==== 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 05-NOV-09 3KKD . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA PAO1; . AUTHOR E.V.FILIPPOVA,M.CHRUSZCZ,M.CYMBOROWSKI,T.SKARINA,A.SAVCHENKO . 608 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27916.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 516 84.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 5 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 434 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.3 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 4 0 0 0 0 0 2 2 1 1 3 0 1 2 3 0 2 0 0 0 0 0 3 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 35 A Q > 0 0 175 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -45.5 21.0 -4.7 16.8 2 36 A R H > + 0 0 77 2,-0.2 4,-2.1 1,-0.2 3,-0.3 0.996 360.0 47.0 -46.7 -61.4 19.4 -8.0 16.4 3 37 A R H > S+ 0 0 67 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.879 112.8 50.3 -45.4 -45.7 16.2 -6.0 17.0 4 38 A Q H > S+ 0 0 34 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.843 106.7 51.5 -71.9 -39.3 17.4 -3.4 14.5 5 39 A A H X S+ 0 0 33 -4,-3.0 4,-4.3 -3,-0.3 5,-0.2 0.972 111.5 48.7 -53.5 -57.4 18.2 -5.8 11.6 6 40 A I H X S+ 0 0 20 -4,-2.1 4,-3.1 2,-0.2 5,-0.3 0.951 114.6 45.0 -47.9 -60.3 14.7 -7.3 11.9 7 41 A L H X S+ 0 0 30 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.910 114.7 48.8 -51.4 -47.3 13.1 -3.9 11.9 8 42 A D H X S+ 0 0 40 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.942 111.8 48.8 -63.5 -43.0 15.3 -2.8 9.0 9 43 A A H X S+ 0 0 0 -4,-4.3 4,-2.0 1,-0.2 -2,-0.2 0.900 108.2 53.0 -59.0 -47.3 14.5 -6.0 7.1 10 44 A A H X S+ 0 0 0 -4,-3.1 4,-1.3 -5,-0.2 -1,-0.2 0.881 109.1 53.9 -53.4 -40.1 10.7 -5.5 7.7 11 45 A X H >X S+ 0 0 13 -4,-2.0 4,-2.4 -5,-0.3 3,-0.9 0.968 105.2 49.7 -55.5 -59.9 11.3 -2.0 6.2 12 46 A R H 3X S+ 0 0 103 -4,-2.1 4,-2.5 1,-0.3 -1,-0.2 0.833 111.2 51.0 -52.6 -39.2 13.0 -3.3 3.0 13 47 A L H 3X S+ 0 0 9 -4,-2.0 4,-1.9 2,-0.2 -1,-0.3 0.832 107.9 52.9 -64.7 -36.0 10.1 -5.7 2.5 14 48 A I H < - 0 0 28 -4,-1.4 3,-0.7 -5,-0.2 -1,-0.3 0.020 43.5 -56.6 72.0-179.1 4.4 -3.6 0.3 19 53 A V G > S+ 0 0 31 1,-0.2 3,-1.8 2,-0.1 -1,-0.2 0.868 125.0 65.7 -61.4 -42.8 2.9 -3.9 3.8 20 54 A R G 3 S+ 0 0 81 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.614 91.4 62.2 -63.8 -19.8 1.2 -7.2 3.2 21 55 A A G < S+ 0 0 31 -3,-0.7 2,-1.2 -4,-0.4 -1,-0.3 0.347 73.6 110.6 -89.6 2.1 4.4 -9.3 2.7 22 56 A V < + 0 0 7 -3,-1.8 2,-0.3 -5,-0.1 23,-0.1 -0.723 41.0 138.7 -76.4 96.5 5.6 -8.5 6.3 23 57 A R > - 0 0 174 -2,-1.2 4,-1.9 1,-0.1 5,-0.2 -0.899 65.8-107.3-130.9 163.4 5.3 -12.0 8.0 24 58 A H H > S+ 0 0 55 -2,-0.3 4,-3.6 2,-0.2 5,-0.3 0.893 118.4 45.8 -58.5 -40.9 7.7 -13.6 10.4 25 59 A R H > S+ 0 0 216 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.996 114.4 43.9 -68.7 -62.8 8.9 -16.1 7.8 26 60 A A H > S+ 0 0 38 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.789 122.1 44.6 -49.3 -31.7 9.4 -13.6 4.9 27 61 A V H X S+ 0 0 0 -4,-1.9 4,-3.2 2,-0.2 5,-0.4 0.933 110.9 47.1 -80.1 -56.8 11.1 -11.3 7.6 28 62 A A H X>S+ 0 0 6 -4,-3.6 5,-2.2 2,-0.2 4,-1.1 0.904 114.2 54.9 -52.1 -39.2 13.3 -13.8 9.5 29 63 A A H ><5S+ 0 0 59 -4,-3.4 3,-0.6 -5,-0.3 -2,-0.2 0.977 111.6 41.8 -48.7 -60.1 14.2 -14.7 5.8 30 64 A E H 3<5S+ 0 0 59 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.789 118.4 42.3 -65.8 -37.6 15.1 -11.1 5.1 31 65 A A H 3<5S- 0 0 16 -4,-3.2 -1,-0.3 2,-0.1 -2,-0.2 0.530 110.3-123.2 -83.6 -10.7 17.0 -10.3 8.3 32 66 A Q T <<5 + 0 0 181 -4,-1.1 -3,-0.2 -3,-0.6 -4,-0.1 0.865 69.3 114.1 73.9 41.3 18.6 -13.7 8.1 33 67 A V S - 0 0 88 0, 0.0 4,-1.0 0, 0.0 -1,-0.0 -0.502 41.0-113.7 -73.4 151.1 15.3 -17.8 12.9 35 69 A L T >4 S+ 0 0 113 2,-0.2 3,-1.5 1,-0.2 -7,-0.0 0.909 115.5 53.5 -36.7 -59.6 11.4 -17.3 13.1 36 70 A S T 34 S+ 0 0 110 1,-0.3 -1,-0.2 2,-0.2 -3,-0.0 0.930 99.7 60.7 -51.3 -54.6 11.5 -17.3 17.0 37 71 A A T 34 0 0 56 1,-0.2 -1,-0.3 -9,-0.0 -2,-0.2 0.844 360.0 360.0 -36.1 -42.0 14.2 -14.6 17.1 38 72 A T << 0 0 42 -3,-1.5 -2,-0.2 -4,-1.0 -1,-0.2 0.965 360.0 360.0 -83.2 360.0 11.6 -12.4 15.2 39 ! 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 40 78 A D >> 0 0 147 0, 0.0 4,-1.6 0, 0.0 3,-1.6 0.000 360.0 360.0 360.0 17.0 2.5 -10.2 17.4 41 79 A I H 3> + 0 0 45 1,-0.3 4,-2.3 2,-0.2 3,-0.2 0.892 360.0 58.5 -52.6 -36.1 3.1 -9.6 13.7 42 80 A D H 3> S+ 0 0 52 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.684 98.7 55.6 -68.2 -23.4 1.4 -6.3 14.4 43 81 A D H <> S+ 0 0 83 -3,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.870 108.7 49.0 -70.9 -39.6 3.9 -5.4 17.1 44 82 A L H X S+ 0 0 16 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.935 112.2 47.1 -61.6 -50.4 6.6 -5.9 14.4 45 83 A I H X S+ 0 0 17 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.947 113.7 48.9 -53.6 -53.6 4.7 -3.7 11.9 46 84 A T H X S+ 0 0 31 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.901 112.2 47.6 -54.5 -47.1 4.2 -1.0 14.6 47 85 A D H X S+ 0 0 88 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.884 110.0 54.1 -62.4 -44.9 7.9 -1.1 15.6 48 86 A T H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.968 112.5 41.9 -53.9 -54.3 8.9 -0.8 11.9 49 87 A F H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.801 109.0 59.5 -69.2 -25.2 6.8 2.2 11.4 50 88 A A H X S+ 0 0 38 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.931 108.4 47.0 -62.2 -42.4 8.0 3.7 14.8 51 89 A L H X S+ 0 0 28 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.852 109.6 51.5 -63.8 -42.3 11.5 3.5 13.4 52 90 A F H X S+ 0 0 14 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.976 111.8 47.1 -62.5 -55.8 10.6 5.1 10.1 53 91 A V H X S+ 0 0 12 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.873 112.1 51.5 -45.3 -47.0 8.9 8.0 11.9 54 92 A E H X S+ 0 0 95 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.908 110.4 47.3 -65.9 -40.6 12.0 8.3 14.2 55 93 A R H X S+ 0 0 69 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.850 113.5 48.2 -67.8 -38.7 14.5 8.5 11.3 56 94 A N H X S+ 0 0 7 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.934 112.8 49.1 -64.7 -48.2 12.3 11.1 9.5 57 95 A A H X S+ 0 0 21 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.926 113.5 46.4 -57.0 -45.9 12.1 13.1 12.6 58 96 A E H X S+ 0 0 114 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.899 112.6 48.8 -68.0 -38.4 15.8 12.9 13.2 59 97 A A H X S+ 0 0 25 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.880 112.0 48.8 -68.6 -35.5 16.7 13.8 9.6 60 98 A L H X S+ 0 0 20 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.926 110.5 52.0 -68.4 -39.6 14.3 16.8 9.7 61 99 A S H X S+ 0 0 82 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.955 110.6 48.3 -57.9 -49.0 15.9 17.8 13.0 62 100 A A H X S+ 0 0 63 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.924 111.3 50.7 -57.0 -41.7 19.4 17.6 11.4 63 101 A F H X S+ 0 0 41 -4,-2.7 4,-0.8 2,-0.2 -1,-0.2 0.941 112.1 44.6 -59.8 -50.7 18.1 19.6 8.4 64 102 A W H >X S+ 0 0 46 -4,-2.7 3,-1.0 1,-0.2 4,-0.7 0.927 112.7 53.7 -63.8 -41.2 16.7 22.4 10.6 65 103 A S H >< S+ 0 0 72 -4,-2.8 3,-0.6 1,-0.2 4,-0.4 0.869 104.4 55.1 -57.0 -43.6 19.9 22.3 12.7 66 104 A S H 3< S+ 0 0 82 -4,-2.5 -1,-0.2 1,-0.2 4,-0.2 0.660 113.8 40.6 -62.0 -22.1 22.0 22.8 9.5 67 105 A V H S+ 0 0 39 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.915 111.0 50.7 -68.5 -40.5 22.7 29.9 11.3 70 108 A D H > S+ 0 0 62 -4,-0.2 4,-3.1 2,-0.2 5,-0.2 0.922 110.3 49.9 -63.5 -41.8 21.2 30.9 8.0 71 109 A L H X S+ 0 0 11 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.935 110.1 51.1 -65.6 -41.7 17.9 31.6 9.7 72 110 A Q H X S+ 0 0 144 -4,-2.5 4,-1.6 -5,-0.3 -1,-0.2 0.918 112.1 45.8 -57.2 -46.3 19.7 33.6 12.3 73 111 A E H X S+ 0 0 130 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.950 110.9 53.4 -67.4 -44.9 21.5 35.7 9.6 74 112 A X H X S+ 0 0 17 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.923 107.0 51.6 -54.4 -41.9 18.3 36.2 7.6 75 113 A A H X S+ 0 0 34 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.909 111.0 47.8 -63.9 -38.1 16.5 37.5 10.7 76 114 A A H X S+ 0 0 57 -4,-1.6 4,-2.2 2,-0.2 5,-0.2 0.928 109.7 52.7 -67.4 -46.0 19.3 40.1 11.3 77 115 A V H X S+ 0 0 33 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.908 110.5 48.6 -52.7 -44.9 19.3 41.2 7.7 78 116 A L H < S+ 0 0 30 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.842 107.2 55.0 -68.3 -31.4 15.5 41.8 7.9 79 117 A A H < S+ 0 0 85 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.904 116.1 37.7 -69.7 -42.9 15.8 43.8 11.1 80 118 A D H < S+ 0 0 149 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.859 133.7 21.7 -70.2 -36.7 18.3 46.2 9.5 81 119 A D >< - 0 0 88 -4,-2.2 3,-1.9 -5,-0.2 -1,-0.2 -0.750 52.5-178.0-143.5 90.4 16.6 46.2 6.1 82 120 A P G > S+ 0 0 84 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.810 85.2 69.8 -55.6 -30.0 13.0 45.3 5.6 83 121 A G G 3 S+ 0 0 20 1,-0.3 3,-0.5 2,-0.1 4,-0.3 0.448 79.3 81.4 -65.2 -3.7 13.5 45.8 1.8 84 122 A A G <> + 0 0 7 -3,-1.9 4,-2.7 1,-0.2 -1,-0.3 0.423 58.9 100.6 -83.2 0.9 15.6 42.7 1.8 85 123 A R H <> S+ 0 0 47 -3,-1.3 4,-2.5 2,-0.2 5,-0.2 0.915 78.1 53.8 -50.9 -49.3 12.5 40.4 1.7 86 124 A G H > S+ 0 0 4 -3,-0.5 4,-1.1 1,-0.2 -1,-0.2 0.943 112.3 46.3 -53.8 -46.9 12.9 39.8 -2.1 87 125 A S H > S+ 0 0 7 -4,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.845 108.4 53.7 -61.7 -49.4 16.5 38.7 -1.5 88 126 A L H X S+ 0 0 7 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.905 103.3 56.5 -54.2 -45.8 15.7 36.5 1.4 89 127 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.863 102.2 57.2 -59.3 -29.9 13.1 34.6 -0.5 90 128 A E H X S+ 0 0 4 -4,-1.1 4,-1.6 -3,-0.2 -1,-0.2 0.944 111.1 43.2 -63.4 -46.8 15.8 33.8 -3.1 91 129 A R H X S+ 0 0 56 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.928 112.9 51.0 -63.0 -48.8 17.9 32.2 -0.4 92 130 A I H X S+ 0 0 11 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.923 108.4 51.0 -59.2 -42.2 15.1 30.3 1.2 93 131 A V H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.2 5,-0.3 0.922 110.0 49.5 -64.7 -43.8 13.8 28.7 -2.0 94 132 A E H X S+ 0 0 22 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.926 112.4 47.5 -62.0 -42.8 17.3 27.4 -2.9 95 133 A L H X S+ 0 0 23 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.929 113.3 49.9 -63.9 -39.8 17.8 25.9 0.6 96 134 A A H X S+ 0 0 19 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.949 111.3 45.4 -66.5 -52.2 14.3 24.3 0.4 97 135 A V H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.868 109.9 55.4 -61.9 -37.3 14.6 22.7 -3.0 98 136 A Q H X S+ 0 0 99 -4,-2.0 4,-2.3 -5,-0.3 -1,-0.2 0.877 106.6 53.5 -57.6 -42.0 18.1 21.4 -2.1 99 137 A Y H X S+ 0 0 33 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.982 111.8 43.0 -50.9 -61.0 16.3 19.8 1.0 100 138 A V H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.896 112.6 54.4 -60.6 -42.4 13.8 18.0 -1.3 101 139 A Q H X S+ 0 0 62 -4,-2.8 4,-1.0 2,-0.2 5,-0.3 0.935 109.2 45.7 -55.3 -47.6 16.5 17.1 -3.8 102 140 A V H >X>S+ 0 0 60 -4,-2.3 5,-1.4 1,-0.3 4,-0.9 0.922 112.8 51.3 -69.2 -36.3 18.7 15.4 -1.2 103 141 A Q H 3<5S+ 0 0 11 -4,-2.5 8,-0.3 1,-0.2 -1,-0.3 0.831 112.7 46.1 -60.7 -37.7 15.7 13.6 0.2 104 142 A L H 3<5S+ 0 0 1 -4,-1.9 -1,-0.2 -3,-0.2 -2,-0.2 0.495 126.1 27.0 -88.5 -8.0 14.6 12.3 -3.2 105 143 A T H X<5S+ 0 0 69 -4,-1.0 3,-0.8 -3,-0.8 -3,-0.2 0.703 132.3 28.7-116.6 -68.7 18.1 11.1 -4.3 106 144 A E T 3<5S+ 0 0 158 -4,-0.9 -3,-0.2 -5,-0.3 3,-0.2 0.784 132.4 33.8 -61.0 -39.9 20.1 10.2 -1.2 107 145 A R T 3> S+ 0 0 83 -3,-0.8 4,-2.5 1,-0.2 5,-0.2 0.837 73.9 49.1 -47.0 -47.1 14.7 7.7 -1.6 109 147 A E H > S+ 0 0 127 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.910 110.3 51.4 -70.1 -41.8 14.1 4.4 0.3 110 148 A H H > S+ 0 0 74 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.909 112.7 46.4 -55.2 -45.2 13.4 6.3 3.6 111 149 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 -8,-0.3 -2,-0.2 0.904 111.2 52.3 -63.8 -40.9 10.9 8.5 1.7 112 150 A L H X S+ 0 0 48 -4,-2.5 4,-1.6 -5,-0.2 -2,-0.2 0.880 108.4 50.3 -60.2 -39.8 9.4 5.3 0.0 113 151 A A H X S+ 0 0 3 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.847 107.7 54.4 -67.9 -34.6 9.0 3.8 3.5 114 152 A E H X S+ 0 0 9 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.839 106.6 51.8 -63.1 -38.6 7.2 7.0 4.6 115 153 A Q H X S+ 0 0 43 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.858 109.3 49.4 -64.1 -38.6 4.8 6.6 1.8 116 154 A A H X S+ 0 0 15 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.918 111.3 50.1 -67.2 -40.5 4.1 3.0 2.8 117 155 A F H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.916 110.2 49.0 -60.1 -49.0 3.5 4.2 6.4 118 156 A R H X S+ 0 0 99 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.936 111.9 48.8 -58.0 -48.6 1.1 6.9 5.4 119 157 A Q H < S+ 0 0 132 -4,-2.0 4,-0.5 1,-0.2 3,-0.2 0.868 114.8 47.8 -54.5 -39.3 -0.8 4.4 3.2 120 158 A E H >X S+ 0 0 22 -4,-2.1 4,-1.3 1,-0.2 3,-1.1 0.868 96.6 67.7 -74.0 -38.9 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Q >> + 0 0 117 1,-0.1 4,-2.9 -7,-0.0 3,-0.5 -0.605 69.2 177.3-141.5 73.0 0.0 33.1 10.7 154 192 A P H 3> S+ 0 0 9 0, 0.0 4,-2.3 0, 0.0 -8,-0.2 0.847 79.1 52.4 -54.8 -34.0 3.0 30.9 11.4 155 193 A E H 3> S+ 0 0 112 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.898 113.8 41.4 -70.8 -39.7 0.9 27.8 12.3 156 194 A Q H <> S+ 0 0 95 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.888 114.9 52.2 -74.7 -35.8 -1.2 27.8 9.2 157 195 A D H X S+ 0 0 23 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.881 105.7 54.9 -63.4 -42.4 1.8 28.7 7.0 158 196 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.887 110.0 47.6 -58.8 -37.7 3.7 25.7 8.5 159 197 A K H X S+ 0 0 103 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.859 111.7 48.2 -70.1 -37.0 0.8 23.4 7.4 160 198 A V H X S+ 0 0 62 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.926 112.3 50.4 -69.3 -46.6 0.6 24.8 3.9 161 199 A L H X S+ 0 0 21 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.929 110.2 49.6 -54.6 -50.4 4.4 24.4 3.6 162 200 A T H X S+ 0 0 18 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.877 109.2 52.9 -52.0 -44.4 4.1 20.9 4.8 163 201 A S H X S+ 0 0 77 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-16.7 224 55 B A G < S+ 0 0 19 -3,-1.6 2,-1.6 -8,-0.2 -1,-0.2 0.538 75.4 100.0 -80.0 -9.4 43.3 66.5 -16.7 225 56 B V < + 0 0 2 -3,-1.4 2,-0.3 -4,-0.2 -1,-0.1 -0.645 48.8 138.2 -86.1 89.5 43.4 66.5 -12.9 226 57 B R > - 0 0 74 -2,-1.6 4,-2.7 1,-0.1 5,-0.3 -0.931 65.6-110.5-123.8 154.6 47.0 67.4 -12.3 227 58 B H H > S+ 0 0 45 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.883 116.7 44.9 -54.2 -43.7 48.3 69.8 -9.6 228 59 B R H > S+ 0 0 164 2,-0.2 4,-3.6 1,-0.2 -1,-0.2 0.869 111.9 49.6 -73.5 -36.4 49.4 72.4 -12.3 229 60 B A H > S+ 0 0 34 2,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.923 113.7 47.3 -65.1 -41.0 46.3 72.3 -14.4 230 61 B V H X S+ 0 0 0 -4,-2.7 4,-1.7 2,-0.2 5,-0.2 0.955 115.1 45.4 -67.5 -47.2 44.2 72.7 -11.3 231 62 B A H >X>S+ 0 0 5 -4,-2.7 5,-1.7 -5,-0.3 4,-1.0 0.953 113.2 49.5 -55.9 -52.4 46.4 75.6 -10.1 232 63 B A H 3<5S+ 0 0 79 -4,-3.6 -1,-0.2 1,-0.2 -2,-0.2 0.854 114.3 48.4 -57.0 -29.9 46.4 77.2 -13.6 233 64 B E H 3<5S+ 0 0 51 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.661 117.1 37.0 -90.9 -22.8 42.6 76.8 -13.6 234 65 B A H <<5S- 0 0 23 -4,-1.7 -1,-0.2 -3,-0.7 -2,-0.2 0.357 108.5-128.2 -99.6 1.0 41.8 78.2 -10.2 235 66 B Q T <5 + 0 0 86 -4,-1.0 -3,-0.2 -5,-0.2 -4,-0.1 0.917 64.1 130.6 49.0 53.1 44.6 80.7 -10.9 236 67 B V < - 0 0 15 -5,-1.7 -1,-0.2 -6,-0.1 -2,-0.2 -0.905 67.5 -82.1-123.7 160.5 46.4 80.0 -7.6 237 68 B P >> - 0 0 75 0, 0.0 3,-1.3 0, 0.0 4,-0.5 -0.277 36.6-122.8 -59.1 149.0 50.0 79.2 -7.0 238 69 B L H >> S+ 0 0 76 1,-0.3 3,-1.7 2,-0.2 4,-1.1 0.893 111.9 58.3 -53.9 -47.4 51.0 75.5 -7.6 239 70 B S H 34 S+ 0 0 85 1,-0.3 4,-0.4 2,-0.2 -1,-0.3 0.682 95.7 68.6 -61.3 -14.0 52.3 75.1 -4.1 240 71 B A H <> S+ 0 0 12 -3,-1.3 4,-1.7 2,-0.2 -1,-0.3 0.829 94.8 52.6 -77.6 -27.3 48.8 76.1 -2.9 241 72 B T H S- 0 0 80 1,-0.1 4,-1.8 -5,-0.1 5,-0.2 -0.630 74.2-148.8 -92.7 133.0 48.2 64.4 -2.5 248 79 B I H > S+ 0 0 30 -2,-0.4 4,-2.9 1,-0.2 5,-0.2 0.891 101.2 56.1 -66.5 -37.5 46.4 64.5 -5.8 249 80 B D H > S+ 0 0 71 1,-0.2 4,-3.3 2,-0.2 -1,-0.2 0.914 104.6 55.3 -56.8 -41.5 44.1 61.5 -4.8 250 81 B D H > S+ 0 0 69 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.909 108.3 46.2 -52.7 -50.2 43.2 63.6 -1.8 251 82 B L H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.950 114.4 49.0 -61.4 -43.2 42.1 66.5 -4.1 252 83 B I H X S+ 0 0 2 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.937 108.6 52.6 -63.9 -46.5 40.2 64.0 -6.3 253 84 B T H X S+ 0 0 21 -4,-3.3 4,-2.0 1,-0.2 -1,-0.2 0.887 112.8 44.4 -52.0 -47.4 38.4 62.4 -3.4 254 85 B D H X S+ 0 0 42 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.868 109.6 54.3 -71.4 -39.1 37.2 65.7 -2.1 255 86 B T H X S+ 0 0 3 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.973 113.9 43.0 -56.1 -55.0 36.1 67.0 -5.4 256 87 B F H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.827 107.1 59.4 -62.9 -32.2 34.0 63.9 -5.9 257 88 B A H X S+ 0 0 33 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.965 110.6 43.9 -56.5 -46.5 32.8 64.1 -2.3 258 89 B L H X S+ 0 0 66 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.937 111.4 53.7 -57.9 -52.0 31.4 67.5 -3.4 259 90 B F H X S+ 0 0 12 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.897 110.7 46.2 -49.8 -55.4 30.1 66.1 -6.7 260 91 B V H X S+ 0 0 11 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.884 110.4 51.4 -53.4 -47.9 28.1 63.3 -4.9 261 92 B E H X S+ 0 0 114 -4,-2.3 4,-2.9 -5,-0.2 5,-0.2 0.931 110.0 52.0 -63.9 -39.4 26.6 65.6 -2.2 262 93 B R H X S+ 0 0 37 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.967 112.6 41.3 -55.5 -60.3 25.4 68.0 -4.9 263 94 B N H X S+ 0 0 11 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.786 113.5 56.9 -65.3 -26.2 23.6 65.3 -7.0 264 95 B A H X S+ 0 0 19 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.961 111.0 41.8 -59.9 -55.3 22.3 63.8 -3.7 265 96 B E H X S+ 0 0 106 -4,-2.9 4,-3.9 2,-0.2 5,-0.3 0.933 111.3 55.0 -63.0 -47.3 20.7 67.0 -2.7 266 97 B A H X S+ 0 0 32 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.924 112.3 45.1 -43.8 -51.9 19.4 67.7 -6.3 267 98 B L H X S+ 0 0 16 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.885 112.4 49.5 -65.6 -43.1 17.7 64.3 -6.2 268 99 B S H X S+ 0 0 80 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.972 113.6 47.8 -58.1 -47.8 16.3 64.8 -2.7 269 100 B A H X S+ 0 0 62 -4,-3.9 4,-1.5 1,-0.2 -2,-0.2 0.854 109.3 53.5 -64.4 -33.9 15.0 68.2 -3.9 270 101 B F H X S+ 0 0 62 -4,-2.4 4,-0.8 -5,-0.3 -1,-0.2 0.931 112.6 43.3 -62.7 -45.8 13.5 66.7 -7.0 271 102 B W H >X S+ 0 0 46 -4,-2.2 3,-1.1 2,-0.2 4,-0.7 0.931 110.3 52.4 -69.1 -50.8 11.5 64.1 -5.0 272 103 B S H >< S+ 0 0 94 -4,-2.5 3,-0.7 1,-0.3 4,-0.3 0.877 111.6 50.0 -53.2 -38.0 10.3 66.4 -2.2 273 104 B S H 3< S+ 0 0 91 -4,-1.5 -1,-0.3 -5,-0.2 4,-0.3 0.641 110.6 47.0 -80.6 -18.0 8.9 68.7 -4.9 274 105 B V H S+ 0 0 50 -4,-0.3 4,-2.3 1,-0.2 3,-0.2 0.963 108.7 49.5 -56.3 -56.0 2.2 66.4 -4.0 277 108 B D H > S+ 0 0 61 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.806 108.2 54.3 -49.4 -39.0 1.6 65.2 -7.5 278 109 B L H X S+ 0 0 8 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.876 107.7 49.7 -74.1 -38.3 2.4 61.7 -6.5 279 110 B Q H X S+ 0 0 80 -4,-2.0 4,-3.0 -3,-0.2 5,-0.3 0.946 108.7 51.5 -58.7 -50.6 -0.3 61.8 -3.8 280 111 B E H X S+ 0 0 118 -4,-2.3 4,-3.1 1,-0.2 -2,-0.2 0.923 111.2 49.7 -55.1 -46.4 -2.9 63.2 -6.2 281 112 B X H X S+ 0 0 6 -4,-2.2 4,-3.5 2,-0.2 -1,-0.2 0.934 110.9 47.2 -56.3 -54.5 -2.1 60.3 -8.5 282 113 B A H X S+ 0 0 21 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.942 116.6 45.2 -48.3 -53.2 -2.4 57.7 -5.8 283 114 B A H X S+ 0 0 52 -4,-3.0 4,-1.3 1,-0.2 -2,-0.2 0.846 114.6 48.5 -64.3 -37.7 -5.7 59.3 -4.6 284 115 B V H X S+ 0 0 62 -4,-3.1 4,-2.0 -5,-0.3 -1,-0.2 0.911 109.7 52.5 -67.3 -43.2 -6.9 59.6 -8.2 285 116 B L H < S+ 0 0 33 -4,-3.5 3,-0.4 1,-0.2 6,-0.3 0.979 106.2 54.4 -52.2 -55.0 -5.9 56.0 -8.9 286 117 B A H < S+ 0 0 80 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.789 108.0 47.6 -57.3 -38.7 -8.0 54.8 -5.9 287 118 B D H < S+ 0 0 142 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.910 131.0 18.8 -69.6 -37.9 -11.2 56.5 -7.0 288 119 B D >< - 0 0 92 -4,-2.0 3,-2.9 -3,-0.4 -1,-0.2 -0.645 58.2-175.0-141.2 88.4 -10.7 55.0 -10.5 289 120 B P G > S+ 0 0 84 0, 0.0 3,-1.4 0, 0.0 4,-0.2 0.687 85.9 71.8 -45.1 -26.9 -8.4 52.0 -11.2 290 121 B G G 3 S+ 0 0 63 1,-0.2 3,-0.5 2,-0.1 4,-0.2 0.556 84.1 71.6 -67.0 -9.0 -9.1 52.4 -14.9 291 122 B A G X> + 0 0 14 -3,-2.9 4,-2.8 -6,-0.3 3,-0.9 0.556 65.6 97.3 -81.1 -12.4 -6.9 55.6 -14.7 292 123 B R H <> S+ 0 0 99 -3,-1.4 4,-2.7 1,-0.3 -1,-0.2 0.870 80.5 54.2 -49.8 -39.0 -3.7 53.6 -14.3 293 124 B G H 3> S+ 0 0 31 -3,-0.5 4,-1.8 1,-0.2 -1,-0.3 0.857 110.5 44.4 -68.1 -34.6 -3.0 54.0 -18.1 294 125 B S H <> S+ 0 0 88 -3,-0.9 4,-2.0 -4,-0.2 -1,-0.2 0.895 111.0 54.8 -75.0 -36.5 -3.3 57.7 -18.0 295 126 B L H X S+ 0 0 19 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.923 105.8 52.5 -63.2 -39.9 -1.2 57.9 -14.9 296 127 B V H X S+ 0 0 0 -4,-2.7 4,-3.6 -5,-0.3 5,-0.2 0.977 107.1 53.2 -56.4 -53.5 1.5 55.9 -16.6 297 128 B E H X S+ 0 0 71 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.853 110.7 46.4 -47.9 -41.8 1.5 58.4 -19.5 298 129 B R H X S+ 0 0 99 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.893 113.2 48.2 -72.9 -38.0 1.9 61.3 -17.1 299 130 B I H X S+ 0 0 16 -4,-2.6 4,-2.9 -5,-0.2 5,-0.2 0.963 109.8 53.6 -65.0 -46.8 4.7 59.6 -15.2 300 131 B V H X S+ 0 0 0 -4,-3.6 4,-2.5 -5,-0.2 5,-0.2 0.935 110.7 46.9 -49.2 -46.4 6.4 58.8 -18.5 301 132 B E H X S+ 0 0 67 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.884 111.8 48.2 -72.1 -37.2 6.3 62.4 -19.5 302 133 B L H X S+ 0 0 69 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.900 113.5 49.6 -65.8 -38.0 7.6 63.8 -16.2 303 134 B A H X S+ 0 0 17 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.927 110.4 48.0 -63.9 -47.3 10.4 61.2 -16.3 304 135 B V H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.897 112.7 50.9 -64.3 -40.8 11.4 62.0 -19.9 305 136 B Q H X S+ 0 0 111 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.919 106.4 54.1 -61.9 -46.1 11.4 65.6 -18.9 306 137 B Y H X S+ 0 0 49 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.935 113.0 42.9 -50.4 -48.4 13.6 64.9 -15.9 307 138 B V H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.906 111.9 52.8 -70.1 -41.9 16.2 63.2 -18.2 308 139 B Q H X S+ 0 0 65 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.904 108.9 50.1 -61.7 -41.2 16.0 65.9 -20.9 309 140 B V H X>S+ 0 0 66 -4,-2.3 4,-2.9 -5,-0.2 5,-1.4 0.931 111.1 49.4 -57.5 -45.3 16.6 68.6 -18.4 310 141 B Q H <5S+ 0 0 16 -4,-1.7 8,-0.4 3,-0.2 4,-0.3 0.894 117.9 40.1 -64.9 -39.8 19.6 66.7 -17.0 311 142 B L H <5S+ 0 0 14 -4,-2.4 4,-0.3 1,-0.1 -2,-0.2 0.980 124.3 34.6 -74.8 -54.2 21.1 66.2 -20.4 312 143 B T H <5S+ 0 0 94 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.775 136.1 17.1 -75.4 -25.4 20.3 69.6 -22.0 313 144 B E T <5S+ 0 0 138 -4,-2.9 -3,-0.2 -5,-0.3 3,-0.2 0.747 129.2 38.3-120.8 -34.4 20.8 71.8 -18.9 314 145 B R S >> + 0 0 111 -4,-0.3 4,-1.8 1,-0.3 -1,-0.2 0.793 67.8 56.1 -54.1 -35.0 25.1 68.2 -18.5 316 147 B E H 3> S+ 0 0 96 -3,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.850 106.3 51.8 -70.8 -34.2 28.2 69.1 -16.5 317 148 B H H <> S+ 0 0 81 -3,-0.9 4,-2.1 2,-0.2 -2,-0.2 0.926 108.2 49.9 -64.6 -47.4 26.6 67.4 -13.4 318 149 B L H X S+ 0 0 0 -4,-1.8 4,-2.3 -8,-0.4 -2,-0.2 0.931 112.0 50.6 -51.3 -44.2 25.9 64.2 -15.3 319 150 B L H X S+ 0 0 1 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.883 110.3 46.3 -70.8 -40.1 29.6 64.3 -16.5 320 151 B A H X S+ 0 0 4 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.867 111.2 55.1 -64.0 -35.7 31.1 64.7 -13.0 321 152 B E H X S+ 0 0 11 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.937 109.0 46.9 -63.8 -42.4 28.7 61.9 -11.9 322 153 B Q H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.923 109.9 50.9 -68.3 -42.2 30.1 59.6 -14.6 323 154 B A H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.888 108.6 55.9 -62.8 -30.3 33.8 60.4 -13.8 324 155 B F H X S+ 0 0 4 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.970 109.0 44.9 -63.6 -47.5 32.8 59.5 -10.1 325 156 B R H X S+ 0 0 15 -4,-2.2 4,-0.7 1,-0.2 -2,-0.2 0.916 112.8 51.1 -59.7 -45.9 31.6 56.1 -11.2 326 157 B Q H >< S+ 0 0 1 -4,-2.5 3,-0.6 1,-0.2 4,-0.3 0.905 115.4 41.8 -57.3 -42.9 34.6 55.5 -13.3 327 158 B E H >X S+ 0 0 11 -4,-2.1 3,-1.5 1,-0.2 4,-1.4 0.862 101.4 67.0 -85.4 -29.3 37.0 56.4 -10.6 328 159 B A H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 7,-0.2 0.658 83.2 80.1 -64.9 -14.0 35.2 54.6 -7.7 329 160 B L T << S+ 0 0 0 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.845 113.2 10.1 -58.9 -33.5 36.0 51.3 -9.4 330 161 B L T <4 S+ 0 0 36 -3,-1.5 -2,-0.2 -4,-0.3 -1,-0.2 0.605 104.9 87.4-132.6 -8.2 39.6 51.3 -8.0 331 162 B N X - 0 0 21 -4,-1.4 4,-2.5 1,-0.2 3,-0.1 -0.830 60.8-157.7 -89.0 109.2 40.1 54.0 -5.5 332 163 B P H > S+ 0 0 82 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.818 90.5 57.5 -58.9 -34.7 39.0 52.5 -2.1 333 164 B R H > S+ 0 0 189 2,-0.2 4,-1.0 1,-0.2 3,-0.5 0.973 110.9 42.6 -55.3 -53.7 38.3 55.9 -0.6 334 165 B L H >> S+ 0 0 0 1,-0.2 4,-3.3 2,-0.2 3,-0.6 0.936 101.4 68.0 -62.8 -46.1 35.8 56.6 -3.4 335 166 B R H 3X S+ 0 0 92 -4,-2.5 4,-2.6 1,-0.3 5,-0.3 0.870 96.8 57.6 -38.7 -50.0 34.3 53.2 -3.3 336 167 B E H 3X S+ 0 0 69 -4,-1.5 4,-1.1 -3,-0.5 -1,-0.3 0.926 111.9 38.5 -41.5 -59.0 33.0 54.2 0.2 337 168 B L H X S+ 0 0 57 -4,-1.0 3,-1.0 1,-0.2 4,-0.9 0.942 111.0 54.3 -69.4 -51.2 21.7 53.6 -2.1 344 175 B I H >X S+ 0 0 53 -4,-2.1 3,-1.9 1,-0.2 4,-0.6 0.950 102.8 61.3 -33.8 -59.4 20.9 57.3 -2.1 345 176 B L H 3< S+ 0 0 23 -4,-2.8 -1,-0.2 1,-0.3 4,-0.2 0.573 108.5 35.5 -60.0 -28.7 19.8 57.0 -5.7 346 177 B S H S+ 0 0 2 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.748 100.0 56.0 -71.7 -24.9 12.0 55.7 -6.0 350 181 B V H X S+ 0 0 33 -4,-1.5 4,-1.9 -3,-0.4 -1,-0.2 0.908 108.8 48.1 -72.7 -40.8 11.0 53.1 -3.3 351 182 B H H X S+ 0 0 71 -4,-1.5 4,-2.8 2,-0.2 5,-0.3 0.941 108.1 56.9 -61.5 -42.6 8.6 55.7 -1.8 352 183 B F H X 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41.3 -28.3 557 182 C H H X S+ 0 0 69 -4,-1.4 4,-2.6 2,-0.2 5,-0.2 0.946 110.4 52.8 -60.4 -46.5 15.8 37.9 -29.7 558 183 C F H X S+ 0 0 15 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.979 113.8 42.2 -49.5 -56.8 15.4 36.4 -26.2 559 184 C F H X>S+ 0 0 0 -4,-2.9 5,-1.6 8,-0.2 4,-0.8 0.867 110.2 58.3 -64.7 -32.3 12.2 38.4 -25.5 560 185 C Q H ><5S+ 0 0 122 -4,-2.4 3,-0.7 -5,-0.3 -1,-0.2 0.957 111.9 40.7 -63.1 -43.8 10.9 37.7 -29.1 561 186 C V H 3<5S+ 0 0 30 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.922 108.3 60.1 -69.2 -45.0 11.1 33.9 -28.4 562 187 C L H 3<5S- 0 0 8 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.636 119.5-108.0 -48.3 -27.5 9.8 34.2 -24.9 563 188 C G T <<5 + 0 0 59 -4,-0.8 -3,-0.2 -3,-0.7 -2,-0.1 0.351 55.1 172.2 110.5 -7.1 6.6 35.6 -26.3 564 189 C S < - 0 0 10 -5,-1.6 -1,-0.2 -6,-0.2 46,-0.1 0.028 33.6-143.0 -44.1 134.9 7.1 39.3 -25.2 565 190 C G S S+ 0 0 68 1,-0.2 -1,-0.1 44,-0.2 -5,-0.0 0.864 101.1 26.9 -60.8 -33.6 4.5 41.8 -26.6 566 191 C Q > + 0 0 68 1,-0.1 4,-2.6 2,-0.1 -1,-0.2 -0.645 69.7 167.6-133.1 66.2 7.3 44.4 -26.8 567 192 C P H > S+ 0 0 5 0, 0.0 4,-2.6 0, 0.0 -8,-0.2 0.795 75.2 56.6 -55.5 -32.6 10.6 42.6 -27.2 568 193 C E H > S+ 0 0 89 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.951 112.9 39.1 -64.9 -52.5 12.6 45.8 -28.2 569 194 C Q H > S+ 0 0 34 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.892 115.1 53.4 -65.6 -42.1 11.6 47.6 -25.0 570 195 C D H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.948 107.8 51.0 -57.9 -46.1 12.0 44.5 -22.8 571 196 C A H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.887 109.9 50.8 -57.5 -42.4 15.5 44.0 -24.2 572 197 C K H X S+ 0 0 59 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.890 110.7 48.4 -65.1 -35.7 16.4 47.6 -23.4 573 198 C V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.909 111.9 48.1 -70.5 -39.3 15.1 47.2 -19.8 574 199 C L H X S+ 0 0 19 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.920 109.7 53.1 -67.6 -43.7 17.0 44.0 -19.2 575 200 C T H X S+ 0 0 1 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.925 108.2 51.6 -53.2 -50.3 20.2 45.6 -20.6 576 201 C S H X S+ 0 0 6 -4,-2.2 4,-1.8 1,-0.2 5,-0.2 0.929 111.3 46.7 -52.0 -51.3 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