==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 05-DEC-11 3VLW . COMPND 2 MOLECULE: ALGQ1; . SOURCE 2 ORGANISM_SCIENTIFIC: SPHINGOMONAS SP.; . AUTHOR Y.NISHITANI,Y.MARUYAMA,T.ITOH,B.MIKAMI,W.HASHIMOTO,K.MURATA . 978 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40823.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 670 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 7.6 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 . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 47 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 106 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 331 33.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.1 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 3 4 3 4 1 6 5 3 2 2 2 4 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 RESIDUES PER ALPHA HELIX . 8 4 2 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 PARALLEL BRIDGES PER LADDER . 6 4 2 6 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 ANTIPARALLEL BRIDGES PER LADDER . 6 4 0 4 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 2 A E 0 0 125 0, 0.0 3,-0.4 0, 0.0 36,-0.0 0.000 360.0 360.0 360.0 158.7 19.2 -12.9 -0.5 2 3 A A + 0 0 109 1,-0.2 35,-0.0 3,-0.0 36,-0.0 0.637 360.0 61.3 -85.0 -18.1 20.1 -9.5 -1.9 3 4 A T S S+ 0 0 51 34,-0.1 -1,-0.2 2,-0.0 34,-0.1 0.449 78.6 130.5 -83.8 -3.1 22.4 -8.8 1.0 4 5 A W - 0 0 109 -3,-0.4 34,-0.2 1,-0.1 35,-0.2 -0.294 44.6-164.4 -57.9 128.9 24.5 -11.8 -0.2 5 6 A V S S+ 0 0 22 33,-2.7 2,-0.3 1,-0.2 34,-0.2 0.803 75.7 18.3 -82.5 -34.2 28.2 -11.1 -0.5 6 7 A T - 0 0 13 32,-1.0 -1,-0.2 1,-0.1 4,-0.1 -0.980 63.3-138.5-141.3 147.8 29.0 -14.2 -2.6 7 8 A E S S+ 0 0 181 -2,-0.3 -1,-0.1 -3,-0.1 -2,-0.0 0.930 93.2 58.1 -73.1 -48.0 26.9 -16.6 -4.7 8 9 A K S S- 0 0 112 1,-0.1 -1,-0.0 0, 0.0 0, 0.0 -0.712 103.2-103.0 -83.3 133.0 28.7 -19.8 -3.5 9 10 A P - 0 0 103 0, 0.0 2,-0.4 0, 0.0 31,-0.2 -0.286 42.2-156.7 -56.7 137.0 28.5 -20.3 0.3 10 11 A L E -a 40 0A 20 29,-2.2 31,-3.2 -4,-0.1 2,-0.5 -0.965 13.9-162.3-127.7 135.6 31.8 -19.4 2.0 11 12 A T E -a 41 0A 91 -2,-0.4 2,-0.3 29,-0.2 31,-0.2 -0.967 13.1-176.1-115.7 126.3 33.4 -20.4 5.3 12 13 A L E -a 42 0A 3 29,-2.6 31,-3.0 -2,-0.5 2,-0.5 -0.913 24.4-123.4-120.6 149.1 36.3 -18.4 6.8 13 14 A K E -a 43 0A 118 -2,-0.3 55,-2.1 29,-0.2 56,-2.1 -0.801 27.0-168.4 -91.6 125.2 38.4 -19.0 9.9 14 15 A I E -ab 44 69A 0 29,-2.7 31,-2.0 -2,-0.5 2,-0.8 -0.963 13.8-158.2-115.1 127.1 38.4 -16.2 12.5 15 16 A H E + b 0 70A 15 54,-2.9 56,-2.2 -2,-0.5 2,-0.4 -0.900 29.8 157.6 -97.3 106.3 40.7 -16.0 15.5 16 17 A M E + b 0 71A 1 -2,-0.8 8,-1.3 54,-0.2 2,-0.5 -0.849 9.4 162.5-136.4 99.5 39.0 -13.7 17.9 17 18 A H E +E 23 0B 6 54,-0.7 2,-0.3 -2,-0.4 6,-0.2 -0.979 21.4 176.4-111.9 122.8 39.8 -13.8 21.6 18 19 A F E >> +E 22 0B 0 4,-2.5 4,-2.4 -2,-0.5 3,-1.6 -0.970 49.1 2.6-137.3 147.3 38.6 -10.8 23.5 19 20 A R T 34 S- 0 0 45 -2,-0.3 -1,-0.1 1,-0.3 4,-0.1 0.704 107.4 -84.4 57.7 26.7 38.4 -9.3 27.0 20 21 A D T 34 S+ 0 0 64 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.539 126.7 60.5 58.6 11.5 40.3 -12.3 28.4 21 22 A K T <4 S+ 0 0 113 -3,-1.6 2,-0.3 1,-0.2 -2,-0.2 0.585 89.9 58.5-139.4 -24.5 37.0 -14.1 28.6 22 23 A W E < -E 18 0B 63 -4,-2.4 -4,-2.5 29,-0.0 2,-0.3 -0.848 45.9-171.1-123.1 152.7 35.2 -14.6 25.2 23 24 A V E -E 17 0B 14 -2,-0.3 -6,-0.2 -6,-0.2 2,-0.1 -0.917 42.6 -83.7-128.7 163.1 35.8 -16.1 21.8 24 25 A W - 0 0 13 -8,-1.3 2,-0.4 -2,-0.3 20,-0.1 -0.434 42.6-162.9 -60.8 135.5 33.9 -15.9 18.5 25 26 A D > - 0 0 44 -2,-0.1 3,-2.0 1,-0.1 6,-0.3 -0.951 17.3-160.8-128.3 112.8 31.1 -18.5 18.4 26 27 A E T 3 S+ 0 0 45 -2,-0.4 9,-0.1 1,-0.3 -1,-0.1 0.677 93.9 64.2 -61.8 -18.4 29.5 -19.4 15.0 27 28 A N T 3 S+ 0 0 105 4,-0.1 -1,-0.3 5,-0.1 16,-0.0 0.532 74.9 118.2 -85.0 -7.5 26.5 -20.7 17.0 28 29 A W S <> S- 0 0 17 -3,-2.0 4,-2.7 1,-0.1 5,-0.2 -0.314 74.2-126.0 -51.4 136.9 25.8 -17.2 18.3 29 30 A P H > S+ 0 0 20 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.907 112.1 47.7 -52.5 -44.7 22.3 -16.0 17.1 30 31 A V H > S+ 0 0 4 350,-2.2 4,-2.7 2,-0.2 5,-0.2 0.922 111.5 49.3 -64.5 -45.8 23.9 -12.8 15.6 31 32 A A H > S+ 0 0 7 349,-0.4 4,-2.2 -6,-0.3 -1,-0.2 0.895 112.2 49.5 -59.0 -42.2 26.7 -14.8 13.9 32 33 A R H X S+ 0 0 141 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.917 112.5 46.8 -61.9 -46.4 24.0 -17.2 12.4 33 34 A E H X S+ 0 0 37 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.887 112.2 49.1 -66.3 -41.6 21.9 -14.3 11.2 34 35 A V H X S+ 0 0 4 -4,-2.7 4,-2.2 2,-0.2 6,-0.4 0.907 111.0 51.2 -63.4 -41.8 24.8 -12.5 9.6 35 36 A A H X S+ 0 0 20 -4,-2.2 4,-2.1 -5,-0.2 5,-0.4 0.894 110.0 49.6 -60.7 -42.7 25.9 -15.7 7.9 36 37 A R H < S+ 0 0 122 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.910 115.2 43.2 -62.0 -45.0 22.4 -16.2 6.5 37 38 A L H < S+ 0 0 17 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.800 125.8 30.8 -74.2 -31.2 22.2 -12.7 5.1 38 39 A T H < S- 0 0 0 -4,-2.2 -33,-2.7 2,-0.2 -32,-1.0 0.624 95.1-128.6-103.5 -17.9 25.8 -12.5 3.7 39 40 A N S < S+ 0 0 25 -4,-2.1 -29,-2.2 -5,-0.3 2,-0.5 0.666 75.6 114.3 68.9 20.2 26.3 -16.1 2.7 40 41 A V E -a 10 0A 2 -6,-0.4 2,-0.5 -5,-0.4 -2,-0.2 -0.980 50.0-163.2-122.4 118.5 29.6 -16.0 4.6 41 42 A K E -a 11 0A 94 -31,-3.2 -29,-2.6 -2,-0.5 2,-0.6 -0.889 6.7-150.6-103.6 127.5 30.1 -18.1 7.8 42 43 A L E -a 12 0A 8 -2,-0.5 2,-0.5 -31,-0.2 -29,-0.2 -0.859 9.0-163.3 -97.5 122.7 32.8 -17.3 10.3 43 44 A V E -a 13 0A 36 -31,-3.0 -29,-2.7 -2,-0.6 2,-0.2 -0.921 18.7-127.6-106.2 126.8 34.2 -20.3 12.2 44 45 A G E +a 14 0A 22 -2,-0.5 -29,-0.2 -31,-0.2 -18,-0.1 -0.486 27.9 174.4 -75.7 139.3 36.2 -19.6 15.4 45 46 A V + 0 0 66 -31,-2.0 -30,-0.2 -2,-0.2 -1,-0.1 0.375 43.2 114.2-120.8 -3.0 39.6 -21.1 15.9 46 47 A A S S- 0 0 16 -32,-0.6 2,-0.7 -22,-0.1 -23,-0.1 -0.389 78.1-100.0 -73.8 149.8 40.7 -19.3 19.1 47 48 A N > - 0 0 85 1,-0.2 3,-0.6 -2,-0.1 -1,-0.1 -0.597 30.9-167.2 -73.4 108.7 41.2 -21.3 22.4 48 49 A R T 3 S+ 0 0 178 -2,-0.7 -1,-0.2 1,-0.2 -2,-0.0 0.732 85.4 57.3 -70.8 -23.7 38.0 -20.8 24.4 49 50 A A T 3 S+ 0 0 83 2,-0.0 -1,-0.2 0, 0.0 2,-0.1 0.728 88.2 95.9 -78.2 -23.8 39.6 -22.2 27.6 50 51 A A < - 0 0 18 -3,-0.6 3,-0.1 1,-0.1 -4,-0.0 -0.351 55.5-164.0 -71.3 148.9 42.4 -19.6 27.5 51 52 A T + 0 0 109 1,-0.1 2,-0.4 -2,-0.1 -1,-0.1 0.036 66.2 78.7-126.3 24.6 42.1 -16.4 29.6 52 53 A N > - 0 0 69 1,-0.1 4,-2.0 2,-0.0 5,-0.1 -0.829 52.1-175.2-135.3 97.7 44.8 -14.1 28.1 53 54 A S H > S+ 0 0 5 -2,-0.4 4,-1.7 1,-0.2 -36,-0.2 0.868 84.2 48.5 -61.1 -43.7 43.6 -12.5 24.8 54 55 A Q H > S+ 0 0 52 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.902 111.4 50.4 -66.4 -42.3 46.9 -10.7 24.0 55 56 A E H > S+ 0 0 94 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.876 107.5 54.4 -61.0 -40.7 48.9 -13.9 24.6 56 57 A Q H X S+ 0 0 26 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.875 108.2 48.8 -64.0 -39.0 46.6 -15.9 22.3 57 58 A F H X S+ 0 0 4 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.933 111.9 50.3 -59.9 -48.7 47.2 -13.4 19.5 58 59 A N H X S+ 0 0 70 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.904 110.4 47.9 -58.4 -46.4 50.9 -13.7 20.1 59 60 A L H X S+ 0 0 95 -4,-2.8 4,-1.6 2,-0.2 -1,-0.2 0.911 112.6 49.5 -61.7 -44.4 50.9 -17.5 20.0 60 61 A M H X S+ 0 0 16 -4,-2.1 4,-0.7 2,-0.2 5,-0.4 0.911 114.4 44.8 -58.8 -47.2 48.8 -17.5 16.8 61 62 A M H >< S+ 0 0 28 -4,-2.6 3,-0.9 1,-0.2 -2,-0.2 0.919 112.4 50.7 -64.8 -46.7 51.2 -15.0 15.2 62 63 A A H 3< S+ 0 0 91 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.772 103.8 60.1 -63.2 -29.0 54.4 -16.8 16.4 63 64 A S H 3< S- 0 0 73 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.735 96.7-141.5 -72.2 -25.9 53.1 -20.1 15.0 64 65 A G << + 0 0 38 -3,-0.9 2,-1.1 -4,-0.7 -3,-0.1 0.296 68.1 114.3 81.6 -10.4 52.9 -18.7 11.5 65 66 A Q - 0 0 161 -5,-0.4 -1,-0.2 256,-0.0 -2,-0.1 -0.769 51.9-170.7 -95.3 91.9 49.6 -20.5 10.7 66 67 A L - 0 0 43 -2,-1.1 -53,-0.1 1,-0.1 4,-0.1 -0.520 15.8-136.5 -85.2 146.8 47.2 -17.6 10.3 67 68 A P - 0 0 10 0, 0.0 254,-0.3 0, 0.0 255,-0.2 -0.003 34.6 -99.5 -77.2-163.9 43.4 -17.8 10.0 68 69 A D S S+ 0 0 26 -55,-2.1 251,-2.0 1,-0.3 2,-0.3 0.787 103.4 22.7 -89.4 -34.0 41.4 -15.7 7.5 69 70 A I E -bC 14 318A 0 -56,-2.1 -54,-2.9 249,-0.2 2,-0.5 -0.990 62.5-160.7-134.8 140.7 40.4 -13.0 10.0 70 71 A V E +bC 15 317A 0 247,-1.8 247,-2.3 -2,-0.3 2,-0.3 -0.993 21.5 170.4-121.7 125.1 41.8 -11.8 13.3 71 72 A G E +bC 16 316A 1 -56,-2.2 -54,-0.7 -2,-0.5 245,-0.2 -0.843 12.5 100.1-127.4 165.5 39.5 -9.8 15.7 72 73 A G E - C 0 315A 0 243,-1.8 243,-2.2 313,-0.9 3,-0.5 -0.772 59.1 -59.8 146.6 173.8 39.5 -8.5 19.3 73 74 A D S S+ 0 0 18 241,-0.2 241,-0.2 -2,-0.2 -56,-0.1 -0.528 105.9 15.5 -86.4 152.1 40.0 -5.7 21.7 74 75 A N S S+ 0 0 60 -2,-0.2 240,-0.2 1,-0.1 -1,-0.2 0.829 86.2 118.6 57.2 40.3 43.3 -3.7 22.2 75 76 A L > + 0 0 6 238,-1.4 4,-3.2 -3,-0.5 5,-0.2 0.355 32.7 105.6-113.8 1.9 44.8 -5.0 18.9 76 77 A K H > S+ 0 0 61 237,-1.8 4,-2.3 1,-0.2 5,-0.2 0.918 84.1 45.8 -47.2 -55.5 45.3 -1.6 17.1 77 78 A D H > S+ 0 0 48 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.875 115.7 46.2 -58.8 -41.3 49.0 -1.6 17.7 78 79 A K H > S+ 0 0 40 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.852 109.8 54.2 -71.6 -36.4 49.4 -5.2 16.6 79 80 A F H X S+ 0 0 0 -4,-3.2 4,-0.8 2,-0.2 -2,-0.2 0.900 113.9 42.7 -59.6 -43.4 47.2 -4.7 13.6 80 81 A I H X S+ 0 0 5 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.927 116.5 45.9 -70.3 -47.5 49.4 -1.8 12.5 81 82 A R H X S+ 0 0 84 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.945 120.4 37.0 -64.1 -51.8 52.8 -3.5 13.2 82 83 A Y H <>S+ 0 0 40 -4,-2.3 5,-2.7 2,-0.2 6,-1.2 0.634 112.8 61.5 -78.7 -13.6 52.0 -6.9 11.6 83 84 A G H ><5S+ 0 0 3 -4,-0.8 3,-1.1 -5,-0.3 -2,-0.2 0.936 106.4 44.0 -69.2 -49.8 50.1 -5.1 8.9 84 85 A M H 3<5S+ 0 0 50 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.779 111.3 55.0 -66.0 -28.0 53.3 -3.2 7.8 85 86 A E T 3<5S- 0 0 122 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.542 121.6-111.0 -81.6 -9.7 55.2 -6.5 8.2 86 87 A G T < 5S+ 0 0 42 -3,-1.1 -3,-0.2 2,-0.3 -2,-0.1 0.508 88.0 114.9 96.9 7.6 52.6 -8.1 5.8 87 88 A A S + 0 0 0 32,-2.8 4,-2.9 -2,-0.1 5,-0.3 0.471 62.4 100.5-106.3 -4.4 42.3 -2.4 3.0 92 93 A N H > S+ 0 0 53 31,-0.3 4,-2.2 1,-0.2 5,-0.1 0.891 89.8 34.7 -50.3 -57.5 42.5 0.9 1.2 93 94 A K H > S+ 0 0 147 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.905 116.6 55.2 -67.2 -44.0 41.8 -0.4 -2.4 94 95 A L H > S+ 0 0 25 -4,-0.3 4,-1.5 2,-0.2 5,-0.2 0.879 111.3 45.0 -56.7 -42.5 39.4 -3.1 -1.2 95 96 A I H X S+ 0 0 10 -4,-2.9 4,-2.6 2,-0.2 3,-0.3 0.959 112.4 50.7 -64.3 -53.6 37.2 -0.5 0.6 96 97 A D H < S+ 0 0 99 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.837 120.3 35.2 -53.6 -38.0 37.3 2.0 -2.3 97 98 A Q H < S+ 0 0 122 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.668 134.7 16.8 -94.5 -19.6 36.2 -0.7 -4.8 98 99 A N H < S+ 0 0 37 -4,-1.5 -3,-0.2 -3,-0.3 -2,-0.2 0.486 106.3 72.7-132.7 -6.8 33.9 -2.9 -2.8 99 100 A A X + 0 0 1 -4,-2.6 4,-2.3 -5,-0.2 5,-0.2 -0.606 37.6 162.6-127.9 74.1 32.7 -1.1 0.4 100 101 A P H > S+ 0 0 84 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.836 80.3 52.1 -60.3 -39.0 30.1 1.7 -0.1 101 102 A N H > S+ 0 0 59 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.895 113.0 44.3 -66.0 -41.8 28.9 1.8 3.6 102 103 A L H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.870 113.1 52.5 -66.7 -40.0 32.5 2.0 4.9 103 104 A K H X S+ 0 0 91 -4,-2.3 4,-2.0 -8,-0.2 -2,-0.2 0.910 111.7 45.5 -61.4 -45.1 33.3 4.7 2.2 104 105 A A H X S+ 0 0 56 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.831 112.8 51.7 -69.1 -34.7 30.3 6.7 3.3 105 106 A F H X S+ 0 0 4 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.950 111.9 44.9 -64.9 -50.2 31.2 6.3 6.9 106 107 A F H < S+ 0 0 11 -4,-2.8 7,-0.2 1,-0.2 -2,-0.2 0.845 109.4 57.1 -63.6 -35.5 34.8 7.4 6.5 107 108 A K H < S+ 0 0 165 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.911 115.9 35.4 -59.2 -44.8 33.6 10.4 4.3 108 109 A T H < S+ 0 0 88 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.581 124.5 44.7 -88.2 -12.6 31.4 11.6 7.1 109 110 A H >X + 0 0 43 -4,-1.4 4,-1.4 1,-0.1 3,-0.8 -0.545 61.8 158.6-128.0 67.4 33.9 10.6 9.9 110 111 A P H 3> S+ 0 0 48 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.873 73.0 61.6 -59.7 -36.5 37.3 11.7 8.7 111 112 A E H 3> S+ 0 0 96 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.822 102.5 50.9 -57.9 -36.0 38.7 11.6 12.2 112 113 A V H <> S+ 0 0 1 -3,-0.8 4,-1.2 2,-0.2 -1,-0.2 0.912 108.3 51.2 -68.6 -44.2 38.0 7.9 12.5 113 114 A Q H >X S+ 0 0 75 -4,-1.4 4,-0.7 -7,-0.2 3,-0.5 0.914 110.6 49.5 -59.2 -43.7 39.8 7.1 9.2 114 115 A R H >< S+ 0 0 153 -4,-2.2 3,-0.7 1,-0.2 -1,-0.2 0.878 106.7 56.4 -60.3 -40.4 42.9 9.1 10.4 115 116 A A H 3< S+ 0 0 32 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.743 112.4 40.3 -67.0 -25.8 42.9 7.2 13.8 116 117 A I H << S+ 0 0 0 -4,-1.2 8,-0.7 -3,-0.5 2,-0.4 0.433 90.6 107.4-103.5 -2.1 43.1 3.7 12.1 117 118 A T B << -G 123 0D 40 -3,-0.7 6,-0.2 -4,-0.7 5,-0.1 -0.653 64.3-135.5 -82.4 129.0 45.6 4.7 9.3 118 119 A A > - 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0 0 5 0, 0.0 2,-0.4 0, 0.0 262,-0.1 -0.198 4.0-142.4 -65.3 162.8 31.5 3.5 20.0 131 132 A D + 0 0 51 260,-0.1 2,-0.2 258,-0.1 260,-0.1 -0.993 55.9 53.4-133.9 125.0 28.6 5.9 20.1 132 133 A G - 0 0 22 -2,-0.4 3,-0.1 258,-0.1 258,-0.0 -0.721 66.8-115.3 136.4 171.6 28.1 8.4 22.9 133 134 A L S S+ 0 0 119 -2,-0.2 175,-1.7 1,-0.1 2,-0.1 0.827 87.1 41.9-107.3 -60.8 30.0 11.2 24.8 134 135 A V + 0 0 8 173,-0.2 173,-0.2 1,-0.1 -1,-0.1 -0.466 51.3 173.4 -89.7 163.0 30.6 10.2 28.4 135 136 A S + 0 0 1 1,-0.4 135,-1.8 171,-0.4 2,-0.2 0.461 56.4 22.5-127.3 -80.8 31.6 6.8 29.7 136 137 A R E +I 269 0F 12 133,-0.2 -1,-0.4 134,-0.1 2,-0.3 -0.587 53.7 170.2-100.1 155.9 32.4 6.4 33.4 137 138 A G E -I 268 0F 0 131,-2.2 131,-1.9 -2,-0.2 2,-0.3 -0.954 40.5 -87.9-149.9 166.8 31.4 8.4 36.5 138 139 A Y E -IJ 267 292F 3 154,-0.7 154,-2.8 -2,-0.3 2,-0.4 -0.614 38.7-168.1 -78.7 137.5 31.7 8.1 40.3 139 140 A F E -IJ 266 291F 0 127,-2.5 127,-2.3 -2,-0.3 2,-0.3 -0.990 4.7-174.9-126.1 136.5 28.9 6.3 42.1 140 141 A I E -IJ 265 290F 0 150,-2.6 150,-2.6 -2,-0.4 2,-1.2 -0.940 36.0-102.6-131.4 152.8 28.3 6.3 45.8 141 142 A R E > - J 0 289F 0 123,-2.4 4,-2.1 -2,-0.3 3,-0.3 -0.640 33.6-175.9 -76.6 97.5 25.9 4.5 48.2 142 143 A Q H > S+ 0 0 39 146,-2.5 4,-2.6 -2,-1.2 5,-0.2 0.838 82.7 56.5 -62.8 -36.8 23.4 7.3 49.0 143 144 A D H > S+ 0 0 29 145,-0.8 4,-2.2 2,-0.2 -1,-0.2 0.848 108.2 47.8 -64.9 -34.2 21.6 5.1 51.5 144 145 A W H > S+ 0 0 1 144,-0.3 4,-2.1 -3,-0.3 -2,-0.2 0.903 110.8 51.5 -71.1 -42.9 24.9 4.5 53.4 145 146 A L H <>S+ 0 0 0 -4,-2.1 5,-3.4 2,-0.2 -2,-0.2 0.940 114.5 42.8 -54.8 -51.1 25.6 8.3 53.4 146 147 A D H ><5S+ 0 0 84 -4,-2.6 3,-1.4 3,-0.2 -2,-0.2 0.906 112.5 52.1 -65.1 -45.4 22.1 9.0 54.8 147 148 A K H 3<5S+ 0 0 118 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.848 114.0 43.8 -60.4 -36.1 22.2 6.2 57.4 148 149 A L T 3<5S- 0 0 36 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.327 114.7-118.6 -91.2 6.7 25.6 7.4 58.6 149 150 A H T < 5 + 0 0 171 -3,-1.4 2,-0.4 1,-0.2 -3,-0.2 0.887 64.2 146.5 55.8 46.0 24.4 11.0 58.6 150 151 A L < - 0 0 38 -5,-3.4 -1,-0.2 -6,-0.2 2,-0.2 -0.902 44.5-133.8-113.6 139.5 27.0 12.0 56.1 151 152 A K - 0 0 194 -2,-0.4 3,-0.1 1,-0.1 11,-0.1 -0.525 46.3 -79.8 -81.3 156.1 26.8 14.6 53.3 152 153 A T - 0 0 46 -2,-0.2 2,-0.2 1,-0.1 -1,-0.1 -0.400 56.8-110.0 -53.6 124.1 28.0 13.8 49.8 153 154 A P - 0 0 1 0, 0.0 -1,-0.1 0, 0.0 140,-0.1 -0.426 36.5-179.6 -65.1 130.8 31.8 14.3 49.9 154 155 A Q + 0 0 76 -2,-0.2 142,-3.0 141,-0.1 2,-0.2 0.650 64.7 35.2-104.4 -24.4 32.9 17.3 47.9 155 156 A T B > S-m 296 0G 38 140,-0.3 4,-2.1 1,-0.1 142,-0.2 -0.766 87.1-105.3-124.6 170.3 36.7 17.1 48.5 156 157 A V H > S+ 0 0 14 140,-1.4 4,-2.3 -2,-0.2 5,-0.1 0.872 121.6 53.0 -63.4 -38.8 39.3 14.3 48.8 157 158 A D H > S+ 0 0 131 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.886 110.1 47.1 -62.1 -42.7 39.5 14.9 52.5 158 159 A E H > S+ 0 0 89 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.865 110.6 52.6 -67.6 -38.1 35.7 14.6 52.9 159 160 A L H X S+ 0 0 0 -4,-2.1 4,-3.3 2,-0.2 5,-0.3 0.897 105.5 54.4 -62.9 -42.4 35.8 11.4 50.8 160 161 A Y H X S+ 0 0 66 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.925 109.8 47.6 -55.6 -46.6 38.4 10.0 53.1 161 162 A T H X S+ 0 0 85 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.918 113.5 47.9 -59.8 -46.5 36.1 10.6 56.0 162 163 A V H X S+ 0 0 5 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.944 113.2 45.9 -60.7 -50.7 33.2 9.1 54.2 163 164 A L H X S+ 0 0 2 -4,-3.3 4,-2.2 1,-0.2 -1,-0.2 0.858 111.6 52.6 -65.2 -36.5 35.1 5.9 53.1 164 165 A K H X S+ 0 0 30 -4,-2.3 4,-2.6 -5,-0.3 5,-0.2 0.888 110.3 48.4 -62.2 -40.9 36.5 5.5 56.6 165 166 A A H X S+ 0 0 12 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.881 109.5 53.0 -66.8 -39.1 32.9 5.7 58.0 166 167 A F H < S+ 0 0 0 -4,-2.5 4,-0.2 1,-0.2 -2,-0.2 0.912 115.5 41.4 -57.9 -44.1 31.9 3.2 55.4 167 168 A K H < S+ 0 0 53 -4,-2.2 12,-0.3 -5,-0.2 -2,-0.2 0.893 127.7 26.8 -71.9 -41.0 34.6 0.9 56.6 168 169 A E H < S+ 0 0 90 -4,-2.6 -3,-0.2 1,-0.1 -2,-0.2 0.660 110.2 61.7-102.7 -20.2 34.3 1.4 60.4 169 170 A K S < S- 0 0 136 -4,-2.4 -1,-0.1 -5,-0.2 -3,-0.1 0.209 94.1-123.7-105.3 16.3 30.7 2.3 61.1 170 171 A D > + 0 0 46 -4,-0.2 3,-1.4 -3,-0.2 5,-0.2 0.887 34.7 178.4 53.1 57.4 28.9 -0.8 59.9 171 172 A P T 3 S+ 0 0 1 0, 0.0 -1,-0.1 0, 0.0 -5,-0.1 0.806 79.5 56.3 -64.1 -28.5 26.4 0.7 57.4 172 173 A N T 3 S- 0 0 24 4,-0.2 -2,-0.1 89,-0.1 90,-0.0 0.547 105.1-135.2 -79.9 -5.1 25.0 -2.7 56.4 173 174 A G < + 0 0 54 -3,-1.4 -3,-0.0 1,-0.1 -1,-0.0 0.625 68.0 120.6 71.8 20.9 24.2 -3.1 60.1 174 175 A N S S- 0 0 67 2,-0.3 -1,-0.1 0, 0.0 3,-0.1 0.372 80.6-114.9 -99.1 4.7 25.3 -6.7 60.6 175 176 A G S S+ 0 0 68 1,-0.3 2,-0.3 -5,-0.2 -5,-0.0 0.410 80.7 111.9 80.0 -1.2 27.9 -6.0 63.3 176 177 A K S S- 0 0 128 -6,-0.0 2,-1.7 1,-0.0 3,-0.4 -0.809 73.8-128.7-106.8 145.6 30.8 -7.0 61.1 177 178 A A + 0 0 80 -2,-0.3 -9,-0.1 1,-0.2 -10,-0.1 -0.545 69.4 124.7 -83.1 67.4 33.6 -5.0 59.5 178 179 A D + 0 0 45 -2,-1.7 -1,-0.2 2,-0.0 -11,-0.1 0.509 31.9 116.9-105.7 -10.6 32.8 -6.5 56.1 179 180 A E - 0 0 4 -3,-0.4 84,-0.2 -12,-0.3 83,-0.1 -0.356 48.8-158.1 -64.3 136.2 32.2 -3.3 54.2 180 181 A I E -k 263 0F 19 82,-4.3 84,-1.8 1,-0.2 85,-0.4 -0.960 5.3-160.2-114.3 107.7 34.5 -2.5 51.3 181 182 A P E S+ 0 0 0 0, 0.0 84,-0.9 0, 0.0 2,-0.5 0.927 74.3 29.3 -58.3 -54.8 34.4 1.3 50.7 182 183 A F E S+kl 265 242F 3 59,-2.2 61,-2.3 82,-0.2 2,-0.3 -0.941 70.8 169.2-114.7 124.7 35.7 1.4 47.1 183 184 A I - 0 0 0 82,-3.0 84,-0.4 -2,-0.5 2,-0.3 -0.838 7.2-174.2-124.5 161.6 35.3 -1.4 44.6 184 185 A N - 0 0 0 -2,-0.3 66,-0.4 82,-0.2 65,-0.1 -0.896 32.5-146.7-162.7 136.1 35.8 -1.8 40.8 185 186 A R S S+ 0 0 40 -2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.777 95.5 62.0 -55.1 -36.1 35.3 -4.2 37.9 186 187 A D > - 0 0 35 1,-0.1 3,-1.6 64,-0.1 4,-0.3 -0.902 68.3-157.4-108.4 115.5 38.5 -2.9 36.4 187 188 A P T > S+ 0 0 12 0, 0.0 3,-2.1 0, 0.0 4,-0.5 0.856 94.0 65.9 -51.8 -40.1 41.8 -3.3 38.2 188 189 A E T >> S+ 0 0 45 1,-0.3 4,-1.0 2,-0.2 3,-0.7 0.696 85.2 72.9 -59.0 -22.3 43.2 -0.3 36.2 189 190 A E H <> S+ 0 0 1 -3,-1.6 4,-0.8 1,-0.2 -1,-0.3 0.745 83.7 67.3 -65.9 -23.9 40.7 2.0 38.0 190 191 A V H X4 S+ 0 0 0 -3,-2.1 3,-0.7 -4,-0.3 -1,-0.2 0.887 99.9 50.3 -62.3 -37.2 42.8 1.7 41.2 191 192 A F H X4 S+ 0 0 4 -3,-0.7 3,-1.9 -4,-0.5 -1,-0.2 0.844 99.9 64.5 -66.4 -34.6 45.5 3.7 39.3 192 193 A R H >< S+ 0 0 2 -4,-1.0 3,-2.3 1,-0.3 -1,-0.2 0.736 82.0 79.6 -63.6 -21.7 42.9 6.3 38.3 193 194 A L G X< S+ 0 0 5 -4,-0.8 3,-1.7 -3,-0.7 4,-0.3 0.684 72.5 78.2 -58.0 -18.6 42.5 7.1 42.0 194 195 A V G X >S+ 0 0 0 -3,-1.9 5,-1.9 1,-0.3 3,-1.4 0.711 74.8 79.0 -63.6 -18.8 45.7 9.2 41.7 195 196 A N G X 5S+ 0 0 2 -3,-2.3 3,-1.7 1,-0.3 -1,-0.3 0.820 81.4 65.1 -52.4 -35.2 43.4 11.7 40.1 196 197 A F G < 5S+ 0 0 4 -3,-1.7 102,-1.7 1,-0.3 -1,-0.3 0.782 104.5 44.7 -61.1 -28.6 42.4 12.6 43.7 197 198 A W G < 5S- 0 0 36 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 -0.003 127.8 -96.1-108.8 29.6 45.9 13.8 44.2 198 199 A G T < 5S+ 0 0 3 -3,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.728 84.9 124.4 71.1 26.3 46.2 15.8 40.9 199 200 A A < - 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0 0 41 -2,-0.4 4,-1.8 1,-0.1 3,-0.3 -0.825 11.3-149.5 -89.4 117.1 57.5 1.8 48.5 458 459 A P H > S+ 0 0 5 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.843 97.1 53.1 -53.1 -38.9 57.1 4.4 45.6 459 460 A E H 4 S+ 0 0 88 1,-0.2 4,-0.3 2,-0.2 3,-0.1 0.895 113.3 42.2 -64.8 -40.9 59.3 6.9 47.4 460 461 A K H 4 S+ 0 0 31 -3,-0.3 134,-0.3 1,-0.2 4,-0.2 0.703 121.7 38.5 -81.0 -22.1 62.2 4.4 47.9 461 462 A T H X S+ 0 0 7 -4,-1.8 4,-3.0 1,-0.1 5,-0.2 0.509 86.7 96.6-107.3 -5.9 62.0 2.9 44.4 462 463 A W H X S+ 0 0 17 -4,-1.3 4,-2.7 -5,-0.2 5,-0.2 0.884 85.0 46.6 -54.0 -50.9 61.3 6.0 42.2 463 464 A N H > S+ 0 0 94 -4,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.889 116.8 43.3 -62.5 -42.8 64.8 6.8 41.1 464 465 A D H > S+ 0 0 36 -4,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.877 112.4 55.0 -68.9 -38.2 65.6 3.1 40.2 465 466 A Y H X S+ 0 0 1 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.911 108.8 48.0 -56.5 -46.1 62.2 2.9 38.5 466 467 A Q H X S+ 0 0 23 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.882 111.2 50.2 -62.9 -41.8 63.1 6.0 36.4 467 468 A Q H X S+ 0 0 90 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.895 109.9 51.1 -62.1 -42.1 66.5 4.4 35.6 468 469 A Q H X S+ 0 0 72 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.888 107.1 53.3 -62.5 -41.2 64.7 1.2 34.6 469 470 A L H <>S+ 0 0 0 -4,-2.2 5,-2.7 2,-0.2 6,-0.3 0.918 110.8 47.5 -58.1 -45.1 62.4 3.2 32.3 470 471 A K H ><5S+ 0 0 113 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.934 111.6 49.5 -60.3 -49.5 65.5 4.7 30.7 471 472 A N H 3<5S+ 0 0 107 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.815 109.6 52.4 -59.4 -34.1 67.1 1.3 30.3 472 473 A R T 3<5S- 0 0 91 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.417 120.9-108.3 -86.6 -0.3 63.9 -0.1 28.7 473 474 A G T <>5S+ 0 0 6 -3,-1.5 4,-1.7 -4,-0.3 3,-0.4 0.596 73.3 138.5 88.7 13.9 63.8 2.7 26.2 474 475 A F H > S+ 0 0 78 -6,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.752 106.1 57.4 -75.2 -21.9 62.5 8.1 27.0 476 477 A Q H > S+ 0 0 98 -3,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.862 108.4 47.9 -67.2 -38.6 63.3 7.1 23.5 477 478 A V H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.911 109.4 53.1 -64.5 -43.8 59.6 6.5 23.1 478 479 A M H X S+ 0 0 25 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.863 105.9 54.5 -60.0 -38.1 58.9 9.9 24.7 479 480 A I H X S+ 0 0 81 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.942 110.5 43.4 -62.1 -50.2 61.2 11.6 22.2 480 481 A V H X S+ 0 0 12 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.865 113.2 52.9 -65.8 -36.7 59.4 10.2 19.1 481 482 A M H X S+ 0 0 8 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.923 112.5 44.5 -62.1 -45.9 56.0 11.0 20.6 482 483 A Q H X S+ 0 0 27 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.888 112.6 51.5 -66.9 -40.7 57.0 14.6 21.2 483 484 A K H X S+ 0 0 120 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.888 111.4 47.5 -61.8 -41.2 58.6 14.9 17.8 484 485 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -60,-0.3 0.882 112.1 50.0 -66.6 -40.7 55.4 13.6 16.2 485 486 A Y H X S+ 0 0 42 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.904 107.5 53.7 -62.4 -44.0 53.3 16.0 18.3 486 487 A D H < S+ 0 0 91 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.828 111.4 46.5 -61.8 -34.9 55.5 19.0 17.3 487 488 A R H < S+ 0 0 134 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.907 118.0 40.7 -68.7 -46.2 54.9 18.2 13.6 488 489 A Q H < 0 0 72 -4,-2.0 -2,-0.2 1,-0.1 -3,-0.2 0.804 360.0 360.0 -78.5 -33.1 51.2 17.7 13.9 489 490 A Y < 0 0 144 -4,-2.8 -1,-0.1 -5,-0.2 0, 0.0 -0.965 360.0 360.0-125.1 360.0 50.4 20.6 16.2 490 !* 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 0.0 491 2 B E > 0 0 122 0, 0.0 3,-1.3 0, 0.0 36,-0.0 0.000 360.0 360.0 360.0 148.5 54.5 -14.0 47.4 492 3 B A T 3 + 0 0 81 1,-0.3 35,-0.1 3,-0.0 36,-0.0 0.710 360.0 60.8 -69.1 -22.1 55.4 -10.8 45.5 493 4 B T T 3 S+ 0 0 24 34,-0.1 -1,-0.3 2,-0.0 34,-0.1 0.505 74.4 131.0 -83.8 -6.0 58.1 -9.9 47.9 494 5 B W < - 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0 0 8 -8,-1.3 2,-0.4 -2,-0.3 22,-0.2 -0.454 42.5-163.6 -60.9 137.8 69.9 -16.1 65.5 515 26 B D > - 0 0 33 -2,-0.1 3,-1.9 1,-0.1 6,-0.3 -0.964 18.3-159.5-131.6 113.0 67.0 -18.6 65.7 516 27 B E T 3 S+ 0 0 55 -2,-0.4 9,-0.1 1,-0.3 -1,-0.1 0.674 94.9 64.6 -63.2 -17.2 65.2 -19.7 62.5 517 28 B N T 3 S+ 0 0 121 4,-0.1 -1,-0.3 5,-0.1 16,-0.0 0.535 74.1 117.3 -84.6 -9.1 62.3 -20.6 64.8 518 29 B W S <> S- 0 0 16 -3,-1.9 4,-2.8 1,-0.1 5,-0.2 -0.368 73.8-128.4 -51.7 132.7 61.8 -17.0 65.7 519 30 B P H > S+ 0 0 42 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.873 111.1 49.7 -53.5 -39.5 58.3 -15.8 64.6 520 31 B V H > S+ 0 0 3 350,-2.4 4,-2.8 2,-0.2 5,-0.2 0.948 110.7 48.5 -64.5 -49.0 60.0 -12.8 62.8 521 32 B A H > S+ 0 0 9 349,-0.4 4,-2.4 -6,-0.3 -1,-0.2 0.901 112.3 50.7 -55.2 -43.6 62.6 -15.0 61.1 522 33 B R H X S+ 0 0 176 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.902 111.8 45.6 -60.9 -45.5 59.8 -17.3 60.0 523 34 B E H X S+ 0 0 27 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.898 112.2 50.7 -69.1 -41.4 57.7 -14.5 58.6 524 35 B V H X S+ 0 0 5 -4,-2.8 4,-2.2 1,-0.2 6,-0.4 0.915 111.3 50.0 -59.0 -43.8 60.7 -13.0 56.8 525 36 B A H X S+ 0 0 20 -4,-2.4 4,-2.2 -5,-0.2 5,-0.3 0.899 109.8 50.9 -60.6 -42.7 61.4 -16.4 55.3 526 37 B R H < S+ 0 0 131 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.887 116.2 39.8 -62.4 -41.5 57.8 -16.8 54.2 527 38 B L H < S+ 0 0 11 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.775 126.8 32.3 -83.2 -27.9 57.8 -13.4 52.4 528 39 B T H < S- 0 0 0 -4,-2.2 -33,-2.1 2,-0.2 -32,-0.9 0.621 94.0-130.8-103.2 -17.2 61.3 -13.5 50.9 529 40 B N S < S+ 0 0 24 -4,-2.2 -29,-2.2 -5,-0.3 2,-0.5 0.660 73.6 113.9 67.9 18.7 61.7 -17.3 50.3 530 41 B V E -s 500 0K 2 -6,-0.4 2,-0.4 -5,-0.3 -1,-0.2 -0.985 50.7-161.4-121.7 122.8 65.1 -17.1 52.0 531 42 B K E -s 501 0K 109 -31,-3.2 -29,-2.9 -2,-0.5 2,-0.6 -0.871 5.3-152.0-103.5 132.3 65.6 -18.9 55.3 532 43 B L E -s 502 0K 9 -2,-0.4 2,-0.5 -31,-0.2 -29,-0.2 -0.925 9.5-162.2-105.2 120.8 68.5 -18.1 57.6 533 44 B V E -s 503 0K 38 -31,-2.9 -29,-2.3 -2,-0.6 2,-0.2 -0.901 20.2-123.1-104.2 126.5 69.7 -20.9 59.8 534 45 B G E +s 504 0K 25 -2,-0.5 -29,-0.2 -31,-0.2 -18,-0.1 -0.449 30.8 172.2 -70.9 134.6 71.8 -20.1 62.9 535 46 B V + 0 0 46 -31,-2.1 -30,-0.2 -2,-0.2 -1,-0.1 0.256 41.7 113.9-123.6 6.4 75.3 -21.7 63.2 536 47 B A S S- 0 0 14 -32,-0.5 2,-0.3 -22,-0.2 -23,-0.1 -0.442 80.6 -87.4 -77.9 154.2 76.6 -19.8 66.2 537 48 B N > - 0 0 78 1,-0.1 3,-0.5 -2,-0.1 -1,-0.1 -0.475 31.6-163.6 -64.7 120.7 77.3 -21.5 69.5 538 49 B R T 3 S+ 0 0 159 -2,-0.3 -1,-0.1 1,-0.2 -25,-0.1 0.448 85.8 57.4 -82.8 -4.0 74.2 -21.6 71.7 539 50 B A T 3 S+ 0 0 88 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.304 85.1 106.4-124.0 47.1 76.2 -22.4 74.8 540 51 B A < - 0 0 21 -3,-0.5 3,-0.1 -29,-0.1 -4,-0.0 -0.881 49.7-160.1-128.9 158.3 78.6 -19.4 74.9 541 52 B T S S+ 0 0 127 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.346 73.2 62.4-121.9 3.9 78.9 -16.3 77.0 542 53 B N > - 0 0 66 1,-0.1 4,-1.7 -31,-0.0 -1,-0.2 -0.921 52.9-167.7-140.3 112.5 81.0 -13.9 75.0 543 54 B S H > S+ 0 0 5 -2,-0.4 4,-1.7 2,-0.2 -36,-0.2 0.862 89.5 49.7 -66.4 -41.8 79.9 -12.5 71.6 544 55 B Q H > S+ 0 0 52 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.895 112.7 46.9 -67.3 -41.3 83.3 -11.0 70.5 545 56 B E H > S+ 0 0 105 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.819 107.7 58.3 -68.6 -31.8 85.2 -14.2 71.3 546 57 B Q H X S+ 0 0 19 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.877 106.2 48.0 -63.3 -39.5 82.5 -16.2 69.4 547 58 B F H X S+ 0 0 4 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.926 113.6 48.1 -61.7 -47.2 83.3 -14.1 66.3 548 59 B N H X S+ 0 0 70 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.918 113.0 46.7 -59.2 -48.3 87.0 -14.8 66.9 549 60 B L H X S+ 0 0 78 -4,-3.2 4,-2.2 2,-0.2 6,-0.3 0.890 111.4 52.5 -61.8 -42.7 86.4 -18.5 67.4 550 61 B M H <>S+ 0 0 2 -4,-2.4 5,-0.6 1,-0.2 4,-0.3 0.927 111.9 46.1 -56.5 -47.9 84.1 -18.6 64.3 551 62 B M H <5S+ 0 0 54 -4,-2.4 3,-0.4 1,-0.2 -2,-0.2 0.837 118.3 41.8 -65.2 -36.3 86.9 -17.0 62.2 552 63 B A H <5S+ 0 0 89 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.711 103.0 65.1 -86.9 -23.5 89.6 -19.3 63.6 553 64 B S T <5S- 0 0 84 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.1 0.457 108.4-115.4 -81.5 -0.7 87.7 -22.6 63.5 554 65 B G T 5S+ 0 0 69 -3,-0.4 2,-0.7 1,-0.3 -3,-0.1 0.423 72.6 138.2 77.8 -1.4 87.5 -22.5 59.7 555 66 B Q < + 0 0 66 -5,-0.6 -1,-0.3 -6,-0.3 -2,-0.2 -0.682 28.1 179.0 -74.4 112.8 83.7 -22.3 60.0 556 67 B L - 0 0 61 -2,-0.7 -53,-0.1 -3,-0.1 4,-0.1 -0.943 6.0-168.3-118.9 112.1 82.6 -19.7 57.5 557 68 B P - 0 0 2 0, 0.0 254,-0.3 0, 0.0 -53,-0.2 -0.048 34.1-109.4 -75.3-173.6 78.8 -19.1 57.3 558 69 B D S S+ 0 0 24 -55,-2.7 251,-2.0 1,-0.3 2,-0.3 0.764 100.9 24.1 -89.2 -32.3 77.0 -17.1 54.5 559 70 B I E -tU 504 808K 0 -56,-2.0 -54,-2.8 249,-0.2 2,-0.4 -0.978 64.2-160.0-133.7 143.4 76.2 -14.1 56.8 560 71 B V E +tU 505 807K 0 247,-1.9 247,-2.3 -2,-0.3 2,-0.3 -0.997 22.0 168.6-124.6 127.1 77.8 -12.8 59.9 561 72 B G E +tU 506 806K 1 -56,-2.2 -54,-0.8 -2,-0.4 245,-0.2 -0.888 10.9 101.5-133.2 162.7 75.8 -10.5 62.2 562 73 B G E > - U 0 805K 0 243,-2.0 243,-2.1 313,-0.8 3,-0.5 -0.794 59.2 -57.6 149.7 174.3 76.0 -8.9 65.7 563 74 B D T 3 S+ 0 0 20 -2,-0.2 241,-0.2 241,-0.2 -54,-0.1 -0.536 107.1 13.6 -83.7 147.6 76.7 -5.9 67.9 564 75 B N T 3 S+ 0 0 57 -2,-0.2 240,-0.2 1,-0.1 -1,-0.2 0.822 85.9 120.6 61.5 39.2 80.0 -4.1 68.0 565 76 B L <> + 0 0 4 238,-1.2 4,-3.4 -3,-0.5 3,-0.3 0.424 31.7 105.6-111.2 -1.9 81.4 -5.7 64.9 566 77 B K H > S+ 0 0 57 237,-1.9 4,-2.7 1,-0.2 5,-0.2 0.898 84.1 45.4 -43.9 -57.3 82.0 -2.6 62.7 567 78 B D H > S+ 0 0 50 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.851 116.4 45.9 -60.6 -36.9 85.8 -2.7 63.1 568 79 B K H > S+ 0 0 42 -3,-0.3 4,-2.2 2,-0.2 5,-0.3 0.862 111.2 52.5 -74.9 -37.5 86.0 -6.4 62.5 569 80 B F H X S+ 0 0 0 -4,-3.4 4,-1.2 2,-0.2 -2,-0.2 0.925 115.4 42.2 -57.2 -46.7 83.6 -6.1 59.5 570 81 B I H X S+ 0 0 2 -4,-2.7 4,-2.5 -5,-0.3 -2,-0.2 0.954 116.7 45.7 -68.7 -51.8 86.0 -3.4 58.1 571 82 B R H X S+ 0 0 47 -4,-2.7 4,-1.0 1,-0.2 -3,-0.2 0.959 120.0 38.2 -56.8 -57.2 89.3 -5.2 58.9 572 83 B Y H <>S+ 0 0 67 -4,-2.2 5,-3.0 1,-0.2 6,-0.9 0.712 112.2 60.5 -72.7 -19.3 88.3 -8.6 57.7 573 84 B G H ><5S+ 0 0 4 -4,-1.2 3,-1.1 -5,-0.3 -1,-0.2 0.939 106.8 44.7 -65.0 -49.7 86.4 -7.0 54.8 574 85 B M H 3<5S+ 0 0 44 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.690 111.7 54.9 -66.9 -20.3 89.7 -5.5 53.6 575 86 B E T 3<5S- 0 0 123 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.511 122.0-108.8 -89.9 -8.5 91.3 -8.9 54.2 576 87 B G T < 5S+ 0 0 46 -3,-1.1 -3,-0.2 -4,-0.3 -2,-0.1 0.482 89.6 112.4 98.4 5.5 88.8 -10.6 51.9 577 88 B A S + 0 0 0 32,-2.8 4,-3.1 -2,-0.1 5,-0.3 0.488 61.7 101.1-106.9 -6.1 78.6 -4.4 48.9 582 93 B N H > S+ 0 0 48 31,-0.3 4,-2.4 1,-0.2 5,-0.1 0.880 90.5 35.4 -49.2 -55.7 78.8 -1.3 46.7 583 94 B K H > S+ 0 0 159 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.899 116.1 54.6 -68.6 -44.8 78.0 -2.9 43.4 584 95 B L H > S+ 0 0 27 -4,-0.3 4,-1.5 2,-0.2 5,-0.2 0.911 113.2 44.0 -53.0 -46.6 75.5 -5.4 44.9 585 96 B I H X S+ 0 0 9 -4,-3.1 4,-2.6 3,-0.2 3,-0.3 0.950 112.2 51.1 -64.0 -51.7 73.6 -2.5 46.5 586 97 B D H < S+ 0 0 106 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.840 120.8 34.3 -55.8 -37.6 73.7 -0.2 43.3 587 98 B Q H < S+ 0 0 149 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.657 135.3 17.1 -93.4 -19.7 72.3 -3.0 41.1 588 99 B N H < S+ 0 0 37 -4,-1.5 -3,-0.2 -3,-0.3 -2,-0.2 0.468 106.2 71.7-135.8 -7.2 69.9 -4.8 43.4 589 100 B A X + 0 0 0 -4,-2.6 4,-2.6 -5,-0.2 3,-0.2 -0.567 38.1 160.2-126.1 71.5 69.0 -2.8 46.5 590 101 B P H > S+ 0 0 33 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.862 79.5 53.6 -58.4 -41.5 66.7 0.2 45.8 591 102 B N H > S+ 0 0 17 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.897 113.0 43.3 -60.2 -43.6 65.5 0.6 49.4 592 103 B L H > S+ 0 0 0 2,-0.2 4,-2.7 -3,-0.2 -1,-0.2 0.901 112.8 52.8 -66.9 -43.1 69.1 0.8 50.6 593 104 B K H X S+ 0 0 28 -4,-2.6 4,-1.7 -8,-0.2 -2,-0.2 0.914 111.9 45.8 -57.6 -46.2 70.0 3.2 47.8 594 105 B A H X S+ 0 0 17 -4,-2.8 4,-1.4 -134,-0.3 -1,-0.2 0.846 111.8 52.1 -66.1 -37.5 67.1 5.5 48.7 595 106 B F H X S+ 0 0 4 -4,-1.8 4,-1.2 -5,-0.2 -2,-0.2 0.914 109.4 48.9 -65.1 -44.5 68.0 5.3 52.4 596 107 B F H < S+ 0 0 9 -4,-2.7 7,-0.3 1,-0.2 -2,-0.2 0.854 106.7 56.8 -64.9 -36.4 71.7 6.3 51.7 597 108 B K H < S+ 0 0 136 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.877 114.8 37.1 -60.3 -41.3 70.6 9.2 49.5 598 109 B T H < S+ 0 0 97 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.592 126.0 41.4 -88.0 -12.6 68.6 10.7 52.4 599 110 B H >X + 0 0 43 -4,-1.2 4,-1.4 -5,-0.1 3,-1.0 -0.475 63.0 156.3-130.6 63.2 71.1 9.6 55.0 600 111 B P H 3> S+ 0 0 74 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.812 73.8 61.6 -61.1 -30.2 74.6 10.3 53.5 601 112 B E H 3> S+ 0 0 83 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.835 102.8 51.6 -61.3 -35.8 76.2 10.5 57.0 602 113 B V H <> S+ 0 0 0 -3,-1.0 4,-1.2 2,-0.2 -1,-0.2 0.909 108.8 48.7 -70.2 -44.3 75.2 6.9 57.6 603 114 B Q H X S+ 0 0 76 -4,-1.4 4,-0.9 -7,-0.3 3,-0.5 0.908 112.6 50.3 -58.5 -43.0 76.8 5.7 54.3 604 115 B R H >< S+ 0 0 87 -4,-2.3 3,-0.6 1,-0.2 -2,-0.2 0.901 106.9 54.5 -60.7 -43.3 79.9 7.7 55.3 605 116 B A H 3< S+ 0 0 21 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.728 113.3 41.0 -65.4 -25.1 79.9 6.1 58.8 606 117 B I H 3< S+ 0 0 0 -4,-1.2 8,-0.7 -3,-0.5 2,-0.3 0.511 89.8 107.1-102.6 -8.2 79.9 2.5 57.4 607 118 B T B << -Y 613 0N 44 -4,-0.9 6,-0.2 -3,-0.6 5,-0.1 -0.583 65.0-134.4 -78.1 128.4 82.3 3.0 54.5 608 119 B A > - 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B 0 779P 0 123,-2.6 4,-2.1 -2,-0.3 148,-0.2 -0.624 33.3-176.0 -76.0 97.4 63.6 5.9 93.9 632 143 B Q H > S+ 0 0 40 146,-2.3 4,-2.8 -2,-1.2 5,-0.2 0.855 83.1 56.3 -61.7 -37.6 61.2 8.8 94.8 633 144 B D H > S+ 0 0 28 145,-0.8 4,-2.2 2,-0.2 -1,-0.2 0.855 107.8 48.1 -64.3 -34.6 59.5 6.6 97.4 634 145 B W H > S+ 0 0 2 144,-0.3 4,-1.7 -3,-0.2 -2,-0.2 0.889 110.8 51.4 -70.5 -41.6 62.8 6.0 99.1 635 146 B L H <>S+ 0 0 0 -4,-2.1 5,-2.9 2,-0.2 -2,-0.2 0.950 113.7 44.0 -55.9 -51.0 63.5 9.8 99.0 636 147 B D H ><5S+ 0 0 85 -4,-2.8 3,-1.3 1,-0.2 -2,-0.2 0.897 111.4 53.5 -63.3 -42.9 60.1 10.6 100.5 637 148 B K H 3<5S+ 0 0 115 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.816 112.6 44.0 -62.1 -33.9 60.4 7.8 103.2 638 149 B L T 3<5S- 0 0 37 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.287 113.5-116.7 -95.2 8.2 63.7 9.1 104.4 639 150 B H T < 5 + 0 0 176 -3,-1.3 2,-0.4 1,-0.2 -3,-0.2 0.892 68.5 140.8 54.6 45.3 62.6 12.8 104.3 640 151 B L < - 0 0 46 -5,-2.9 -1,-0.2 -6,-0.2 2,-0.2 -0.911 46.3-134.5-116.2 144.2 65.1 13.7 101.6 641 152 B K - 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