-0.7 4,-3.0 2,-0.2 5,-0.2 0.887 89.9 50.1 -61.7 -46.8 45.0 -1.7 78.4 76 82 A K H > S+ 0 0 97 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.905 112.2 49.2 -61.2 -40.3 42.4 0.9 79.4 77 83 A Q H > S+ 0 0 85 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.901 113.7 45.4 -64.0 -43.9 44.6 3.7 78.1 78 84 A D H X S+ 0 0 14 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.902 111.8 51.9 -65.6 -43.4 45.2 1.8 74.8 79 85 A A H X S+ 0 0 13 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.886 111.0 49.3 -59.4 -39.8 41.4 1.1 74.5 80 86 A E H X S+ 0 0 84 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.919 112.1 46.6 -64.4 -48.3 40.8 4.8 75.0 81 87 A Q H X S+ 0 0 60 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.880 114.7 48.0 -59.9 -42.7 43.4 5.8 72.3 82 88 A L H X S+ 0 0 22 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.904 112.2 49.2 -66.6 -42.3 41.9 3.2 69.9 83 89 A W H X S+ 0 0 11 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.937 115.2 42.1 -62.4 -49.3 38.3 4.4 70.6 84 90 A F H X S+ 0 0 44 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.855 113.6 53.2 -73.1 -27.8 39.2 8.1 70.0 85 91 A A H X S+ 0 0 13 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.876 110.6 48.5 -67.6 -38.0 41.4 7.2 66.9 86 92 A A H X S+ 0 0 5 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.932 114.1 44.7 -66.0 -46.5 38.4 5.2 65.5 87 93 A L H X S+ 0 0 2 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.891 112.8 51.7 -67.0 -37.6 36.0 8.1 66.1 88 94 A T H X S+ 0 0 72 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.917 109.6 50.1 -64.1 -42.7 38.5 10.6 64.7 89 95 A W H X S+ 0 0 19 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.910 108.6 52.9 -60.2 -44.5 38.8 8.4 61.5 90 96 A A H < S+ 0 0 0 -4,-2.2 7,-0.2 1,-0.2 -1,-0.2 0.851 113.0 43.1 -58.2 -41.8 35.0 8.4 61.2 91 97 A X H < S+ 0 0 55 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.816 115.1 50.2 -75.3 -32.6 34.8 12.3 61.4 92 98 A A H < S+ 0 0 69 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.701 116.2 40.7 -78.1 -23.6 37.8 12.6 59.0 93 99 A N X + 0 0 48 -4,-1.6 4,-2.5 -5,-0.2 -1,-0.2 -0.675 65.4 167.7-125.0 72.6 36.4 10.2 56.3 94 100 A P H > S+ 0 0 94 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.850 77.0 48.6 -61.7 -33.5 32.6 11.0 56.0 95 101 A L H > S+ 0 0 67 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.960 115.1 42.6 -69.3 -50.9 32.1 8.9 52.8 96 102 A K H > S+ 0 0 52 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.846 115.5 51.7 -63.0 -33.9 33.9 5.8 54.0 97 103 A Q H X S+ 0 0 4 -4,-2.5 4,-2.6 -7,-0.2 -1,-0.2 0.922 107.6 50.3 -69.6 -43.7 32.2 6.2 57.4 98 104 A A H X S+ 0 0 22 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.886 108.0 56.0 -59.3 -36.6 28.7 6.4 55.8 99 105 A F H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 5,-0.3 0.880 108.5 46.8 -61.2 -42.0 29.7 3.2 53.9 100 106 A F H X S+ 0 0 4 -4,-1.6 4,-2.2 2,-0.2 5,-0.4 0.939 109.8 53.0 -66.5 -45.4 30.3 1.4 57.3 101 107 A Q H < S+ 0 0 20 -4,-2.6 4,-0.2 1,-0.2 -2,-0.2 0.922 117.4 39.0 -57.8 -39.8 27.0 2.7 58.7 102 108 A L H < S+ 0 0 21 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.845 133.8 15.6 -79.3 -35.9 25.2 1.3 55.6 103 109 A Y H >< S+ 0 0 10 -4,-2.3 3,-0.7 -5,-0.1 6,-0.5 0.696 97.2 85.9-116.9 -24.1 27.1 -2.0 55.1 104 110 A S T 3< S+ 0 0 4 -4,-2.2 -3,-0.1 -5,-0.3 -4,-0.1 0.717 112.7 13.7 -52.5 -37.0 29.3 -3.1 58.2 105 111 A X T 3 S+ 0 0 11 -5,-0.4 -1,-0.2 -4,-0.2 -2,-0.1 0.175 103.5 114.7-129.8 18.1 26.5 -4.9 60.1 106 112 A S S X S- 0 0 2 -3,-0.7 3,-0.8 1,-0.1 185,-0.1 -0.534 74.9-120.1 -91.3 155.7 23.9 -5.2 57.4 107 113 A P T 3 S+ 0 0 57 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.525 100.5 83.8 -68.9 -3.4 22.5 -8.4 55.8 108 114 A T T 3 S+ 0 0 50 2,-0.1 2,-0.3 -5,-0.1 -5,-0.1 0.911 78.4 66.7 -67.1 -47.0 23.9 -7.0 52.4 109 115 A V S < S- 0 0 4 -3,-0.8 5,-0.1 -6,-0.5 -62,-0.0 -0.622 100.0-100.3 -80.8 137.0 27.5 -8.2 52.8 110 116 A E > - 0 0 117 -2,-0.3 4,-2.1 1,-0.1 3,-0.5 -0.257 27.1-126.6 -51.3 135.1 28.1 -12.0 52.8 111 117 A Q H > S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.860 110.4 56.7 -55.4 -39.0 28.6 -13.4 56.4 112 118 A S H > S+ 0 0 75 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.859 108.6 45.8 -61.7 -38.6 31.9 -15.0 55.3 113 119 A V H > S+ 0 0 16 -3,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.885 111.4 51.4 -72.4 -39.8 33.3 -11.5 54.1 114 120 A R H X S+ 0 0 15 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.861 110.0 52.1 -63.2 -33.9 32.0 -9.8 57.4 115 121 A D H X>S+ 0 0 49 -4,-2.2 4,-3.1 2,-0.2 5,-0.6 0.859 105.5 53.4 -68.0 -41.2 33.8 -12.7 59.3 116 122 A Q H X>S+ 0 0 104 -4,-1.6 5,-1.7 1,-0.2 4,-1.3 0.884 112.5 44.8 -62.9 -39.3 37.1 -12.0 57.4 117 123 A A H <>S+ 0 0 1 -4,-1.8 5,-2.4 3,-0.2 -2,-0.2 0.913 118.3 44.1 -68.3 -43.2 36.9 -8.3 58.4 118 124 A X H <5S+ 0 0 17 -4,-2.1 8,-0.3 3,-0.2 7,-0.2 0.932 129.1 21.4 -68.4 -54.7 36.0 -9.2 62.1 119 125 A H H <5S+ 0 0 92 -4,-3.1 -3,-0.2 -5,-0.1 -2,-0.2 0.654 134.4 35.3 -94.3 -18.0 38.5 -12.0 62.8 120 126 A G T ><> + 0 0 19 -3,-1.2 4,-1.3 1,-0.3 3,-0.3 0.755 63.8 69.3 -58.3 -29.7 41.5 -9.7 64.8 124 130 A F H 3> S+ 0 0 39 -3,-0.3 4,-2.1 -4,-0.2 -1,-0.3 0.734 88.7 65.4 -63.6 -25.0 43.6 -7.6 67.2 125 131 A I H <> S+ 0 0 40 -3,-1.7 4,-2.1 -7,-0.2 -1,-0.2 0.945 102.7 44.8 -64.8 -49.4 40.3 -6.4 68.9 126 132 A A H X S+ 0 0 8 -4,-0.6 4,-2.5 -3,-0.3 -1,-0.2 0.835 111.3 55.5 -62.1 -33.6 39.5 -9.9 70.2 127 133 A E H X S+ 0 0 87 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.912 107.9 47.7 -67.2 -39.6 43.2 -10.2 71.3 128 134 A L H X S+ 0 0 41 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.890 111.5 50.4 -67.0 -38.4 42.9 -7.0 73.4 129 135 A I H X S+ 0 0 4 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.938 110.1 50.5 -62.5 -46.6 39.6 -8.3 74.9 130 136 A R H X S+ 0 0 116 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.884 111.3 49.0 -57.2 -41.6 41.4 -11.6 75.8 131 137 A Q H X S+ 0 0 96 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.909 111.4 49.0 -66.0 -40.6 44.3 -9.6 77.4 132 138 A G H <>S+ 0 0 0 -4,-2.3 6,-2.3 2,-0.2 5,-2.1 0.790 111.2 49.7 -67.5 -31.2 41.8 -7.5 79.4 133 139 A Q H ><5S+ 0 0 42 -4,-2.0 3,-0.9 4,-0.2 -2,-0.2 0.901 110.5 50.0 -73.4 -41.8 40.0 -10.7 80.6 134 140 A A H 3<5S+ 0 0 91 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.798 110.5 50.1 -65.6 -32.5 43.3 -12.3 81.7 135 141 A S T 3<5S- 0 0 69 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.464 115.5-115.5 -85.7 -4.5 44.3 -9.1 83.7 136 142 A G T < 5S+ 0 0 46 -3,-0.9 -3,-0.2 -4,-0.2 -2,-0.1 0.638 89.8 107.1 78.0 17.2 40.9 -9.0 85.4 137 143 A E S - 0 0 28 0, 0.0 4,-1.9 0, 0.0 3,-0.4 -0.329 49.1-130.9 -53.5 130.9 31.5 -14.8 74.8 143 149 A I H > S+ 0 0 53 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.849 103.5 52.3 -53.5 -43.3 34.3 -13.1 72.8 144 150 A E H > S+ 0 0 24 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.866 108.6 50.0 -68.0 -34.4 32.3 -12.8 69.6 145 151 A L H > S+ 0 0 3 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.905 110.9 50.7 -67.2 -40.9 29.3 -11.1 71.4 146 152 A X H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.906 110.6 48.1 -65.0 -41.1 31.8 -8.6 72.9 147 153 A Q H X S+ 0 0 10 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.926 112.5 48.6 -67.7 -40.3 33.4 -7.8 69.5 148 154 A D H X S+ 0 0 2 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.885 110.7 52.5 -61.4 -38.5 29.9 -7.3 67.9 149 155 A N H X S+ 0 0 6 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.922 107.6 49.5 -63.6 -45.4 29.1 -5.1 70.9 150 156 A C H X S+ 0 0 11 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.915 113.6 48.6 -54.7 -45.7 32.3 -3.0 70.3 151 157 A H H X S+ 0 0 35 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.907 111.7 47.7 -62.0 -46.6 31.2 -2.7 66.7 152 158 A G H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.865 112.9 48.3 -63.9 -39.9 27.6 -1.7 67.6 153 159 A Q H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.880 110.3 52.0 -70.9 -36.2 28.7 0.9 70.1 154 160 A Y H X S+ 0 0 17 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.935 111.7 46.5 -61.7 -47.1 31.2 2.4 67.6 155 161 A L H X S+ 0 0 4 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.869 113.1 49.8 -65.6 -34.2 28.4 2.7 65.0 156 162 A A H X S+ 0 0 2 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.919 112.9 45.6 -68.6 -44.5 26.1 4.2 67.6 157 163 A A H X S+ 0 0 4 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.878 114.8 47.2 -69.6 -36.5 28.7 6.8 68.7 158 164 A T H X S+ 0 0 2 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.828 110.6 52.2 -76.3 -29.7 29.6 7.7 65.1 159 165 A R H X S+ 0 0 13 -4,-1.7 4,-2.4 -5,-0.2 -2,-0.2 0.953 112.7 47.5 -62.4 -49.4 25.9 8.0 64.2 160 166 A Y H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.898 114.4 43.9 -57.2 -50.9 25.6 10.4 67.2 161 167 A F H < S+ 0 0 1 -4,-2.4 7,-0.3 2,-0.2 -1,-0.2 0.802 113.5 50.2 -74.4 -25.0 28.6 12.5 66.3 162 168 A V H < S+ 0 0 65 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.886 114.7 45.5 -75.6 -37.1 27.8 12.7 62.6 163 169 A D H < S+ 0 0 14 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.790 127.7 29.0 -70.5 -33.7 24.2 13.8 63.6 164 170 A H S >X S+ 0 0 19 -4,-1.9 3,-1.4 -5,-0.2 4,-0.7 -0.661 70.2 168.3-126.9 71.9 25.5 16.3 66.2 165 171 A P G >4 S+ 0 0 71 0, 0.0 3,-0.7 0, 0.0 4,-0.5 0.806 75.4 62.5 -62.0 -25.9 29.0 17.4 64.8 166 172 A E G >4 S+ 0 0 101 1,-0.2 3,-0.7 2,-0.2 4,-0.1 0.793 97.3 58.7 -66.3 -27.7 29.2 20.3 67.4 167 173 A R G X4 S+ 0 0 56 -3,-1.4 3,-1.6 1,-0.2 7,-0.3 0.776 92.2 66.2 -75.1 -24.0 29.1 17.7 70.2 168 174 A W G << S+ 0 0 31 -4,-0.7 -1,-0.2 -3,-0.7 -2,-0.2 0.756 97.6 56.6 -67.0 -22.7 32.3 16.0 68.8 169 175 A Q G < S+ 0 0 144 -3,-0.7 2,-0.6 -4,-0.5 -1,-0.3 0.477 91.1 88.5 -83.6 -5.5 34.1 19.3 69.8 170 176 A Q X> - 0 0 76 -3,-1.6 4,-2.0 1,-0.1 3,-0.8 -0.881 65.8-156.0-104.6 113.1 32.9 18.9 73.4 171 177 A A H 3> S+ 0 0 55 -2,-0.6 4,-3.0 1,-0.2 5,-0.2 0.786 94.5 59.0 -53.4 -36.6 35.2 16.8 75.7 172 178 A H H 3> S+ 0 0 118 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.898 108.5 45.7 -63.2 -39.4 32.3 15.9 78.1 173 179 A E H <> S+ 0 0 11 -3,-0.8 4,-1.9 -6,-0.3 -2,-0.2 0.919 114.8 47.3 -68.0 -45.1 30.4 14.2 75.1 174 180 A R H X S+ 0 0 76 -4,-2.0 4,-1.9 -7,-0.3 -2,-0.2 0.929 112.7 48.6 -62.2 -47.0 33.6 12.4 73.9 175 181 A S H X S+ 0 0 72 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.893 109.7 52.7 -60.7 -41.1 34.4 11.2 77.5 176 182 A A H X S+ 0 0 7 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.891 106.1 54.6 -62.7 -38.7 30.8 10.0 77.9 177 183 A S H X S+ 0 0 3 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.906 110.4 44.5 -64.0 -44.0 31.1 8.0 74.6 178 184 A F H X S+ 0 0 11 -4,-1.9 4,-3.3 2,-0.2 5,-0.3 0.884 110.2 56.4 -64.9 -38.9 34.3 6.1 75.9 179 185 A A H X S+ 0 0 20 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.929 107.9 47.3 -58.6 -43.9 32.6 5.5 79.3 180 186 A L H X S+ 0 0 2 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.908 115.8 46.7 -63.6 -41.0 29.6 3.8 77.6 181 187 A F H X S+ 0 0 21 -4,-1.7 4,-0.8 -5,-0.2 -2,-0.2 0.947 118.4 38.3 -64.9 -55.5 32.1 1.7 75.5 182 188 A W H >X S+ 0 0 15 -4,-3.3 4,-2.1 1,-0.2 3,-0.8 0.916 113.7 54.4 -63.6 -48.2 34.5 0.7 78.4 183 189 A N H 3< S+ 0 0 15 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.743 99.4 61.9 -65.3 -24.0 31.7 0.2 81.1 184 190 A A H 3< S+ 0 0 0 -4,-1.1 -1,-0.2 -5,-0.2 188,-0.2 0.919 118.1 29.4 -62.8 -40.0 29.9 -2.3 78.8 185 191 A X H << S+ 0 0 7 -4,-0.8 -46,-3.3 -3,-0.8 -2,-0.2 0.652 96.1 104.4 -89.4 -33.4 33.0 -4.6 78.9 186 192 A A B < S-A 138 0A 2 -4,-2.1 -48,-0.3 -48,-0.3 -49,-0.1 -0.308 77.7-101.7 -62.4 147.7 34.6 -3.8 82.3 187 193 A V 0 0 57 -50,-1.9 -1,-0.1 -51,-0.1 -2,-0.1 -0.356 360.0 360.0 -63.5 145.9 34.3 -6.3 85.3 188 194 A R 0 0 187 -2,-0.1 189,-0.0 189,-0.0 184,-0.0 -0.939 360.0 360.0-128.1 360.0 31.7 -5.5 88.0 189 !* 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 0.0 190 7 B R 0 0 138 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -48.0 -5.9 -7.3 53.7 191 8 B T > - 0 0 88 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.439 360.0-116.9 -78.1 156.5 -6.4 -3.5 53.0 192 9 B K H > S+ 0 0 125 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.938 117.0 51.2 -60.7 -42.8 -4.9 -2.0 49.8 193 10 B K H > S+ 0 0 86 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.887 110.8 47.5 -60.5 -44.0 -2.7 0.3 52.0 194 11 B Q H > S+ 0 0 70 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.891 107.5 55.3 -68.9 -38.7 -1.4 -2.7 54.1 195 12 B A H X S+ 0 0 25 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.892 110.9 47.4 -59.6 -38.8 -0.7 -4.9 51.0 196 13 B I H X S+ 0 0 0 -4,-1.8 4,-3.0 2,-0.2 -2,-0.2 0.927 112.6 47.3 -66.2 -51.0 1.5 -1.9 49.7 197 14 B L H X S+ 0 0 22 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.931 115.2 45.9 -60.1 -43.8 3.3 -1.6 53.1 198 15 B E H X S+ 0 0 103 -4,-3.2 4,-2.1 2,-0.2 -2,-0.2 0.901 114.9 47.3 -67.2 -39.3 3.9 -5.3 53.4 199 16 B T H X S+ 0 0 22 -4,-2.3 4,-2.7 -5,-0.3 -2,-0.2 0.926 112.8 49.2 -65.9 -43.3 5.1 -5.5 49.7 200 17 B A H X S+ 0 0 0 -4,-3.0 4,-3.4 2,-0.2 5,-0.3 0.886 108.5 53.9 -64.2 -41.3 7.4 -2.5 50.2 201 18 B L H X S+ 0 0 9 -4,-2.3 4,-1.3 -5,-0.2 -1,-0.2 0.949 111.3 45.2 -56.7 -51.1 8.9 -4.1 53.3 202 19 B Q H X S+ 0 0 58 -4,-2.1 4,-2.4 1,-0.2 3,-0.2 0.935 119.5 40.5 -58.4 -50.7 9.7 -7.3 51.4 203 20 B L H X>S+ 0 0 9 -4,-2.7 4,-3.1 1,-0.2 5,-0.6 0.878 110.5 55.4 -70.6 -40.3 11.2 -5.4 48.4 204 21 B F H <5S+ 0 0 0 -4,-3.4 4,-0.4 3,-0.2 -1,-0.2 0.776 114.9 43.2 -63.5 -25.5 13.1 -2.7 50.4 205 22 B V H <5S+ 0 0 34 -4,-1.3 -2,-0.2 -5,-0.3 -1,-0.2 0.913 122.1 35.0 -83.9 -49.5 14.8 -5.5 52.3 206 23 B S H <5S+ 0 0 71 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.801 138.2 16.5 -77.4 -29.0 15.6 -7.8 49.3 207 24 B Q T <5S- 0 0 72 -4,-3.1 4,-0.3 -5,-0.2 -3,-0.2 0.398 103.8-120.8-123.8 -4.8 16.3 -5.1 46.6 208 25 B G < - 0 0 18 -5,-0.6 4,-0.2 -4,-0.4 -1,-0.2 0.008 31.8 -78.2 83.2 171.1 16.9 -1.9 48.6 209 26 B F S > S+ 0 0 13 -5,-0.2 3,-0.9 2,-0.2 -1,-0.1 0.953 130.7 35.4 -72.7 -53.5 15.0 1.4 48.5 210 27 B H T 3 S+ 0 0 89 1,-0.2 -1,-0.2 -192,-0.1 -2,-0.1 0.665 113.7 60.5 -76.8 -17.7 16.7 2.8 45.3 211 28 B G T 3 S+ 0 0 25 -4,-0.3 2,-0.5 -7,-0.1 -1,-0.2 0.500 97.1 73.9 -83.5 -7.9 16.8 -0.7 43.7 212 29 B T S < S- 0 0 1 -3,-0.9 2,-0.2 -4,-0.2 -190,-0.0 -0.931 70.7-151.3-111.4 128.9 13.0 -0.9 44.0 213 30 B S > - 0 0 51 -2,-0.5 4,-2.0 1,-0.1 5,-0.1 -0.667 23.8-123.5 -95.1 155.7 10.6 1.0 41.6 214 31 B T H > S+ 0 0 34 -2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.828 113.7 58.6 -63.8 -30.4 7.1 2.1 42.6 215 32 B A H > S+ 0 0 53 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.930 106.0 47.2 -63.7 -48.0 5.8 0.1 39.6 216 33 B T H > S+ 0 0 52 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.921 112.9 50.2 -57.6 -46.3 7.3 -3.1 41.0 217 34 B I H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.940 113.3 44.3 -57.7 -55.0 5.8 -2.3 44.5 218 35 B A H X>S+ 0 0 2 -4,-2.7 5,-2.8 2,-0.2 4,-0.7 0.872 115.7 49.1 -55.9 -43.7 2.2 -1.7 43.0 219 36 B R H ><5S+ 0 0 207 -4,-2.5 3,-1.0 3,-0.2 -2,-0.2 0.960 114.8 42.4 -63.1 -53.0 2.5 -4.8 40.8 220 37 B E H 3<5S+ 0 0 127 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.812 113.7 53.0 -66.0 -31.1 3.7 -7.2 43.6 221 38 B A H 3<5S- 0 0 16 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.603 112.8-121.1 -77.3 -13.2 1.1 -5.6 46.1 222 39 B G T <<5S+ 0 0 69 -3,-1.0 2,-0.3 -4,-0.7 -3,-0.2 0.756 72.1 120.0 77.0 28.1 -1.7 -6.3 43.4 223 40 B V < - 0 0 20 -5,-2.8 -1,-0.3 -6,-0.2 2,-0.1 -0.865 69.0-103.5-121.3 157.2 -2.7 -2.6 43.1 224 41 B A >> - 0 0 65 -2,-0.3 4,-1.5 1,-0.1 3,-0.9 -0.504 34.9-116.0 -73.7 147.4 -2.8 -0.1 40.2 225 42 B T H 3> S+ 0 0 77 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.835 117.5 60.1 -53.7 -34.5 0.1 2.5 40.3 226 43 B G H 3> S+ 0 0 50 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.871 102.7 50.1 -59.7 -41.8 -2.6 5.2 40.8 227 44 B T H <> S+ 0 0 33 -3,-0.9 4,-1.6 1,-0.2 -1,-0.2 0.849 107.8 54.5 -65.2 -39.0 -3.7 3.5 44.1 228 45 B L H X S+ 0 0 0 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.917 109.7 45.8 -61.4 -45.8 -0.1 3.4 45.3 229 46 B F H < S+ 0 0 82 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.744 106.2 60.4 -73.3 -22.4 0.4 7.2 44.8 230 47 B H H < S+ 0 0 143 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.966 115.9 32.4 -63.7 -53.6 -3.0 8.0 46.5 231 48 B H H < S+ 0 0 61 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.801 137.1 25.0 -72.1 -34.8 -1.9 6.4 49.7 232 49 B F < - 0 0 3 -4,-2.2 -1,-0.3 -5,-0.2 6,-0.1 -0.854 64.3-164.6-138.9 98.5 1.8 7.4 49.3 233 50 B P S S+ 0 0 78 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 0.735 79.5 16.9 -58.2 -22.5 2.6 10.4 47.0 234 51 B S S > S- 0 0 32 -6,-0.1 4,-1.7 1,-0.1 5,-0.1 -0.936 75.8-116.1-143.9 164.5 6.3 9.4 46.8 235 52 B K H > S+ 0 0 34 -2,-0.3 4,-2.3 2,-0.2 5,-0.1 0.824 117.9 58.7 -68.8 -32.2 8.5 6.3 47.4 236 53 B E H > S+ 0 0 98 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.910 105.4 47.5 -60.0 -48.2 10.2 8.4 50.1 237 54 B Q H > S+ 0 0 83 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.872 110.1 53.0 -64.4 -38.9 6.8 8.9 52.0 238 55 B L H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.922 110.6 46.9 -62.6 -45.1 6.1 5.1 51.7 239 56 B L H X S+ 0 0 7 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.896 113.6 49.0 -61.8 -41.7 9.5 4.3 53.2 240 57 B E H X S+ 0 0 44 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.910 113.2 45.7 -65.6 -42.7 8.9 6.9 56.0 241 58 B Q H X S+ 0 0 92 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.884 115.3 47.6 -68.8 -39.3 5.4 5.5 56.8 242 59 B L H X S+ 0 0 9 -4,-2.4 4,-2.8 -5,-0.2 5,-0.2 0.937 111.8 51.1 -62.6 -49.7 6.7 1.9 56.7 243 60 B F H X S+ 0 0 1 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.931 114.3 41.7 -53.4 -53.9 9.7 2.9 59.0 244 61 B L H X S+ 0 0 34 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.854 113.8 55.0 -65.5 -35.7 7.4 4.6 61.6 245 62 B G H X S+ 0 0 30 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.926 111.0 42.1 -62.2 -50.2 4.9 1.7 61.3 246 63 B V H X S+ 0 0 2 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.919 113.9 53.0 -66.4 -43.0 7.5 -1.0 62.1 247 64 B K H X S+ 0 0 13 -4,-2.5 4,-2.7 -5,-0.2 -2,-0.2 0.925 109.7 49.5 -57.2 -43.0 9.0 1.1 64.9 248 65 B Q H X S+ 0 0 77 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.917 110.4 49.6 -63.4 -43.7 5.5 1.5 66.4 249 66 B E H X S+ 0 0 72 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.912 113.0 47.2 -57.6 -46.5 4.9 -2.4 66.2 250 67 B F H X S+ 0 0 15 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.936 113.9 46.8 -59.6 -49.7 8.3 -3.0 67.9 251 68 B A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.914 113.9 48.7 -60.8 -44.3 7.6 -0.3 70.6 252 69 B D H X S+ 0 0 89 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.892 112.5 48.1 -62.2 -45.7 4.1 -1.8 71.2 253 70 B A H X S+ 0 0 34 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.904 113.8 44.6 -64.4 -46.4 5.4 -5.5 71.4 254 71 B I H < S+ 0 0 7 -4,-2.4 3,-0.3 2,-0.2 4,-0.3 0.897 116.2 46.4 -71.3 -36.2 8.2 -4.8 73.9 255 72 B Q H >< S+ 0 0 92 -4,-2.1 3,-1.2 -5,-0.2 -2,-0.2 0.886 110.0 53.7 -72.2 -37.7 6.0 -2.5 76.2 256 73 B A H 3< S+ 0 0 87 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.717 104.3 57.6 -66.9 -23.0 3.1 -5.1 76.2 257 74 B S T 3< S+ 0 0 76 -4,-1.0 2,-0.5 -3,-0.3 -1,-0.2 0.493 85.4 101.4 -87.0 -6.1 5.5 -7.8 77.3 258 75 B V < - 0 0 35 -3,-1.2 2,-0.6 -4,-0.3 9,-0.1 -0.733 46.3-174.1 -88.5 129.1 6.6 -5.9 80.5 259 76 B S - 0 0 95 -2,-0.5 2,-0.1 8,-0.0 -3,-0.0 -0.851 26.0-157.2-113.6 79.1 5.1 -6.9 83.9 260 77 B S + 0 0 72 -2,-0.6 4,-0.1 1,-0.1 -2,-0.0 -0.428 27.5 177.5 -67.2 136.5 6.7 -4.1 86.0 261 78 B R - 0 0 212 2,-0.3 -1,-0.1 -2,-0.1 3,-0.1 0.254 64.9 -92.7-115.9 0.8 7.2 -4.5 89.8 262 79 B G S S+ 0 0 67 1,-0.3 2,-0.6 2,-0.0 -2,-0.1 0.272 90.0 123.6 101.9 -9.3 8.9 -1.1 90.2 263 80 B D > - 0 0 76 1,-0.2 4,-2.3 2,-0.0 -1,-0.3 -0.786 48.2-157.9 -89.1 117.5 12.5 -2.4 89.8 264 81 B L H > S+ 0 0 17 -2,-0.6 4,-2.9 2,-0.2 5,-0.2 0.895 90.9 49.8 -61.3 -48.1 14.2 -0.5 86.9 265 82 B K H > S+ 0 0 98 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.900 112.6 48.4 -59.9 -41.5 16.9 -3.1 86.3 266 83 B Q H > S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.900 113.7 46.8 -64.1 -42.1 14.3 -5.9 86.2 267 84 B D H X S+ 0 0 18 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.880 111.5 50.9 -67.1 -40.0 12.1 -3.8 83.8 268 85 B A H X S+ 0 0 11 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.889 110.5 50.6 -63.6 -38.4 15.2 -3.0 81.6 269 86 B E H X S+ 0 0 80 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.925 111.2 46.7 -65.2 -47.4 15.9 -6.8 81.5 270 87 B Q H X S+ 0 0 52 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.888 114.6 48.1 -60.2 -42.9 12.3 -7.6 80.4 271 88 B L H X S+ 0 0 23 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.900 111.9 49.4 -65.7 -42.5 12.4 -4.9 77.8 272 89 B W H X S+ 0 0 12 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.937 114.7 42.5 -63.5 -47.9 15.8 -6.1 76.4 273 90 B F H X S+ 0 0 42 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.853 113.0 53.5 -73.5 -26.4 14.7 -9.7 76.2 274 91 B A H X S+ 0 0 14 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.885 110.1 48.7 -70.0 -36.3 11.3 -8.7 74.7 275 92 B A H X S+ 0 0 6 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.936 114.0 44.8 -66.0 -47.3 13.2 -6.7 72.0 276 93 B L H X S+ 0 0 2 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.890 112.7 52.0 -66.7 -37.2 15.5 -9.6 71.2 277 94 B T H X S+ 0 0 75 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.922 109.6 50.1 -62.9 -43.0 12.5 -12.0 71.2 278 95 B W H X S+ 0 0 18 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.904 108.4 52.7 -61.3 -43.9 10.8 -9.7 68.7 279 96 B A H < S+ 0 0 1 -4,-2.1 7,-0.2 1,-0.2 -1,-0.2 0.861 112.9 43.7 -58.8 -41.4 13.9 -9.6 66.5 280 97 B X H < S+ 0 0 56 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.829 115.4 49.3 -73.4 -35.3 14.0 -13.4 66.3 281 98 B A H < S+ 0 0 69 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.703 115.9 41.7 -77.8 -24.7 10.2 -13.7 65.8 282 99 B N X + 0 0 48 -4,-1.7 4,-2.4 -5,-0.1 -1,-0.2 -0.692 64.3 167.9-125.0 73.7 10.1 -11.1 62.9 283 100 B P H > S+ 0 0 96 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.850 77.3 48.6 -61.7 -34.2 13.1 -11.8 60.6 284 101 B L H > S+ 0 0 64 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.955 115.0 42.8 -68.5 -51.1 11.9 -9.5 57.8 285 102 B K H > S+ 0 0 52 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.838 115.2 51.6 -64.3 -33.3 11.1 -6.5 60.0 286 103 B Q H X S+ 0 0 3 -4,-2.4 4,-2.5 -7,-0.2 -1,-0.2 0.923 108.1 49.9 -69.5 -43.4 14.4 -7.0 61.9 287 104 B A H X S+ 0 0 18 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.885 108.1 56.0 -59.7 -37.5 16.4 -7.1 58.7 288 105 B F H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 5,-0.3 0.880 108.2 47.1 -60.7 -41.6 14.6 -3.8 57.8 289 106 B F H X S+ 0 0 2 -4,-1.6 4,-2.2 2,-0.2 5,-0.4 0.937 109.8 52.9 -66.7 -46.5 15.9 -2.3 61.1 290 107 B Q H < S+ 0 0 21 -4,-2.5 -2,-0.2 1,-0.2 4,-0.2 0.892 118.0 38.5 -56.2 -37.1 19.5 -3.6 60.4 291 108 B L H < S+ 0 0 26 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.826 134.3 14.9 -82.3 -35.2 19.3 -1.9 57.0 292 109 B Y H >< S+ 0 0 10 -4,-2.4 3,-0.7 -5,-0.1 6,-0.5 0.690 97.6 85.6-118.6 -23.3 17.5 1.4 57.7 293 110 B S T 3< S+ 0 0 5 -4,-2.2 -3,-0.1 -5,-0.3 -4,-0.1 0.720 112.6 14.7 -52.8 -38.0 17.3 2.2 61.6 294 111 B X T 3 S+ 0 0 13 -5,-0.4 -1,-0.2 -4,-0.2 -2,-0.1 0.167 103.7 113.9-127.7 16.8 20.7 3.9 61.8 295 112 B S S X S- 0 0 4 -3,-0.7 3,-0.8 1,-0.1 -197,-0.0 -0.537 74.9-120.4 -91.4 155.3 21.4 4.5 58.1 296 113 B P T 3 S+ 0 0 63 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.518 100.3 84.1 -69.5 -2.6 21.7 7.9 56.3 297 114 B T T 3 S+ 0 0 52 2,-0.1 2,-0.3 -5,-0.1 -5,-0.1 0.906 78.4 66.9 -67.2 -45.8 18.8 6.6 54.0 298 115 B V S < S- 0 0 4 -3,-0.8 5,-0.1 -6,-0.5 -62,-0.0 -0.636 100.0-101.2 -81.5 136.4 15.9 7.7 56.4 299 116 B E >> - 0 0 121 -2,-0.3 4,-2.1 1,-0.1 3,-0.5 -0.265 25.9-127.1 -51.7 135.3 15.4 11.5 56.9 300 117 B Q H 3> S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.854 110.4 57.8 -55.6 -38.6 16.9 12.6 60.3 301 118 B S H 3> S+ 0 0 85 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.857 108.7 44.5 -57.7 -43.2 13.5 14.2 61.2 302 119 B V H <> S+ 0 0 15 -3,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.880 111.5 52.1 -72.6 -39.6 11.7 10.8 60.8 303 120 B R H X S+ 0 0 17 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.867 110.0 51.7 -63.2 -34.2 14.5 9.0 62.7 304 121 B D H X>S+ 0 0 49 -4,-2.2 4,-3.1 2,-0.2 5,-0.6 0.865 105.8 53.3 -67.6 -41.6 13.9 11.6 65.5 305 122 B Q H X>S+ 0 0 105 -4,-1.6 5,-1.8 1,-0.2 4,-1.3 0.880 112.6 44.8 -63.0 -38.6 10.1 11.0 65.5 306 123 B A H <>S+ 0 0 1 -4,-1.8 5,-2.3 3,-0.2 -2,-0.2 0.915 118.5 43.8 -69.0 -43.7 10.9 7.2 66.1 307 124 B X H <5S+ 0 0 19 -4,-2.1 8,-0.3 3,-0.2 7,-0.2 0.929 129.3 21.4 -68.0 -54.8 13.5 8.0 68.7 308 125 B H H <5S+ 0 0 91 -4,-3.1 -3,-0.2 -5,-0.1 -2,-0.2 0.624 134.5 35.2 -94.9 -17.2 11.8 10.7 70.8 309 126 B G T ><> + 0 0 20 -3,-1.3 4,-1.4 1,-0.3 3,-0.4 0.752 63.4 69.9 -58.9 -28.8 10.2 8.2 74.0 313 130 B F H 3> S+ 0 0 38 -3,-0.3 4,-2.1 -4,-0.2 -1,-0.3 0.722 88.9 64.3 -64.1 -24.7 9.6 5.9 77.0 314 131 B I H <> S+ 0 0 40 -3,-1.7 4,-2.0 -7,-0.2 -1,-0.2 0.943 103.0 46.2 -65.0 -45.5 13.3 4.8 76.7 315 132 B A H X S+ 0 0 7 -4,-0.6 4,-2.6 -3,-0.4 -2,-0.2 0.878 110.8 54.1 -63.0 -38.2 14.5 8.3 77.5 316 133 B E H X S+ 0 0 90 -4,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.889 108.5 48.3 -64.4 -40.8 12.0 8.4 80.4 317 134 B L H X S+ 0 0 40 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.888 111.3 50.1 -67.1 -37.5 13.4 5.2 81.9 318 135 B I H X S+ 0 0 5 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.938 110.7 49.7 -64.6 -46.2 17.0 6.5 81.6 319 136 B R H X S+ 0 0 123 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.896 111.8 49.0 -57.6 -43.2 16.0 9.8 83.4 320 137 B Q H X S+ 0 0 99 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.914 111.3 49.4 -63.7 -41.4 14.3 7.6 86.2 321 138 B G H <>S+ 0 0 0 -4,-2.4 5,-2.3 2,-0.2 6,-2.3 0.791 111.6 48.6 -68.2 -30.0 17.5 5.5 86.5 322 139 B Q H ><5S+ 0 0 42 -4,-2.0 3,-1.1 4,-0.2 -2,-0.2 0.918 111.1 49.7 -75.4 -41.2 19.7 8.6 86.7 323 140 B A H 3<5S+ 0 0 93 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.788 110.7 50.5 -65.7 -31.4 17.4 10.2 89.4 324 141 B S T 3<5S- 0 0 68 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.423 115.8-114.5 -87.3 -2.0 17.5 6.9 91.5 325 142 B G T < 5S+ 0 0 46 -3,-1.1 -3,-0.2 2,-0.2 -2,-0.1 0.664 90.4 106.8 75.9 21.8 21.3 6.7 91.3 326 143 B E S - 0 0 29 0, 0.0 4,-1.8 0, 0.0 3,-0.3 -0.367 46.5-135.3 -56.6 132.2 23.9 12.9 77.7 332 149 B I H > S+ 0 0 42 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.814 101.5 55.9 -61.6 -36.0 20.5 10.9 77.3 333 150 B E H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.896 108.4 48.0 -67.6 -35.0 20.6 11.1 73.5 334 151 B L H > S+ 0 0 3 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.906 113.4 48.8 -67.3 -40.1 24.0 9.5 73.4 335 152 B X H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.884 110.6 49.7 -67.2 -39.0 22.8 6.8 75.8 336 153 B Q H X S+ 0 0 10 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.929 111.6 47.8 -68.3 -41.4 19.7 6.2 73.7 337 154 B D H X S+ 0 0 3 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.898 111.2 53.2 -61.8 -38.4 21.8 5.9 70.5 338 155 B N H X S+ 0 0 7 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.916 106.7 50.3 -62.1 -45.9 24.0 3.5 72.5 339 156 B C H X S+ 0 0 13 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.911 113.0 48.6 -54.4 -46.6 21.0 1.4 73.5 340 157 B H H X S+ 0 0 37 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.905 111.7 47.2 -61.3 -47.8 20.1 1.3 69.8 341 158 B G H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.873 113.1 49.0 -63.3 -39.6 23.6 0.3 68.7 342 159 B Q H X S+ 0 0 2 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.881 110.1 51.6 -69.8 -36.7 23.9 -2.4 71.4 343 160 B Y H X S+ 0 0 15 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.930 111.5 46.9 -62.8 -45.9 20.5 -3.8 70.3 344 161 B L H X S+ 0 0 4 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.884 113.1 49.7 -66.4 -34.4 21.6 -4.0 66.7 345 162 B A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.921 113.3 44.8 -68.0 -45.4 24.9 -5.6 67.7 346 163 B A H X S+ 0 0 4 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.867 115.0 47.8 -68.7 -37.4 23.1 -8.3 69.9 347 164 B T H X S+ 0 0 1 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.815 110.0 52.7 -75.3 -29.4 20.5 -9.0 67.2 348 165 B R H X S+ 0 0 13 -4,-1.7 4,-2.4 -5,-0.2 -2,-0.2 0.960 112.5 47.0 -62.9 -50.4 23.2 -9.3 64.5 349 166 B Y H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.889 115.1 43.3 -56.2 -51.6 24.9 -11.8 66.8 350 167 B F H < S+ 0 0 1 -4,-2.4 7,-0.3 2,-0.2 -1,-0.2 0.802 113.7 50.5 -75.0 -24.6 21.8 -13.9 67.5 351 168 B V H < S+ 0 0 67 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.878 114.9 45.0 -75.1 -36.8 20.6 -13.8 63.9 352 169 B D H < S+ 0 0 14 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.782 127.9 29.3 -71.5 -33.2 24.2 -15.0 62.8 353 170 B H S >X S+ 0 0 22 -4,-1.8 3,-1.3 -5,-0.2 4,-0.7 -0.656 70.1 167.4-126.4 70.5 24.2 -17.7 65.6 354 171 B P G >4 S+ 0 0 70 0, 0.0 3,-0.7 0, 0.0 4,-0.5 0.808 75.0 62.3 -61.6 -26.1 20.6 -18.6 66.2 355 172 B E G >4 S+ 0 0 101 1,-0.2 3,-0.8 2,-0.2 4,-0.1 0.794 97.3 58.5 -66.7 -28.2 21.6 -21.7 68.3 356 173 B R G X4 S+ 0 0 58 -3,-1.3 3,-1.6 1,-0.2 7,-0.3 0.769 91.8 67.4 -74.7 -23.4 23.2 -19.3 70.9 357 174 B W G << S+ 0 0 30 -3,-0.7 -1,-0.2 -4,-0.7 -2,-0.2 0.755 96.3 57.5 -65.9 -23.7 19.8 -17.5 71.4 358 175 B Q G < S+ 0 0 144 -3,-0.8 2,-0.6 -4,-0.5 -1,-0.3 0.474 90.4 88.0 -82.3 -6.1 18.7 -20.9 73.0 359 176 B Q X> - 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