==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 01-SEP-00 1FQ0 . COMPND 2 MOLECULE: KDPG ALDOLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.H.NAISMITH . 639 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26665.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 465 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 93 14.6 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 . 51 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 212 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 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 1 3 5 0 0 10 5 3 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 6 6 3 3 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 3 3 3 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 1 A M > 0 0 104 0, 0.0 3,-1.4 0, 0.0 127,-0.0 0.000 360.0 360.0 360.0 118.4 30.8 8.9 28.2 2 2 A K T 3 + 0 0 188 1,-0.3 103,-0.0 3,-0.0 3,-0.0 0.668 360.0 49.8 -65.2 -22.9 34.4 7.5 27.7 3 3 A N T 3 S+ 0 0 65 102,-0.2 2,-0.6 1,-0.1 -1,-0.3 0.435 96.4 81.9 -97.3 3.2 36.2 10.8 28.5 4 4 A W < - 0 0 17 -3,-1.4 105,-0.1 1,-0.1 -1,-0.1 -0.876 52.8-173.9-110.8 101.2 34.2 11.4 31.7 5 5 A K S S+ 0 0 215 -2,-0.6 2,-0.6 103,-0.5 -1,-0.1 0.835 83.9 52.4 -63.4 -28.5 35.5 9.6 34.8 6 6 A T S S- 0 0 60 102,-0.4 -1,-0.1 83,-0.1 2,-0.1 -0.927 93.4-133.2-107.3 124.7 32.5 10.9 36.7 7 7 A S > - 0 0 54 -2,-0.6 4,-1.4 1,-0.1 -2,-0.1 -0.362 12.3-126.3 -74.8 154.4 29.2 10.1 34.9 8 8 A A H > S+ 0 0 6 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.903 111.4 59.5 -64.2 -35.7 26.6 12.8 34.5 9 9 A E H > S+ 0 0 101 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.897 100.2 52.5 -60.2 -44.3 24.2 10.3 36.0 10 10 A S H > S+ 0 0 42 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.856 106.0 56.2 -63.1 -34.2 26.1 10.0 39.3 11 11 A I H >< S+ 0 0 4 -4,-1.4 3,-0.9 1,-0.2 4,-0.4 0.972 112.8 40.2 -59.1 -52.1 26.1 13.8 39.6 12 12 A L H 3< S+ 0 0 2 -4,-1.9 3,-0.3 1,-0.2 -2,-0.2 0.729 113.3 53.8 -72.5 -20.8 22.2 13.8 39.4 13 13 A T H 3< S+ 0 0 76 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.482 83.5 88.1 -92.7 -1.7 21.7 10.8 41.6 14 14 A T S << S- 0 0 55 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.1 0.905 105.8 -17.1 -61.4 -44.3 23.7 12.1 44.5 15 15 A G - 0 0 29 -4,-0.4 -1,-0.2 -3,-0.3 26,-0.1 -0.947 63.6-107.7-154.0 170.5 20.8 14.0 46.1 16 16 A P S S+ 0 0 37 0, 0.0 165,-2.2 0, 0.0 2,-0.4 0.702 99.1 51.6 -80.5 -18.5 17.3 15.2 45.3 17 17 A V E -a 181 0A 8 163,-0.2 26,-0.3 187,-0.0 165,-0.2 -0.969 56.3-169.1-128.0 129.4 18.2 19.0 45.2 18 18 A V E -a 182 0A 4 163,-2.5 165,-1.8 -2,-0.4 2,-0.2 -0.938 27.5-133.1-111.5 112.1 21.0 20.8 43.3 19 19 A P E -a 183 0A 1 0, 0.0 26,-1.8 0, 0.0 2,-0.9 -0.497 7.2-142.2 -70.5 133.9 21.3 24.4 44.6 20 20 A V E -c 45 0B 13 163,-2.5 2,-0.4 -2,-0.2 167,-0.2 -0.859 29.5-156.6 -95.5 104.2 21.5 27.0 41.8 21 21 A I E -c 46 0B 1 24,-3.1 26,-2.4 -2,-0.9 2,-0.6 -0.711 26.5-175.7 -98.3 134.4 24.1 29.5 43.3 22 22 A V - 0 0 45 -2,-0.4 2,-0.8 165,-0.3 170,-0.1 -0.916 15.9-170.3-122.4 100.2 24.7 33.2 42.6 23 23 A V + 0 0 2 -2,-0.6 29,-0.3 24,-0.3 33,-0.1 -0.839 16.0 169.2 -98.3 109.4 27.7 34.3 44.6 24 24 A K + 0 0 154 -2,-0.8 2,-0.7 1,-0.2 28,-0.2 0.862 69.4 50.5 -86.7 -38.1 28.3 38.0 44.7 25 25 A K S > S- 0 0 100 1,-0.2 3,-1.9 27,-0.0 4,-0.4 -0.878 70.3-152.7-108.8 115.4 30.9 38.1 47.4 26 26 A L G > S+ 0 0 70 -2,-0.7 3,-1.5 1,-0.3 4,-0.4 0.819 90.8 64.7 -49.8 -39.9 33.8 35.8 46.9 27 27 A E G 3 S+ 0 0 122 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.760 98.0 56.0 -60.3 -23.5 34.6 35.6 50.7 28 28 A H G <> S+ 0 0 32 -3,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.619 84.8 85.5 -86.5 -8.2 31.2 33.9 51.3 29 29 A A H <> S+ 0 0 0 -3,-1.5 4,-2.4 -4,-0.4 -1,-0.2 0.893 87.6 45.3 -57.7 -53.5 31.7 31.0 48.9 30 30 A V H > S+ 0 0 17 -4,-0.4 4,-2.4 -3,-0.2 -1,-0.2 0.910 116.5 42.7 -64.6 -47.9 33.6 28.5 51.1 31 31 A P H > S+ 0 0 42 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.835 112.8 54.8 -72.0 -25.1 31.5 28.8 54.3 32 32 A M H X S+ 0 0 2 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.956 109.7 47.7 -66.0 -45.7 28.3 28.8 52.2 33 33 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.913 111.4 49.3 -61.6 -44.7 29.5 25.5 50.6 34 34 A K H X S+ 0 0 115 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.867 109.6 53.2 -62.5 -34.3 30.3 24.1 54.1 35 35 A A H X S+ 0 0 5 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.909 109.2 48.0 -68.2 -40.2 26.8 25.1 55.3 36 36 A L H <>S+ 0 0 0 -4,-2.3 5,-2.9 2,-0.2 3,-0.4 0.912 113.1 47.9 -66.4 -41.6 25.1 23.3 52.4 37 37 A V H ><5S+ 0 0 35 -4,-2.2 3,-2.1 1,-0.2 -2,-0.2 0.891 107.1 56.5 -66.6 -38.6 27.2 20.2 53.0 38 38 A A H 3<5S+ 0 0 73 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.762 106.8 51.5 -65.2 -21.1 26.4 20.3 56.7 39 39 A G T 3<5S- 0 0 8 -4,-0.9 -1,-0.3 -3,-0.4 169,-0.2 0.288 128.7 -98.6 -97.5 9.8 22.8 20.3 55.7 40 40 A G T < 5S+ 0 0 54 -3,-2.1 2,-0.6 1,-0.2 -3,-0.2 0.601 85.8 122.8 88.8 13.8 23.2 17.2 53.5 41 41 A V < + 0 0 4 -5,-2.9 -2,-0.2 -6,-0.1 -1,-0.2 -0.954 21.9 157.9-116.3 117.4 23.5 18.9 50.2 42 42 A R + 0 0 89 -2,-0.6 26,-3.5 25,-0.1 2,-1.0 0.693 46.5 84.2-110.0 -31.4 26.7 18.2 48.2 43 43 A V E - d 0 68B 5 -26,-0.3 2,-0.6 24,-0.2 26,-0.2 -0.706 62.1-170.8 -81.7 103.7 26.2 18.9 44.5 44 44 A L E - d 0 69B 0 24,-2.4 26,-3.1 -2,-1.0 2,-0.8 -0.857 15.2-161.5-104.6 121.6 26.8 22.6 44.2 45 45 A E E -cd 20 70B 11 -26,-1.8 -24,-3.1 -2,-0.6 2,-0.9 -0.813 7.0-167.5 -99.3 103.3 26.1 24.6 40.9 46 46 A V E -cd 21 71B 0 24,-2.6 26,-1.9 -2,-0.8 -24,-0.1 -0.797 20.1-137.9 -91.0 108.9 28.0 27.9 41.0 47 47 A T E - d 0 72B 1 -26,-2.4 2,-1.9 -2,-0.9 3,-0.5 -0.310 10.1-127.2 -68.9 145.4 26.5 30.0 38.1 48 48 A L S S+ 0 0 23 24,-1.6 -1,-0.1 1,-0.2 3,-0.1 -0.557 81.7 106.2 -89.6 70.6 28.8 32.1 35.9 49 49 A R + 0 0 106 -2,-1.9 2,-0.3 1,-0.1 -1,-0.2 0.263 68.0 54.9-129.2 4.6 26.7 35.1 36.5 50 50 A T S > S- 0 0 27 -3,-0.5 3,-1.5 1,-0.1 4,-0.3 -0.972 85.1-115.0-137.1 151.6 29.0 37.1 38.9 51 51 A E T 3 S+ 0 0 201 -2,-0.3 3,-0.3 1,-0.3 4,-0.3 0.825 113.9 48.7 -57.2 -34.4 32.6 38.2 38.4 52 52 A C T 3> S+ 0 0 12 -29,-0.3 4,-2.4 -28,-0.2 3,-0.3 0.457 80.0 105.0 -88.4 4.8 34.0 36.0 41.2 53 53 A A H <> S+ 0 0 2 -3,-1.5 4,-2.1 1,-0.3 5,-0.2 0.897 79.8 46.1 -51.5 -53.3 32.2 32.8 40.1 54 54 A V H > S+ 0 0 18 -3,-0.3 4,-1.7 -4,-0.3 -1,-0.3 0.853 114.3 49.9 -63.2 -31.3 35.2 31.0 38.6 55 55 A D H > S+ 0 0 79 -3,-0.3 4,-2.5 -4,-0.3 -1,-0.2 0.865 108.2 53.3 -74.8 -30.1 37.3 32.0 41.7 56 56 A A H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.881 108.0 50.5 -66.2 -41.6 34.5 30.7 44.0 57 57 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.899 111.6 47.6 -63.0 -44.2 34.5 27.3 42.2 58 58 A R H X S+ 0 0 96 -4,-1.7 4,-2.4 -5,-0.2 5,-0.2 0.958 113.7 47.4 -62.4 -47.3 38.3 27.1 42.6 59 59 A A H X S+ 0 0 24 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.877 114.3 46.7 -64.1 -39.5 38.1 28.0 46.3 60 60 A I H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 7,-0.2 0.910 110.8 51.1 -69.8 -41.5 35.3 25.5 47.0 61 61 A A H < S+ 0 0 34 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.951 116.2 42.2 -62.0 -46.1 37.0 22.7 45.1 62 62 A K H < S+ 0 0 182 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.917 125.8 31.0 -67.7 -38.7 40.2 23.2 47.1 63 63 A E H < S+ 0 0 101 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.622 114.3 48.6-102.7 -12.9 38.6 23.8 50.5 64 64 A V >< + 0 0 10 -4,-2.4 3,-2.9 -5,-0.2 -1,-0.2 -0.529 60.1 173.2-125.0 66.7 35.4 21.8 50.9 65 65 A P T 3 S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.626 73.8 62.5 -49.0 -21.9 36.5 18.4 49.7 66 66 A E T 3 S+ 0 0 120 -3,-0.1 2,-0.2 2,-0.0 -5,-0.1 0.569 91.1 87.6 -83.1 -6.4 33.1 16.7 50.7 67 67 A A S < S- 0 0 6 -3,-2.9 2,-0.8 -7,-0.2 -24,-0.2 -0.614 70.3-144.8 -92.8 148.3 31.3 19.0 48.1 68 68 A I E -d 43 0B 21 -26,-3.5 -24,-2.4 -2,-0.2 2,-0.4 -0.874 30.6-170.4-109.5 94.7 30.8 18.2 44.4 69 69 A V E +d 44 0B 0 -2,-0.8 20,-2.7 -26,-0.2 21,-0.3 -0.714 12.6 162.0 -94.3 139.2 31.2 21.6 43.0 70 70 A G E -d 45 0B 0 -26,-3.1 -24,-2.6 -2,-0.4 2,-0.3 -0.834 33.7-100.1-140.9 178.1 30.4 22.4 39.4 71 71 A A E -de 46 91B 0 19,-2.2 21,-1.9 -2,-0.3 2,-0.3 -0.762 25.7-161.3-105.3 155.4 29.6 25.4 37.2 72 72 A G E +d 47 0B 0 -26,-1.9 -24,-1.6 -2,-0.3 21,-0.2 -0.771 68.6 36.0-125.9 169.6 26.3 26.8 35.9 73 73 A T + 0 0 9 -2,-0.3 2,-0.8 1,-0.2 20,-0.2 0.841 69.5 168.8 53.7 38.3 25.4 29.1 33.0 74 74 A V + 0 0 0 18,-2.1 -1,-0.2 -3,-0.2 17,-0.0 -0.737 5.7 174.9 -83.2 112.9 28.2 27.7 30.9 75 75 A L + 0 0 37 -2,-0.8 -1,-0.2 -3,-0.1 25,-0.1 0.595 51.8 4.7-100.1 -14.7 27.5 29.1 27.4 76 76 A N S > S- 0 0 44 24,-0.1 4,-2.1 23,-0.1 3,-0.4 -0.972 81.3 -85.7-161.5 171.3 30.3 28.1 25.2 77 77 A P H > S+ 0 0 51 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.847 120.4 59.6 -54.1 -36.2 33.6 26.0 24.9 78 78 A Q H > S+ 0 0 151 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.943 108.4 41.7 -62.2 -45.4 35.6 28.9 26.3 79 79 A Q H > S+ 0 0 36 -3,-0.4 4,-2.9 1,-0.2 5,-0.3 0.921 112.9 54.8 -68.6 -41.4 33.7 29.0 29.6 80 80 A L H X S+ 0 0 11 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.936 109.1 47.8 -55.3 -46.6 33.6 25.2 29.8 81 81 A A H X S+ 0 0 63 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.944 111.9 51.1 -62.0 -43.4 37.5 25.1 29.4 82 82 A E H X S+ 0 0 89 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.932 112.2 42.9 -62.2 -47.7 37.8 27.8 32.1 83 83 A V H X>S+ 0 0 0 -4,-2.9 5,-2.7 1,-0.2 4,-0.5 0.884 112.1 56.5 -68.3 -31.4 35.6 26.1 34.7 84 84 A T H ><5S+ 0 0 44 -4,-2.3 3,-1.2 -5,-0.3 -1,-0.2 0.941 108.2 47.1 -60.9 -44.2 37.3 22.8 33.9 85 85 A E H 3<5S+ 0 0 132 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.837 108.1 56.2 -68.0 -30.6 40.7 24.4 34.6 86 86 A A H 3<5S- 0 0 6 -4,-1.8 -1,-0.3 -5,-0.2 -25,-0.2 0.490 127.0 -94.1 -79.8 -5.3 39.4 25.9 37.9 87 87 A G T <<5 + 0 0 32 -3,-1.2 -3,-0.2 -4,-0.5 -18,-0.2 0.595 62.8 163.3 106.1 11.5 38.3 22.5 39.2 88 88 A A < - 0 0 7 -5,-2.7 -18,-0.3 1,-0.2 -1,-0.2 -0.400 26.4-158.4 -64.3 141.7 34.6 22.1 38.3 89 89 A Q S S+ 0 0 69 -20,-2.7 2,-0.3 1,-0.2 -19,-0.2 0.525 75.6 6.0 -96.5 -10.4 33.5 18.5 38.5 90 90 A F - 0 0 0 -21,-0.3 -19,-2.2 19,-0.2 2,-0.4 -0.973 66.8-137.0-163.6 161.6 30.6 19.1 36.2 91 91 A A E -ef 71 111B 0 19,-2.6 21,-2.7 -2,-0.3 2,-0.4 -0.981 11.0-165.0-130.8 144.2 29.1 21.8 34.0 92 92 A I E - f 0 112B 6 -21,-1.9 -18,-2.1 -2,-0.4 -2,-0.0 -0.987 4.6-171.1-127.2 138.4 25.5 22.9 33.5 93 93 A S E - f 0 113B 0 19,-1.0 21,-2.0 -2,-0.4 40,-0.2 -0.967 29.1-131.2-128.6 145.8 24.2 25.1 30.8 94 94 A P S S- 0 0 13 0, 0.0 2,-0.2 0, 0.0 41,-0.2 0.732 92.5 -6.5 -67.1 -21.1 20.7 26.6 30.4 95 95 A G S S- 0 0 0 451,-0.2 19,-0.4 452,-0.1 2,-0.3 -0.830 79.9-109.1-153.9-175.1 20.4 25.3 26.8 96 96 A L - 0 0 5 -2,-0.2 2,-0.3 17,-0.2 455,-0.1 -0.866 21.1-177.7-129.8 163.9 22.7 23.5 24.3 97 97 A T > - 0 0 7 -2,-0.3 4,-2.9 1,-0.1 5,-0.3 -0.956 40.5-110.5-150.2 152.3 24.6 24.2 21.0 98 98 A E H > S+ 0 0 72 -2,-0.3 4,-3.4 1,-0.2 5,-0.2 0.922 117.9 52.0 -55.4 -48.5 26.8 22.0 18.8 99 99 A P H > S+ 0 0 66 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.915 113.7 45.0 -57.0 -41.4 30.0 23.7 19.7 100 100 A L H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.943 115.0 46.7 -68.4 -43.1 29.2 23.3 23.4 101 101 A L H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 5,-0.2 0.903 114.2 48.8 -64.1 -40.1 28.1 19.7 23.0 102 102 A K H X S+ 0 0 114 -4,-3.4 4,-1.2 -5,-0.3 -2,-0.2 0.954 112.5 45.6 -68.4 -46.2 31.2 18.9 21.0 103 103 A A H X S+ 0 0 25 -4,-2.3 4,-1.1 -5,-0.2 3,-0.2 0.902 113.1 52.5 -62.4 -42.1 33.7 20.5 23.4 104 104 A A H < S+ 0 0 2 -4,-2.4 3,-0.5 -5,-0.2 5,-0.2 0.943 109.4 45.7 -59.8 -51.4 32.0 18.9 26.4 105 105 A T H < S+ 0 0 17 -4,-2.1 -102,-0.2 1,-0.2 -1,-0.2 0.702 113.5 50.6 -67.5 -19.4 32.1 15.2 25.1 106 106 A E H < S+ 0 0 130 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.680 108.0 76.2 -87.9 -19.0 35.8 15.7 24.0 107 107 A G S < S- 0 0 24 -4,-1.1 -3,-0.1 -3,-0.5 -104,-0.1 -0.063 89.3-108.0 -84.0-173.4 36.5 17.0 27.5 108 108 A T S S+ 0 0 89 -104,-0.1 -103,-0.5 2,-0.1 -102,-0.4 0.542 87.2 59.5 -95.0 -13.3 36.9 15.6 30.9 109 109 A I S S- 0 0 20 -5,-0.2 -19,-0.2 -105,-0.1 -2,-0.1 -0.914 84.2 -99.5-122.9 152.7 33.8 16.5 32.9 110 110 A P - 0 0 1 0, 0.0 -19,-2.6 0, 0.0 2,-0.5 -0.332 26.6-155.1 -66.8 141.7 30.1 15.9 32.4 111 111 A L E -f 91 0B 0 -21,-0.2 -19,-0.2 -10,-0.1 20,-0.2 -0.973 4.8-168.0-111.8 127.7 27.9 18.5 30.9 112 112 A I E -f 92 0B 0 -21,-2.7 -19,-1.0 -2,-0.5 2,-0.2 -0.904 20.9-166.8-116.0 99.5 24.2 18.3 31.9 113 113 A P E -f 93 0B 0 0, 0.0 20,-1.9 0, 0.0 -17,-0.2 -0.587 16.7-117.3 -92.2 152.2 22.6 20.8 29.4 114 114 A G E -g 133 0C 0 -21,-2.0 2,-0.3 -19,-0.4 20,-0.2 -0.506 29.3-176.4 -84.6 153.2 19.1 22.2 29.5 115 115 A I E -g 134 0C 1 18,-1.8 20,-1.0 -20,-0.2 3,-0.1 -0.925 20.9-175.5-139.0 161.4 16.5 21.5 26.8 116 116 A S S S+ 0 0 14 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.452 71.4 40.6-130.3 -18.6 13.0 22.8 26.2 117 117 A T S > S- 0 0 7 1,-0.1 4,-2.3 32,-0.0 -1,-0.2 -0.892 79.5-112.9-134.0 164.4 12.0 20.8 23.1 118 118 A V H > S+ 0 0 1 -2,-0.3 4,-3.0 231,-0.2 191,-0.2 0.827 117.0 55.6 -63.2 -33.9 12.3 17.3 21.6 119 119 A S H > S+ 0 0 9 2,-0.2 4,-1.9 189,-0.2 -1,-0.2 0.891 109.1 46.9 -67.5 -35.9 14.5 18.7 18.8 120 120 A E H > S+ 0 0 13 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.910 112.7 49.9 -70.8 -38.8 16.9 20.1 21.4 121 121 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.950 109.8 50.9 -63.2 -48.8 16.8 16.8 23.3 122 122 A M H X S+ 0 0 2 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.869 106.7 53.9 -59.4 -37.9 17.5 14.9 20.1 123 123 A L H X S+ 0 0 38 -4,-1.9 4,-0.7 2,-0.2 -1,-0.2 0.903 110.8 46.5 -62.8 -40.8 20.5 17.1 19.3 124 124 A G H ><>S+ 0 0 0 -4,-1.9 5,-1.8 1,-0.2 3,-1.2 0.919 110.3 53.6 -67.3 -40.3 21.9 16.3 22.7 125 125 A M H ><5S+ 0 0 44 -4,-2.6 3,-1.8 1,-0.3 -1,-0.2 0.771 96.1 67.1 -65.7 -25.3 21.2 12.6 22.2 126 126 A D H 3<5S+ 0 0 56 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.828 102.3 48.2 -64.6 -26.6 23.1 12.8 18.9 127 127 A Y T <<5S- 0 0 61 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.213 127.6 -99.8 -95.7 15.5 26.2 13.3 21.1 128 128 A G T < 5S+ 0 0 56 -3,-1.8 -3,-0.2 1,-0.2 2,-0.2 0.526 70.2 150.5 84.0 7.2 25.3 10.4 23.4 129 129 A L < + 0 0 11 -5,-1.8 -1,-0.2 1,-0.1 3,-0.1 -0.463 19.8 169.4 -76.8 145.4 23.8 12.4 26.3 130 130 A K + 0 0 102 -2,-0.2 27,-2.3 1,-0.1 2,-0.5 0.500 61.5 70.7-124.6 -16.4 21.1 10.8 28.5 131 131 A E E + h 0 157C 28 25,-0.2 2,-0.3 -20,-0.2 27,-0.2 -0.886 59.7 165.4-110.9 132.4 20.9 13.4 31.3 132 132 A F E - 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m 0 282E 7 -26,-0.3 2,-0.7 24,-0.2 26,-0.2 -0.765 61.0-168.3 -85.0 109.6 -1.5 5.5 6.9 258 44 B L E - m 0 283E 0 24,-2.7 26,-3.2 -2,-0.9 2,-0.9 -0.868 14.6-162.4-113.1 112.3 0.1 3.5 9.7 259 45 B E E -lm 234 284E 11 -26,-1.7 -24,-2.8 -2,-0.7 2,-0.9 -0.751 6.4-168.7 -91.3 103.2 2.7 4.9 12.0 260 46 B V E -lm 235 285E 0 24,-2.2 26,-2.0 -2,-0.9 -24,-0.1 -0.810 19.3-140.2 -95.0 104.2 4.6 2.1 13.8 261 47 B T E > - m 0 286E 1 -26,-2.2 2,-2.3 -2,-0.9 3,-0.6 -0.345 11.2-127.8 -67.2 138.3 6.6 3.7 16.6 262 48 B L T 3 S+ 0 0 28 24,-2.3 -1,-0.1 1,-0.2 3,-0.1 -0.504 81.0 106.2 -81.5 70.2 10.1 2.5 17.3 263 49 B R T 3 + 0 0 110 -2,-2.3 2,-0.3 1,-0.1 -1,-0.2 0.346 67.2 54.1-129.6 0.3 9.2 2.1 20.9 264 50 B T S X S- 0 0 29 -3,-0.6 3,-1.5 1,-0.1 4,-0.3 -0.960 85.7-112.8-133.2 157.7 8.9 -1.7 21.3 265 51 B E T 3 S+ 0 0 204 -2,-0.3 3,-0.4 1,-0.3 4,-0.3 0.858 114.3 48.1 -58.0 -38.5 11.4 -4.4 20.5 266 52 B C T 3> S+ 0 0 12 -29,-0.3 4,-2.0 1,-0.2 -1,-0.3 0.423 79.9 106.3 -84.7 4.1 9.2 -5.9 17.7 267 53 B A H <> S+ 0 0 1 -3,-1.5 4,-2.2 1,-0.2 3,-0.3 0.874 79.7 44.7 -50.9 -53.8 8.6 -2.6 16.0 268 54 B V H > S+ 0 0 18 -3,-0.4 4,-2.2 -4,-0.3 -1,-0.2 0.890 114.3 51.7 -62.0 -36.9 10.9 -3.0 12.9 269 55 B D H > S+ 0 0 80 -4,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.828 107.9 52.3 -68.0 -29.6 9.6 -6.6 12.5 270 56 B A H X S+ 0 0 0 -4,-2.0 4,-2.8 -3,-0.3 5,-0.2 0.909 108.0 50.5 -71.2 -42.5 5.9 -5.4 12.6 271 57 B I H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.952 112.7 47.2 -57.3 -50.1 6.7 -2.8 9.9 272 58 B R H X S+ 0 0 105 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.913 113.9 46.8 -60.5 -42.4 8.2 -5.6 7.8 273 59 B A H X S+ 0 0 30 -4,-2.2 4,-3.5 2,-0.2 5,-0.3 0.883 112.9 48.6 -68.5 -39.3 5.3 -8.0 8.4 274 60 B I H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 7,-0.3 0.903 111.3 50.3 -66.7 -39.8 2.7 -5.4 7.6 275 61 B A H < S+ 0 0 31 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.846 118.7 39.9 -68.1 -30.9 4.5 -4.4 4.4 276 62 B K H < S+ 0 0 158 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.911 127.3 28.8 -87.4 -40.1 4.6 -8.0 3.5 277 63 B E H < S+ 0 0 112 -4,-3.5 -3,-0.2 1,-0.2 -2,-0.2 0.663 129.2 36.5 -94.9 -18.3 1.1 -9.2 4.6 278 64 B V >< + 0 0 1 -4,-2.6 3,-2.4 -5,-0.3 -1,-0.2 -0.535 66.3 163.3-130.3 64.2 -0.9 -6.0 4.2 279 65 B P T 3 S+ 0 0 85 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.743 70.1 66.0 -54.7 -26.7 0.7 -4.4 1.0 280 66 B E T 3 S+ 0 0 108 -3,-0.1 2,-0.2 2,-0.1 -5,-0.1 0.624 84.7 89.5 -75.6 -10.8 -2.3 -2.1 0.6 281 67 B A S < S- 0 0 2 -3,-2.4 2,-1.2 -7,-0.3 -24,-0.2 -0.571 79.5-131.3 -83.3 150.1 -1.5 -0.3 3.8 282 68 B I E -m 257 0E 27 -26,-2.9 -24,-2.7 -2,-0.2 2,-0.3 -0.774 38.0-170.5 -97.6 87.3 0.8 2.7 3.7 283 69 B V E +m 258 0E 1 -2,-1.2 20,-2.9 -26,-0.2 21,-0.4 -0.642 12.1 162.3 -84.6 136.7 3.0 1.5 6.6 284 70 B G E -m 259 0E 0 -26,-3.2 -24,-2.2 -2,-0.3 2,-0.4 -0.793 31.9-105.4-139.6-179.6 5.7 3.8 8.1 285 71 B A E -mn 260 305E 0 19,-1.8 21,-2.6 -2,-0.2 2,-0.3 -0.886 23.8-163.4-115.7 150.2 7.8 4.2 11.2 286 72 B G E +m 261 0E 0 -26,-2.0 -24,-2.3 -2,-0.4 21,-0.2 -0.777 67.9 37.3-123.1 169.1 7.6 6.6 14.1 287 73 B T + 0 0 12 -2,-0.3 2,-0.7 1,-0.2 20,-0.2 0.791 69.9 167.6 58.4 30.3 10.0 7.8 16.8 288 74 B V + 0 0 0 18,-2.3 -1,-0.2 -3,-0.2 17,-0.0 -0.684 6.3 174.8 -75.4 115.5 12.8 7.7 14.2 289 75 B L + 0 0 32 -2,-0.7 -1,-0.2 -3,-0.1 25,-0.1 0.598 51.2 8.5-103.1 -15.1 15.6 9.5 16.1 290 76 B N S > S- 0 0 43 24,-0.1 4,-2.3 23,-0.1 3,-0.3 -0.970 80.8 -89.0-159.4 169.1 18.7 9.3 13.8 291 77 B P H > S+ 0 0 51 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.768 120.8 57.8 -55.8 -30.4 20.1 8.3 10.4 292 78 B Q H > S+ 0 0 144 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.936 108.5 43.1 -70.6 -46.4 20.8 4.8 11.6 293 79 B Q H > S+ 0 0 39 -3,-0.3 4,-2.6 1,-0.2 5,-0.3 0.926 112.4 54.9 -65.8 -38.2 17.2 4.2 12.6 294 80 B L H X S+ 0 0 10 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.919 108.4 48.2 -58.6 -44.5 16.0 5.8 9.4 295 81 B A H X S+ 0 0 61 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.910 111.2 51.5 -62.5 -42.1 18.1 3.4 7.3 296 82 B E H X S+ 0 0 90 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.920 112.5 43.0 -62.9 -46.2 16.8 0.4 9.3 297 83 B V H <>S+ 0 0 0 -4,-2.6 5,-2.6 2,-0.2 4,-0.5 0.873 112.3 55.3 -70.1 -30.4 13.1 1.2 8.8 298 84 B T H ><5S+ 0 0 45 -4,-2.2 3,-1.1 -5,-0.3 -2,-0.2 0.934 109.2 46.4 -64.3 -44.6 13.8 2.1 5.2 299 85 B E H 3<5S+ 0 0 137 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.769 108.4 58.1 -67.7 -27.5 15.3 -1.4 4.6 300 86 B A T 3<5S- 0 0 7 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.532 126.8 -96.1 -80.9 -7.3 12.4 -2.9 6.5 301 87 B G T < 5 + 0 0 29 -3,-1.1 -3,-0.2 -4,-0.5 -18,-0.2 0.513 63.8 160.5 107.2 2.5 9.9 -1.5 4.0 302 88 B A < - 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