==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-MAY-09 3A2M . COMPND 2 MOLECULE: HALOALKANE DEHALOGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BRADYRHIZOBIUM JAPONICUM; . AUTHOR Y.SATO,T.SENDA . 598 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22221.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 441 73.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 71 11.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 4 0.7 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 . 39 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 82 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 202 33.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.0 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 6 0 2 0 2 3 1 0 2 0 3 1 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 4 0 0 3 1 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 . 2 0 0 2 0 1 1 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 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 8 A E 0 0 183 0, 0.0 15,-2.2 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 126.4 14.4 15.4 30.4 2 9 A I E +A 15 0A 76 13,-0.2 13,-0.2 11,-0.0 2,-0.2 -0.883 360.0 170.2-108.3 108.6 17.3 13.8 32.4 3 10 A R E -A 14 0A 99 11,-2.8 11,-2.4 -2,-0.6 2,-0.4 -0.455 26.6-127.1-116.1 174.7 18.1 15.6 35.6 4 11 A R E -A 13 0A 127 9,-0.2 9,-0.2 -2,-0.2 58,-0.0 -0.989 15.2-164.9-132.2 134.1 20.2 15.1 38.7 5 12 A A E -A 12 0A 0 7,-2.7 7,-2.4 -2,-0.4 2,-0.3 -0.971 25.6-120.2-117.3 136.9 19.2 15.4 42.4 6 13 A P E +A 11 0A 85 0, 0.0 2,-0.4 0, 0.0 5,-0.3 -0.621 38.4 179.2 -72.6 131.2 21.6 15.6 45.4 7 14 A V E > -A 10 0A 3 3,-2.0 3,-2.6 -2,-0.3 74,-0.1 -0.960 59.0 -28.9-141.6 115.1 21.0 12.6 47.6 8 15 A L T 3 S- 0 0 98 -2,-0.4 3,-0.1 1,-0.3 69,-0.0 0.756 124.2 -47.6 53.2 32.9 22.8 11.8 50.8 9 16 A G T 3 S+ 0 0 92 1,-0.4 -1,-0.3 0, 0.0 2,-0.2 0.475 136.0 66.4 86.2 3.7 26.0 13.6 49.7 10 17 A S E < S-A 7 0A 31 -3,-2.6 -3,-2.0 53,-0.1 -1,-0.4 -0.368 82.8-111.9-125.4-151.9 26.0 11.9 46.3 11 18 A S E -A 6 0A 22 -5,-0.3 52,-2.8 -2,-0.2 2,-0.4 -0.997 10.2-150.2-150.6 153.7 23.5 12.2 43.5 12 19 A M E -A 5 0A 0 -7,-2.4 -7,-2.7 -2,-0.3 2,-0.2 -0.992 16.2-142.5-124.4 131.0 20.8 10.4 41.6 13 20 A A E +A 4 0A 0 -2,-0.4 42,-3.2 46,-0.3 2,-0.3 -0.563 26.3 177.8 -81.8 154.9 20.0 10.9 37.9 14 21 A Y E -AB 3 54A 1 -11,-2.4 -11,-2.8 40,-0.3 2,-0.4 -0.987 27.6-131.6-157.8 153.7 16.4 10.8 36.9 15 22 A R E -AB 2 53A 52 38,-2.1 38,-2.7 -2,-0.3 2,-0.4 -0.839 27.5-172.8-102.7 143.0 14.1 11.2 33.9 16 23 A E E + B 0 52A 14 -15,-2.2 2,-0.3 -2,-0.4 36,-0.2 -1.000 11.6 156.2-143.3 135.8 11.0 13.2 34.3 17 24 A T E + B 0 51A 52 34,-2.0 34,-3.1 -2,-0.4 2,-0.1 -0.982 31.9 56.2-154.3 160.8 8.0 13.9 32.0 18 25 A G S S- 0 0 24 -2,-0.3 2,-0.2 32,-0.2 32,-0.1 -0.064 92.2 -51.2 100.8 153.5 4.4 15.0 32.2 19 26 A A > - 0 0 58 27,-0.6 3,-0.9 1,-0.1 -2,-0.1 -0.471 49.5-140.5 -52.3 130.9 2.6 18.0 33.6 20 27 A Q T 3 S+ 0 0 119 1,-0.3 -1,-0.1 -2,-0.2 30,-0.1 0.367 95.1 73.6 -87.1 6.0 4.0 18.3 37.2 21 28 A D T 3 S+ 0 0 151 2,-0.1 -1,-0.3 28,-0.1 -2,-0.1 0.148 86.6 83.2 -93.8 17.2 0.5 19.3 38.4 22 29 A A S < S- 0 0 28 -3,-0.9 27,-0.1 1,-0.2 26,-0.1 -0.642 96.9 -67.9-115.1 171.1 -0.7 15.6 38.0 23 30 A P - 0 0 27 0, 0.0 27,-2.8 0, 0.0 2,-0.3 -0.274 58.7-114.8 -60.5 149.6 -0.5 12.4 40.2 24 31 A V E -c 50 0A 22 65,-0.4 67,-2.6 25,-0.2 2,-0.4 -0.664 26.4-166.3 -88.7 141.2 3.1 11.2 40.5 25 32 A V E -cd 51 91A 0 25,-2.6 27,-2.8 -2,-0.3 2,-0.5 -0.989 6.6-156.6-123.4 123.0 4.2 7.9 39.1 26 33 A L E -cd 52 92A 1 65,-3.1 67,-2.5 -2,-0.4 2,-0.5 -0.874 5.3-155.9 -99.6 123.5 7.6 6.5 40.2 27 34 A F E - d 0 93A 0 25,-2.4 2,-0.6 -2,-0.5 67,-0.2 -0.889 9.4-163.5-102.3 122.4 9.2 4.0 37.8 28 35 A L E - d 0 94A 1 65,-3.1 67,-1.6 -2,-0.5 70,-0.2 -0.930 3.9-168.3-118.4 113.1 11.7 1.7 39.5 29 36 A H - 0 0 0 -2,-0.6 2,-0.1 25,-0.5 6,-0.1 -0.303 4.9-161.4 -83.6 170.3 14.2 -0.3 37.5 30 37 A G > + 0 0 0 67,-0.2 3,-1.5 4,-0.2 -1,-0.1 -0.310 40.8 12.2-128.1-137.4 16.4 -3.2 38.7 31 38 A N T 3 S- 0 0 2 1,-0.3 3,-0.1 -2,-0.1 -1,-0.1 -0.703 120.6 -12.5 -96.3 136.1 19.5 -5.1 37.7 32 39 A P T 3 S+ 0 0 1 0, 0.0 -1,-0.3 0, 0.0 28,-0.1 -0.524 116.3 84.4-103.9 51.5 21.5 -4.2 35.5 33 40 A T < - 0 0 2 -3,-1.5 27,-0.4 26,-0.1 2,-0.3 0.011 51.4-158.3-102.8-162.0 19.3 -1.6 34.0 34 41 A S > - 0 0 6 25,-0.1 3,-2.2 -3,-0.1 4,-0.2 -0.898 55.5 -62.3-158.7-173.0 18.5 2.2 34.6 35 42 A S G > S+ 0 0 0 1,-0.3 3,-1.8 -2,-0.3 4,-0.2 0.707 119.1 83.8 -55.1 -19.7 15.7 4.6 33.8 36 43 A H G > S+ 0 0 9 1,-0.3 3,-1.6 2,-0.2 -1,-0.3 0.798 78.1 64.8 -47.7 -38.7 16.7 3.9 30.2 37 44 A I G < S+ 0 0 3 -3,-2.2 3,-0.3 1,-0.3 -1,-0.3 0.704 100.9 50.3 -66.2 -19.3 14.4 0.8 30.3 38 45 A W G X> S+ 0 0 0 -3,-1.8 4,-2.8 -4,-0.2 3,-1.8 0.388 78.1 108.4 -93.4 0.5 11.3 3.0 30.8 39 46 A R T <4 S+ 0 0 42 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.784 84.3 37.9 -58.5 -32.8 12.2 5.3 27.8 40 47 A N T 34 S+ 0 0 72 -3,-0.3 -1,-0.3 -4,-0.2 4,-0.1 0.497 117.4 52.0 -95.2 -3.1 9.4 4.0 25.5 41 48 A I T X> S+ 0 0 0 -3,-1.8 3,-1.6 2,-0.1 4,-0.8 0.822 95.5 66.5 -96.8 -44.6 6.9 3.7 28.3 42 49 A L H >X S+ 0 0 11 -4,-2.8 4,-2.5 1,-0.3 3,-1.0 0.849 95.1 56.7 -47.5 -45.2 7.2 7.2 29.8 43 50 A P H 34 S+ 0 0 72 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.708 106.1 51.9 -65.6 -18.4 5.7 9.0 26.8 44 51 A L H <4 S+ 0 0 27 -3,-1.6 -2,-0.2 2,-0.1 524,-0.1 0.655 116.6 37.7 -86.4 -21.5 2.5 6.9 27.0 45 52 A V H XX S+ 0 0 0 -3,-1.0 3,-1.9 -4,-0.8 4,-1.1 0.664 95.5 81.2-101.2 -27.3 1.9 7.7 30.7 46 53 A S T 3< S+ 0 0 26 -4,-2.5 -27,-0.6 1,-0.3 -2,-0.1 0.759 81.2 66.6 -55.2 -29.3 3.0 11.3 30.7 47 54 A P T 34 S+ 0 0 68 0, 0.0 -1,-0.3 0, 0.0 519,-0.2 0.772 116.4 27.1 -63.5 -21.2 -0.4 12.5 29.4 48 55 A V T <4 S+ 0 0 26 -3,-1.9 2,-0.3 1,-0.2 -2,-0.2 0.489 125.1 30.6-116.7 -5.0 -2.0 11.4 32.6 49 56 A A S < S- 0 0 0 -4,-1.1 2,-0.9 -27,-0.1 -25,-0.2 -0.996 73.8-106.7-154.5 157.2 0.7 11.6 35.2 50 57 A H E - c 0 24A 16 -27,-2.8 -25,-2.6 -2,-0.3 2,-0.5 -0.794 47.5-153.2 -84.5 104.1 3.9 13.3 36.4 51 58 A C E +Bc 17 25A 0 -34,-3.1 -34,-2.0 -2,-0.9 2,-0.4 -0.719 18.7 178.8 -91.4 126.9 6.4 10.6 35.6 52 59 A I E +Bc 16 26A 2 -27,-2.8 -25,-2.4 -2,-0.5 -36,-0.2 -0.988 3.1 179.8-130.4 121.3 9.6 10.3 37.6 53 60 A A E -B 15 0A 0 -38,-2.7 -38,-2.1 -2,-0.4 -18,-0.1 -0.866 12.4-163.3-124.5 94.4 12.1 7.5 36.8 54 61 A P E -B 14 0A 0 0, 0.0 2,-0.6 0, 0.0 -25,-0.5 -0.472 19.6-127.7 -77.8 152.5 15.2 7.5 39.0 55 62 A D - 0 0 1 -42,-3.2 -42,-0.2 -21,-0.1 3,-0.1 -0.864 36.9-118.4 -85.1 122.6 18.5 5.7 38.3 56 63 A L > - 0 0 1 -2,-0.6 3,-2.6 1,-0.2 6,-0.3 -0.218 45.8 -77.3 -57.7 155.5 19.3 3.7 41.4 57 64 A I T 3 S+ 0 0 1 1,-0.3 -1,-0.2 17,-0.1 7,-0.1 -0.331 123.4 16.6 -58.1 134.7 22.5 4.7 43.2 58 65 A G T 3 S+ 0 0 1 5,-2.1 2,-0.3 1,-0.3 -1,-0.3 0.424 112.2 97.0 76.5 2.0 25.5 3.3 41.3 59 66 A F S X S- 0 0 0 -3,-2.6 3,-2.3 4,-0.1 -46,-0.3 -0.814 85.3 -16.9-115.9 161.9 23.3 2.7 38.2 60 67 A G T 3 S- 0 0 8 -27,-0.4 -26,-0.1 -2,-0.3 -3,-0.0 -0.224 127.8 -21.6 50.1-126.8 22.7 4.7 35.0 61 68 A Q T 3 S+ 0 0 102 -4,-0.0 -1,-0.3 3,-0.0 -47,-0.1 0.252 107.1 117.5 -99.8 10.6 23.9 8.3 35.4 62 69 A S S < S- 0 0 7 -3,-2.3 -50,-0.2 -6,-0.3 -6,-0.1 -0.221 74.4 -80.5 -70.5 161.1 23.7 8.3 39.2 63 70 A G - 0 0 13 -52,-2.8 -5,-2.1 1,-0.1 -1,-0.1 -0.124 30.8-138.0 -51.6 158.6 26.6 8.8 41.5 64 71 A K + 0 0 82 -7,-0.1 -1,-0.1 -6,-0.1 -7,-0.0 -0.515 27.7 179.4-123.6 65.2 29.0 6.0 42.3 65 72 A P - 0 0 26 0, 0.0 2,-1.7 0, 0.0 -55,-0.0 -0.202 42.1-105.1 -65.3 157.1 29.8 6.2 46.1 66 73 A D S S+ 0 0 134 2,-0.0 2,-0.2 3,-0.0 -2,-0.0 -0.608 75.7 126.8 -87.2 78.9 32.1 3.7 47.6 67 74 A I S S- 0 0 38 -2,-1.7 6,-0.0 1,-0.0 0, 0.0 -0.694 73.1-104.0-130.6 174.9 29.4 1.7 49.4 68 75 A A - 0 0 62 -2,-0.2 137,-0.1 1,-0.0 -2,-0.0 0.751 38.6-143.6 -76.5 -27.8 28.3 -2.0 49.6 69 76 A Y + 0 0 3 1,-0.2 -1,-0.0 136,-0.1 2,-0.0 0.809 39.8 161.0 60.6 37.1 25.2 -1.5 47.3 70 77 A R >> - 0 0 74 1,-0.1 4,-2.0 138,-0.0 3,-0.6 -0.308 58.1 -97.7 -73.5 166.6 23.2 -3.9 49.4 71 78 A F H 3> S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.917 126.6 53.1 -51.3 -44.6 19.3 -3.9 49.1 72 79 A F H 3> S+ 0 0 65 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.772 103.6 55.9 -70.2 -23.8 19.2 -1.7 52.3 73 80 A D H <> S+ 0 0 24 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.950 108.0 48.7 -67.8 -45.5 21.6 0.8 50.8 74 81 A H H X S+ 0 0 1 -4,-2.0 4,-2.8 1,-0.2 5,-0.2 0.874 107.5 56.1 -59.5 -40.6 19.3 1.2 47.8 75 82 A V H X S+ 0 0 11 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.930 108.1 47.3 -54.5 -49.6 16.3 1.6 50.2 76 83 A R H X S+ 0 0 113 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.913 114.5 45.7 -62.0 -45.7 18.1 4.5 51.9 77 84 A Y H X S+ 0 0 16 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.912 113.2 48.7 -68.0 -41.7 19.0 6.3 48.7 78 85 A L H X S+ 0 0 4 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.934 111.4 49.9 -64.2 -43.8 15.6 5.8 47.1 79 86 A D H X S+ 0 0 48 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.920 112.3 48.8 -54.1 -44.8 13.8 7.2 50.3 80 87 A A H X S+ 0 0 17 -4,-2.2 4,-2.9 1,-0.2 -1,-0.2 0.876 109.1 52.2 -66.7 -38.1 16.2 10.2 50.2 81 88 A F H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.931 109.6 49.0 -60.8 -49.6 15.5 10.8 46.5 82 89 A I H X>S+ 0 0 12 -4,-2.4 5,-1.9 2,-0.2 4,-0.6 0.898 113.5 46.8 -57.7 -46.6 11.7 10.8 47.1 83 90 A E H ><5S+ 0 0 161 -4,-2.3 3,-1.3 2,-0.2 -2,-0.2 0.949 111.7 51.3 -59.1 -50.5 12.1 13.2 50.1 84 91 A Q H 3<5S+ 0 0 77 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.872 110.7 47.9 -58.6 -41.0 14.4 15.5 48.0 85 92 A R H 3<5S- 0 0 67 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.568 110.6-124.9 -74.6 -10.5 11.9 15.6 45.1 86 93 A G T <<5 + 0 0 55 -3,-1.3 2,-0.5 -4,-0.6 -3,-0.2 0.734 49.0 163.9 74.1 25.2 9.1 16.4 47.6 87 94 A V < + 0 0 19 -5,-1.9 -1,-0.2 1,-0.2 3,-0.1 -0.651 15.6 177.6 -81.9 120.5 6.9 13.5 46.5 88 95 A T + 0 0 117 -2,-0.5 2,-0.3 1,-0.3 -1,-0.2 0.640 69.0 2.1-100.5 -16.3 4.2 12.9 49.1 89 96 A S + 0 0 27 2,-0.0 -65,-0.4 24,-0.0 -1,-0.3 -0.961 69.7 166.8-163.4 155.2 2.4 10.1 47.4 90 97 A A E - e 0 113A 0 22,-2.4 24,-2.5 -2,-0.3 25,-0.6 -0.992 37.8-109.6-161.7 155.4 2.8 8.2 44.1 91 98 A Y E -de 25 115A 0 -67,-2.6 -65,-3.1 -2,-0.3 2,-0.4 -0.671 39.4-141.2 -76.7 150.7 1.8 5.2 42.0 92 99 A L E -de 26 116A 1 23,-2.4 25,-3.1 -2,-0.3 2,-0.4 -0.965 17.8-173.6-119.5 132.6 4.8 2.8 41.7 93 100 A V E +de 27 117A 0 -67,-2.5 -65,-3.1 -2,-0.4 2,-0.3 -0.998 24.5 168.8-125.7 120.7 5.6 0.9 38.5 94 101 A A E -de 28 118A 0 23,-2.3 25,-0.9 -2,-0.4 2,-0.3 -0.966 26.2-174.3-144.3 151.3 8.4 -1.6 39.0 95 102 A Q E > - e 0 119A 0 -67,-1.6 3,-2.0 -2,-0.3 25,-0.2 -0.980 63.7 -22.0-141.7 146.7 10.4 -4.6 37.6 96 103 A D E >> S+ e 0 121A 11 24,-1.5 3,-1.8 23,-0.8 4,-0.9 -0.208 135.7 0.7 57.0-132.2 13.1 -6.9 39.1 97 104 A W H 3> S+ 0 0 3 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.750 126.6 70.4 -60.8 -24.1 14.8 -5.3 42.1 98 105 A G H <> S+ 0 0 0 -3,-2.0 4,-2.7 1,-0.2 -1,-0.3 0.853 95.3 55.0 -57.7 -33.4 12.5 -2.2 41.6 99 106 A T H <> S+ 0 0 0 -3,-1.8 4,-3.3 2,-0.2 5,-0.2 0.897 104.7 50.8 -68.3 -38.0 9.7 -4.5 42.9 100 107 A A H X S+ 0 0 0 -4,-0.9 4,-2.3 2,-0.2 5,-0.2 0.932 112.9 47.2 -64.3 -41.5 11.5 -5.3 46.1 101 108 A L H X S+ 0 0 4 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.934 113.9 47.8 -62.4 -43.8 12.0 -1.6 46.7 102 109 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.912 112.9 47.4 -63.6 -48.8 8.4 -0.9 45.8 103 110 A F H X S+ 0 0 2 -4,-3.3 4,-1.9 2,-0.2 -1,-0.2 0.905 114.5 46.9 -59.7 -43.8 7.1 -3.7 48.2 104 111 A H H X S+ 0 0 30 -4,-2.3 4,-1.6 -5,-0.2 -2,-0.2 0.855 113.0 49.2 -68.1 -38.0 9.4 -2.5 51.0 105 112 A L H X S+ 0 0 6 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.948 111.1 49.3 -63.9 -49.5 8.4 1.1 50.5 106 113 A A H < S+ 0 0 7 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.865 109.9 52.6 -58.5 -38.1 4.6 0.2 50.5 107 114 A A H < S+ 0 0 36 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.883 116.1 38.1 -68.0 -38.8 5.1 -1.8 53.7 108 115 A R H < S+ 0 0 99 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.765 131.4 27.4 -81.3 -28.3 6.7 1.0 55.6 109 116 A R >X + 0 0 99 -4,-2.6 3,-2.3 -5,-0.1 4,-0.6 -0.570 62.4 163.1-135.5 63.5 4.6 3.8 54.1 110 117 A P G >4 S+ 0 0 82 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.866 77.9 62.2 -57.4 -30.8 1.1 2.4 53.1 111 118 A D G 34 S+ 0 0 111 1,-0.2 -5,-0.1 -3,-0.1 -2,-0.0 0.630 97.5 59.4 -65.1 -17.2 -0.2 6.0 53.0 112 119 A F G <4 S+ 0 0 4 -3,-2.3 -22,-2.4 -7,-0.2 2,-0.6 0.749 84.7 89.4 -81.2 -27.9 2.2 6.8 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164.7 -98.9 136.7 11.2 -10.6 43.6 123 130 A R - 0 0 39 -2,-0.4 101,-0.1 88,-0.1 2,-0.1 -0.962 49.6 -80.1-141.6 154.9 9.7 -12.8 46.4 124 131 A P - 0 0 21 0, 0.0 88,-0.2 0, 0.0 86,-0.0 -0.417 43.9-155.1 -56.7 135.4 11.3 -15.0 49.1 125 132 A M B -h 212 0B 8 86,-2.8 88,-2.6 1,-0.1 89,-0.2 -0.923 8.9-163.0-121.5 100.1 12.3 -18.3 47.5 126 133 A P S S+ 0 0 73 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.830 77.2 13.8 -54.3 -37.4 12.5 -21.2 50.1 127 134 A T S > S- 0 0 69 86,-0.1 3,-1.8 85,-0.1 4,-0.4 -0.897 83.3-104.7-131.5 167.9 14.5 -23.3 47.6 128 135 A W G > S+ 0 0 46 -2,-0.3 3,-1.2 1,-0.3 -1,-0.0 0.781 117.0 68.7 -61.6 -27.2 16.4 -22.9 44.4 129 136 A Q G 3 S+ 0 0 91 1,-0.2 -1,-0.3 4,-0.0 5,-0.3 0.735 92.9 59.0 -57.6 -27.0 13.5 -24.6 42.7 130 137 A D G X S+ 0 0 38 -3,-1.8 3,-1.0 3,-0.1 2,-0.5 0.599 86.4 87.4 -82.1 -13.5 11.5 -21.4 43.5 131 138 A F T < S+ 0 0 6 -3,-1.2 16,-0.1 -4,-0.4 3,-0.1 -0.800 112.5 1.0 -83.8 126.2 14.0 -19.3 41.5 132 139 A H T 3 S- 0 0 30 -2,-0.5 -1,-0.3 1,-0.2 115,-0.1 0.880 100.1-171.0 55.6 41.1 12.7 -19.3 37.9 133 140 A H < + 0 0 30 -3,-1.0 116,-0.3 114,-0.4 2,-0.3 -0.326 16.6 153.5 -61.3 137.7 9.9 -21.5 39.2 134 141 A T - 0 0 15 -5,-0.3 -3,-0.0 -3,-0.1 9,-0.0 -0.916 39.5-155.5-163.6 146.3 7.6 -23.0 36.6 135 142 A E + 0 0 138 -2,-0.3 2,-0.6 4,-0.0 3,-0.1 0.231 63.6 114.1-101.2 10.7 5.4 -26.1 36.3 136 143 A V >> - 0 0 45 1,-0.1 3,-1.8 108,-0.1 4,-0.7 -0.758 62.2-145.8 -92.5 116.5 5.6 -26.2 32.5 137 144 A A G >4 S+ 0 0 89 -2,-0.6 3,-0.9 1,-0.3 4,-0.3 0.844 97.8 52.6 -50.0 -42.3 7.5 -29.3 31.2 138 145 A E G 34 S+ 0 0 157 1,-0.2 4,-0.3 2,-0.1 3,-0.3 0.708 107.6 52.8 -68.8 -20.8 9.0 -27.5 28.2 139 146 A E G <> S+ 0 0 33 -3,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.577 80.0 92.0 -90.9 -9.2 10.4 -24.7 30.5 140 147 A Q H S+ 0 0 131 -4,-0.3 4,-1.5 -3,-0.3 -1,-0.2 0.947 109.0 45.6 -64.1 -55.0 15.5 -26.7 30.9 142 149 A H H > S+ 0 0 113 -4,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.867 111.0 55.6 -56.9 -39.4 15.8 -22.9 30.7 143 150 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.926 105.0 51.3 -64.5 -45.5 14.9 -22.6 34.4 144 151 A E H X S+ 0 0 82 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.830 106.5 53.8 -60.7 -34.3 17.8 -24.9 35.5 145 152 A A H X S+ 0 0 59 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.873 108.7 49.6 -69.8 -37.6 20.3 -22.9 33.4 146 153 A A H X S+ 0 0 22 -4,-1.7 4,-2.5 2,-0.2 5,-0.3 0.914 110.5 50.4 -61.5 -47.2 19.3 -19.7 35.2 147 154 A R H X S+ 0 0 3 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.934 110.0 50.7 -57.4 -44.0 19.6 -21.4 38.5 148 155 A A H X S+ 0 0 49 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.899 111.5 47.1 -65.5 -39.0 23.1 -22.6 37.6 149 156 A V H X S+ 0 0 53 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.913 113.6 45.9 -68.0 -44.4 24.2 -19.1 36.5 150 157 A F H X S+ 0 0 25 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.852 106.4 59.5 -73.9 -29.6 22.9 -17.3 39.6 151 158 A R H < S+ 0 0 98 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.916 109.6 45.6 -57.8 -42.2 24.4 -20.0 41.9 152 159 A K H >< S+ 0 0 94 -4,-1.4 3,-1.5 1,-0.2 7,-0.4 0.897 106.6 56.6 -69.4 -40.5 27.7 -19.0 40.4 153 160 A F H 3< S+ 0 0 1 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.866 109.4 48.2 -53.6 -37.9 27.0 -15.3 40.7 154 161 A R T 3< S+ 0 0 49 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.407 92.9 97.1 -87.8 2.3 26.5 -16.0 44.5 155 162 A T S <> S- 0 0 50 -3,-1.5 4,-2.6 -4,-0.2 5,-0.4 -0.781 85.2-108.7 -91.2 128.6 29.7 -18.0 44.7 156 163 A P T 4 S+ 0 0 108 0, 0.0 2,-1.8 0, 0.0 -2,-0.1 -0.282 99.2 4.4 -53.9 139.9 32.8 -16.2 46.0 157 164 A G T > S+ 0 0 48 1,-0.2 4,-2.2 -4,-0.1 5,-0.2 -0.353 124.0 68.4 78.6 -53.4 35.5 -15.6 43.3 158 165 A E H > S+ 0 0 80 -2,-1.8 4,-2.3 1,-0.2 5,-0.2 0.937 99.2 47.6 -64.2 -47.0 33.2 -17.0 40.6 159 166 A G H X>S+ 0 0 0 -4,-2.6 4,-2.9 -7,-0.4 5,-0.6 0.907 111.0 52.1 -60.2 -43.6 30.7 -14.1 40.7 160 167 A E H >>S+ 0 0 59 -5,-0.4 5,-2.2 1,-0.2 4,-1.2 0.922 110.8 47.4 -55.8 -48.7 33.5 -11.5 40.6 161 168 A A H <>S+ 0 0 40 -4,-2.2 5,-2.5 3,-0.2 -2,-0.2 0.915 117.5 42.7 -59.2 -45.4 35.0 -13.1 37.5 162 169 A M H <5S+ 0 0 52 -4,-2.3 6,-3.2 3,-0.2 -2,-0.2 0.926 129.3 21.8 -68.5 -49.6 31.6 -13.3 35.8 163 170 A I H <5S+ 0 0 0 -4,-2.9 4,-0.4 4,-0.2 -3,-0.2 0.909 129.8 36.4 -92.4 -48.7 30.2 -10.0 36.6 164 171 A L T < + 0 0 14 -4,-0.4 4,-2.7 -6,-0.2 3,-0.4 0.807 43.1 161.0 54.3 36.0 30.5 -8.2 32.5 168 175 A A H >> + 0 0 12 -6,-3.2 5,-2.2 1,-0.2 4,-2.1 0.752 63.3 58.5 -62.3 -30.3 28.2 -11.2 32.1 169 176 A F H 4>S+ 0 0 5 3,-0.2 5,-2.5 2,-0.2 -1,-0.2 0.950 116.4 33.0 -68.8 -44.6 25.1 -9.5 33.6 170 177 A V H 45S+ 0 0 0 -3,-0.4 -2,-0.2 -7,-0.2 -1,-0.2 0.909 128.1 38.8 -74.6 -44.3 25.1 -6.7 31.0 171 178 A E H <5S+ 0 0 63 -4,-2.7 -3,-0.2 3,-0.1 -2,-0.2 0.725 134.7 11.4 -83.7 -24.0 26.4 -8.8 28.1 172 179 A R T X5S+ 0 0 183 -4,-2.1 4,-1.9 -5,-0.3 -3,-0.2 0.737 125.0 45.3-120.0 -53.0 24.6 -12.1 28.7 173 180 A V H >44 S+ 0 0 51 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.850 110.5 64.9 -59.1 -31.9 20.0 -9.7 26.2 176 183 A G H 3< S+ 0 0 54 -4,-1.9 -2,-0.2 1,-0.3 -3,-0.1 0.704 102.0 48.4 -59.4 -26.3 19.0 -13.2 27.4 177 184 A G T << S+ 0 0 7 -3,-1.4 97,-2.3 -4,-1.0 95,-0.4 0.126 96.2 81.1-103.8 19.2 15.9 -11.8 28.9 178 185 A I < - 0 0 9 -3,-1.6 4,-0.1 95,-0.1 97,-0.1 -0.995 64.4-154.9-120.3 127.3 14.7 -9.8 25.9 179 186 A V S S+ 0 0 79 -2,-0.4 -1,-0.1 91,-0.1 92,-0.1 0.948 79.9 53.0 -68.3 -48.9 12.9 -11.7 23.1 180 187 A R S S- 0 0 89 1,-0.1 2,-0.6 0, 0.0 -2,-0.1 -0.266 95.2-106.3 -77.7 169.0 13.8 -9.2 20.4 181 188 A K - 0 0 172 -2,-0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.889 35.2-127.4 -98.4 123.9 17.4 -8.1 19.6 182 189 A L - 0 0 11 -2,-0.6 2,-0.1 1,-0.1 -4,-0.0 -0.385 23.2-113.2 -66.9 145.5 18.0 -4.5 20.7 183 190 A G >> - 0 0 22 1,-0.1 4,-2.3 -2,-0.0 3,-0.8 -0.390 31.3-106.0 -65.9 157.9 19.4 -2.1 18.2 184 191 A D H 3> S+ 0 0 131 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.859 122.6 52.0 -48.6 -45.2 23.0 -0.8 18.8 185 192 A E H 34 S+ 0 0 136 1,-0.2 -1,-0.2 2,-0.2 -3,-0.0 0.731 111.1 48.1 -71.6 -24.2 21.6 2.6 19.9 186 193 A E H <4 S+ 0 0 28 -3,-0.8 -2,-0.2 2,-0.1 -1,-0.2 0.787 114.3 44.9 -81.7 -36.2 19.3 0.9 22.4 187 194 A M H >X S+ 0 0 14 -4,-2.3 3,-1.7 1,-0.1 4,-1.0 0.826 98.5 72.6 -74.7 -34.7 22.0 -1.4 23.9 188 195 A A H >X S+ 0 0 42 -4,-2.2 4,-2.1 1,-0.3 3,-0.9 0.865 91.4 54.2 -55.7 -43.4 24.7 1.3 24.2 189 196 A P H 34 S+ 0 0 42 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.654 104.1 58.0 -67.5 -11.0 23.1 3.1 27.2 190 197 A Y H <4 S+ 0 0 2 -3,-1.7 -2,-0.2 -4,-0.2 -130,-0.1 0.735 111.3 42.5 -80.1 -27.6 23.0 -0.2 29.1 191 198 A R H X< S+ 0 0 101 -4,-1.0 3,-2.1 -3,-0.9 -3,-0.1 0.836 98.0 72.2 -83.7 -38.5 26.8 -0.5 28.7 192 199 A T T 3< S+ 0 0 101 -4,-2.1 -1,-0.1 1,-0.3 -2,-0.1 0.752 90.3 57.8 -60.9 -28.4 27.9 3.1 29.4 193 200 A P T 3 S+ 0 0 11 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.709 107.8 50.6 -68.3 -14.6 27.3 3.1 33.2 194 201 A F < + 0 0 3 -3,-2.1 -2,-0.1 1,-0.1 6,-0.1 -0.507 57.5 141.2-128.2 59.7 29.6 0.1 33.6 195 202 A P + 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.717 68.5 38.6 -74.5 -19.7 33.0 0.7 31.9 196 203 A T S > S- 0 0 61 -3,-0.2 4,-0.9 1,-0.1 3,-0.1 -0.882 81.7-113.0-131.2 157.8 35.2 -0.9 34.6 197 204 A P T >4 S+ 0 0 67 0, 0.0 3,-0.9 0, 0.0 4,-0.2 0.896 118.7 52.3 -52.2 -43.5 35.2 -3.9 37.0 198 205 A E G >4 S+ 0 0 90 1,-0.3 3,-1.7 2,-0.2 -33,-0.0 0.893 104.1 56.6 -60.9 -42.7 34.9 -1.5 40.0 199 206 A S G 34 S+ 0 0 5 1,-0.3 -1,-0.3 2,-0.1 4,-0.2 0.681 99.5 62.3 -61.0 -21.8 31.9 0.2 38.4 200 207 A R G XX + 0 0 27 -3,-0.9 4,-1.6 -4,-0.9 3,-0.9 0.402 69.0 105.7 -88.2 4.5 30.2 -3.2 38.2 201 208 A R H <> S+ 0 0 76 -3,-1.7 4,-2.2 1,-0.3 3,-0.3 0.873 78.8 51.1 -51.6 -44.4 30.1 -3.7 42.0 202 209 A P H 3> S+ 0 0 4 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.829 106.0 55.9 -64.0 -29.2 26.4 -2.9 42.3 203 210 A V H <4 S+ 0 0 0 -3,-0.9 -2,-0.2 2,-0.2 -3,-0.1 0.818 111.5 43.3 -73.2 -32.0 25.6 -5.4 39.6 204 211 A L H X S+ 0 0 12 -4,-1.6 4,-1.0 -3,-0.3 -1,-0.2 0.849 109.7 57.1 -76.9 -35.5 27.4 -8.2 41.6 205 212 A A H X S+ 0 0 16 -4,-2.2 4,-0.6 -5,-0.2 3,-0.4 0.904 97.8 63.0 -65.0 -39.6 25.8 -7.2 44.9 206 213 A F H >X S+ 0 0 0 -4,-1.7 3,-1.7 1,-0.2 4,-0.7 0.911 101.3 45.7 -59.7 -50.1 22.3 -7.5 43.6 207 214 A P H >4 S+ 0 0 1 0, 0.0 3,-0.6 0, 0.0 -1,-0.2 0.841 109.4 58.7 -63.7 -25.5 22.2 -11.3 42.9 208 215 A R H 3< S+ 0 0 63 -4,-1.0 -2,-0.2 -3,-0.4 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-41.7 -15.8 14.5 2.6 448 154 B R H X S+ 0 0 12 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.909 110.3 51.2 -63.6 -39.9 -18.6 17.1 3.0 449 155 B A H X S+ 0 0 47 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.911 110.6 48.7 -64.0 -41.7 -19.3 16.8 -0.8 450 156 B V H X S+ 0 0 50 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.935 114.6 43.7 -63.1 -48.3 -19.5 13.0 -0.6 451 157 B F H X S+ 0 0 25 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.838 108.8 57.3 -72.0 -30.9 -21.8 13.0 2.4 452 158 B R H < S+ 0 0 150 -4,-2.6 4,-0.3 -5,-0.2 -1,-0.2 0.922 109.9 47.3 -59.2 -43.7 -24.0 15.8 0.9 453 159 B K H >< S+ 0 0 98 -4,-1.9 3,-1.6 1,-0.2 7,-0.4 0.923 106.8 55.1 -63.7 -45.7 -24.4 13.4 -2.1 454 160 B F H 3< S+ 0 0 1 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.879 110.1 48.4 -51.5 -39.1 -25.2 10.4 0.1 455 161 B R T 3< S+ 0 0 47 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.494 92.0 97.7 -82.5 -4.8 -28.0 12.5 1.7 456 162 B T S <> S- 0 0 60 -3,-1.6 4,-2.1 -4,-0.3 3,-0.4 -0.723 86.2-106.0 -89.6 128.6 -29.4 13.6 -1.7 457 163 B P T 4 S+ 0 0 113 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 -0.286 101.4 4.5 -54.6 136.2 -32.4 11.7 -3.0 458 164 B G T > S+ 0 0 44 1,-0.1 4,-1.7 -4,-0.1 5,-0.1 -0.258 121.1 71.5 86.0 -46.9 -31.4 9.4 -5.9 459 165 B E H > S+ 0 0 100 -2,-0.9 4,-2.1 -3,-0.4 5,-0.2 0.924 96.0 49.2 -66.6 -46.5 -27.7 10.2 -5.6 460 166 B G H X>S+ 0 0 0 -4,-2.1 4,-3.1 -7,-0.4 5,-0.6 0.894 107.9 55.6 -64.6 -38.1 -27.1 8.3 -2.4 461 167 B E H >>S+ 0 0 52 -5,-0.3 5,-1.9 1,-0.2 4,-1.4 0.935 109.3 46.1 -56.7 -46.9 -28.9 5.3 -3.8 462 168 B A H <>S+ 0 0 54 -4,-1.7 5,-2.2 3,-0.2 -1,-0.2 0.882 119.0 41.7 -63.7 -41.1 -26.6 5.1 -6.8 463 169 B M H <5S+ 0 0 40 -4,-2.1 6,-2.9 3,-0.2 -2,-0.2 0.924 127.9 24.8 -75.2 -46.7 -23.5 5.6 -4.7 464 170 B I H <5S+ 0 0 0 -4,-3.1 4,-0.3 4,-0.2 -3,-0.2 0.900 130.2 33.2 -93.0 -44.6 -24.3 3.3 -1.7 465 171 B L T < + 0 0 13 -4,-0.3 4,-2.5 -6,-0.1 3,-0.3 0.849 42.8 161.0 54.6 37.4 -21.3 0.0 -2.6 469 175 B A H >> + 0 0 9 -6,-2.9 5,-2.3 1,-0.2 4,-2.0 0.746 61.9 59.5 -64.3 -28.1 -19.2 3.1 -2.1 470 176 B F H 4>S+ 0 0 5 3,-0.2 5,-2.2 2,-0.2 -1,-0.2 0.941 115.8 33.8 -67.3 -44.2 -19.5 3.2 1.7 471 177 B V H 45S+ 0 0 0 -3,-0.3 -2,-0.2 -7,-0.2 -1,-0.2 0.883 126.5 39.8 -74.7 -42.2 -17.9 -0.3 2.0 472 178 B E H <5S+ 0 0 70 -4,-2.5 -3,-0.2 3,-0.1 -2,-0.2 0.727 134.9 9.1 -86.3 -23.4 -15.5 -0.1 -0.9 473 179 B R T X5S+ 0 0 187 -4,-2.0 4,-1.9 -5,-0.3 -3,-0.2 0.715 124.0 48.5-123.2 -52.2 -14.3 3.5 -0.6 474 180 B V H >44 S+ 0 0 52 0, 0.0 3,-1.7 0, 0.0 -1,-0.2 0.859 110.8 66.0 -60.6 -29.2 -10.8 1.8 3.5 477 183 B G H 3< S+ 0 0 48 -4,-1.9 -2,-0.2 1,-0.3 -3,-0.1 0.717 101.1 48.4 -56.6 -27.7 -10.6 5.6 3.2 478 184 B G T << S+ 0 0 6 -3,-1.8 97,-2.2 -4,-0.8 95,-0.5 0.142 97.3 81.1-104.2 17.8 -10.7 5.9 6.9 479 185 B I < - 0 0 9 -3,-1.7 4,-0.1 95,-0.1 97,-0.1 -0.992 62.9-155.9-121.7 127.5 -8.0 3.3 7.7 480 186 B V S S+ 0 0 83 -2,-0.4 -1,-0.1 91,-0.1 92,-0.1 0.946 79.1 57.2 -68.3 -51.3 -4.3 4.4 7.4 481 187 B R S S- 0 0 88 1,-0.1 2,-0.6 0, 0.0 -2,-0.1 -0.305 94.4-108.0 -72.6 164.3 -3.0 0.8 6.9 482 188 B K - 0 0 186 -2,-0.0 2,-0.1 1,-0.0 -1,-0.1 -0.869 35.6-128.0 -93.1 123.1 -4.1 -1.4 4.0 483 189 B L - 0 0 19 -2,-0.6 2,-0.1 1,-0.1 5,-0.0 -0.394 21.4-112.6 -67.8 144.8 -6.3 -4.2 5.2 484 190 B G >> - 0 0 22 1,-0.1 4,-2.2 -2,-0.1 3,-0.8 -0.392 29.4-110.3 -66.0 154.7 -5.5 -7.8 4.2 485 191 B D H 3> S+ 0 0 133 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.874 121.4 52.0 -50.9 -43.5 -7.9 -9.5 1.9 486 192 B E H 34 S+ 0 0 139 1,-0.2 -1,-0.2 2,-0.2 -3,-0.0 0.727 111.0 48.1 -69.3 -24.7 -9.0 -11.8 4.8 487 193 B E H <4 S+ 0 0 30 -3,-0.8 -2,-0.2 2,-0.1 -1,-0.2 0.767 114.3 45.4 -81.6 -34.4 -9.6 -8.7 7.0 488 194 B M H >X S+ 0 0 13 -4,-2.2 3,-1.6 1,-0.1 4,-0.9 0.813 97.7 72.3 -76.5 -33.0 -11.6 -6.9 4.3 489 195 B A H >X S+ 0 0 41 -4,-2.1 4,-1.9 1,-0.3 3,-1.1 0.876 91.0 55.4 -59.1 -43.5 -13.8 -9.8 3.2 490 196 B P H 34 S+ 0 0 42 0, 0.0 -1,-0.3 0, 0.0 -153,-0.1 0.651 102.1 59.4 -66.2 -11.1 -16.1 -9.9 6.4 491 197 B Y H <4 S+ 0 0 2 -3,-1.6 -2,-0.2 -4,-0.2 -130,-0.1 0.761 111.0 41.8 -78.7 -27.6 -16.9 -6.2 5.8 492 198 B R H X< S+ 0 0 101 -3,-1.1 3,-2.2 -4,-0.9 -3,-0.1 0.810 98.0 72.8 -84.1 -37.3 -18.3 -7.2 2.4 493 199 B T T 3< S+ 0 0 105 -4,-1.9 -1,-0.1 1,-0.3 -2,-0.1 0.769 89.4 58.9 -62.6 -28.3 -20.2 -10.4 3.2 494 200 B P T 3 S+ 0 0 11 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.685 109.3 48.8 -64.7 -14.9 -23.1 -8.7 5.1 495 201 B F < + 0 0 2 -3,-2.2 -2,-0.1 1,-0.1 6,-0.1 -0.471 57.8 144.8-130.7 58.9 -23.9 -6.7 2.0 496 202 B P + 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.664 68.3 41.1 -72.2 -18.7 -24.1 -8.9 -1.2 497 203 B T S > S- 0 0 65 1,-0.1 4,-0.7 -29,-0.0 3,-0.2 -0.896 82.5-114.0-129.2 157.2 -26.9 -7.0 -2.9 498 204 B P T >4 S+ 0 0 45 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.923 118.5 50.1 -47.7 -49.1 -28.0 -3.3 -3.4 499 205 B E G >4 S+ 0 0 123 1,-0.3 3,-1.6 2,-0.2 -33,-0.0 0.827 101.7 61.2 -66.4 -33.1 -31.1 -3.8 -1.3 500 206 B S G 34 S+ 0 0 15 1,-0.3 -1,-0.3 -3,-0.2 4,-0.2 0.715 96.4 63.9 -63.1 -20.9 -29.0 -5.4 1.5 501 207 B R G XX + 0 0 28 -3,-1.4 4,-1.7 -4,-0.7 3,-0.8 0.366 68.3 106.3 -85.3 3.8 -27.2 -2.0 1.7 502 208 B R H <> S+ 0 0 102 -3,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.886 77.4 52.3 -53.7 -40.3 -30.3 -0.1 2.8 503 209 B P H 3> S+ 0 0 4 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.850 107.6 54.0 -65.5 -29.0 -29.1 0.3 6.4 504 210 B V H <4 S+ 0 0 0 -3,-0.8 -2,-0.2 1,-0.2 -3,-0.1 0.843 112.0 42.7 -71.1 -35.8 -25.8 1.7 5.1 505 211 B L H X S+ 0 0 3 -4,-1.7 4,-1.0 2,-0.2 -1,-0.2 0.802 109.1 60.9 -74.8 -33.8 -27.6 4.4 3.0 506 212 B A H X S+ 0 0 17 -4,-2.2 4,-0.5 -5,-0.2 3,-0.2 0.911 97.0 60.0 -61.7 -43.4 -30.0 5.1 6.0 507 213 B F H >X S+ 0 0 0 -4,-1.6 3,-1.7 1,-0.2 4,-0.7 0.893 100.3 48.6 -59.1 -52.5 -27.2 6.2 8.4 508 214 B P H >4 S+ 0 0 1 0, 0.0 3,-0.8 0, 0.0 -1,-0.2 0.873 109.5 56.5 -57.9 -31.5 -25.7 9.1 6.5 509 215 B R H 3< S+ 0 0 60 -4,-1.0 -2,-0.2 -3,-0.2 -3,-0.1 0.585 104.9 53.3 -71.7 -12.0 -29.2 10.5 6.1 510 216 B E H << S+ 0 0 13 -3,-1.7 -1,-0.2 -4,-0.5 -3,-0.1 0.527 77.9 121.1 -94.2 -13.0 -29.6 10.3 9.9 511 217 B L S << S- 0 0 7 -3,-0.8 2,-1.5 -4,-0.7 10,-0.1 -0.290 73.4-117.3 -58.3 135.1 -26.5 12.4 10.7 512 218 B P + 0 0 0 0, 0.0 -86,-2.7 0, 0.0 2,-0.5 -0.565 56.5 151.0 -79.3 88.9 -27.5 15.5 12.7 513 219 B I B > -qR 426 516D 2 3,-1.8 3,-1.7 -2,-1.5 -84,-0.1 -0.984 67.5 -16.4-129.2 123.7 -26.5 18.2 10.2 514 220 B A T 3 S- 0 0 64 -88,-3.1 -1,-0.1 -2,-0.5 -86,-0.1 0.832 125.5 -55.2 51.6 37.9 -28.1 21.7 10.0 515 221 B G T 3 S+ 0 0 32 -89,-0.3 -1,-0.3 1,-0.2 6,-0.1 0.495 97.3 151.5 82.9 4.1 -31.2 20.5 11.9 516 222 B E B < +R 513 0D 119 -3,-1.7 -3,-1.8 1,-0.2 -1,-0.2 -0.980 62.3 27.0-126.8 132.6 -32.0 17.5 9.7 517 223 B P S > S- 0 0 9 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.549 85.2-157.6 -71.5 147.2 -33.4 15.1 10.5 518 224 B A H > S+ 0 0 67 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.863 85.9 52.0 -65.0 -41.4 -35.0 17.1 13.3 519 225 B D H > S+ 0 0 58 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.933 114.5 42.1 -63.1 -45.3 -35.8 14.2 15.6 520 226 B V H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.915 112.8 54.1 -66.0 -43.2 -32.2 12.9 15.6 521 227 B Y H X S+ 0 0 26 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.929 112.7 43.7 -56.3 -48.7 -30.7 16.4 15.9 522 228 B E H X S+ 0 0 135 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.941 113.1 51.2 -60.1 -51.9 -32.9 17.1 19.0 523 229 B A H X S+ 0 0 15 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.910 113.4 44.7 -55.3 -43.3 -32.1 13.6 20.5 524 230 B L H X S+ 0 0 0 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.807 109.8 54.4 -78.3 -27.0 -28.4 14.1 20.0 525 231 B Q H X S+ 0 0 107 -4,-2.1 4,-1.8 -5,-0.3 -1,-0.2 0.940 113.7 43.6 -59.7 -48.1 -28.4 17.7 21.3 526 232 B S H X S+ 0 0 77 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.911 113.4 50.8 -64.3 -43.4 -30.1 16.4 24.5 527 233 B A H X S+ 0 0 1 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.870 110.2 50.3 -64.4 -37.1 -27.7 13.4 24.6 528 234 B H H X S+ 0 0 27 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.831 106.8 53.8 -71.1 -30.9 -24.7 15.7 24.3 529 235 B A H X S+ 0 0 64 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.935 110.5 47.7 -63.6 -44.4 -26.0 17.9 27.1 530 236 B A H X S+ 0 0 35 -4,-2.1 4,-1.3 2,-0.2 3,-0.3 0.890 109.6 52.9 -64.0 -43.4 -26.3 14.8 29.3 531 237 B L H >< S+ 0 0 2 -4,-2.2 3,-0.6 1,-0.2 31,-0.3 0.924 106.8 52.8 -58.6 -45.7 -22.8 13.8 28.4 532 238 B A H 3< S+ 0 0 51 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.793 117.3 37.8 -59.1 -33.2 -21.4 17.2 29.3 533 239 B A H 3< S+ 0 0 80 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.549 91.4 119.8 -93.8 -12.2 -23.0 16.9 32.8 534 240 B S << - 0 0 14 -4,-1.3 28,-0.5 -3,-0.6 -3,-0.1 -0.155 47.4-160.5 -64.9 149.2 -22.4 13.2 33.3 535 241 B S + 0 0 78 26,-0.1 -1,-0.1 2,-0.1 3,-0.1 0.504 54.6 108.3-108.9 -9.0 -20.3 12.0 36.3 536 242 B Y S S- 0 0 21 1,-0.1 -120,-0.2 -120,-0.0 26,-0.1 -0.330 81.8 -88.8 -67.8 152.6 -19.3 8.5 35.1 537 243 B P - 0 0 10 0, 0.0 -120,-2.2 0, 0.0 2,-0.3 -0.357 48.1-166.0 -63.5 142.6 -15.7 7.8 34.0 538 244 B K E -op 417 564C 1 25,-3.0 27,-2.4 -122,-0.2 2,-0.4 -0.960 17.8-164.4-133.3 149.9 -14.8 8.5 30.4 539 245 B L E -op 418 565C 0 -122,-2.5 -120,-2.8 -2,-0.3 2,-0.5 -0.967 9.9-167.8-133.6 114.3 -12.0 7.7 28.0 540 246 B L E -op 419 566C 0 25,-3.0 27,-3.0 -2,-0.4 2,-0.4 -0.919 5.5-159.4-105.1 123.8 -11.7 9.6 24.7 541 247 B F E -op 420 567C 1 -122,-2.7 -120,-0.5 -2,-0.5 2,-0.3 -0.818 9.8-170.3 -98.0 146.2 -9.3 8.3 22.1 542 248 B T E - p 0 568C 3 25,-2.1 27,-3.2 -2,-0.4 28,-0.5 -0.993 8.1-159.6-135.7 142.8 -8.0 10.6 19.3 543 249 B G E - 0 0 0 -2,-0.3 28,-0.2 6,-0.3 4,-0.1 -0.696 36.2 -84.8-107.3 170.5 -6.1 10.0 16.1 544 250 B E E S- p 0 571C 96 26,-2.3 28,-1.8 1,-0.3 6,-0.1 -0.977 113.6 -7.8-119.4 115.4 -4.1 12.5 14.0 545 251 B P E S- p 0 572C 46 0, 0.0 -1,-0.3 0, 0.0 28,-0.2 -0.996 93.6-177.4 -85.7 -3.0 -5.7 14.0 12.1 546 252 B G - 0 0 8 26,-2.6 28,-0.3 4,-0.1 4,-0.1 -0.419 25.9-122.2 69.5-158.0 -8.8 11.9 12.8 547 253 B A S S+ 0 0 13 26,-0.4 27,-0.1 2,-0.4 3,-0.1 0.271 95.4 22.4-145.5 -72.0 -12.0 12.6 10.8 548 254 B L S S+ 0 0 16 1,-0.2 2,-0.4 -115,-0.1 -114,-0.3 0.706 129.7 43.8 -74.2 -21.5 -15.1 13.5 12.8 549 255 B V S S- 0 0 1 -116,-0.1 -2,-0.4 -126,-0.0 -6,-0.3 -0.972 75.2-153.6-133.6 112.1 -12.9 14.6 15.8 550 256 B S > - 0 0 6 -2,-0.4 4,-3.0 -116,-0.2 5,-0.2 -0.487 28.4-115.4 -81.0 154.8 -9.8 16.7 15.4 551 257 B P H > S+ 0 0 27 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.901 118.0 49.2 -55.1 -41.6 -7.0 16.5 18.0 552 258 B E H > S+ 0 0 83 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.903 112.4 47.2 -68.7 -41.4 -7.6 20.1 19.0 553 259 B F H > S+ 0 0 23 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.917 110.2 53.9 -64.0 -41.3 -11.3 19.6 19.3 554 260 B A H X S+ 0 0 0 -4,-3.0 4,-2.9 1,-0.2 5,-0.2 0.876 105.9 52.7 -59.8 -40.5 -10.7 16.4 21.3 555 261 B E H X S+ 0 0 115 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.936 114.3 40.6 -65.4 -46.9 -8.5 18.2 23.8 556 262 B R H X S+ 0 0 144 -4,-1.7 4,-1.3 2,-0.2 -2,-0.2 0.869 114.9 52.6 -67.0 -42.7 -11.1 20.9 24.5 557 263 B F H >X S+ 0 0 25 -4,-2.7 4,-0.9 2,-0.2 3,-0.7 0.973 111.7 44.7 -57.3 -54.3 -14.0 18.5 24.5 558 264 B A H >< S+ 0 0 8 -4,-2.9 3,-0.9 1,-0.3 6,-0.3 0.896 111.2 53.3 -58.7 -44.8 -12.3 16.1 27.1 559 265 B A H 3< S+ 0 0 84 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.783 105.5 56.0 -61.4 -27.9 -11.2 19.0 29.3 560 266 B S H << S+ 0 0 78 -4,-1.3 -1,-0.2 -3,-0.7 -2,-0.2 0.720 98.5 77.7 -76.8 -23.3 -14.9 20.2 29.4 561 267 B L S << S- 0 0 15 -3,-0.9 2,-0.4 -4,-0.9 3,-0.4 -0.334 84.9-110.5 -83.8 165.2 -16.2 16.9 30.7 562 268 B T S S- 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