==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-OCT-12 2YPO . COMPND 2 MOLECULE: PHOSPHO-2-DEHYDRO-3-DEOXYHEPTONATE ALDOLASE AROG; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR N.J.BLACKMORE,S.REICHAU,W.JIAO,R.D.HUTTON,E.N.BAKER,G.B.JAME . 917 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34262.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 650 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 92 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 59 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 329 35.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.3 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 2 0 2 0 2 0 0 5 1 0 4 2 2 0 2 0 4 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 1 5 4 4 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 PARALLEL BRIDGES PER LADDER . 4 0 4 0 1 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 . 4 1 0 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 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 0 188 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -65.9 97.1 -52.3 20.9 2 2 A N - 0 0 137 1,-0.1 467,-0.1 466,-0.0 0, 0.0 0.814 360.0 -84.7 69.3 34.4 93.7 -50.9 19.7 3 3 A W S S+ 0 0 163 1,-0.1 466,-2.6 465,-0.1 2,-0.3 0.696 90.5 115.9 57.6 47.1 91.4 -53.4 21.4 4 4 A T E -A 468 0A 44 464,-0.3 2,-0.4 -3,-0.1 464,-0.2 -0.890 45.3-156.5-140.0 151.7 91.4 -56.3 18.9 5 5 A V E -A 467 0A 16 462,-2.0 462,-2.4 -2,-0.3 2,-0.3 -0.990 16.5-136.0-134.8 140.9 92.6 -59.8 18.9 6 6 A D E -A 466 0A 76 -2,-0.4 460,-0.3 460,-0.2 619,-0.0 -0.753 10.7-157.1 -93.8 141.0 93.4 -61.8 15.8 7 7 A I E -A 465 0A 0 458,-3.8 458,-2.9 -2,-0.3 619,-0.0 -0.984 19.1-130.4-120.9 120.5 92.2 -65.3 15.4 8 8 A P E -A 464 0A 41 0, 0.0 2,-0.4 0, 0.0 456,-0.2 -0.338 11.3-147.8 -71.5 147.6 94.2 -67.5 13.0 9 9 A I 0 0 31 454,-1.6 36,-0.0 -2,-0.0 39,-0.0 -0.907 360.0 360.0-104.5 144.8 92.7 -69.5 10.3 10 10 A D 0 0 148 912,-0.6 454,-0.1 -2,-0.4 0, 0.0 -0.456 360.0 360.0-113.3 360.0 94.3 -72.8 9.2 11 ! 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 12 15 A L 0 0 113 0, 0.0 38,-0.0 0, 0.0 39,-0.0 0.000 360.0 360.0 360.0 158.9 86.8 -82.2 2.6 13 16 A P - 0 0 116 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.355 360.0-116.4 -58.1 140.6 85.8 -83.4 -1.0 14 17 A P - 0 0 103 0, 0.0 3,-0.1 0, 0.0 6,-0.0 -0.177 42.2 -79.2 -71.4 174.2 84.7 -80.5 -3.3 15 18 A L - 0 0 46 1,-0.1 5,-0.1 2,-0.1 242,-0.0 -0.298 69.4 -74.3 -65.5 159.2 81.1 -80.4 -4.6 16 19 A P > - 0 0 49 0, 0.0 4,-2.4 0, 0.0 5,-0.2 -0.195 41.0-119.5 -60.4 147.7 80.4 -82.7 -7.6 17 20 A T H > S+ 0 0 93 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.891 111.1 51.1 -53.8 -47.1 81.9 -81.5 -11.0 18 21 A D H > S+ 0 0 95 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.900 112.3 46.5 -62.6 -42.7 78.6 -81.3 -12.8 19 22 A L H > S+ 0 0 8 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.901 112.3 50.9 -63.5 -41.4 77.0 -79.2 -10.1 20 23 A R H X S+ 0 0 96 -4,-2.4 4,-3.2 2,-0.2 -2,-0.2 0.882 106.5 54.6 -63.7 -39.9 80.1 -77.0 -10.0 21 24 A T H X S+ 0 0 88 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.894 110.2 46.9 -62.5 -40.9 79.9 -76.5 -13.8 22 25 A R H X S+ 0 0 139 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.900 114.8 46.1 -62.4 -47.0 76.3 -75.3 -13.4 23 26 A L H X S+ 0 0 8 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.900 108.8 54.0 -65.4 -41.7 77.2 -73.0 -10.6 24 27 A D H X S+ 0 0 91 -4,-3.2 4,-0.7 2,-0.2 -1,-0.2 0.904 109.5 50.2 -61.3 -37.6 80.2 -71.6 -12.3 25 28 A A H >< S+ 0 0 69 -4,-1.7 3,-0.7 1,-0.2 4,-0.2 0.932 112.5 46.1 -66.9 -40.5 78.0 -70.7 -15.3 26 29 A A H >< S+ 0 0 13 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.914 110.9 51.2 -68.8 -39.8 75.5 -69.0 -13.2 27 30 A L H 3< S+ 0 0 26 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.591 90.0 78.3 -81.5 -2.6 78.0 -67.0 -11.2 28 31 A A T << S+ 0 0 85 -3,-0.7 -1,-0.3 -4,-0.7 -2,-0.2 0.621 76.7 101.0 -70.8 -17.7 79.6 -65.7 -14.3 29 32 A K S < S- 0 0 62 -3,-1.6 258,-0.1 -4,-0.2 2,-0.1 -0.313 91.6 -89.5 -64.2 151.5 76.7 -63.4 -14.4 30 33 A P - 0 0 103 0, 0.0 258,-2.4 0, 0.0 2,-0.5 -0.452 39.8-156.3 -67.0 140.3 77.3 -59.8 -13.2 31 34 A A > - 0 0 38 256,-0.2 3,-0.5 257,-0.2 2,-0.1 -0.970 5.8-147.6-120.2 119.8 76.7 -59.3 -9.5 32 35 A A T 3 S+ 0 0 29 -2,-0.5 250,-0.0 1,-0.2 249,-0.0 -0.418 74.2 19.5 -77.4 158.7 75.9 -55.9 -8.2 33 36 A Q T 3 S+ 0 0 43 1,-0.2 -1,-0.2 -2,-0.1 97,-0.1 0.682 81.1 155.9 63.4 22.4 76.9 -54.5 -4.7 34 37 A Q < - 0 0 47 -3,-0.5 -1,-0.2 1,-0.1 214,-0.1 -0.529 48.3-100.5 -82.1 150.2 79.7 -57.0 -4.1 35 38 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 114,-0.0 -0.291 25.6-131.8 -60.8 157.7 82.6 -56.2 -1.7 36 39 A T + 0 0 92 2,-0.0 3,-0.1 3,-0.0 -2,-0.0 0.125 56.1 132.0-106.7 32.1 85.9 -55.1 -3.3 37 40 A W - 0 0 20 1,-0.2 125,-0.1 2,-0.1 5,-0.0 -0.231 67.2 -76.6 -81.7 161.4 88.4 -57.3 -1.6 38 41 A P > - 0 0 57 0, 0.0 4,-2.6 0, 0.0 3,-0.2 -0.294 32.7-133.1 -61.9 143.2 91.1 -59.2 -3.3 39 42 A A H > S+ 0 0 82 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.802 104.3 53.7 -62.3 -39.5 90.1 -62.4 -5.1 40 43 A D H > S+ 0 0 115 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.915 110.9 45.2 -67.8 -37.5 92.9 -64.4 -3.7 41 44 A Q H > S+ 0 0 71 -3,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.908 113.0 51.8 -73.4 -42.2 92.0 -63.5 -0.1 42 45 A A H X S+ 0 0 3 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.913 108.4 51.9 -56.8 -50.7 88.2 -64.2 -0.8 43 46 A L H X S+ 0 0 89 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.911 107.4 51.8 -49.8 -47.2 89.1 -67.6 -2.3 44 47 A A H X S+ 0 0 51 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.925 112.4 46.3 -59.6 -40.4 91.1 -68.5 0.9 45 48 A M H X S+ 0 0 4 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.900 110.0 52.3 -72.7 -36.2 88.1 -67.5 3.1 46 49 A R H X S+ 0 0 38 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.906 106.2 55.3 -62.4 -40.6 85.6 -69.4 0.9 47 50 A T H < S+ 0 0 72 -4,-2.3 4,-0.4 1,-0.2 -2,-0.2 0.894 107.5 49.2 -62.7 -39.5 87.8 -72.4 1.3 48 51 A V H >< S+ 0 0 23 -4,-1.7 3,-1.8 1,-0.2 4,-0.4 0.968 112.8 47.4 -58.2 -51.2 87.6 -72.2 5.1 49 52 A L H >< S+ 0 0 0 -4,-2.4 3,-0.8 1,-0.3 -2,-0.2 0.759 97.3 70.0 -71.1 -22.4 83.9 -71.9 5.0 50 53 A E T 3< S+ 0 0 93 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.685 106.9 40.0 -64.8 -23.2 83.4 -74.8 2.6 51 54 A S T < S+ 0 0 40 -3,-1.8 503,-0.3 -4,-0.4 -1,-0.2 0.398 91.9 107.2-104.2 1.6 84.5 -77.2 5.4 52 55 A V S < S- 0 0 4 -3,-0.8 501,-0.1 -4,-0.4 3,-0.1 -0.410 82.5 -90.7 -80.0 156.7 82.7 -75.6 8.4 53 56 A P - 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.406 53.8-106.1 -55.1 139.4 79.6 -77.1 10.1 54 57 A P - 0 0 6 0, 0.0 218,-0.2 0, 0.0 3,-0.1 -0.229 9.9-136.5 -72.2 156.5 76.5 -75.8 8.4 55 58 A V S S+ 0 0 0 216,-2.2 2,-0.2 200,-0.1 217,-0.2 0.894 91.9 15.1 -75.8 -38.5 74.2 -73.2 10.1 56 59 A T S S- 0 0 0 215,-1.7 -1,-0.1 217,-0.2 215,-0.0 -0.731 76.7-132.3-126.7 167.5 71.1 -75.1 9.0 57 60 A V >> - 0 0 13 -2,-0.2 4,-1.2 1,-0.1 3,-1.0 -0.929 25.5-111.4-126.4 156.9 70.6 -78.7 7.6 58 61 A P H 3> S+ 0 0 29 0, 0.0 4,-2.6 0, 0.0 3,-0.5 0.888 110.9 60.5 -62.7 -32.3 68.6 -79.8 4.6 59 62 A S H 3> S+ 0 0 60 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.869 104.2 51.4 -60.5 -35.1 65.8 -81.6 6.5 60 63 A E H <> S+ 0 0 25 -3,-1.0 4,-2.1 2,-0.2 -1,-0.3 0.872 109.6 49.5 -66.1 -37.2 64.8 -78.3 8.2 61 64 A I H X S+ 0 0 2 -4,-1.2 4,-2.5 -3,-0.5 -2,-0.2 0.887 109.7 51.6 -70.0 -40.7 64.7 -76.5 4.8 62 65 A V H X S+ 0 0 64 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.931 111.0 48.9 -59.5 -44.8 62.4 -79.3 3.4 63 66 A R H X S+ 0 0 33 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.921 109.9 49.7 -61.5 -42.3 60.2 -78.9 6.3 64 67 A L H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.900 106.9 55.9 -62.4 -43.0 60.1 -75.2 5.9 65 68 A Q H X S+ 0 0 35 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.930 108.2 50.1 -55.1 -43.4 59.2 -75.7 2.2 66 69 A E H X S+ 0 0 118 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.915 111.6 46.3 -57.7 -44.8 56.2 -77.8 3.4 67 70 A Q H X S+ 0 0 43 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.869 111.7 51.7 -71.2 -34.8 55.0 -75.2 5.8 68 71 A L H X S+ 0 0 4 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.834 101.8 60.0 -70.9 -32.6 55.4 -72.5 3.2 69 72 A A H X S+ 0 0 15 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.892 103.9 52.9 -54.5 -38.8 53.4 -74.5 0.7 70 73 A Q H <>S+ 0 0 76 -4,-1.4 5,-2.7 1,-0.2 6,-0.6 0.879 108.1 49.5 -66.8 -40.5 50.6 -74.3 3.3 71 74 A V H ><5S+ 0 0 0 -4,-1.4 3,-1.8 4,-0.3 5,-0.3 0.926 108.6 51.9 -58.5 -50.1 51.0 -70.5 3.4 72 75 A A H 3<5S+ 0 0 13 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.861 107.0 55.3 -61.6 -31.0 50.9 -70.2 -0.4 73 76 A K T 3<5S- 0 0 98 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.373 121.7-105.5 -80.1 2.0 47.6 -72.3 -0.4 74 77 A G T < 5S+ 0 0 24 -3,-1.8 -3,-0.2 2,-0.2 -2,-0.1 0.657 95.5 106.4 85.5 16.6 45.9 -69.9 2.0 75 78 A E S - 0 0 13 -2,-0.3 3,-0.6 1,-0.1 4,-0.3 -0.925 21.4-128.4-119.4 154.7 76.0 -56.4 14.2 88 91 A F G > S+ 0 0 1 -2,-0.4 3,-1.2 1,-0.2 -1,-0.1 0.887 109.2 52.6 -63.0 -41.6 78.7 -58.5 15.6 89 92 A M G 3 S+ 0 0 70 1,-0.2 -1,-0.2 372,-0.1 -3,-0.0 0.755 111.9 43.9 -70.5 -20.8 78.9 -56.4 18.7 90 93 A D G < S+ 0 0 88 -3,-0.6 2,-2.2 1,-0.1 -1,-0.2 0.266 80.8 109.4-100.0 4.0 75.2 -56.7 19.5 91 94 A N < + 0 0 5 -3,-1.2 2,-0.3 -4,-0.3 -1,-0.1 -0.493 55.4 133.5 -81.5 65.7 75.1 -60.4 18.7 92 95 A T S > S- 0 0 32 -2,-2.2 4,-2.7 421,-0.1 5,-0.3 -0.753 71.8-104.4-118.2 164.1 74.6 -61.2 22.4 93 96 A E H > S+ 0 0 42 419,-0.4 4,-2.7 -2,-0.3 5,-0.3 0.926 117.3 47.6 -57.7 -48.9 72.3 -63.4 24.5 94 97 A P H > S+ 0 0 53 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.912 115.4 45.5 -66.6 -36.2 70.0 -60.6 25.7 95 98 A H H > S+ 0 0 14 2,-0.2 4,-2.0 1,-0.2 316,-0.3 0.931 115.5 44.1 -68.8 -49.2 69.6 -59.1 22.3 96 99 A I H X S+ 0 0 2 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.920 115.4 50.5 -58.5 -47.2 69.0 -62.4 20.5 97 100 A R H X S+ 0 0 92 -4,-2.7 4,-3.0 -5,-0.3 -2,-0.2 0.931 109.7 51.1 -58.2 -45.0 66.6 -63.5 23.3 98 101 A G H X S+ 0 0 3 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.901 111.6 45.7 -63.7 -36.0 64.8 -60.2 23.1 99 102 A N H X S+ 0 0 9 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.886 113.4 49.5 -73.7 -38.1 64.3 -60.5 19.3 100 103 A V H X S+ 0 0 3 -4,-3.0 4,-2.5 2,-0.2 -2,-0.2 0.939 111.9 49.1 -61.8 -44.7 63.2 -64.1 19.6 101 104 A R H X S+ 0 0 57 -4,-3.0 4,-2.6 -5,-0.2 -2,-0.2 0.931 110.3 51.2 -59.0 -47.3 60.8 -63.1 22.4 102 105 A A H X S+ 0 0 1 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.900 110.9 48.1 -57.7 -40.5 59.4 -60.3 20.2 103 106 A L H X S+ 0 0 2 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.895 112.7 46.8 -68.3 -44.0 58.8 -62.6 17.3 104 107 A L H X S+ 0 0 11 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.889 109.4 55.8 -64.8 -36.7 57.1 -65.2 19.4 105 108 A Q H X S+ 0 0 13 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.942 112.0 42.9 -61.6 -46.4 54.9 -62.5 21.1 106 109 A M H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.888 109.3 58.7 -59.7 -44.7 53.7 -61.3 17.7 107 110 A A H X S+ 0 0 5 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.852 103.4 49.9 -64.2 -39.4 53.2 -64.9 16.4 108 111 A V H X S+ 0 0 15 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.924 112.8 47.3 -65.7 -39.5 50.7 -65.9 19.1 109 112 A V H X S+ 0 0 0 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.909 116.1 45.4 -64.9 -42.6 48.6 -62.8 18.5 110 113 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.851 108.7 54.1 -70.6 -34.4 48.8 -63.4 14.8 111 114 A T H X>S+ 0 0 52 -4,-2.6 4,-1.8 2,-0.2 5,-1.1 0.946 111.7 47.2 -62.1 -45.7 48.0 -67.1 15.0 112 115 A Y H <5S+ 0 0 72 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.918 116.0 44.0 -61.6 -47.7 44.8 -66.2 17.1 113 116 A G H <5S+ 0 0 3 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.846 117.1 44.2 -66.1 -38.1 43.8 -63.5 14.6 114 117 A A H <5S- 0 0 12 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.703 94.2-141.0 -81.4 -19.6 44.5 -65.6 11.5 115 118 A S T <5S+ 0 0 108 -4,-1.8 -3,-0.2 1,-0.2 -4,-0.1 0.822 74.4 79.7 57.8 39.1 42.9 -68.8 12.9 116 119 A M S - 0 0 28 4,-3.1 3,-2.4 -2,-0.5 -2,-0.0 -0.151 37.6 -85.8 -85.3-176.3 78.5 -41.4 2.9 138 141 A A T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.700 127.1 53.7 -67.4 -18.5 77.7 -38.1 4.6 139 142 A L T 3 S- 0 0 123 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.309 121.4-104.9 -93.4 3.3 80.9 -38.1 6.6 140 143 A G S < S+ 0 0 56 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.644 81.1 125.3 80.1 21.1 83.1 -38.5 3.4 141 144 A L S S- 0 0 33 1,-0.1 -4,-3.1 14,-0.0 -1,-0.3 -0.716 73.3 -94.3-109.3 154.6 83.8 -42.2 4.1 142 145 A R B -J 136 0C 78 -2,-0.3 -6,-0.2 -6,-0.2 -7,-0.1 -0.453 63.6 -91.1 -63.7 141.1 83.3 -45.2 2.1 143 146 A S - 0 0 6 -8,-1.2 2,-0.4 -9,-0.3 -1,-0.1 -0.213 29.8-112.9 -65.6 143.0 79.9 -46.6 3.1 144 147 A Y - 0 0 9 8,-0.1 -1,-0.1 1,-0.1 8,-0.1 -0.604 31.8-176.8 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0.871 110.4 51.6 -52.9 -42.8 55.0 -65.9 25.8 195 198 A H H X S+ 0 0 1 -4,-2.2 4,-1.6 -5,-0.3 -1,-0.2 0.846 100.3 62.1 -78.9 -21.1 51.3 -64.8 26.3 196 199 A D H X S+ 0 0 90 -4,-1.5 4,-2.0 -3,-0.3 -1,-0.2 0.890 102.1 53.4 -63.1 -35.1 52.0 -63.6 30.0 197 200 A W H X S+ 0 0 76 -4,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.951 104.8 53.7 -61.3 -45.4 54.4 -61.1 28.4 198 201 A N H X S+ 0 0 0 -4,-1.5 4,-1.6 1,-0.2 -2,-0.2 0.879 105.1 54.6 -59.5 -30.7 51.6 -60.0 26.1 199 202 A R H X S+ 0 0 106 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.901 105.8 51.6 -69.6 -39.2 49.4 -59.4 29.3 200 203 A E H X S+ 0 0 96 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.923 106.1 56.0 -60.7 -42.4 52.0 -57.1 30.8 201 204 A F H X S+ 0 0 12 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.893 107.2 48.6 -55.2 -43.9 52.1 -55.1 27.5 202 205 A V H < S+ 0 0 23 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.948 111.5 48.9 -64.8 -46.3 48.4 -54.5 27.7 203 206 A R H < S+ 0 0 180 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.880 121.6 34.4 -59.8 -37.8 48.5 -53.4 31.4 204 207 A T H < S+ 0 0 71 -4,-2.3 -2,-0.2 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4,-2.7 2,-0.2 -1,-0.2 0.880 108.3 53.8 -67.6 -39.6 41.5 -61.3 26.9 217 220 A E H X S+ 0 0 68 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.912 109.7 48.3 -63.7 -40.6 40.0 -63.3 24.1 218 221 A I H X S+ 0 0 3 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.928 110.4 50.1 -61.6 -46.2 43.5 -64.8 23.4 219 222 A D H X S+ 0 0 19 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.914 111.2 50.0 -60.6 -43.9 44.0 -65.6 27.1 220 223 A R H X S+ 0 0 165 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.891 109.1 53.0 -63.8 -33.5 40.5 -67.3 27.2 221 224 A G H X S+ 0 0 23 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.913 110.6 45.5 -63.4 -46.9 41.5 -69.2 24.1 222 225 A L H X S+ 0 0 11 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.902 111.9 51.2 -62.3 -42.7 44.6 -70.5 25.8 223 226 A R H X S+ 0 0 151 -4,-2.9 4,-2.9 2,-0.2 -2,-0.2 0.879 106.7 55.8 -65.6 -30.1 42.8 -71.3 28.9 224 227 A F H X S+ 0 0 142 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.902 104.7 53.7 -67.0 -41.0 40.2 -73.3 26.8 225 228 A M H <>S+ 0 0 63 -4,-1.8 5,-1.8 2,-0.2 3,-0.3 0.950 110.8 44.4 -55.0 -48.4 43.0 -75.3 25.4 226 229 A S H ><5S+ 0 0 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S+ 0 0 100 -4,-2.1 4,-3.2 2,-0.2 5,-0.2 0.939 111.9 49.1 -58.3 -48.0 81.5 -62.9 43.7 482 24 B T H X S+ 0 0 89 -4,-2.4 4,-2.0 -5,-0.2 -2,-0.2 0.941 114.5 43.2 -55.1 -48.7 83.0 -63.8 47.0 483 25 B R H X S+ 0 0 116 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.884 114.8 49.0 -70.7 -39.8 82.7 -67.5 46.5 484 26 B L H X S+ 0 0 10 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.954 112.0 49.3 -64.8 -45.7 83.9 -67.4 42.9 485 27 B D H X S+ 0 0 78 -4,-3.2 4,-1.0 -5,-0.2 -2,-0.2 0.905 112.3 48.7 -56.3 -43.5 86.9 -65.2 43.8 486 28 B A H X S+ 0 0 58 -4,-2.0 4,-0.8 -5,-0.2 3,-0.4 0.910 111.5 49.7 -68.8 -37.9 87.8 -67.6 46.7 487 29 B A H >< S+ 0 0 3 -4,-2.5 3,-1.1 1,-0.2 266,-0.2 0.953 112.5 45.0 -65.6 -45.6 87.6 -70.6 44.5 488 30 B L H 3< S+ 0 0 34 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.648 103.7 65.6 -75.6 -12.0 89.8 -69.2 41.8 489 31 B A H 3< S+ 0 0 86 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.693 85.6 94.5 -80.5 -15.7 92.3 -67.9 44.4 490 32 B K S << S- 0 0 69 -3,-1.1 258,-0.1 -4,-0.8 259,-0.1 -0.264 96.4 -79.7 -69.2 163.1 93.1 -71.5 45.2 491 33 B P - 0 0 105 0, 0.0 258,-2.5 0, 0.0 2,-0.5 -0.328 47.2-159.6 -65.8 137.3 96.0 -73.4 43.6 492 34 B A > - 0 0 42 256,-0.2 3,-0.5 257,-0.2 2,-0.1 -0.965 3.1-151.0-124.1 119.1 95.1 -74.6 40.1 493 35 B A T 3 S+ 0 0 26 -2,-0.5 250,-0.0 1,-0.2 249,-0.0 -0.455 71.4 20.7 -79.0 162.0 97.1 -77.4 38.5 494 36 B Q T 3 S+ 0 0 43 1,-0.2 -1,-0.2 -2,-0.1 249,-0.1 0.679 80.7 153.8 58.6 24.4 97.6 -77.9 34.7 495 37 B Q < - 0 0 47 -3,-0.5 -1,-0.2 1,-0.1 214,-0.1 -0.547 48.4-103.9 -80.6 150.5 96.8 -74.3 33.7 496 38 B P - 0 0 15 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.287 25.5-131.0 -62.1 155.1 98.3 -72.7 30.5 497 39 B T + 0 0 85 2,-0.0 125,-0.3 3,-0.0 3,-0.0 -0.912 54.8 131.0-112.8 93.3 101.1 -70.3 31.0 498 40 B W - 0 0 26 -2,-0.8 125,-0.1 125,-0.1 5,-0.0 -0.938 65.9 -74.4-136.3 160.9 100.1 -67.3 29.0 499 41 B P > - 0 0 59 0, 0.0 4,-2.4 0, 0.0 3,-0.2 -0.297 33.5-132.6 -63.2 143.3 100.2 -63.6 30.1 500 42 B A H > S+ 0 0 83 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.838 104.5 54.3 -64.1 -36.5 97.4 -62.5 32.4 501 43 B D H > S+ 0 0 108 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.889 109.8 44.9 -66.0 -39.8 96.7 -59.4 30.4 502 44 B Q H > S+ 0 0 87 -3,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.900 113.1 52.1 -74.3 -43.6 96.1 -61.3 27.2 503 45 B A H X S+ 0 0 3 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.929 107.9 53.0 -50.4 -48.7 94.0 -63.9 29.1 504 46 B L H X S+ 0 0 91 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.891 106.2 51.4 -53.6 -46.8 91.9 -61.1 30.5 505 47 B A H X S+ 0 0 18 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.911 112.0 46.9 -58.7 -46.1 91.2 -59.7 27.1 506 48 B M H X S+ 0 0 8 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.907 110.7 52.1 -67.0 -39.6 90.0 -63.1 25.8 507 49 B R H X S+ 0 0 31 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.906 107.2 53.8 -62.6 -35.9 87.8 -63.7 28.9 508 50 B T H < S+ 0 0 35 -4,-2.2 4,-0.4 -5,-0.2 -1,-0.2 0.895 107.9 48.9 -68.2 -36.5 86.3 -60.3 28.3 509 51 B V H >X S+ 0 0 3 -4,-1.8 3,-1.6 1,-0.2 4,-0.5 0.970 113.3 47.9 -59.2 -48.1 85.4 -61.3 24.8 510 52 B L H >< S+ 0 0 0 -4,-2.6 3,-0.6 1,-0.3 -2,-0.2 0.782 96.2 71.5 -70.4 -20.8 83.9 -64.6 26.0 511 53 B E T 3< S+ 0 0 98 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.717 106.8 38.3 -68.8 -18.1 81.9 -62.9 28.8 512 54 B S T <4 S+ 0 0 61 -3,-1.6 -419,-0.4 -4,-0.4 -1,-0.2 0.466 90.5 107.2-108.6 0.5 79.6 -61.5 26.0 513 55 B V S << S- 0 0 2 -3,-0.6 -421,-0.1 -4,-0.5 -420,-0.1 -0.362 83.9 -90.2 -76.1 155.2 79.3 -64.3 23.5 514 56 B P - 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.362 54.7-108.6 -53.4 132.8 76.1 -66.4 23.1 515 57 B P - 0 0 3 0, 0.0 218,-0.2 0, 0.0 3,-0.1 -0.250 10.2-131.9 -70.5 160.0 76.3 -69.3 25.5 516 58 B V S S+ 0 0 1 216,-2.2 2,-0.2 200,-0.1 217,-0.2 0.880 91.5 13.2 -77.9 -38.0 76.9 -72.9 24.3 517 59 B T S S- 0 0 1 215,-1.5 -1,-0.1 217,-0.2 215,-0.0 -0.768 75.9-129.0-128.1 172.3 74.1 -74.2 26.5 518 60 B V >> - 0 0 8 -2,-0.2 4,-1.2 1,-0.1 3,-0.9 -0.922 24.4-113.0-126.3 156.1 71.3 -72.6 28.6 519 61 B P H 3> S+ 0 0 36 0, 0.0 4,-2.4 0, 0.0 3,-0.4 0.853 111.3 59.9 -59.4 -37.9 70.2 -73.1 32.2 520 62 B S H 3> S+ 0 0 56 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.847 105.6 50.9 -57.2 -35.1 66.9 -74.8 31.6 521 63 B E H <> S+ 0 0 4 -3,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.858 109.6 48.7 -64.8 -37.4 68.7 -77.6 29.7 522 64 B I H X S+ 0 0 2 -4,-1.2 4,-2.5 -3,-0.4 -2,-0.2 0.865 110.3 51.7 -72.5 -40.5 71.1 -78.1 32.6 523 65 B V H X S+ 0 0 63 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.933 111.4 48.1 -59.9 -44.9 68.2 -78.2 35.0 524 66 B R H X S+ 0 0 53 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.931 109.9 51.3 -62.6 -42.8 66.6 -80.8 32.8 525 67 B L H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.924 106.1 55.4 -60.1 -41.2 69.8 -82.8 32.6 526 68 B Q H X S+ 0 0 41 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.916 107.6 50.4 -58.0 -41.2 70.0 -82.8 36.4 527 69 B E H X S+ 0 0 121 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.915 112.3 46.1 -57.6 -46.0 66.4 -84.3 36.5 528 70 B Q H X S+ 0 0 45 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.887 110.9 51.2 -70.9 -34.7 67.4 -87.0 34.1 529 71 B L H X S+ 0 0 4 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.816 102.4 60.9 -71.6 -30.5 70.6 -87.8 35.9 530 72 B A H X S+ 0 0 14 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.894 102.6 53.1 -58.8 -36.8 68.7 -88.0 39.3 531 73 B Q H <>S+ 0 0 74 -4,-1.4 5,-2.6 1,-0.2 6,-0.5 0.894 108.3 50.0 -63.8 -44.6 66.8 -90.9 37.6 532 74 B V H ><5S+ 0 0 0 -4,-1.4 3,-2.0 4,-0.3 5,-0.3 0.944 109.8 49.5 -54.9 -51.9 70.2 -92.5 36.8 533 75 B A H 3<5S+ 0 0 12 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.851 106.3 57.2 -63.8 -32.6 71.4 -92.2 40.4 534 76 B K T 3<5S- 0 0 99 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.395 122.2-105.4 -74.2 -1.6 68.1 -93.7 41.7 535 77 B G T < 5S+ 0 0 23 -3,-2.0 -3,-0.2 2,-0.2 -2,-0.1 0.701 95.7 107.4 85.6 17.5 68.7 -96.8 39.6 536 78 B E S S+ 0 0 4 -2,-0.3 3,-0.9 1,-0.2 -1,-0.1 0.895 110.3 56.7 -61.9 -38.2 89.7 -77.6 15.2 550 92 B M T 3 S+ 0 0 156 1,-0.2 -1,-0.2 372,-0.1 -3,-0.0 0.851 112.7 40.3 -60.9 -38.8 90.9 -79.3 12.0 551 93 B D T 3 S+ 0 0 66 1,-0.1 2,-2.6 -3,-0.1 -1,-0.2 0.387 80.0 111.2 -94.6 2.3 88.4 -82.2 12.6 552 94 B N < + 0 0 5 -3,-0.9 2,-0.3 -4,-0.5 -1,-0.1 -0.383 53.9 134.0 -78.6 68.3 85.5 -80.1 13.8 553 95 B T S > S- 0 0 19 -2,-2.6 4,-3.1 -501,-0.1 5,-0.3 -0.769 71.2-110.5-122.2 162.0 83.5 -80.9 10.6 554 96 B E H > S+ 0 0 42 -503,-0.3 4,-2.4 -2,-0.3 5,-0.2 0.861 117.5 50.9 -61.8 -41.3 80.0 -82.0 9.7 555 97 B P H > S+ 0 0 49 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.909 115.4 43.1 -63.2 -41.1 81.1 -85.4 8.6 556 98 B H H > S+ 0 0 8 2,-0.2 4,-2.0 1,-0.2 316,-0.3 0.903 115.9 46.1 -71.5 -47.1 83.1 -86.0 11.9 557 99 B I H X S+ 0 0 2 -4,-3.1 4,-2.9 2,-0.2 5,-0.2 0.912 112.9 50.2 -60.7 -47.9 80.4 -84.5 14.2 558 100 B R H X S+ 0 0 85 -4,-2.4 4,-3.1 -5,-0.3 -1,-0.2 0.898 109.3 52.8 -59.3 -41.0 77.7 -86.5 12.5 559 101 B G H X S+ 0 0 4 -4,-1.5 4,-2.1 -5,-0.2 -1,-0.2 0.906 111.1 44.9 -62.4 -43.8 79.7 -89.7 12.8 560 102 B N H X S+ 0 0 10 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.891 113.9 49.5 -67.4 -37.1 80.2 -89.2 16.5 561 103 B V H X S+ 0 0 2 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.943 112.5 48.1 -65.8 -43.8 76.6 -88.3 17.0 562 104 B R H X S+ 0 0 53 -4,-3.1 4,-2.6 -5,-0.2 -1,-0.2 0.899 109.4 52.5 -58.0 -48.5 75.5 -91.3 15.1 563 105 B A H X S+ 0 0 2 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.898 111.5 48.1 -61.5 -34.2 77.9 -93.7 17.0 564 106 B L H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.893 111.8 46.7 -72.6 -46.1 76.5 -92.4 20.2 565 107 B L H X S+ 0 0 11 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.874 110.5 54.4 -57.7 -40.4 72.9 -92.8 19.1 566 108 B Q H X S+ 0 0 11 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.913 112.2 44.0 -60.0 -52.2 73.7 -96.4 17.8 567 109 B M H X S+ 0 0 2 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.897 109.4 57.5 -58.5 -42.7 75.1 -97.4 21.2 568 110 B A H X S+ 0 0 4 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.855 104.0 50.1 -66.4 -37.6 72.3 -95.8 23.1 569 111 B V H X S+ 0 0 14 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.925 112.8 46.7 -67.7 -38.1 69.6 -97.8 21.5 570 112 B V H X S+ 0 0 0 -4,-1.4 4,-2.1 1,-0.2 -2,-0.2 0.897 115.6 47.0 -64.7 -47.3 71.4 -101.0 22.1 571 113 B L H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.859 108.1 54.4 -63.8 -34.2 72.0 -99.9 25.7 572 114 B T H X>S+ 0 0 56 -4,-2.5 4,-2.0 2,-0.2 5,-1.0 0.936 110.3 47.6 -66.4 -43.8 68.4 -98.8 26.2 573 115 B Y H <5S+ 0 0 70 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.917 115.2 44.3 -60.0 -45.8 67.2 -102.2 25.2 574 116 B G H <5S+ 0 0 3 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.880 117.0 44.5 -70.8 -36.3 69.6 -104.1 27.3 575 117 B A H <5S- 0 0 15 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.745 93.8-140.8 -78.8 -19.2 69.1 -101.9 30.3 576 118 B S T <5S+ 0 0 109 -4,-2.0 -3,-0.2 1,-0.2 -4,-0.1 0.857 74.7 81.8 58.2 33.2 65.2 -101.8 30.0 577 119 B M S - 0 0 38 4,-2.9 3,-2.0 -2,-0.5 -2,-0.1 -0.105 37.1 -84.3 -83.6-174.1 107.1 -84.8 25.7 599 141 B A T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.664 128.6 54.1 -66.9 -18.4 109.0 -87.8 24.2 600 142 B L T 3 S- 0 0 130 2,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.328 119.5-109.5 -91.7 3.0 110.3 -85.6 21.3 601 143 B G S < S+ 0 0 56 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.574 79.0 128.2 74.2 14.2 111.7 -83.0 23.8 602 144 B L S S- 0 0 27 1,-0.1 -4,-2.9 14,-0.0 -1,-0.3 -0.677 75.6 -89.3 -97.8 150.1 108.9 -80.4 22.8 603 145 B R B -X 597 0J 62 -2,-0.3 -6,-0.2 -6,-0.2 -7,-0.1 -0.408 65.3 -96.9 -51.4 130.6 106.7 -78.6 25.2 604 146 B S - 0 0 2 -8,-2.4 2,-0.3 -9,-0.1 -1,-0.1 -0.208 30.4-111.2 -63.3 144.0 103.7 -81.0 25.5 605 147 B Y - 0 0 4 1,-0.1 -1,-0.1 8,-0.1 8,-0.1 -0.626 31.4-176.5 -69.7 130.2 100.5 -80.6 23.4 606 148 B R - 0 0 19 1,-0.4 -15,-3.2 -2,-0.3 3,-0.2 0.167 52.2 -79.8-113.9 13.9 97.7 -79.6 25.8 607 149 B G >> - 0 0 1 -17,-0.3 3,-2.5 1,-0.1 4,-2.2 -0.005 54.3 -71.5 96.0 160.9 94.8 -79.6 23.2 608 150 B D T 34 S+ 0 0 13 -61,-0.5 -18,-0.2 1,-0.3 -1,-0.1 0.605 124.7 66.4 -66.3 -17.8 93.7 -77.0 20.7 609 151 B M T 34 S+ 0 0 2 -20,-2.7 -1,-0.3 -3,-0.2 -19,-0.1 0.707 119.0 24.0 -73.1 -16.0 92.4 -74.5 23.4 610 152 B I T <4 S- 0 0 0 -3,-2.5 13,-2.7 -21,-0.5 2,-0.2 0.815 128.3 -22.3-115.9 -56.2 96.1 -74.1 24.5 611 153 B N S < S- 0 0 0 -4,-2.2 -1,-0.4 11,-0.2 2,-0.3 -0.803 71.1 -73.9-147.2-166.1 98.5 -74.9 21.8 612 154 B G - 0 0 7 7,-2.4 4,-0.2 -2,-0.2 -5,-0.0 -0.689 20.2-138.1-107.3 149.3 99.0 -76.8 18.5 613 155 B F S S+ 0 0 111 -2,-0.3 -8,-0.1 -8,-0.1 -1,-0.1 0.816 70.0 109.7 -69.4 -32.2 99.4 -80.5 17.8 614 156 B A S S- 0 0 44 1,-0.2 2,-2.3 5,-0.1 -2,-0.1 -0.127 79.4-117.9 -53.6 137.2 102.2 -80.0 15.2 615 157 B P S S+ 0 0 86 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.436 77.0 102.5 -83.7 68.8 105.5 -81.3 16.5 616 158 B D S > S- 0 0 72 -2,-2.3 4,-1.2 -4,-0.2 3,-0.3 -0.987 75.9-119.5-147.1 154.3 107.5 -78.0 16.5 617 159 B A H >> S+ 0 0 70 -2,-0.3 3,-0.6 1,-0.2 4,-0.5 0.852 109.4 51.9 -62.9 -39.1 108.4 -75.6 19.1 618 160 B A H >4 S+ 0 0 81 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.897 108.2 51.9 -68.1 -40.4 106.6 -72.6 17.8 619 161 B A H 34 S+ 0 0 29 -3,-0.3 -7,-2.4 1,-0.2 -1,-0.3 0.794 105.5 58.6 -60.8 -27.3 103.3 -74.5 17.4 620 162 B R H << S+ 0 0 12 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.506 76.0 112.5 -88.9 -7.3 103.6 -75.6 21.1 621 163 B E S << S- 0 0 117 -3,-1.0 2,-0.3 -4,-0.5 -9,-0.2 -0.430 80.1-107.4 -63.6 140.9 103.7 -72.1 22.6 622 164 B H - 0 0 18 -125,-0.3 -11,-0.2 -11,-0.1 -1,-0.1 -0.547 37.7-166.5 -73.3 126.7 100.6 -71.4 24.7 623 165 B D > - 0 0 55 -13,-2.7 3,-2.4 -2,-0.3 4,-0.2 -0.909 17.8-160.1-126.6 112.5 98.3 -69.0 22.8 624 166 B P T > S+ 0 0 7 0, 0.0 3,-1.9 0, 0.0 4,-0.5 0.683 88.7 73.4 -63.8 -23.4 95.4 -67.3 24.6 625 167 B S T >> S+ 0 0 14 1,-0.3 4,-2.0 2,-0.2 3,-0.7 0.748 82.2 73.6 -61.9 -20.1 93.7 -66.5 21.3 626 168 B R H <> S+ 0 0 32 -3,-2.4 4,-2.6 1,-0.2 -1,-0.3 0.714 83.4 67.9 -64.5 -21.3 92.9 -70.3 21.3 627 169 B L H <> S+ 0 0 0 -3,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.907 105.3 39.3 -63.0 -43.9 90.3 -69.6 24.0 628 170 B V H <> S+ 0 0 0 -3,-0.7 4,-2.3 -4,-0.5 -2,-0.2 0.912 115.2 52.3 -76.9 -39.2 88.1 -67.6 21.5 629 171 B R H X S+ 0 0 6 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.906 109.1 52.5 -58.8 -40.5 88.8 -70.1 18.7 630 172 B A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.920 109.2 46.9 -58.3 -51.0 87.8 -72.9 21.0 631 173 B Y H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 5,-0.3 0.887 111.9 50.9 -60.1 -42.4 84.5 -71.2 21.9 632 174 B A H X S+ 0 0 1 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.937 113.4 45.7 -65.3 -41.8 83.7 -70.5 18.1 633 175 B N H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.884 114.3 49.0 -61.8 -44.0 84.4 -74.1 17.3 634 176 B A H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.914 111.2 48.2 -63.0 -47.6 82.3 -75.3 20.3 635 177 B S H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.899 112.2 49.1 -67.0 -38.6 79.4 -73.2 19.4 636 178 B A H X S+ 0 0 0 -4,-2.1 4,-1.6 -5,-0.3 -1,-0.2 0.906 112.5 48.1 -65.1 -41.1 79.4 -74.2 15.8 637 179 B A H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.938 111.2 49.9 -62.6 -45.0 79.6 -77.9 16.8 638 180 B M H X S+ 0 0 3 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.893 106.3 57.0 -61.9 -42.1 76.7 -77.5 19.3 639 181 B N H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.922 110.7 43.2 -53.4 -47.2 74.6 -75.8 16.7 640 182 B L H X S+ 0 0 0 -4,-1.6 4,-3.4 2,-0.2 5,-0.2 0.906 110.2 55.9 -71.8 -36.7 75.0 -78.8 14.4 641 183 B V H X S+ 0 0 1 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.927 109.3 46.9 -58.9 -44.9 74.4 -81.3 17.3 642 184 B R H X S+ 0 0 24 -4,-2.7 4,-1.1 2,-0.2 -1,-0.2 0.915 113.5 48.5 -60.7 -47.8 71.1 -79.6 18.0 643 185 B A H >< S+ 0 0 1 -4,-1.9 3,-0.5 -5,-0.2 4,-0.4 0.933 112.8 48.7 -61.6 -41.8 70.1 -79.6 14.3 644 186 B L H >< S+ 0 0 9 -4,-3.4 3,-1.0 1,-0.3 6,-0.5 0.903 109.6 50.7 -69.3 -31.6 71.1 -83.3 14.0 645 187 B T H 3< S+ 0 0 12 -4,-2.2 54,-0.6 1,-0.2 -1,-0.3 0.691 108.9 50.0 -81.2 -20.1 69.2 -84.4 17.0 646 188 B S T << S+ 0 0 71 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.352 106.5 77.5 -96.1 2.8 66.0 -82.7 15.9 647 189 B S S X S- 0 0 26 -3,-1.0 3,-1.7 -4,-0.4 4,-0.1 -0.365 106.5 -85.1 -90.5 179.3 66.3 -84.4 12.4 648 190 B G G > S+ 0 0 44 1,-0.3 3,-1.3 2,-0.2 6,-0.2 0.599 114.1 84.6 -65.9 -9.5 65.7 -87.9 11.1 649 191 B L G 3 S+ 0 0 15 -5,-0.4 -1,-0.3 1,-0.3 -4,-0.1 0.840 91.8 44.8 -59.2 -36.5 69.2 -88.7 12.3 650 192 B A G < S+ 0 0 15 -3,-1.7 2,-0.3 -6,-0.5 -1,-0.3 0.348 82.1 124.5 -96.4 7.2 67.8 -89.4 15.8 651 193 B S <> - 0 0 23 -3,-1.3 4,-2.6 1,-0.2 3,-0.5 -0.505 62.4-137.0 -66.2 126.8 64.8 -91.4 14.5 652 194 B L H > S+ 0 0 54 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.852 100.9 52.2 -52.4 -40.5 65.0 -94.7 16.3 653 195 B H H > S+ 0 0 59 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.868 111.2 46.6 -71.7 -33.0 64.2 -96.7 13.2 654 196 B L H > S+ 0 0 49 -3,-0.5 4,-1.3 -6,-0.2 3,-0.2 0.972 112.1 50.0 -71.5 -51.9 66.9 -95.1 11.2 655 197 B V H X S+ 0 0 4 -4,-2.6 4,-1.4 1,-0.2 3,-0.4 0.885 109.6 51.9 -52.7 -41.8 69.5 -95.5 13.9 656 198 B H H X S+ 0 0 1 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.871 100.0 61.5 -78.3 -22.3 68.7 -99.2 14.3 657 199 B D H X S+ 0 0 71 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.867 101.6 54.9 -61.8 -33.7 69.1 -99.9 10.5 658 200 B W H X S+ 0 0 57 -4,-1.3 4,-2.1 -3,-0.4 -1,-0.2 0.952 104.0 53.4 -61.2 -46.2 72.7 -98.8 10.9 659 201 B N H X S+ 0 0 0 -4,-1.4 4,-1.4 1,-0.2 -2,-0.2 0.895 105.1 55.2 -58.9 -29.0 73.0 -101.4 13.7 660 202 B R H X S+ 0 0 91 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.916 105.9 51.2 -74.6 -32.6 71.6 -104.0 11.2 661 203 B E H X S+ 0 0 117 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.913 105.8 56.2 -65.1 -40.2 74.4 -103.2 8.6 662 204 B F H X S+ 0 0 11 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.880 106.8 49.2 -56.2 -44.3 77.0 -103.6 11.4 663 205 B V H < S+ 0 0 23 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.933 111.2 50.1 -64.3 -43.5 75.8 -107.1 12.1 664 206 B R H < S+ 0 0 202 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.883 120.2 34.1 -58.6 -41.8 75.9 -108.0 8.4 665 207 B T H < S+ 0 0 71 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.505 92.9 99.8-101.2 -6.8 79.5 -106.7 7.9 666 208 B S S >< S- 0 0 12 -4,-1.6 3,-1.7 -5,-0.2 4,-0.2 -0.631 71.3-132.4 -79.0 143.5 81.2 -107.5 11.2 667 209 B P T 3 S+ 0 0 95 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.652 113.3 40.3 -61.5 -23.2 83.5 -110.5 11.5 668 210 B A T >> S+ 0 0 26 1,-0.1 3,-1.9 2,-0.1 4,-0.9 0.109 79.0 121.7-109.8 21.2 81.7 -111.4 14.8 669 211 B G H X> + 0 0 5 -3,-1.7 4,-1.0 1,-0.3 3,-0.5 0.810 68.8 61.2 -55.3 -30.7 78.2 -110.4 13.4 670 212 B A H 34 S+ 0 0 96 1,-0.2 4,-0.5 -4,-0.2 -1,-0.3 0.801 98.7 57.1 -64.6 -32.0 76.9 -113.9 14.1 671 213 B R H <4 S+ 0 0 169 -3,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.844 116.2 33.9 -70.1 -28.6 77.7 -113.4 17.8 672 214 B Y H S+ 0 0 66 -4,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.902 114.2 41.5 -62.6 -45.1 70.3 -112.6 18.0 675 217 B L H > S+ 0 0 5 -4,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.916 112.9 53.8 -70.8 -38.9 70.4 -109.5 20.2 676 218 B A H X S+ 0 0 4 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.867 110.9 47.0 -61.2 -38.9 70.2 -107.3 17.2 677 219 B T H X S+ 0 0 38 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.876 108.8 54.1 -68.9 -39.0 67.1 -109.2 16.0 678 220 B E H X S+ 0 0 73 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.907 109.9 48.8 -61.7 -38.4 65.5 -109.0 19.4 679 221 B I H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.930 109.6 50.1 -63.5 -47.1 66.0 -105.2 19.3 680 222 B D H X S+ 0 0 27 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.926 111.4 50.0 -59.8 -43.9 64.5 -104.9 15.8 681 223 B R H X S+ 0 0 178 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.866 108.8 53.1 -63.2 -32.5 61.5 -107.0 17.1 682 224 B G H X S+ 0 0 22 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.922 109.6 47.1 -68.7 -43.7 61.2 -104.7 20.0 683 225 B L H X S+ 0 0 10 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.919 111.4 50.9 -60.3 -45.1 61.1 -101.6 17.7 684 226 B R H X S+ 0 0 153 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.871 106.3 56.3 -62.0 -33.9 58.6 -103.3 15.5 685 227 B F H X S+ 0 0 142 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.884 105.0 52.0 -64.4 -42.0 56.4 -104.1 18.5 686 228 B M H <>S+ 0 0 64 -4,-1.7 5,-2.1 2,-0.2 -1,-0.2 0.946 111.0 45.7 -58.8 -45.2 56.4 -100.5 19.4 687 229 B S H ><5S+ 0 0 67 -4,-2.0 3,-1.9 1,-0.2 -2,-0.2 0.937 110.9 54.7 -63.0 -44.4 55.2 -99.5 16.0 688 230 B A H 3<5S+ 0 0 84 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.790 102.2 56.8 -54.5 -34.5 52.6 -102.3 16.1 689 231 B C T 3<5S- 0 0 84 -4,-2.0 -1,-0.3 -3,-0.2 -2,-0.2 0.372 129.9 -96.0 -82.6 1.1 51.2 -101.0 19.3 690 232 B G T < 5S+ 0 0 55 -3,-1.9 2,-0.7 1,-0.2 -3,-0.2 0.637 74.5 144.7 95.5 22.7 50.6 -97.6 17.5 691 233 B V < - 0 0 40 -5,-2.1 -1,-0.2 -6,-0.2 2,-0.2 -0.813 23.8-176.9 -91.8 107.3 53.8 -95.6 18.6 692 234 B A > - 0 0 50 -2,-0.7 3,-1.8 1,-0.1 4,-0.4 -0.574 43.7 -99.7 -93.2 167.6 54.9 -93.3 15.7 693 235 B D G > S+ 0 0 70 1,-0.3 3,-2.2 2,-0.2 -1,-0.1 0.871 123.2 62.3 -53.7 -42.1 58.0 -91.0 15.9 694 236 B R G 3 S+ 0 0 245 1,-0.3 -1,-0.3 4,-0.0 4,-0.1 0.719 98.1 58.0 -56.6 -26.5 55.8 -88.1 16.7 695 237 B N G < S+ 0 0 98 -3,-1.8 2,-0.4 2,-0.1 -1,-0.3 0.610 93.7 82.1 -74.8 -19.3 54.8 -90.0 19.9 696 238 B L S < S- 0 0 54 -3,-2.2 2,-0.1 -4,-0.4 3,-0.1 -0.778 88.5-117.5 -93.6 132.1 58.5 -90.2 21.0 697 239 B Q - 0 0 132 -2,-0.4 3,-0.1 1,-0.1 -2,-0.1 -0.448 48.5 -96.0 -58.1 140.9 60.1 -87.2 22.8 698 240 B T - 0 0 80 1,-0.1 -52,-0.1 -2,-0.1 -1,-0.1 -0.285 46.0 -88.8 -74.3 156.9 62.9 -86.0 20.5 699 241 B A - 0 0 18 -54,-0.6 2,-0.5 -3,-0.1 -1,-0.1 -0.323 38.4-156.7 -67.6 136.6 66.5 -87.2 21.1 700 242 B E - 0 0 39 -3,-0.1 -119,-0.5 -2,-0.1 2,-0.5 -0.963 10.7-176.9-119.3 124.0 68.6 -85.1 23.5 701 243 B I E -r 581 0I 9 -2,-0.5 -119,-0.2 -121,-0.1 2,-0.2 -0.992 16.0-153.8-120.3 117.0 72.4 -85.2 23.3 702 244 B Y E -r 582 0I 4 -121,-2.4 -119,-3.1 -2,-0.5 2,-0.4 -0.515 11.8-121.7 -86.7 158.6 74.0 -83.1 26.0 703 245 B A E +r 583 0I 0 -121,-0.2 32,-2.0 -2,-0.2 33,-1.7 -0.802 34.6 166.4-107.8 139.1 77.5 -81.6 25.7 704 246 B S E +rs 584 736I 0 -121,-1.3 -119,-1.6 -119,-0.5 2,-0.3 -0.994 7.3 162.4-144.7 157.0 80.3 -82.3 28.1 705 247 B H E - s 0 737I 2 31,-0.9 33,-1.4 -2,-0.3 2,-0.5 -0.970 49.1 -78.6-159.9 166.6 84.0 -81.8 28.5 706 248 B E E - s 0 738I 19 -2,-0.3 2,-1.4 31,-0.2 3,-0.3 -0.659 41.4-131.3 -67.6 121.8 86.7 -81.8 31.2 707 249 B A + 0 0 1 31,-2.0 33,-0.2 -2,-0.5 3,-0.1 -0.595 61.5 132.9 -71.5 91.9 86.6 -78.5 33.1 708 250 B L + 0 0 0 -2,-1.4 2,-1.0 1,-0.2 -1,-0.2 0.812 46.1 62.4-114.5 -54.0 90.3 -77.9 32.8 709 251 B V >> - 0 0 1 -3,-0.3 4,-2.3 1,-0.2 3,-0.8 -0.676 59.9-168.3 -88.1 104.8 91.1 -74.4 31.6 710 252 B L H 3> S+ 0 0 9 -2,-1.0 4,-2.3 1,-0.3 5,-0.3 0.793 84.2 61.8 -71.1 -22.2 89.8 -72.1 34.3 711 253 B D H 3> S+ 0 0 28 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.904 110.8 41.4 -64.7 -39.0 90.2 -69.0 32.1 712 254 B Y H <> S+ 0 0 0 -3,-0.8 4,-1.3 2,-0.2 -2,-0.2 0.947 116.9 47.0 -73.3 -49.0 87.7 -70.5 29.7 713 255 B E H < S+ 0 0 2 -4,-2.3 3,-0.4 1,-0.2 4,-0.3 0.929 112.6 48.5 -61.5 -43.2 85.2 -71.9 32.3 714 256 B R H >< S+ 0 0 70 -4,-2.3 3,-1.1 1,-0.2 -1,-0.2 0.913 110.4 51.4 -66.3 -36.5 85.1 -68.7 34.4 715 257 B A H 3< S+ 0 0 0 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 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