==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-SEP-11 3TR8 . COMPND 2 MOLECULE: OLIGORIBONUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: COXIELLA BURNETII; . AUTHOR J.CHEUNG,M.FRANKLIN,M.RUDOLPH,M.CASSIDY,E.GARY,F.BURSHTEYN,J . 368 2 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16658.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 254 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 21 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 4 0 4 0 0 2 2 2 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 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 PARALLEL BRIDGES PER LADDER . 1 2 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 -2 A S 0 0 174 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 174.8 18.3 -34.6 8.9 2 -1 A N - 0 0 125 2,-0.1 0, 0.0 1,-0.0 0, 0.0 -0.978 360.0-111.4-168.8 169.6 17.6 -33.8 12.6 3 0 A A + 0 0 98 -2,-0.3 2,-0.1 2,-0.0 -1,-0.0 0.181 68.1 127.0-102.6 16.1 16.0 -31.3 15.0 4 1 A X - 0 0 147 1,-0.1 -2,-0.1 2,-0.0 95,-0.0 -0.430 65.9-124.8 -67.5 151.1 19.2 -29.9 16.4 5 2 A D + 0 0 67 -2,-0.1 -1,-0.1 93,-0.1 94,-0.1 0.541 62.8 131.2 -82.4 -5.9 19.3 -26.1 16.2 6 3 A F + 0 0 91 92,-0.3 2,-0.2 94,-0.1 94,-0.2 -0.108 22.9 141.9 -53.6 142.1 22.6 -25.7 14.3 7 4 A S > - 0 0 42 92,-2.5 3,-1.0 3,-0.0 -2,-0.0 -0.844 53.6-134.2-176.2 143.0 22.6 -23.4 11.3 8 5 A D T 3 S+ 0 0 66 -2,-0.2 92,-0.1 1,-0.2 -2,-0.1 0.469 107.8 64.4 -82.5 -0.6 24.9 -20.9 9.7 9 6 A D T 3 S+ 0 0 97 2,-0.1 -1,-0.2 96,-0.1 91,-0.1 0.510 81.3 111.2 -92.3 -9.4 21.8 -18.6 9.4 10 7 A N < - 0 0 7 -3,-1.0 2,-0.4 89,-0.3 27,-0.2 -0.312 63.5-131.8 -68.3 149.3 21.6 -18.4 13.2 11 8 A L E -A 36 0A 3 25,-2.9 25,-2.0 94,-0.1 2,-0.6 -0.816 6.9-145.5-106.3 141.8 22.4 -15.1 15.0 12 9 A I E -Ab 35 107A 1 94,-0.7 96,-1.9 -2,-0.4 2,-0.4 -0.921 12.5-166.6-108.6 116.7 24.6 -14.7 18.0 13 10 A W E +Ab 34 108A 0 21,-3.1 21,-2.4 -2,-0.6 2,-0.4 -0.854 11.6 179.0-100.8 134.4 23.6 -12.0 20.6 14 11 A L E -A 33 0A 3 94,-2.0 2,-0.4 -2,-0.4 19,-0.2 -0.995 11.1-173.8-141.6 133.2 26.2 -11.0 23.2 15 12 A D E -A 32 0A 21 17,-2.1 17,-1.5 -2,-0.4 2,-0.3 -0.952 5.4-171.4-123.6 147.8 26.3 -8.6 26.1 16 13 A L E -A 31 0A 5 -2,-0.4 2,-0.4 15,-0.2 15,-0.2 -0.927 13.4-152.5-129.5 156.5 29.1 -7.5 28.4 17 14 A E E -A 30 0A 19 13,-1.5 12,-3.0 -2,-0.3 13,-1.5 -0.991 22.5-172.9-123.6 139.1 29.5 -5.4 31.5 18 15 A X E -A 28 0A 20 -2,-0.4 10,-0.2 10,-0.3 3,-0.1 -0.695 38.5-115.8-122.5 176.0 32.8 -3.7 32.2 19 16 A T S S- 0 0 4 8,-1.7 43,-0.4 -2,-0.2 2,-0.3 0.560 94.0 -25.2 -86.4 -9.9 34.5 -1.8 34.9 20 17 A G S S- 0 0 14 7,-0.4 -1,-0.1 41,-0.1 -2,-0.1 -0.930 71.2 -83.0-174.4-163.7 34.5 1.2 32.6 21 18 A L S S+ 0 0 118 -2,-0.3 -1,-0.0 -3,-0.1 0, 0.0 0.538 93.8 90.1-102.1 -11.8 34.6 2.6 29.0 22 19 A D >> - 0 0 78 1,-0.2 4,-4.5 2,-0.1 3,-1.4 -0.787 52.9-171.0 -95.4 106.3 38.3 2.2 28.4 23 20 A P T 34 S+ 0 0 7 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.804 87.2 54.0 -65.7 -31.2 39.1 -1.2 26.9 24 21 A E T 34 S+ 0 0 80 1,-0.1 -2,-0.1 3,-0.0 3,-0.0 0.502 126.4 22.9 -79.8 -4.4 42.9 -0.7 27.2 25 22 A R T <4 S+ 0 0 187 -3,-1.4 -1,-0.1 2,-0.0 2,-0.1 0.597 115.6 63.8-133.0 -34.7 42.5 0.1 30.9 26 23 A D < - 0 0 31 -4,-4.5 2,-0.3 1,-0.0 -8,-0.0 -0.330 67.4-138.0 -92.3 177.2 39.2 -1.5 32.0 27 24 A R - 0 0 76 -2,-0.1 -8,-1.7 -3,-0.0 2,-0.4 -0.880 20.1-102.4-133.2 162.0 38.1 -5.1 32.2 28 25 A I E +A 18 0A 0 -2,-0.3 -10,-0.3 -10,-0.2 3,-0.1 -0.720 32.7 173.1 -80.5 133.6 35.1 -7.4 31.4 29 26 A I E + 0 0 2 -12,-3.0 22,-2.7 -2,-0.4 2,-0.3 0.420 66.0 25.8-120.4 -6.8 33.3 -8.4 34.6 30 27 A E E -AC 17 50A 4 -13,-1.5 -13,-1.5 20,-0.3 2,-0.3 -0.986 57.5-177.8-154.2 150.7 30.3 -10.1 32.9 31 28 A I E +AC 16 49A 0 18,-1.6 18,-2.1 -2,-0.3 2,-0.3 -0.995 6.8 166.8-145.9 147.3 29.5 -12.0 29.7 32 29 A A E -A 15 0A 0 -17,-1.5 -17,-2.1 -2,-0.3 2,-0.3 -0.976 10.0-166.1-158.5 147.6 26.3 -13.6 28.3 33 30 A T E -A 14 0A 0 -2,-0.3 13,-3.5 14,-0.3 2,-0.4 -0.982 4.3-170.4-138.2 150.6 25.2 -14.9 25.0 34 31 A I E -AD 13 45A 0 -21,-2.4 -21,-3.1 -2,-0.3 2,-0.5 -0.994 13.6-146.6-139.6 134.9 21.9 -15.9 23.4 35 32 A V E +AD 12 44A 0 9,-2.5 8,-2.5 -2,-0.4 9,-1.3 -0.884 22.3 170.0-103.4 128.9 21.4 -17.6 20.0 36 33 A T E -AD 11 42A 0 -25,-2.0 -25,-2.9 -2,-0.5 6,-0.2 -0.841 31.4-117.1-122.1 165.4 18.3 -16.9 17.9 37 34 A N > - 0 0 39 4,-2.0 3,-1.6 -2,-0.3 -27,-0.1 -0.303 46.9 -89.2 -83.9-176.2 17.4 -17.9 14.3 38 35 A S T 3 S+ 0 0 17 1,-0.3 -28,-0.1 2,-0.1 293,-0.1 0.801 129.5 61.4 -66.5 -26.9 17.0 -15.2 11.7 39 36 A H T 3 S- 0 0 105 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.443 118.8-113.9 -77.2 -0.3 13.3 -15.0 12.6 40 37 A L < + 0 0 0 -3,-1.6 2,-0.3 1,-0.3 -2,-0.1 0.448 65.5 150.3 80.3 1.5 14.5 -13.9 16.1 41 38 A D - 0 0 70 1,-0.1 -4,-2.0 -5,-0.0 2,-0.5 -0.521 51.4-120.8 -63.6 126.9 13.2 -17.1 17.7 42 39 A I E +D 36 0A 63 -2,-0.3 -6,-0.3 -6,-0.2 3,-0.1 -0.606 33.5 177.8 -73.8 119.0 15.4 -17.9 20.7 43 40 A L E - 0 0 45 -8,-2.5 2,-0.3 -2,-0.5 -7,-0.2 0.903 64.8 -15.6 -87.1 -49.3 16.9 -21.3 20.3 44 41 A A E -D 35 0A 18 -9,-1.3 -9,-2.5 -39,-0.1 -1,-0.3 -0.966 58.2-128.5-159.9 139.0 19.1 -21.5 23.4 45 42 A E E -D 34 0A 78 -2,-0.3 -11,-0.2 -11,-0.2 3,-0.1 -0.701 31.0-134.4 -89.2 142.1 20.5 -19.1 26.0 46 43 A G - 0 0 10 -13,-3.5 2,-0.1 -2,-0.3 46,-0.1 -0.315 34.6 -68.8 -91.3 175.5 24.2 -19.3 26.7 47 44 A P - 0 0 35 0, 0.0 2,-0.6 0, 0.0 -14,-0.3 -0.418 41.6-146.0 -64.8 134.0 26.2 -19.3 29.9 48 45 A A - 0 0 45 -16,-0.2 2,-0.5 -2,-0.1 -16,-0.2 -0.917 21.1-168.2-104.7 113.7 26.1 -16.1 32.0 49 46 A F E -C 31 0A 32 -18,-2.1 -18,-1.6 -2,-0.6 2,-0.5 -0.894 22.8-152.1-112.7 120.0 29.5 -15.6 33.7 50 47 A A E -C 30 0A 12 -2,-0.5 2,-0.6 -20,-0.2 33,-0.3 -0.748 31.5-139.9 -71.5 130.2 30.4 -13.1 36.4 51 48 A I - 0 0 0 -22,-2.7 33,-0.2 -2,-0.5 27,-0.1 -0.883 10.3-124.3-106.0 118.8 34.1 -12.7 35.7 52 49 A H + 0 0 81 31,-2.0 33,-0.2 -2,-0.6 27,-0.1 -0.295 33.2 173.9 -60.0 131.8 36.4 -12.4 38.7 53 50 A Q - 0 0 12 25,-0.1 28,-0.1 31,-0.1 2,-0.1 -0.978 37.7 -96.5-134.9 151.0 38.6 -9.4 39.0 54 51 A P >> - 0 0 71 0, 0.0 3,-2.4 0, 0.0 4,-1.5 -0.377 31.0-120.1 -67.9 144.7 41.0 -8.3 41.8 55 52 A D H 3> S+ 0 0 88 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.820 110.0 69.1 -52.7 -35.7 39.6 -5.8 44.3 56 53 A K H 34 S+ 0 0 182 1,-0.2 -1,-0.3 2,-0.2 0, 0.0 0.689 106.5 41.3 -58.3 -18.3 42.4 -3.4 43.5 57 54 A L H X4 S+ 0 0 37 -3,-2.4 3,-1.7 2,-0.1 -2,-0.2 0.868 112.8 49.4 -93.8 -50.0 40.6 -3.0 40.1 58 55 A L H >< S+ 0 0 5 -4,-1.5 3,-1.2 1,-0.3 -2,-0.2 0.807 107.3 56.9 -60.1 -31.8 37.0 -2.9 41.2 59 56 A T T 3< S+ 0 0 103 -4,-2.6 -1,-0.3 1,-0.2 -3,-0.1 0.488 97.8 63.8 -81.2 -1.5 37.8 -0.3 43.8 60 57 A A T < S+ 0 0 82 -3,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.243 78.6 112.2-103.4 10.5 39.2 2.0 41.1 61 58 A X S < S- 0 0 17 -3,-1.2 -41,-0.1 1,-0.1 -42,-0.0 -0.523 73.4-106.6 -79.8 151.3 35.8 2.3 39.3 62 59 A D > - 0 0 92 -43,-0.4 4,-2.2 -2,-0.2 3,-0.4 -0.172 37.1 -95.4 -69.8 170.3 34.0 5.7 39.3 63 60 A N H > S+ 0 0 149 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.904 122.7 57.3 -51.4 -46.4 31.0 6.4 41.4 64 61 A W H > S+ 0 0 170 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.874 111.6 39.5 -57.5 -42.9 28.6 5.5 38.5 65 62 A N H > S+ 0 0 24 -3,-0.4 4,-2.3 2,-0.2 5,-0.3 0.838 114.4 51.7 -79.4 -33.8 30.0 2.0 38.0 66 63 A T H X S+ 0 0 52 -4,-2.2 4,-1.1 2,-0.2 5,-0.2 0.842 112.3 49.6 -69.4 -32.4 30.4 1.2 41.7 67 64 A S H X S+ 0 0 73 -4,-2.4 4,-2.2 -5,-0.3 -2,-0.2 0.961 115.8 39.6 -68.0 -53.5 26.8 2.3 42.2 68 65 A H H X S+ 0 0 49 -4,-1.9 4,-2.1 -5,-0.2 6,-0.3 0.896 117.2 46.2 -67.5 -45.5 25.3 0.2 39.3 69 66 A H H < S+ 0 0 4 -4,-2.3 6,-2.6 2,-0.2 5,-0.5 0.775 115.1 47.1 -74.8 -27.5 27.4 -3.0 39.7 70 67 A T H >< S+ 0 0 77 -4,-1.1 3,-1.3 -5,-0.3 6,-0.2 0.947 114.2 47.5 -70.3 -51.6 26.9 -3.1 43.5 71 68 A A H 3< S+ 0 0 85 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.2 0.834 111.2 49.9 -59.2 -37.9 23.1 -2.5 43.2 72 69 A S T 3< S- 0 0 32 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.554 111.4-121.5 -81.3 -7.3 22.7 -5.1 40.4 73 70 A G S <> S+ 0 0 28 -3,-1.3 4,-1.6 -4,-0.2 -3,-0.2 0.420 81.4 119.0 83.0 -1.6 24.6 -7.6 42.5 74 71 A L H > + 0 0 0 -5,-0.5 4,-1.8 -6,-0.3 -4,-0.2 0.882 67.8 58.8 -62.6 -38.6 27.2 -8.1 39.8 75 72 A L H > S+ 0 0 23 -6,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.892 106.4 45.4 -61.7 -43.6 30.0 -6.9 42.1 76 73 A E H > S+ 0 0 109 -7,-0.3 4,-1.8 -6,-0.2 -1,-0.2 0.892 112.3 52.6 -67.0 -38.2 29.4 -9.6 44.8 77 74 A R H < S+ 0 0 91 -4,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.811 109.4 51.3 -63.8 -30.9 29.1 -12.2 42.1 78 75 A V H >< S+ 0 0 0 -4,-1.8 3,-1.7 2,-0.2 -2,-0.2 0.942 107.4 49.7 -72.5 -50.2 32.5 -11.0 40.7 79 76 A K H 3< S+ 0 0 73 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.886 115.9 44.8 -52.2 -41.9 34.3 -11.2 44.0 80 77 A N T 3< S+ 0 0 121 -4,-1.8 -1,-0.3 -5,-0.2 2,-0.2 0.316 91.2 117.0 -89.2 7.3 33.0 -14.8 44.5 81 78 A S < - 0 0 22 -3,-1.7 -30,-0.1 1,-0.1 -3,-0.1 -0.505 45.3-169.5 -81.1 143.8 33.7 -15.9 40.9 82 79 A S + 0 0 110 -2,-0.2 2,-0.5 -32,-0.1 -1,-0.1 0.064 62.8 96.8-111.2 20.9 36.2 -18.7 40.0 83 80 A V - 0 0 20 -33,-0.3 -31,-2.0 -5,-0.1 2,-0.2 -0.939 50.6-172.3-118.2 129.3 36.0 -17.8 36.3 84 81 A D > - 0 0 80 -2,-0.5 4,-2.4 -33,-0.2 5,-0.3 -0.536 46.0 -84.2-106.4 178.7 38.5 -15.7 34.4 85 82 A E H > S+ 0 0 34 1,-0.2 4,-2.7 -33,-0.2 5,-0.2 0.897 125.0 49.7 -46.9 -50.9 38.4 -14.3 30.8 86 83 A V H > S+ 0 0 84 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.888 111.8 45.8 -63.6 -43.5 39.8 -17.5 29.3 87 84 A E H > S+ 0 0 84 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.905 114.9 47.8 -66.8 -41.6 37.5 -20.0 31.0 88 85 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.915 113.6 48.7 -64.1 -42.1 34.4 -17.8 30.2 89 86 A E H X S+ 0 0 6 -4,-2.7 4,-3.1 -5,-0.3 -2,-0.2 0.934 112.5 47.7 -61.9 -48.1 35.6 -17.5 26.6 90 87 A T H X S+ 0 0 61 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.908 114.9 44.5 -60.6 -45.8 36.2 -21.3 26.2 91 88 A L H X S+ 0 0 76 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.891 116.0 46.9 -69.2 -39.7 32.8 -22.2 27.7 92 89 A T H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.919 113.2 50.4 -63.2 -44.5 31.0 -19.6 25.7 93 90 A L H X S+ 0 0 27 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.902 108.2 51.4 -61.1 -43.2 32.9 -20.8 22.6 94 91 A A H < S+ 0 0 34 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.812 112.6 47.9 -65.6 -29.9 32.0 -24.4 23.3 95 92 A F H >< S+ 0 0 29 -4,-1.4 3,-1.2 -5,-0.1 4,-0.2 0.922 111.6 47.3 -74.9 -46.9 28.3 -23.4 23.5 96 93 A L H >X S+ 0 0 0 -4,-2.6 3,-2.2 1,-0.3 4,-1.9 0.857 98.7 68.0 -65.3 -37.2 28.2 -21.2 20.4 97 94 A E T 3< S+ 0 0 116 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.1 0.489 94.2 61.1 -66.5 -0.3 29.9 -23.8 18.1 98 95 A K T <4 S+ 0 0 140 -3,-1.2 -92,-0.3 3,-0.1 -1,-0.3 0.559 112.8 32.5 -99.7 -11.5 26.9 -26.0 18.5 99 96 A Y T <4 S+ 0 0 43 -3,-2.2 -92,-2.5 1,-0.4 -89,-0.3 0.638 129.7 10.2-115.4 -24.4 24.4 -23.5 16.9 100 97 A V S < S- 0 0 0 -4,-1.9 -1,-0.4 -94,-0.2 -92,-0.2 -0.983 71.6-118.7-153.0 151.3 26.6 -21.7 14.3 101 98 A S > - 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0 0 39 -2,-0.3 3,-1.3 1,-0.1 4,-0.5 -0.384 51.5 -68.3 -89.8 171.0 27.9 21.1 18.3 287 99 B A T 3 S+ 0 0 63 1,-0.2 28,-0.2 2,-0.1 27,-0.2 -0.259 112.4 5.1 -63.5 136.1 30.1 18.6 20.1 288 100 B G T 3 S+ 0 0 30 26,-3.3 -1,-0.2 2,-0.1 29,-0.2 0.594 100.5 105.7 72.6 12.9 28.8 15.2 21.2 289 101 B K < + 0 0 95 -3,-1.3 -2,-0.1 25,-0.5 26,-0.1 0.890 66.1 56.0 -91.3 -44.9 25.4 15.8 19.5 290 102 B S S S- 0 0 1 -4,-0.5 26,-3.7 24,-0.4 -2,-0.1 -0.691 76.9-127.3 -96.0 142.1 25.5 13.6 16.4 291 103 B P - 0 0 6 0, 0.0 -94,-0.7 0, 0.0 2,-0.6 -0.420 41.2 -90.4 -74.1 160.1 26.1 9.8 16.3 292 104 B L E -hk 197 319C 0 26,-1.9 28,-3.2 24,-0.3 2,-0.4 -0.645 51.6-160.6 -72.7 118.1 28.8 8.4 14.0 293 105 B C E +hk 198 320C 0 -96,-2.1 -94,-2.1 -2,-0.6 2,-0.3 -0.882 38.1 68.5-111.2 134.8 27.0 7.8 10.7 294 106 B G E S- k 0 321C 3 26,-2.1 28,-2.5 -2,-0.4 2,-0.5 -0.983 82.7 -44.2 162.9-155.1 28.1 5.5 7.9 295 107 B N S S- 0 0 26 -2,-0.3 26,-0.1 26,-0.2 60,-0.1 -0.956 112.7 -16.4-112.3 125.4 28.7 1.8 7.1 296 108 B S S > S+ 0 0 22 -2,-0.5 3,-0.6 1,-0.1 4,-0.4 0.934 78.7 170.1 49.7 58.5 30.4 -0.5 9.6 297 109 B V T 3> + 0 0 1 1,-0.2 4,-2.9 -3,-0.2 5,-0.2 0.435 51.3 87.9 -87.6 -1.7 31.7 2.5 11.5 298 110 B a H 3> S+ 0 0 9 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.932 89.7 53.2 -58.5 -44.6 33.0 0.7 14.6 299 111 B Q H <> S+ 0 0 21 -3,-0.6 4,-1.2 1,-0.2 -1,-0.2 0.872 111.0 46.6 -56.5 -39.9 36.3 0.2 12.8 300 112 B D H > S+ 0 0 6 -4,-0.4 4,-3.3 2,-0.2 3,-0.3 0.907 109.0 54.2 -68.2 -44.4 36.4 3.9 12.1 301 113 B R H X S+ 0 0 17 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.827 107.9 51.7 -57.6 -33.9 35.5 4.7 15.7 302 114 B R H X S+ 0 0 18 -4,-2.1 4,-0.9 2,-0.2 -1,-0.2 0.790 112.9 43.0 -78.7 -29.6 38.5 2.5 16.8 303 115 B F H X>S+ 0 0 0 -4,-1.2 4,-2.8 -3,-0.3 5,-0.6 0.888 114.2 51.0 -78.7 -42.4 40.9 4.4 14.5 304 116 B L H X5S+ 0 0 0 -4,-3.3 4,-2.4 1,-0.2 8,-0.3 0.930 108.1 53.4 -57.2 -46.9 39.5 7.8 15.5 305 117 B S H <5S+ 0 0 38 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.870 117.3 37.2 -55.8 -39.1 39.8 6.9 19.1 306 118 B R H <5S+ 0 0 62 -4,-0.9 -2,-0.2 2,-0.1 -1,-0.2 0.815 133.9 19.4 -86.8 -32.1 43.5 6.1 18.6 307 119 B Y H <5S+ 0 0 52 -4,-2.8 -3,-0.2 1,-0.1 -2,-0.2 0.663 131.3 34.7-115.7 -23.2 44.6 8.7 16.1 308 120 B X X< + 0 0 0 -4,-2.4 4,-2.7 -5,-0.6 5,-0.2 -0.519 60.1 162.0-135.1 69.0 42.0 11.5 16.3 309 121 B P H > S+ 0 0 70 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.811 76.1 52.4 -56.0 -39.0 40.8 11.8 20.0 310 122 B R H > S+ 0 0 111 2,-0.2 4,-1.0 1,-0.2 -2,-0.1 0.937 113.8 40.8 -67.1 -49.3 39.3 15.3 19.5 311 123 B L H > S+ 0 0 0 2,-0.2 4,-0.7 1,-0.2 3,-0.5 0.913 114.2 55.1 -63.4 -42.9 37.2 14.4 16.5 312 124 B N H >< S+ 0 0 18 -4,-2.7 3,-1.3 -8,-0.3 -2,-0.2 0.937 108.7 46.8 -53.8 -49.3 36.3 11.1 18.1 313 125 B Q H 3< S+ 0 0 149 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.723 99.1 72.3 -65.8 -21.3 35.0 12.9 21.2 314 126 B F H 3< S+ 0 0 15 -4,-1.0 -26,-3.3 -3,-0.5 -25,-0.5 0.727 88.9 75.5 -68.4 -22.4 33.1 15.3 18.9 315 127 B F S << S- 0 0 8 -3,-1.3 -28,-0.1 -4,-0.7 -23,-0.0 -0.594 91.7-105.0 -89.1 151.1 30.6 12.5 18.1 316 128 B H - 0 0 70 -26,-3.7 -24,-0.3 -2,-0.2 -27,-0.1 -0.267 39.2-107.1 -59.7 160.6 27.8 11.2 20.4 317 129 B Y S S+ 0 0 111 -29,-0.2 -1,-0.1 -26,-0.1 -2,-0.1 0.810 95.8 79.4 -61.2 -30.8 28.6 7.8 21.9 318 130 B R - 0 0 81 1,-0.1 -26,-1.9 -180,-0.0 2,-0.3 -0.080 69.3-135.9 -82.6 175.8 26.1 6.1 19.6 319 131 B H E -k 292 0C 17 -28,-0.2 2,-0.6 2,-0.1 -26,-0.2 -0.963 9.4-154.2-132.3 146.5 26.3 5.0 16.0 320 132 B L E -k 293 0C 0 -28,-3.2 -26,-2.1 -2,-0.3 2,-0.6 -0.911 28.1-179.7-117.3 98.9 24.0 5.1 12.9 321 133 B D E >> -k 294 0C 11 -2,-0.6 3,-1.0 -28,-0.2 4,-0.6 -0.898 23.5-165.6-109.9 114.1 25.2 2.2 10.9 322 134 B V H >> S+ 0 0 0 -28,-2.5 4,-1.9 -2,-0.6 3,-0.6 0.782 85.8 73.8 -65.7 -27.7 23.5 1.5 7.5 323 135 B T H 3> S+ 0 0 2 -29,-0.4 4,-2.6 1,-0.3 -1,-0.2 0.851 88.9 60.6 -55.8 -35.1 25.0 -2.0 7.5 324 136 B T H <> S+ 0 0 1 -3,-1.0 4,-2.0 1,-0.2 -1,-0.3 0.912 105.2 46.8 -57.8 -44.6 22.5 -3.0 10.2 325 137 B L H X + 0 0 1 -4,-1.6 3,-2.0 -5,-0.4 4,-1.7 -0.306 61.3 169.3-154.0 61.3 13.7 -9.1 2.4 334 146 B P H 3> S+ 0 0 74 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.788 79.2 59.0 -50.5 -35.4 16.5 -10.3 0.1 335 147 B Q H 34 S+ 0 0 136 2,-0.2 4,-0.3 1,-0.2 -5,-0.1 0.809 107.0 48.2 -65.2 -30.3 14.8 -8.9 -3.0 336 148 B I H X4 S+ 0 0 23 -3,-2.0 3,-1.0 -7,-0.3 4,-0.3 0.936 113.7 45.2 -72.5 -49.9 14.9 -5.4 -1.4 337 149 B A H >< S+ 0 0 14 -4,-1.7 3,-1.6 -8,-0.5 -2,-0.2 0.901 110.0 55.8 -57.9 -43.1 18.6 -5.7 -0.5 338 150 B A T 3< S+ 0 0 67 -4,-2.8 3,-0.3 1,-0.3 -1,-0.2 0.615 95.5 67.3 -69.4 -12.4 19.4 -7.1 -3.9 339 151 B A T < S+ 0 0 66 -3,-1.0 2,-0.3 -4,-0.3 -1,-0.3 0.535 98.2 54.1 -87.1 -6.3 17.9 -4.0 -5.6 340 152 B H S < S+ 0 0 45 -3,-1.6 2,-0.5 -4,-0.3 -1,-0.2 -0.686 71.8 179.9-127.8 79.8 20.6 -1.7 -4.3 341 153 B I - 0 0 146 -2,-0.3 2,-0.4 -3,-0.3 -3,-0.1 -0.681 14.5-151.0 -83.4 125.0 24.0 -3.2 -5.2 342 154 B K - 0 0 64 -2,-0.5 2,-0.5 2,-0.0 -2,-0.0 -0.809 10.7-166.4 -98.7 135.6 26.9 -1.1 -4.0 343 155 B E - 0 0 165 -2,-0.4 2,-0.2 2,-0.0 -2,-0.0 -0.850 19.4-149.3-119.6 94.9 30.2 -0.9 -5.8 344 156 B S - 0 0 47 -2,-0.5 7,-0.0 1,-0.1 -2,-0.0 -0.417 17.0-165.0 -72.9 129.9 32.7 0.7 -3.5 345 157 B Q - 0 0 118 -2,-0.2 -1,-0.1 2,-0.2 3,-0.1 0.469 40.1-124.9 -86.2 -3.5 35.5 2.7 -4.9 346 158 B H S S+ 0 0 49 1,-0.2 2,-0.4 2,-0.1 -89,-0.1 0.848 71.3 126.3 58.1 36.3 37.3 2.6 -1.6 347 159 B L > - 0 0 19 1,-0.1 4,-2.8 -88,-0.0 -1,-0.2 -0.994 63.2-132.0-122.2 133.5 37.5 6.4 -1.5 348 160 B A H > S+ 0 0 0 -2,-0.4 4,-2.7 1,-0.2 5,-0.2 0.896 102.1 44.4 -53.3 -56.5 36.2 8.1 1.6 349 161 B L H > S+ 0 0 27 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.858 116.5 48.1 -60.7 -37.8 34.0 10.9 -0.1 350 162 B Q H > S+ 0 0 54 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.914 111.9 49.4 -66.6 -43.9 32.6 8.4 -2.5 351 163 B D H X S+ 0 0 16 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.886 108.3 52.4 -66.5 -39.9 31.8 5.8 0.2 352 164 B I H X S+ 0 0 3 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.903 108.3 51.7 -60.8 -41.5 30.1 8.4 2.4 353 165 B R H X S+ 0 0 91 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.855 110.5 48.9 -62.3 -35.3 27.9 9.4 -0.6 354 166 B D H X S+ 0 0 34 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.893 106.9 55.7 -70.7 -40.9 27.0 5.7 -1.0 355 167 B S H X S+ 0 0 5 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.900 110.0 45.4 -58.4 -44.2 26.2 5.3 2.7 356 168 B I H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.962 112.9 49.5 -63.4 -52.3 23.7 8.1 2.5 357 169 B E H X S+ 0 0 96 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.836 109.7 53.6 -55.6 -35.4 22.1 6.9 -0.7 358 170 B E H X S+ 0 0 2 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.921 109.6 46.3 -66.9 -43.3 21.9 3.4 0.9 359 171 B L H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.912 110.0 53.7 -66.0 -42.4 20.0 4.8 3.9 360 172 B R H X S+ 0 0 80 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.882 108.3 52.9 -56.0 -38.7 17.7 6.8 1.7 361 173 B Y H X S+ 0 0 35 -4,-1.6 4,-2.1 -5,-0.2 5,-0.2 0.923 109.3 45.3 -65.8 -47.5 16.9 3.6 -0.1 362 174 B Y H X>S+ 0 0 2 -4,-2.0 4,-2.9 1,-0.2 5,-1.8 0.844 106.6 61.4 -66.0 -33.9 16.0 1.5 2.9 363 175 B R H <5S+ 0 0 38 -4,-2.2 6,-0.5 3,-0.2 -1,-0.2 0.892 113.8 35.1 -58.3 -40.7 13.8 4.4 4.2 364 176 B A H <5S+ 0 0 62 -4,-1.3 -2,-0.2 -3,-0.2 -1,-0.2 0.829 132.5 26.6 -82.3 -34.6 11.6 4.2 1.2 365 177 B H H <5S+ 0 0 95 -4,-2.1 -3,-0.2 -5,-0.1 -2,-0.2 0.539 131.3 28.8-113.3 -10.9 11.7 0.4 0.6 366 178 B L T <5S+ 0 0 0 -4,-2.9 -183,-3.9 -5,-0.2 2,-0.2 0.602 102.7 79.3-122.0 -23.5 12.3 -1.2 4.0 367 179 B L B