==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 20-DEC-10 3Q2J . COMPND 2 MOLECULE: AMINOGLYCOSIDE 3'-PHOSPHOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR D.H.FONG,B.XIONG,J.HWANG,A.M.BERGHUIS . 524 2 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24230.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 360 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 15.5 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 . 6 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 32 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 31.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 1 1 0 0 4 3 1 2 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 2 1 5 0 6 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 4 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 4 A M 0 0 56 0, 0.0 2,-1.1 0, 0.0 418,-0.1 0.000 360.0 360.0 360.0 -32.4 6.3 9.5 62.5 2 5 A R + 0 0 12 78,-0.0 2,-0.3 80,-0.0 80,-0.2 -0.158 360.0 64.6 81.8 -41.9 8.4 7.8 65.2 3 6 A I S S- 0 0 0 -2,-1.1 75,-0.0 1,-0.0 80,-0.0 -0.847 90.8-109.3-108.6 153.3 9.4 11.0 66.9 4 7 A S > - 0 0 11 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.340 27.2-109.3 -77.4 159.7 6.9 13.3 68.7 5 8 A P H > S+ 0 0 103 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.901 121.2 54.7 -50.1 -42.3 5.9 16.7 67.4 6 9 A E H > S+ 0 0 126 1,-0.2 4,-1.4 2,-0.2 -3,-0.0 0.920 109.6 44.3 -58.0 -48.4 7.9 18.2 70.3 7 10 A L H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.892 110.6 54.3 -69.1 -41.4 11.1 16.3 69.5 8 11 A K H X S+ 0 0 29 -4,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.910 107.5 51.6 -54.7 -42.9 10.8 17.1 65.8 9 12 A K H < S+ 0 0 160 -4,-2.0 3,-0.5 -5,-0.2 4,-0.3 0.856 108.3 53.2 -64.7 -32.6 10.6 20.8 66.7 10 13 A L H < S+ 0 0 87 -4,-1.4 3,-0.3 1,-0.2 -1,-0.2 0.857 115.3 37.4 -68.7 -37.5 13.7 20.5 68.8 11 14 A I H >< S+ 0 0 5 -4,-1.7 3,-1.4 1,-0.2 -1,-0.2 0.341 87.1 103.4-101.5 5.8 15.9 19.0 66.1 12 15 A E T 3< S+ 0 0 52 -4,-0.6 410,-0.8 -3,-0.5 411,-0.2 0.856 76.4 51.8 -57.7 -45.7 14.5 21.0 63.1 13 16 A K T 3 S+ 0 0 146 -4,-0.3 2,-0.3 -3,-0.3 -1,-0.3 0.281 96.7 89.1 -83.0 12.0 17.3 23.5 62.7 14 17 A Y S < S- 0 0 54 -3,-1.4 2,-0.8 19,-0.1 19,-0.2 -0.806 82.7-119.2-107.7 149.7 19.9 20.7 62.5 15 18 A R E -A 32 0A 156 17,-3.2 17,-2.8 -2,-0.3 2,-0.4 -0.817 33.0-138.2 -89.5 114.4 21.0 18.8 59.4 16 19 A a E +A 31 0A 27 -2,-0.8 2,-0.4 15,-0.2 15,-0.2 -0.578 24.1 179.1 -79.5 127.2 20.0 15.2 59.9 17 20 A V E -A 30 0A 51 13,-3.2 13,-2.8 -2,-0.4 2,-0.3 -0.965 27.4-128.5-127.0 117.6 22.5 12.5 58.9 18 21 A K E -A 29 0A 64 -2,-0.4 11,-0.2 11,-0.2 398,-0.0 -0.456 27.4-130.5 -61.1 122.9 21.9 8.8 59.3 19 22 A D - 0 0 57 9,-2.5 2,-0.4 -2,-0.3 9,-0.1 -0.229 34.1 -92.7 -61.5 166.0 24.8 7.2 61.1 20 23 A T - 0 0 110 1,-0.1 -1,-0.1 2,-0.0 9,-0.1 0.143 58.6-101.0 -74.7 24.1 26.2 4.0 59.5 21 24 A E S > S+ 0 0 37 -2,-0.4 3,-1.2 7,-0.3 -1,-0.1 0.839 74.7 148.9 56.3 34.0 24.0 1.8 61.6 22 25 A G T 3 S+ 0 0 60 1,-0.2 -1,-0.1 6,-0.1 5,-0.1 0.765 70.2 47.4 -65.5 -26.5 27.0 1.1 63.9 23 26 A M T > S- 0 0 49 3,-0.2 3,-2.4 2,-0.1 -1,-0.2 0.111 95.4-171.3-105.9 21.1 24.7 0.7 66.9 24 27 A S T < + 0 0 61 -3,-1.2 3,-0.1 1,-0.4 19,-0.1 -0.260 69.9 38.5 -49.2 136.1 22.2 -1.6 65.3 25 28 A P T 3 S+ 0 0 27 0, 0.0 -1,-0.4 0, 0.0 19,-0.3 -0.989 115.3 70.1 -75.7 -9.3 19.6 -2.5 66.4 26 29 A A S < S- 0 0 7 -3,-2.4 2,-0.5 17,-0.1 -3,-0.2 -0.464 81.2-133.7 -67.4 142.2 19.5 1.1 67.6 27 30 A K E - B 0 42A 52 15,-3.0 15,-2.8 -2,-0.1 2,-0.4 -0.886 23.8-164.8 -94.7 128.3 19.0 3.7 64.9 28 31 A V E - B 0 41A 6 -2,-0.5 -9,-2.5 13,-0.2 2,-0.5 -0.953 7.2-171.1-118.8 130.1 21.5 6.6 65.3 29 32 A Y E -AB 18 40A 4 11,-3.1 11,-2.6 -2,-0.4 2,-0.4 -0.980 16.2-142.9-123.8 125.3 21.2 10.0 63.6 30 33 A K E -AB 17 39A 54 -13,-2.8 -13,-3.2 -2,-0.5 2,-0.7 -0.699 14.0-156.7 -78.4 130.6 23.9 12.7 63.7 31 34 A L E -AB 16 38A 1 7,-3.1 7,-2.2 -2,-0.4 2,-0.7 -0.891 6.3-156.2-115.6 98.5 22.3 16.1 63.9 32 35 A V E +AB 15 37A 35 -17,-2.8 -17,-3.2 -2,-0.7 5,-0.2 -0.654 19.8 174.0 -80.8 114.0 24.7 18.7 62.5 33 36 A G - 0 0 18 3,-2.2 -19,-0.1 -2,-0.7 -1,-0.0 -0.448 43.7-103.9-105.0-176.2 24.0 22.2 63.9 34 37 A E S S+ 0 0 185 -21,-0.2 3,-0.1 -2,-0.2 -1,-0.1 0.910 118.0 23.5 -73.6 -43.9 25.8 25.5 63.6 35 38 A N S S- 0 0 134 1,-0.2 2,-0.3 -3,-0.0 -1,-0.1 0.560 131.3 -9.7-104.6 -10.2 27.4 25.5 67.1 36 39 A E - 0 0 88 -5,-0.1 -3,-2.2 2,-0.0 2,-0.4 -0.982 63.0-100.6-168.1 177.8 27.4 21.7 67.8 37 40 A N E -B 32 0A 34 -2,-0.3 52,-0.8 -5,-0.2 2,-0.3 -0.907 27.4-166.5-110.1 141.1 26.4 18.2 67.0 38 41 A L E -BC 31 88A 11 -7,-2.2 -7,-3.1 -2,-0.4 2,-0.4 -0.887 10.6-142.8-117.6 158.1 23.6 16.3 68.7 39 42 A Y E -BC 30 87A 52 48,-2.6 48,-2.7 -2,-0.3 2,-0.5 -0.990 6.0-161.9-121.8 129.9 22.9 12.6 68.5 40 43 A L E -BC 29 86A 0 -11,-2.6 -11,-3.1 -2,-0.4 2,-0.4 -0.950 11.5-172.7-105.7 126.0 19.4 11.1 68.3 41 44 A K E -BC 28 85A 9 44,-2.7 44,-2.7 -2,-0.5 2,-0.4 -0.981 4.4-175.4-125.5 128.6 19.4 7.4 69.2 42 45 A M E -BC 27 84A 0 -15,-2.8 -15,-3.0 -2,-0.4 2,-0.4 -0.965 10.8-174.0-131.7 138.8 16.2 5.3 68.8 43 46 A T E - C 0 83A 1 40,-1.9 40,-2.7 -2,-0.4 -17,-0.1 -0.999 23.3-125.5-133.9 139.9 15.1 1.7 69.6 44 47 A D > - 0 0 24 -2,-0.4 3,-2.0 -19,-0.3 4,-0.2 -0.237 32.3 -97.5 -83.7 169.2 11.9 -0.0 68.7 45 48 A S G > S+ 0 0 67 1,-0.3 3,-1.1 2,-0.2 -1,-0.1 0.655 113.4 74.0 -64.1 -17.4 9.4 -1.8 71.0 46 49 A R G 3 S+ 0 0 79 1,-0.2 -1,-0.3 3,-0.0 7,-0.1 0.807 101.7 46.2 -63.8 -22.5 10.8 -5.3 70.3 47 50 A Y G X S+ 0 0 17 -3,-2.0 3,-2.6 5,-0.1 6,-0.5 0.371 80.7 141.9-100.7 1.5 13.8 -4.2 72.5 48 51 A K T < S+ 0 0 99 -3,-1.1 3,-0.1 1,-0.3 -3,-0.0 -0.141 76.8 3.6 -46.1 127.7 11.7 -2.7 75.3 49 52 A G T 3 S+ 0 0 46 1,-0.2 -1,-0.3 2,-0.0 2,-0.2 0.553 105.2 112.7 69.2 7.5 13.3 -3.4 78.7 50 53 A T S X S- 0 0 6 -3,-2.6 3,-1.6 1,-0.0 6,-0.2 -0.572 89.0 -96.1 -97.4 174.8 16.4 -5.2 77.3 51 54 A T T 3 S+ 0 0 4 1,-0.3 158,-0.1 -2,-0.2 -3,-0.1 0.432 125.0 61.8 -70.6 3.9 19.9 -3.9 77.5 52 55 A Y T 3 S+ 0 0 30 -5,-0.4 2,-0.4 156,-0.1 -1,-0.3 0.599 75.8 107.7 -95.1 -19.8 19.3 -2.5 73.9 53 56 A D X> - 0 0 4 -3,-1.6 3,-1.4 -6,-0.5 4,-1.3 -0.454 63.1-150.1 -64.7 115.1 16.5 -0.2 75.1 54 57 A V H 3> S+ 0 0 0 -2,-0.4 4,-2.7 1,-0.3 -1,-0.2 0.698 95.2 70.1 -62.3 -17.0 17.8 3.4 75.0 55 58 A E H 3> S+ 0 0 49 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.931 100.7 48.9 -60.2 -37.7 15.5 4.3 77.8 56 59 A R H <> S+ 0 0 24 -3,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.927 109.1 50.2 -67.3 -44.5 17.8 2.1 79.8 57 60 A E H X S+ 0 0 3 -4,-1.3 4,-2.3 1,-0.2 -1,-0.2 0.883 108.4 54.0 -58.8 -39.5 20.8 3.9 78.4 58 61 A K H X S+ 0 0 33 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.924 106.7 51.6 -61.3 -45.3 19.1 7.3 79.4 59 62 A D H X S+ 0 0 36 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.873 111.7 46.3 -58.9 -42.4 18.7 6.1 83.0 60 63 A M H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.884 109.2 54.7 -71.6 -36.7 22.3 5.2 83.3 61 64 A M H X S+ 0 0 2 -4,-2.3 4,-0.8 2,-0.2 -2,-0.2 0.936 110.4 46.0 -62.1 -44.4 23.5 8.4 81.7 62 65 A L H >< S+ 0 0 85 -4,-2.3 3,-0.8 1,-0.2 -1,-0.2 0.922 114.6 47.5 -61.0 -44.0 21.5 10.4 84.3 63 66 A W H 3< S+ 0 0 31 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.843 110.2 53.4 -68.1 -30.8 22.8 8.3 87.1 64 67 A L H >X S+ 0 0 0 -4,-2.3 3,-2.9 -5,-0.1 4,-2.4 0.589 76.7 119.1 -83.0 -11.9 26.4 8.6 85.8 65 68 A E T << S+ 0 0 123 -4,-0.8 -3,-0.0 -3,-0.8 7,-0.0 -0.357 87.2 13.9 -53.7 123.4 26.3 12.4 85.7 66 69 A G T 34 S+ 0 0 85 2,-0.4 -1,-0.3 4,-0.1 -2,-0.1 0.350 124.4 64.1 89.5 -8.8 29.1 13.4 88.1 67 70 A K T <4 S+ 0 0 81 -3,-2.9 -2,-0.2 1,-0.5 -3,-0.1 0.716 111.4 12.6-112.7 -40.8 30.6 9.9 88.3 68 71 A L S < S- 0 0 9 -4,-2.4 2,-0.6 -7,-0.1 -1,-0.5 -0.980 85.2 -99.4-135.2 152.1 31.8 9.3 84.7 69 72 A P + 0 0 46 0, 0.0 134,-1.6 0, 0.0 -4,-0.1 -0.593 60.8 152.1 -68.7 112.8 32.2 11.6 81.7 70 73 A V - 0 0 36 -2,-0.6 134,-0.1 132,-0.2 -4,-0.1 -0.935 48.6 -87.8-139.2 161.2 29.1 11.0 79.6 71 74 A P - 0 0 5 0, 0.0 2,-0.3 0, 0.0 19,-0.1 -0.301 50.0-103.9 -65.7 158.1 27.0 12.9 77.1 72 75 A K - 0 0 126 17,-0.1 16,-2.0 1,-0.0 2,-0.5 -0.647 26.4-121.4 -84.5 136.3 24.2 15.1 78.5 73 76 A V E +D 87 0A 31 -2,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.699 35.6 171.8 -74.0 121.3 20.6 13.8 78.2 74 77 A L E - 0 0 66 12,-2.8 2,-0.3 -2,-0.5 13,-0.2 0.787 63.2 -6.0-102.1 -38.6 18.7 16.5 76.2 75 78 A H E -D 86 0A 23 11,-1.6 11,-3.0 2,-0.0 -1,-0.4 -0.962 58.1-175.1-155.6 140.1 15.4 14.9 75.6 76 79 A F E +D 85 0A 48 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.992 14.4 156.3-136.9 140.6 13.9 11.5 76.2 77 80 A E E -D 84 0A 22 7,-1.9 7,-3.2 -2,-0.3 2,-0.5 -0.996 38.5-133.6-152.6 150.7 10.5 10.1 75.2 78 81 A R E +D 83 0A 94 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.939 38.9 172.5 -92.7 129.0 8.5 6.9 74.5 79 82 A H E > -D 82 0A 61 3,-2.9 3,-2.8 -2,-0.5 -2,-0.1 -0.952 60.4 -23.7-145.3 125.3 6.6 7.6 71.3 80 83 A D T 3 S- 0 0 119 -2,-0.3 -35,-0.2 1,-0.3 3,-0.1 0.863 128.4 -47.0 42.9 47.7 4.5 5.1 69.2 81 84 A G T 3 S+ 0 0 27 1,-0.3 -1,-0.3 -37,-0.1 2,-0.3 0.196 116.7 115.4 85.7 -17.6 6.5 2.2 70.6 82 85 A W E < - D 0 79A 9 -3,-2.8 -3,-2.9 -80,-0.2 2,-0.6 -0.623 59.0-143.1 -86.4 142.8 9.9 3.9 70.1 83 86 A S E -CD 43 78A 2 -40,-2.7 -40,-1.9 -2,-0.3 2,-0.5 -0.948 24.7-165.9 -98.2 121.8 12.3 4.9 72.8 84 87 A N E -CD 42 77A 0 -7,-3.2 -7,-1.9 -2,-0.6 2,-0.5 -0.932 11.0-178.2-118.6 116.5 13.9 8.2 71.7 85 88 A L E -CD 41 76A 0 -44,-2.7 -44,-2.7 -2,-0.5 2,-0.5 -0.950 6.5-168.4-116.9 119.4 17.0 9.7 73.3 86 89 A L E +CD 40 75A 4 -11,-3.0 -12,-2.8 -2,-0.5 -11,-1.6 -0.906 22.3 169.0-101.0 129.2 18.5 13.0 72.2 87 90 A M E -CD 39 73A 11 -48,-2.7 -48,-2.6 -2,-0.5 -14,-0.2 -0.943 34.4-102.5-140.3 161.2 21.9 13.7 73.6 88 91 A S E -C 38 0A 34 -16,-2.0 2,-0.3 -2,-0.3 -50,-0.2 -0.246 48.9 -92.1 -73.4 168.7 24.9 16.0 73.4 89 92 A E - 0 0 75 -52,-0.8 -17,-0.1 1,-0.1 -1,-0.1 -0.639 45.3-106.4 -81.1 139.0 28.1 14.9 71.6 90 93 A A - 0 0 11 -2,-0.3 2,-0.3 -19,-0.1 112,-0.1 -0.250 36.5-111.5 -56.2 152.6 30.8 13.3 73.8 91 94 A D S S+ 0 0 109 110,-0.4 2,-0.1 103,-0.1 110,-0.1 -0.652 75.5 15.8 -86.6 147.2 33.9 15.4 74.6 92 95 A G S S- 0 0 29 -2,-0.3 2,-0.4 102,-0.1 104,-0.2 -0.463 99.2 -44.7 94.1-164.3 37.3 14.6 73.2 93 96 A V E -E 195 0B 60 102,-2.7 102,-2.8 -2,-0.1 108,-0.2 -0.902 57.2-105.9-111.7 136.1 38.4 12.3 70.3 94 97 A L E >> -E 194 0B 31 -2,-0.4 4,-2.5 100,-0.2 3,-0.8 -0.320 29.1-128.3 -55.1 130.5 37.0 8.8 69.7 95 98 A C H 3> S+ 0 0 1 98,-2.8 4,-2.0 1,-0.3 96,-0.2 0.903 106.5 56.6 -48.6 -54.6 39.6 6.2 70.7 96 99 A S H 34 S+ 0 0 46 94,-2.3 -1,-0.3 97,-0.2 95,-0.1 0.860 115.1 41.6 -49.7 -34.6 39.5 4.2 67.5 97 100 A E H X4 S+ 0 0 101 -3,-0.8 3,-1.5 93,-0.2 4,-0.4 0.904 108.3 57.0 -78.9 -44.8 40.4 7.5 65.7 98 101 A E H 3< S+ 0 0 80 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.802 121.5 29.3 -58.1 -30.9 43.0 8.8 68.2 99 102 A Y T 3< S+ 0 0 38 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.080 85.4 116.8-118.9 22.1 45.1 5.7 67.7 100 103 A E S < S+ 0 0 150 -3,-1.5 -2,-0.1 1,-0.2 -1,-0.1 0.931 96.9 17.1 -53.6 -53.2 44.0 4.9 64.1 101 104 A D S S+ 0 0 135 -4,-0.4 2,-1.0 -3,-0.1 -1,-0.2 0.609 103.5 104.9 -96.0 -17.4 47.6 5.4 62.8 102 105 A E - 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K 0 347D 1 40,-1.8 40,-2.6 -2,-0.4 -17,-0.1 -0.987 25.2-123.2-133.3 143.7 15.5 -10.9 54.8 308 47 B D > - 0 0 20 -2,-0.3 3,-1.7 -19,-0.3 38,-0.2 -0.239 31.9 -95.5 -88.0 174.1 13.1 -11.7 57.7 309 48 B S G > S+ 0 0 72 1,-0.3 3,-1.2 35,-0.2 -1,-0.1 0.649 112.7 73.1 -67.6 -17.1 9.4 -12.6 57.6 310 49 B R G 3 S+ 0 0 83 1,-0.2 -1,-0.3 3,-0.0 7,-0.1 0.831 100.3 49.0 -63.9 -24.8 8.1 -9.0 58.1 311 50 B Y G X S+ 0 0 20 -3,-1.7 3,-2.0 5,-0.1 6,-0.6 0.360 78.3 133.7-101.0 4.7 9.1 -8.3 54.6 312 51 B K T < S+ 0 0 96 -3,-1.2 3,-0.1 1,-0.3 -4,-0.0 -0.254 74.9 16.7 -56.2 136.9 7.6 -11.3 52.8 313 52 B G T 3 S+ 0 0 43 1,-0.3 -1,-0.3 2,-0.0 2,-0.2 0.311 106.0 105.6 84.8 -10.1 5.7 -10.4 49.7 314 53 B T S X S- 0 0 5 -3,-2.0 3,-1.4 1,-0.1 -1,-0.3 -0.488 89.7-102.5 -99.6 172.0 7.4 -7.0 49.4 315 54 B T T 3 S+ 0 0 4 1,-0.3 158,-0.1 -2,-0.2 -3,-0.1 0.406 120.3 63.2 -72.8 2.8 10.1 -5.7 47.1 316 55 B Y T 3 S+ 0 0 27 -5,-0.4 2,-0.4 156,-0.1 -1,-0.3 0.606 76.6 102.9 -92.2 -20.6 12.5 -6.2 50.1 317 56 B D X> - 0 0 3 -3,-1.4 4,-1.2 -6,-0.6 3,-1.1 -0.515 68.5-144.6 -69.8 120.6 12.0 -10.0 50.3 318 57 B V H 3> S+ 0 0 0 -2,-0.4 4,-2.7 1,-0.3 -1,-0.2 0.656 95.3 72.1 -62.3 -14.0 15.0 -11.7 48.7 319 58 B E H 3> S+ 0 0 47 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.957 99.4 46.8 -61.7 -44.1 12.7 -14.4 47.4 320 59 B R H <> S+ 0 0 30 -3,-1.1 4,-2.3 -6,-0.3 -2,-0.2 0.894 111.3 51.5 -62.6 -40.6 11.4 -11.8 44.9 321 60 B E H X S+ 0 0 4 -4,-1.2 4,-2.3 1,-0.2 -1,-0.2 0.906 109.1 50.8 -62.8 -40.7 15.0 -10.9 44.1 322 61 B K H X S+ 0 0 28 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.932 108.5 51.7 -61.2 -47.3 15.9 -14.5 43.5 323 62 B D H X S+ 0 0 40 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.928 111.8 46.6 -54.3 -48.2 12.9 -14.9 41.1 324 63 B M H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.886 110.6 53.1 -64.2 -37.0 14.1 -11.9 39.1 325 64 B M H X S+ 0 0 2 -4,-2.3 4,-0.9 2,-0.2 -2,-0.2 0.910 109.3 48.0 -66.4 -40.8 17.7 -13.1 39.1 326 65 B L H >< S+ 0 0 85 -4,-2.6 3,-0.5 1,-0.2 -1,-0.2 0.915 114.1 48.0 -61.3 -43.9 16.6 -16.5 37.7 327 66 B W H 3< S+ 0 0 21 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.837 110.0 52.4 -65.7 -34.3 14.5 -14.7 35.1 328 67 B L H >X S+ 0 0 0 -4,-2.3 3,-3.1 -5,-0.2 4,-2.1 0.627 75.8 119.8 -80.4 -14.4 17.3 -12.3 34.1 329 68 B E T << S+ 0 0 103 -4,-0.9 7,-0.0 -3,-0.5 -3,-0.0 -0.328 88.6 11.3 -53.6 120.9 19.9 -15.0 33.5 330 69 B G T 34 S+ 0 0 81 2,-0.5 -1,-0.3 4,-0.1 -2,-0.1 0.304 124.0 67.5 93.3 -9.9 20.9 -14.6 29.8 331 70 B K T <4 S+ 0 0 85 -3,-3.1 -2,-0.2 1,-0.4 -3,-0.1 0.781 110.9 10.8-109.0 -45.6 19.1 -11.2 29.5 332 71 B L S < S- 0 0 8 -4,-2.1 2,-0.9 135,-0.0 -2,-0.5 -0.963 86.0 -99.8-129.9 151.4 21.2 -9.0 31.8 333 72 B P + 0 0 51 0, 0.0 134,-1.3 0, 0.0 -4,-0.1 -0.619 65.2 144.9 -70.6 108.9 24.6 -9.6 33.5 334 73 B V - 0 0 30 -2,-0.9 134,-0.1 132,-0.2 -4,-0.1 -0.905 52.6 -79.2-138.2 165.9 23.6 -10.6 37.1 335 74 B P - 0 0 7 0, 0.0 2,-0.3 0, 0.0 18,-0.1 -0.187 48.0-109.7 -64.4 160.8 24.8 -12.9 39.8 336 75 B K - 0 0 85 17,-0.1 16,-1.8 -7,-0.0 2,-0.8 -0.709 24.7-121.3 -91.1 140.1 24.0 -16.6 39.6 337 76 B V E +L 351 0D 21 -2,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.760 34.1 173.5 -82.8 110.7 21.5 -18.1 42.1 338 77 B L E - 0 0 80 12,-2.3 2,-0.3 -2,-0.8 13,-0.2 0.824 65.6 -10.3 -89.0 -34.7 23.5 -20.8 44.0 339 78 B H E -L 350 0D 42 11,-1.6 11,-3.3 2,-0.0 2,-0.4 -0.937 57.7-172.3-162.0 141.0 20.8 -21.7 46.6 340 79 B F E +L 349 0D 41 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.997 16.2 157.7-135.7 140.6 17.5 -20.3 47.8 341 80 B E E -L 348 0D 16 7,-2.1 7,-2.9 -2,-0.4 2,-0.5 -0.984 37.9-131.4-149.8 161.2 15.4 -21.3 50.8 342 81 B R E +L 347 0D 128 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.980 35.8 172.0-105.9 127.9 12.8 -20.3 53.3 343 82 B H E > -L 346 0D 45 3,-2.5 3,-1.9 -2,-0.5 -2,-0.1 -0.913 62.4 -23.1-145.5 116.5 13.9 -21.2 56.8 344 83 B D T 3 S- 0 0 98 -2,-0.4 -35,-0.2 1,-0.3 3,-0.1 0.880 127.6 -46.5 51.9 47.1 12.1 -20.3 60.1 345 84 B G T 3 S+ 0 0 34 1,-0.3 -1,-0.3 -37,-0.1 2,-0.2 0.195 117.4 117.6 84.5 -17.7 10.4 -17.3 58.5 346 85 B W E < - L 0 343D 10 -3,-1.9 -3,-2.5 -38,-0.2 2,-0.5 -0.535 57.3-145.0 -81.8 147.8 13.7 -16.2 56.8 347 86 B S E -KL 307 342D 2 -40,-2.6 -40,-1.8 -5,-0.2 2,-0.5 -0.975 22.8-168.4-111.2 120.7 14.3 -15.9 53.1 348 87 B N E -KL 306 341D 0 -7,-2.9 -7,-2.1 -2,-0.5 2,-0.5 -0.941 10.0-176.3-122.5 125.0 17.9 -16.9 52.3 349 88 B L E -KL 305 340D 0 -44,-2.6 -44,-2.8 -2,-0.5 2,-0.5 -0.969 6.8-166.4-124.9 123.4 19.6 -16.4 49.0 350 89 B L E +KL 304 339D 5 -11,-3.3 -12,-2.3 -2,-0.5 -11,-1.6 -0.925 23.7 166.8-107.6 132.7 23.2 -17.6 48.2 351 90 B M E -KL 303 337D 13 -48,-2.4 -48,-2.5 -2,-0.5 -14,-0.2 -0.951 34.2-101.2-146.3 160.8 24.6 -16.1 45.0 352 91 B S E -K 302 0D 32 -16,-1.8 2,-0.3 -2,-0.3 -50,-0.2 -0.198 48.3 -89.8 -75.2 172.7 27.9 -15.6 43.1 353 92 B E - 0 0 82 -52,-0.7 -1,-0.1 1,-0.1 -17,-0.1 -0.661 44.5-106.3 -83.7 139.0 29.9 -12.4 43.1 354 93 B A - 0 0 17 -2,-0.3 2,-0.5 1,-0.1 112,-0.1 -0.201 36.1-113.0 -56.0 154.8 29.2 -9.8 40.4 355 94 B D S S+ 0 0 86 110,-0.4 2,-0.2 103,-0.1 110,-0.1 -0.804 72.4 8.1 -96.0 130.4 31.7 -9.5 37.6 356 95 B G S S- 0 0 31 -2,-0.5 2,-0.4 102,-0.1 104,-0.2 -0.614 96.2 -36.3 108.8-162.0 33.8 -6.4 37.3 357 96 B V E -M 459 0E 52 102,-2.6 102,-2.8 -2,-0.2 108,-0.2 -0.882 59.8-106.9-111.2 132.5 34.4 -3.2 39.3 358 97 B L E >> -M 458 0E 35 -2,-0.4 3,-2.6 100,-0.2 4,-1.5 -0.312 29.0-127.8 -58.4 132.8 31.8 -1.4 41.3 359 98 B C H 3> S+ 0 0 2 98,-2.9 4,-1.7 95,-0.3 3,-0.2 0.847 108.7 56.4 -55.1 -39.0 30.9 1.7 39.5 360 99 B S H 34 S+ 0 0 43 94,-1.3 -1,-0.3 1,-0.2 95,-0.1 0.540 111.6 46.7 -72.1 -3.7 31.4 3.9 42.6 361 100 B E H <4 S+ 0 0 111 -3,-2.6 3,-0.4 93,-0.2 4,-0.3 0.627 105.3 54.6-108.9 -24.3 35.0 2.5 42.7 362 101 B E H < S+ 0 0 60 -4,-1.5 3,-0.3 -3,-0.2 -2,-0.2 0.817 116.1 41.7 -74.5 -31.5 35.9 2.9 39.0 363 102 B Y S >< S+ 0 0 70 -4,-1.7 3,-0.5 -5,-0.3 4,-0.3 0.226 85.7 114.2 -93.1 11.2 34.9 6.5 39.5 364 103 B E T 3 S- 0 0 99 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.941 103.4 -18.5 -43.8 -64.2 36.8 6.4 42.8 365 104 B D T 3 S+ 0 0 142 -4,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 -0.626 105.6 105.9-147.8 76.0 39.4 8.8 41.6 366 105 B E S < S- 0 0 87 -3,-0.5 -3,-0.1 -2,-0.1 -2,-0.1 0.487 70.7-136.2-124.4 -18.9 39.4 9.0 37.8 367 106 B Q + 0 0 179 -4,-0.3 3,-0.2 1,-0.1 -4,-0.1 0.826 58.8 137.9 62.6 32.9 37.8 12.4 37.4 368 107 B S >> + 0 0 19 1,-0.2 4,-1.0 2,-0.1 3,-0.7 -0.593 13.2 157.0-108.0 68.7 35.6 10.9 34.6 369 108 B P H >> S+ 0 0 19 0, 0.0 4,-1.8 0, 0.0 3,-0.8 0.907 74.6 54.1 -62.1 -39.4 32.2 12.3 35.3 370 109 B E H 3> S+ 0 0 103 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.776 100.1 61.1 -66.4 -24.9 31.0 11.8 31.7 371 110 B K H <> S+ 0 0 104 -3,-0.7 4,-1.6 2,-0.2 -1,-0.3 0.820 104.4 49.6 -72.2 -27.9 31.9 8.1 31.9 372 111 B I H X S+ 0 0 49 -4,-3.2 3,-0.7 -5,-0.2 4,-0.6 0.945 110.5 48.9 -55.4 -47.8 20.0 -2.0 27.9 383 122 B F H >< S+ 0 0 0 -4,-2.9 3,-1.5 1,-0.2 64,-0.6 0.921 107.3 54.2 -61.5 -43.1 16.8 -2.1 30.1 384 123 B H H 3< S+ 0 0 84 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.753 104.2 56.9 -63.8 -21.7 14.6 -0.8 27.2 385 124 B S H << S+ 0 0 87 -4,-1.2 2,-0.3 -3,-0.7 -1,-0.3 0.631 83.4 108.4 -82.8 -13.5 15.9 -3.7 25.0 386 125 B I S << S- 0 0 18 -3,-1.5 2,-0.7 -4,-0.6 61,-0.4 -0.475 71.5-130.3 -71.5 129.4 14.8 -6.3 27.5 387 126 B D + 0 0 103 -2,-0.3 3,-0.3 1,-0.1 -1,-0.1 -0.692 27.9 178.0 -77.4 113.6 11.8 -8.4 26.5 388 127 B I > + 0 0 29 -2,-0.7 3,-1.8 1,-0.2 -1,-0.1 0.151 42.4 115.7-102.7 18.2 9.4 -8.3 29.5 389 128 B S T 3 S+ 0 0 93 1,-0.3 -1,-0.2 0, 0.0 -2,-0.0 0.844 91.8 27.9 -60.2 -30.9 6.5 -10.4 28.0 390 129 B D T 3 S+ 0 0 97 -3,-0.3 -1,-0.3 -63,-0.1 -2,-0.1 -0.030 84.7 149.8-119.0 27.9 7.1 -13.0 30.6 391 130 B C < - 0 0 6 -3,-1.8 -3,-0.1 1,-0.1 -67,-0.1 -0.469 44.9-138.8 -66.5 130.2 8.5 -10.9 33.4 392 131 B P S S+ 0 0 61 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.770 79.4 44.5 -62.0 -33.1 7.5 -12.4 36.8 393 132 B Y - 0 0 53 -73,-0.0 82,-2.6 2,-0.0 2,-0.6 -0.939 57.3-160.9-126.2 143.6 6.7 -9.1 38.5 394 133 B T B -o 475 0F 54 -2,-0.4 2,-1.0 80,-0.2 82,-0.1 -0.948 5.8-171.8-117.3 106.8 4.8 -6.0 37.7 395 134 B N + 0 0 6 80,-2.3 82,-0.3 -2,-0.6 79,-0.1 -0.494 24.5 162.3 -95.4 61.9 5.8 -3.1 39.9 396 135 B S > - 0 0 25 -2,-1.0 4,-2.8 80,-0.1 5,-0.2 -0.293 57.3-100.3 -69.8 164.9 3.2 -0.7 38.7 397 136 B L H > S+ 0 0 3 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.875 125.8 56.0 -55.9 -37.8 2.3 2.3 40.8 398 137 B D H > S+ 0 0 100 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.919 110.7 44.8 -58.8 -43.4 -0.8 0.4 42.1 399 138 B S H > S+ 0 0 44 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.943 115.3 46.1 -65.9 -49.1 1.5 -2.4 43.3 400 139 B R H X S+ 0 0 6 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.885 114.9 47.5 -63.6 -39.5 4.1 -0.1 44.8 401 140 B L H X S+ 0 0 3 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.868 109.9 51.9 -72.2 -36.8 1.5 2.0 46.6 402 141 B A H X S+ 0 0 61 -4,-2.2 4,-1.8 -5,-0.3 -2,-0.2 0.928 113.6 45.3 -62.6 -44.2 -0.3 -1.1 47.9 403 142 B E H X S+ 0 0 20 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.910 110.6 53.2 -65.9 -41.0 3.0 -2.3 49.3 404 143 B L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.882 106.3 54.6 -59.3 -37.2 3.8 1.2 50.7 405 144 B D H X S+ 0 0 53 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.937 109.2 47.2 -60.2 -47.1 0.5 1.1 52.5 406 145 B Y H X S+ 0 0 87 -4,-1.8 4,-0.9 2,-0.2 -2,-0.2 0.903 110.6 51.6 -63.3 -41.9 1.4 -2.1 54.1 407 146 B L H ><>S+ 0 0 0 -4,-2.4 5,-3.5 1,-0.2 6,-1.0 0.921 111.8 46.6 -63.9 -42.6 4.8 -0.9 55.1 408 147 B L H ><5S+ 0 0 29 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.865 107.8 56.7 -65.2 -36.7 3.3 2.3 56.7 409 148 B N H 3<5S+ 0 0 105 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.696 116.1 37.1 -66.4 -20.2 0.6 0.2 58.6 410 149 B N T <<5S- 0 0 82 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.174 112.1-113.1-119.3 12.6 3.3 -1.8 60.2 411 150 B D T < 5S+ 0 0 55 -3,-1.1 -3,-0.2 1,-0.1 -4,-0.1 0.874 82.7 122.1 56.0 39.8 6.0 0.8 60.8 412 151 B L < + 0 0 18 -5,-3.5 -4,-0.2 -6,-0.2 -5,-0.1 0.415 39.5 106.4-107.1 -4.7 8.3 -0.9 58.2 413 152 B A S S- 0 0 3 -6,-1.0 2,-1.9 1,-0.1 112,-0.2 -0.345 88.2 -99.5 -70.8 159.6 8.6 2.2 55.9 414 153 B D + 0 0 58 110,-2.6 2,-0.5 -2,-0.0 -1,-0.1 -0.490 49.6 176.6 -84.7 71.0 11.8 4.0 56.0 415 154 B V + 0 0 4 -2,-1.9 2,-0.2 109,-0.1 109,-0.1 -0.660 28.2 112.3 -75.3 123.7 10.9 6.9 58.3 416 155 B D S >> S- 0 0 20 -2,-0.5 3,-1.9 -398,-0.0 4,-0.7 -0.717 75.1 -23.3-161.5-151.4 14.0 9.1 58.8 417 156 B a H >> S+ 0 0 14 1,-0.3 3,-1.7 -2,-0.2 4,-1.7 0.846 122.8 62.0 -44.1 -46.5 15.6 12.5 58.2 418 157 B E H 34 S+ 0 0 61 1,-0.3 -1,-0.3 2,-0.2 -3,-0.1 0.741 106.7 44.9 -61.2 -24.7 13.5 13.2 55.1 419 158 B N H <4 S+ 0 0 9 -3,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.584 116.4 47.2 -89.7 -11.6 10.3 13.1 57.2 420 159 B W H << S+ 0 0 4 -3,-1.7 -2,-0.2 -4,-0.7 -3,-0.1 0.606 80.0 113.4-108.0 -16.6 11.8 15.2 60.0 421 160 B E S >< S- 0 0 90 -4,-1.7 3,-0.7 2,-0.1 -409,-0.1 -0.213 71.1-123.4 -63.3 148.2 13.4 18.2 58.2 422 161 B E T 3 S+ 0 0 87 -410,-0.8 2,-1.4 1,-0.3 -1,-0.1 0.913 110.7 57.7 -54.7 -46.4 12.1 21.7 58.7 423 162 B D T 3 S+ 0 0 144 -411,-0.2 -1,-0.3 2,-0.0 -2,-0.1 -0.324 76.5 132.8 -85.5 52.4 11.7 22.0 54.9 424 163 B T < - 0 0 31 -2,-1.4 -5,-0.1 -3,-0.7 -6,-0.0 -0.925 47.7-155.0-101.9 129.2 9.4 19.0 54.6 425 164 B P S S+ 0 0 112 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.619 76.9 65.2 -76.2 -14.5 6.3 19.6 52.5 426 165 B F S S- 0 0 40 1,-0.1 -2,-0.0 -7,-0.0 6,-0.0 -0.926 70.6-146.0-118.0 133.4 4.4 16.9 54.3 427 166 B K S S- 0 0 157 -2,-0.4 -1,-0.1 1,-0.1 -3,-0.0 0.937 83.5 -9.6 -56.8 -48.3 3.3 16.8 57.9 428 167 B D S > S- 0 0 53 1,-0.0 4,-1.3 -8,-0.0 3,-0.3 -0.834 80.3 -87.8-143.3 177.2 3.7 13.0 58.1 429 168 B P H > S+ 0 0 8 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.851 119.9 58.5 -60.8 -36.6 4.4 9.9 56.0 430 169 B R H > S+ 0 0 64 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.877 101.5 53.8 -60.0 -41.3 0.6 9.4 55.3 431 170 B E H > S+ 0 0 80 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.891 108.2 50.7 -62.7 -36.8 0.2 12.8 53.7 432 171 B L H X S+ 0 0 4 -4,-1.3 4,-2.8 1,-0.2 -1,-0.2 0.926 110.8 49.8 -62.2 -43.9 3.1 11.9 51.4 433 172 B Y H X S+ 0 0 20 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.891 108.9 49.7 -63.3 -44.3 1.3 8.7 50.6 434 173 B D H X S+ 0 0 86 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.845 112.1 50.8 -64.9 -34.2 -2.1 10.3 49.8 435 174 B F H X S+ 0 0 82 -4,-1.8 4,-3.0 -5,-0.2 -2,-0.2 0.959 110.9 46.4 -65.0 -50.3 -0.2 12.7 47.6 436 175 B L H < S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.842 114.7 48.7 -60.3 -33.8 1.6 9.9 45.7 437 176 B K H < S+ 0 0 113 -4,-2.2 3,-0.5 -5,-0.2 -1,-0.2 0.870 115.6 43.0 -75.2 -37.5 -1.8 8.1 45.4 438 177 B T H < S+ 0 0 105 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.880 115.2 46.9 -74.9 -42.4 -3.6 11.2 44.2 439 178 B E S < S+ 0 0 104 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.206 76.4 154.3 -90.7 14.9 -1.0 12.4 41.7 440 179 B K - 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