==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-JAN-01 1HY3 . COMPND 2 MOLECULE: ESTROGEN SULFOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.C.PEDERSEN,E.V.PETROCHENKO,S.SHEVTSOV,M.NEGISHI . 575 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26045.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 384 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 3.8 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 27 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 207 36.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 6 7 0 1 2 2 4 2 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 2 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 PARALLEL BRIDGES PER LADDER . 3 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 0 ANTIPARALLEL BRIDGES PER LADDER . 4 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 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 N > 0 0 121 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -43.2 -18.7 -9.4 25.6 2 3 A S H > + 0 0 56 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.931 360.0 50.6 -63.2 -46.7 -15.1 -8.9 26.8 3 4 A E H > S+ 0 0 114 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.880 109.7 50.5 -59.4 -39.5 -13.8 -11.0 23.9 4 5 A L H > S+ 0 0 98 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.892 109.1 52.2 -66.0 -37.8 -15.8 -9.0 21.4 5 6 A D H X S+ 0 0 32 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.933 110.6 47.4 -62.3 -46.4 -14.3 -5.8 23.0 6 7 A Y H X S+ 0 0 12 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.888 109.7 53.9 -62.2 -39.6 -10.8 -7.3 22.5 7 8 A Y H < S+ 0 0 178 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.845 109.3 48.3 -63.6 -35.3 -11.7 -8.2 19.0 8 9 A E H < S+ 0 0 106 -4,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.855 118.9 38.8 -74.0 -34.3 -12.7 -4.6 18.2 9 10 A K H < S+ 0 0 66 -4,-1.9 11,-2.1 -5,-0.1 2,-0.3 0.802 113.4 44.7 -87.8 -33.7 -9.6 -3.1 19.8 10 11 A F E < +A 19 0A 8 -4,-2.6 2,-0.3 9,-0.2 9,-0.2 -0.830 51.2 179.0-120.2 158.5 -6.7 -5.4 18.8 11 12 A E E -A 18 0A 86 7,-2.6 7,-2.0 -2,-0.3 2,-0.2 -0.980 30.7-108.2-150.6 149.6 -5.5 -7.2 15.7 12 13 A E E -A 17 0A 125 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.572 24.0-174.7 -87.3 147.7 -2.5 -9.4 15.0 13 14 A V E > S-A 16 0A 14 3,-1.8 3,-2.1 -2,-0.2 -2,-0.0 -0.971 83.0 -10.9-137.9 119.4 0.6 -8.4 12.9 14 15 A H T 3 S- 0 0 109 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 0.863 132.0 -56.5 56.9 34.1 3.1 -11.2 12.3 15 16 A G T 3 S+ 0 0 52 1,-0.2 2,-0.5 153,-0.0 -1,-0.3 0.409 113.9 117.7 81.4 -2.3 1.2 -13.2 14.9 16 17 A I E < -A 13 0A 38 -3,-2.1 -3,-1.8 152,-0.1 -1,-0.2 -0.872 69.3-118.6-103.8 125.7 1.5 -10.5 17.6 17 18 A L E +A 12 0A 30 -2,-0.5 150,-2.9 146,-0.3 151,-0.3 -0.341 45.0 173.5 -60.6 137.7 -1.6 -8.9 19.1 18 19 A M E -A 11 0A 0 -7,-2.0 -7,-2.6 148,-0.2 2,-0.2 -0.970 40.9 -86.8-147.6 158.1 -1.4 -5.1 18.4 19 20 A Y E >> -A 10 0A 24 -2,-0.3 3,-1.3 -9,-0.2 4,-0.8 -0.495 42.0-129.1 -64.2 131.4 -3.5 -1.9 18.7 20 21 A K H >> S+ 0 0 70 -11,-2.1 4,-1.7 1,-0.3 3,-0.8 0.833 106.2 58.7 -53.3 -38.7 -5.6 -1.6 15.6 21 22 A D H 3> S+ 0 0 67 -12,-0.3 4,-0.5 1,-0.2 64,-0.3 0.821 105.5 50.8 -61.8 -30.3 -4.4 1.9 14.8 22 23 A F H <4 S+ 0 0 24 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.652 109.7 51.0 -80.7 -17.2 -0.8 0.7 14.7 23 24 A V H X< S+ 0 0 19 -3,-0.8 3,-2.0 -4,-0.8 4,-0.2 0.807 90.4 72.8 -90.9 -32.5 -1.6 -2.1 12.3 24 25 A K H 3< S+ 0 0 134 -4,-1.7 3,-0.2 1,-0.3 -1,-0.1 0.856 114.1 26.4 -51.3 -40.0 -3.5 -0.2 9.6 25 26 A Y T >X S+ 0 0 75 -4,-0.5 3,-1.5 1,-0.1 4,-0.6 -0.125 79.0 134.2-116.6 37.6 -0.2 1.4 8.4 26 27 A W H X> + 0 0 12 -3,-2.0 4,-3.0 1,-0.3 3,-1.3 0.798 63.3 69.4 -56.5 -31.5 2.2 -1.3 9.5 27 28 A D H 3> S+ 0 0 134 1,-0.3 4,-2.6 -4,-0.2 -1,-0.3 0.850 92.9 59.3 -55.9 -34.1 4.0 -1.2 6.2 28 29 A N H <4 S+ 0 0 68 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.795 111.0 40.5 -65.0 -29.8 5.2 2.2 7.1 29 30 A V H X< S+ 0 0 6 -3,-1.3 3,-1.6 -4,-0.6 -2,-0.2 0.876 112.2 55.1 -83.3 -43.3 6.9 0.7 10.2 30 31 A E H 3< S+ 0 0 88 -4,-3.0 84,-0.4 1,-0.3 85,-0.3 0.898 113.9 41.0 -56.3 -42.8 8.1 -2.4 8.3 31 32 A A T 3< S+ 0 0 66 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.264 83.7 142.9 -90.8 10.9 9.9 -0.2 5.7 32 33 A F < - 0 0 5 -3,-1.6 2,-0.8 1,-0.1 83,-0.4 -0.278 47.7-133.4 -57.2 133.9 11.3 2.3 8.2 33 34 A Q - 0 0 123 82,-0.1 -1,-0.1 81,-0.1 -2,-0.1 -0.799 20.9-160.8 -96.8 109.5 14.8 3.5 7.3 34 35 A A - 0 0 4 -2,-0.8 3,-0.0 4,-0.0 82,-0.0 -0.292 9.3-136.4 -79.9 167.0 17.2 3.5 10.3 35 36 A R > - 0 0 76 66,-0.1 3,-2.2 1,-0.1 84,-0.1 -0.924 25.5-112.3-122.4 148.8 20.4 5.5 10.4 36 37 A P T 3 S+ 0 0 85 0, 0.0 86,-0.3 0, 0.0 -1,-0.1 0.836 116.0 48.7 -49.9 -38.9 23.7 4.0 11.7 37 38 A D T 3 S+ 0 0 81 84,-0.1 2,-0.0 2,-0.1 -3,-0.0 0.313 81.5 126.1 -89.2 11.2 23.7 6.2 14.8 38 39 A D < - 0 0 2 -3,-2.2 84,-0.7 62,-0.1 2,-0.5 -0.381 48.7-151.2 -65.1 146.1 20.1 5.5 15.8 39 40 A L E -bc 102 122B 2 62,-2.4 64,-3.3 82,-0.1 2,-0.4 -0.987 8.1-154.5-123.3 118.7 19.7 4.3 19.4 40 41 A V E -bc 103 123B 0 82,-2.2 84,-2.9 -2,-0.5 2,-0.6 -0.790 7.4-163.6 -97.7 135.2 16.7 2.0 20.0 41 42 A I E -bc 104 124B 0 62,-3.5 64,-2.0 -2,-0.4 2,-0.4 -0.965 18.5-174.4-116.2 108.6 15.1 1.7 23.5 42 43 A A E +bc 105 125B 0 82,-2.6 84,-2.0 -2,-0.6 2,-0.3 -0.884 11.4 154.0-110.8 138.5 13.0 -1.4 23.5 43 44 A T E - c 0 126B 0 62,-1.7 84,-0.1 -2,-0.4 3,-0.1 -0.993 45.0-111.0-156.0 157.0 10.7 -2.6 26.3 44 45 A Y > - 0 0 0 82,-0.7 3,-1.3 -2,-0.3 5,-0.2 -0.631 69.8 -70.7 -83.3 151.8 7.6 -4.6 27.0 45 46 A P T 3 S+ 0 0 4 0, 0.0 92,-0.2 0, 0.0 -1,-0.2 -0.096 116.0 6.5 -48.1 137.2 4.8 -2.2 28.0 46 47 A K T 3 S+ 0 0 25 90,-0.1 90,-0.1 1,-0.1 91,-0.1 0.703 86.8 124.4 63.5 26.7 5.1 -0.5 31.4 47 48 A S S < S- 0 0 0 -3,-1.3 144,-0.1 79,-0.1 -1,-0.1 0.429 95.5 -78.2 -92.8 0.3 8.6 -1.9 32.1 48 49 A G S >> S+ 0 0 14 -4,-0.1 4,-1.9 3,-0.1 3,-0.6 0.635 75.7 151.7 111.9 21.2 10.1 1.6 32.7 49 50 A T H 3> S+ 0 0 9 1,-0.2 4,-2.2 -5,-0.2 5,-0.2 0.884 74.5 51.3 -47.4 -48.4 10.5 2.9 29.2 50 51 A T H 3> S+ 0 0 9 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.849 107.2 54.7 -63.1 -35.3 10.2 6.5 30.3 51 52 A W H <> S+ 0 0 37 -3,-0.6 4,-1.8 2,-0.2 -2,-0.2 0.979 113.3 37.6 -64.3 -59.1 12.8 6.1 33.0 52 53 A V H X S+ 0 0 0 -4,-1.9 4,-2.9 1,-0.2 5,-0.2 0.859 112.5 60.8 -65.0 -31.2 15.6 4.8 30.8 53 54 A S H X S+ 0 0 3 -4,-2.2 4,-2.4 -5,-0.3 -1,-0.2 0.922 107.0 44.5 -60.0 -45.0 14.6 7.1 28.0 54 55 A E H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.866 112.3 52.4 -68.7 -35.8 15.2 10.2 30.1 55 56 A I H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.948 112.1 45.9 -62.9 -48.3 18.5 8.8 31.4 56 57 A V H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.908 110.7 53.0 -61.6 -41.4 19.6 8.2 27.9 57 58 A Y H X S+ 0 0 31 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.911 108.7 50.0 -61.5 -41.9 18.5 11.7 26.8 58 59 A M H <>S+ 0 0 0 -4,-2.3 5,-3.4 1,-0.2 6,-0.4 0.900 108.1 53.0 -63.0 -41.3 20.5 13.3 29.6 59 60 A I H ><5S+ 0 0 3 -4,-2.2 3,-1.0 1,-0.2 -1,-0.2 0.895 109.6 49.4 -61.9 -37.7 23.6 11.3 28.6 60 61 A Y H 3<5S+ 0 0 46 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.844 112.5 47.1 -68.7 -34.2 23.1 12.7 25.0 61 62 A K T ><5S- 0 0 68 -4,-1.8 3,-1.0 -5,-0.2 -1,-0.2 0.221 114.9-112.7 -93.2 15.4 22.8 16.2 26.3 62 63 A E T < 5S- 0 0 68 -3,-1.0 -3,-0.2 1,-0.2 3,-0.1 0.813 75.8 -56.8 57.7 30.2 25.8 16.0 28.6 63 64 A G T 3 - 0 0 60 -3,-1.0 4,-1.0 -6,-0.4 3,-0.7 -0.713 23.0-170.3 -87.1 95.1 21.8 19.6 30.4 65 66 A V T 34 S+ 0 0 38 -2,-1.2 3,-0.4 1,-0.2 4,-0.4 0.822 83.7 58.6 -53.3 -36.2 18.4 19.5 32.1 66 67 A E T >> S+ 0 0 138 1,-0.2 3,-1.3 2,-0.2 4,-0.6 0.897 103.3 50.9 -63.1 -41.5 17.2 22.5 30.2 67 68 A K T <4 S+ 0 0 90 -3,-0.7 -1,-0.2 1,-0.3 -2,-0.2 0.714 105.2 58.9 -69.0 -19.5 17.9 20.8 26.8 68 69 A C T 3< S+ 0 0 0 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.548 106.0 48.1 -85.6 -8.0 15.8 17.9 28.1 69 70 A K T <4 S+ 0 0 84 -3,-1.3 -2,-0.2 -4,-0.4 -1,-0.2 0.464 74.2 104.9-108.2 -6.4 12.8 20.1 28.6 70 71 A E S < S- 0 0 148 -4,-0.6 2,-0.3 -3,-0.2 -1,-0.1 0.726 100.9 -6.5 -48.0 -22.0 12.8 21.9 25.2 71 72 A D S S- 0 0 74 -3,-0.2 -1,-0.1 -4,-0.1 5,-0.1 -0.967 94.3 -71.5-165.5 164.8 9.9 19.6 24.4 72 73 A V >> - 0 0 20 -2,-0.3 4,-2.2 1,-0.1 3,-2.1 -0.273 47.0-112.3 -64.1 150.8 7.9 16.7 25.9 73 74 A I H 3> S+ 0 0 4 162,-3.4 4,-2.4 1,-0.3 163,-0.1 0.813 115.0 59.2 -56.7 -34.0 9.5 13.3 26.0 74 75 A F H 34 S+ 0 0 31 161,-0.3 5,-0.4 1,-0.2 -1,-0.3 0.586 112.5 40.9 -75.1 -4.7 7.2 11.7 23.5 75 76 A N H <4 S+ 0 0 59 -3,-2.1 -2,-0.2 3,-0.1 -1,-0.2 0.706 115.0 49.8-104.4 -34.8 8.4 14.4 21.0 76 77 A R H < S+ 0 0 10 -4,-2.2 26,-0.4 1,-0.3 -2,-0.2 0.825 124.2 31.3 -71.0 -31.4 12.0 14.2 22.0 77 78 A I S < S- 0 0 3 -4,-2.4 -1,-0.3 -5,-0.2 26,-0.1 -0.793 91.7-141.5-131.3 86.7 12.0 10.5 21.7 78 79 A P - 0 0 1 0, 0.0 26,-2.7 0, 0.0 2,-1.1 -0.150 13.0-125.8 -52.5 138.6 9.5 9.3 19.0 79 80 A F B > -d 104 0B 34 -5,-0.4 3,-1.7 24,-0.2 11,-0.3 -0.781 25.7-147.1 -89.0 97.2 7.5 6.2 19.6 80 81 A L T 3 S+ 0 0 1 24,-2.2 11,-0.4 -2,-1.1 -1,-0.2 0.788 87.3 30.1 -32.0 -67.4 8.4 4.1 16.5 81 82 A E T 3 S+ 0 0 1 23,-0.3 -1,-0.3 9,-0.2 2,-0.2 0.461 87.5 123.7 -82.7 -0.8 5.2 2.2 15.8 82 83 A C < + 0 0 23 -3,-1.7 8,-3.1 7,-0.1 9,-0.4 -0.430 33.4 154.3 -65.6 125.6 2.8 4.7 17.3 83 84 A R E +F 89 0C 29 -2,-0.2 6,-0.2 6,-0.2 2,-0.1 -0.984 25.3 167.6-155.9 140.8 0.2 5.7 14.7 84 85 A K E >> -F 88 0C 99 4,-2.2 3,-2.5 1,-0.4 4,-1.0 -0.609 66.4 -82.5-153.6 83.2 -3.3 7.1 14.6 85 86 A E T 34 S- 0 0 65 -64,-0.3 -1,-0.4 1,-0.3 -60,-0.0 -0.306 99.8 -31.2 52.5-115.3 -4.2 8.3 11.1 86 87 A N T 34 S+ 0 0 142 -2,-0.1 -1,-0.3 -3,-0.1 3,-0.1 0.310 127.9 80.6-115.0 7.5 -2.7 11.8 10.9 87 88 A L T <4 S+ 0 0 122 -3,-2.5 2,-0.3 1,-0.3 -2,-0.2 0.829 107.7 12.8 -80.5 -35.0 -3.1 12.7 14.6 88 89 A M E < +F 84 0C 64 -4,-1.0 -4,-2.2 4,-0.0 -1,-0.3 -0.996 64.0 167.9-143.4 139.3 0.0 10.8 15.7 89 90 A N E > -F 83 0C 26 -2,-0.3 4,-2.0 -6,-0.2 -6,-0.2 -0.679 12.3-176.4-158.0 96.5 2.8 9.3 13.6 90 91 A G H > S+ 0 0 0 -8,-3.1 4,-2.2 -11,-0.3 5,-0.2 0.879 88.3 53.0 -61.7 -41.6 6.1 8.0 15.1 91 92 A V H > S+ 0 0 4 -11,-0.4 4,-3.0 -9,-0.4 -1,-0.2 0.939 109.6 49.5 -60.2 -46.2 7.7 7.2 11.8 92 93 A K H > S+ 0 0 138 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.897 109.5 52.0 -59.2 -42.2 7.0 10.7 10.5 93 94 A Q H < S+ 0 0 48 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.892 113.2 44.9 -60.9 -40.5 8.5 12.2 13.7 94 95 A L H >< S+ 0 0 0 -4,-2.2 3,-1.0 2,-0.2 -2,-0.2 0.908 108.7 55.2 -72.0 -43.0 11.6 10.1 13.2 95 96 A D H 3< S+ 0 0 80 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.901 110.3 46.1 -57.2 -42.3 12.0 10.8 9.5 96 97 A E T 3< S+ 0 0 85 -4,-2.0 -1,-0.3 -5,-0.2 2,-0.2 0.569 90.1 110.3 -78.0 -10.4 12.0 14.6 10.1 97 98 A M < - 0 0 45 -3,-1.0 2,-1.3 -4,-0.4 4,-0.1 -0.472 65.1-143.0 -70.0 132.1 14.4 14.3 12.9 98 99 A N - 0 0 149 -2,-0.2 -1,-0.1 2,-0.1 -2,-0.1 -0.720 56.3 -90.9 -97.8 83.3 17.9 15.7 12.3 99 100 A S S S+ 0 0 40 -2,-1.3 -1,-0.1 -5,-0.2 -61,-0.1 0.596 96.2 93.9 -15.2 169.8 19.8 13.0 14.3 100 101 A P S S- 0 0 67 0, 0.0 2,-0.3 0, 0.0 -62,-0.1 0.279 70.8-160.6 -71.7 127.0 21.2 11.5 16.5 101 102 A R - 0 0 0 -4,-0.1 -62,-2.4 -2,-0.0 2,-0.5 -0.605 18.4-158.3 -88.7 137.1 17.8 9.8 17.0 102 103 A I E -b 39 0B 3 -26,-0.4 2,-0.5 -2,-0.3 -62,-0.2 -0.965 20.2-157.3-110.4 122.4 16.6 7.9 20.1 103 104 A V E -b 40 0B 0 -64,-3.3 -62,-3.5 -2,-0.5 2,-0.4 -0.893 7.0-155.0-110.3 127.0 13.8 5.5 19.2 104 105 A K E +bd 41 79B 23 -26,-2.7 -24,-2.2 -2,-0.5 2,-0.3 -0.799 26.0 154.3 -98.8 138.3 11.2 4.1 21.6 105 106 A T E -b 42 0B 0 -64,-2.0 -62,-1.7 -2,-0.4 7,-0.0 -0.988 39.4-158.8-156.5 156.1 9.5 0.8 20.8 106 107 A H + 0 0 16 -2,-0.3 -64,-0.1 -64,-0.2 -1,-0.0 0.157 54.4 132.9-118.6 12.9 7.7 -2.1 22.5 107 108 A L - 0 0 0 -63,-0.1 -2,-0.1 1,-0.1 5,-0.1 -0.315 59.8-120.0 -70.5 144.0 8.3 -4.5 19.6 108 109 A P >> - 0 0 6 0, 0.0 3,-1.8 0, 0.0 4,-0.9 -0.458 39.8-100.1 -74.0 159.0 9.6 -8.0 20.1 109 110 A P G >4 S+ 0 0 4 0, 0.0 3,-0.8 0, 0.0 -2,-0.1 0.845 121.1 61.2 -47.1 -40.5 12.9 -8.5 18.2 110 111 A E G 34 S+ 0 0 126 1,-0.2 4,-0.1 -96,-0.0 -3,-0.0 0.751 108.3 41.6 -61.7 -27.5 11.1 -10.3 15.4 111 112 A L G <4 S+ 0 0 13 -3,-1.8 -1,-0.2 2,-0.1 3,-0.1 0.511 81.9 116.7 -99.9 -6.7 9.1 -7.2 14.5 112 113 A L S << S- 0 0 7 -4,-0.9 5,-0.1 -3,-0.8 -82,-0.0 -0.414 85.3 -90.0 -62.2 133.4 11.7 -4.6 14.9 113 114 A P >> - 0 0 3 0, 0.0 3,-1.9 0, 0.0 4,-0.7 -0.210 31.8-126.1 -49.2 128.3 12.2 -3.0 11.4 114 115 A A H >> S+ 0 0 65 -84,-0.4 4,-2.9 1,-0.3 3,-0.5 0.781 104.1 70.8 -45.5 -36.1 14.9 -4.9 9.5 115 116 A S H 3> S+ 0 0 14 -83,-0.4 4,-2.3 -85,-0.3 -1,-0.3 0.845 92.2 56.0 -54.4 -37.7 16.8 -1.6 8.9 116 117 A F H <4>S+ 0 0 1 -3,-1.9 5,-2.3 2,-0.2 -1,-0.2 0.887 112.5 41.8 -63.7 -38.7 17.9 -1.4 12.5 117 118 A W H X<5S+ 0 0 73 -4,-0.7 3,-1.2 -3,-0.5 -2,-0.2 0.926 113.2 53.2 -73.0 -46.0 19.5 -4.8 12.4 118 119 A E H 3<5S+ 0 0 162 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.863 113.7 42.0 -57.9 -38.4 21.0 -4.2 9.0 119 120 A K T 3<5S- 0 0 90 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.464 108.5-128.7 -89.3 0.6 22.7 -1.0 10.2 120 121 A D T < 5 - 0 0 87 -3,-1.2 -3,-0.2 -4,-0.2 -4,-0.1 0.853 36.6-171.0 56.0 42.5 23.6 -2.7 13.4 121 122 A C < - 0 0 5 -5,-2.3 -1,-0.2 -6,-0.2 -82,-0.1 -0.299 27.9-104.7 -64.2 144.8 22.1 0.1 15.6 122 123 A K E -c 39 0B 27 -84,-0.7 -82,-2.2 -86,-0.3 2,-0.4 -0.458 40.5-163.3 -68.1 142.8 22.8 -0.0 19.3 123 124 A I E -ce 40 186B 0 62,-2.7 64,-2.8 -84,-0.2 2,-0.5 -0.989 14.2-159.4-133.7 138.6 19.8 -1.2 21.3 124 125 A I E -ce 41 187B 0 -84,-2.9 -82,-2.6 -2,-0.4 2,-0.5 -0.985 12.9-164.6-116.7 123.5 19.0 -0.9 25.0 125 126 A Y E -ce 42 188B 0 62,-3.2 64,-3.5 -2,-0.5 2,-0.5 -0.941 1.9-159.3-112.3 130.5 16.4 -3.3 26.3 126 127 A L E -ce 43 189B 0 -84,-2.0 -82,-0.7 -2,-0.5 2,-0.3 -0.955 9.1-171.0-114.0 127.6 14.7 -2.8 29.6 127 128 A C E - e 0 190B 0 62,-2.6 64,-3.8 -2,-0.5 2,-0.3 -0.811 4.8-174.8-114.8 151.3 13.1 -5.7 31.5 128 129 A R - 0 0 13 -2,-0.3 5,-0.1 62,-0.2 -80,-0.1 -0.979 41.7 -83.0-143.2 151.8 10.8 -5.7 34.6 129 130 A N > - 0 0 22 -2,-0.3 4,-2.0 1,-0.1 3,-0.4 -0.297 41.3-122.6 -61.6 138.1 9.4 -8.6 36.6 130 131 A A H > S+ 0 0 3 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.799 104.8 54.5 -49.3 -42.8 6.1 -9.9 35.1 131 132 A K H > S+ 0 0 25 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.924 110.9 44.0 -64.6 -43.5 3.9 -9.4 38.1 132 133 A D H > S+ 0 0 1 -3,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.863 113.1 53.5 -67.7 -35.0 4.7 -5.7 38.5 133 134 A V H X S+ 0 0 0 -4,-2.0 4,-3.1 1,-0.2 5,-0.2 0.930 106.3 52.4 -63.7 -45.1 4.4 -5.3 34.7 134 135 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.904 109.8 48.9 -57.9 -42.5 0.9 -6.9 34.8 135 136 A V H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.965 115.4 42.7 -62.1 -52.3 -0.2 -4.5 37.5 136 137 A S H X S+ 0 0 8 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.855 113.5 52.4 -63.1 -35.6 1.1 -1.4 35.7 137 138 A F H X S+ 0 0 0 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.889 104.6 57.1 -68.8 -37.1 -0.3 -2.7 32.3 138 139 A Y H X S+ 0 0 36 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.934 108.5 45.8 -58.3 -47.0 -3.7 -3.2 33.9 139 140 A Y H X S+ 0 0 85 -4,-1.8 4,-2.1 1,-0.2 5,-0.2 0.885 108.2 56.9 -64.2 -38.0 -3.8 0.5 34.9 140 141 A F H X S+ 0 0 39 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.927 104.1 53.8 -57.7 -45.7 -2.6 1.5 31.4 141 142 A F H < S+ 0 0 6 -4,-2.4 6,-0.2 1,-0.2 -1,-0.2 0.901 111.5 45.4 -55.2 -43.3 -5.6 -0.3 30.0 142 143 A L H < S+ 0 0 95 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.822 119.2 38.0 -73.1 -32.3 -8.0 1.7 32.2 143 144 A M H < S+ 0 0 26 -4,-2.1 104,-2.9 -3,-0.1 2,-0.5 0.694 104.0 71.6 -94.8 -20.5 -6.4 5.1 31.6 144 145 A V B >< S-G 246 0D 23 -4,-2.4 3,-0.7 -5,-0.2 102,-0.2 -0.850 78.8-122.1-106.2 131.9 -5.5 5.1 27.9 145 146 A A T 3 S+ 0 0 63 100,-1.9 -2,-0.1 -2,-0.5 100,-0.0 -0.225 90.6 52.8 -62.4 153.4 -8.0 5.2 25.0 146 147 A G T 3 S+ 0 0 31 1,-0.4 -1,-0.2 -126,-0.0 -126,-0.2 0.454 84.8 107.6 98.8 1.6 -7.9 2.3 22.6 147 148 A H < - 0 0 18 -3,-0.7 -1,-0.4 -6,-0.2 2,-0.1 -0.802 66.2-123.5-112.0 155.4 -8.2 -0.5 25.1 148 149 A P - 0 0 2 0, 0.0 -146,-0.1 0, 0.0 -145,-0.0 -0.421 51.5 -77.9 -85.4 169.2 -11.1 -2.8 25.9 149 150 A N - 0 0 102 1,-0.2 3,-0.1 -2,-0.1 -143,-0.1 -0.589 41.8-151.2 -68.5 120.7 -12.5 -2.9 29.5 150 151 A P - 0 0 5 0, 0.0 6,-0.2 0, 0.0 -1,-0.2 0.547 24.4-152.6 -73.0 -5.2 -9.9 -5.1 31.2 151 152 A G - 0 0 25 4,-0.1 2,-0.0 5,-0.1 0, 0.0 -0.370 51.9 -8.5 67.4-148.9 -12.5 -6.4 33.6 152 153 A S S > S- 0 0 47 -3,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.297 73.8-109.1 -75.7 165.6 -11.2 -7.5 37.0 153 154 A F H > S+ 0 0 18 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.924 119.8 52.3 -62.9 -43.3 -7.5 -7.8 37.8 154 155 A P H > S+ 0 0 61 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.903 110.8 48.1 -60.5 -38.0 -7.7 -11.6 37.9 155 156 A E H > S+ 0 0 118 2,-0.2 4,-1.7 1,-0.2 3,-0.4 0.947 112.6 48.0 -65.5 -47.7 -9.4 -11.6 34.5 156 157 A F H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.914 108.2 55.4 -59.0 -43.2 -6.8 -9.3 33.0 157 158 A V H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.820 103.2 55.3 -62.5 -30.3 -4.0 -11.4 34.4 158 159 A E H X S+ 0 0 70 -4,-1.4 4,-1.5 -3,-0.4 -1,-0.2 0.935 108.9 47.0 -67.1 -43.0 -5.4 -14.5 32.7 159 160 A K H <>S+ 0 0 20 -4,-1.7 5,-2.9 1,-0.2 -2,-0.2 0.865 111.7 53.0 -64.2 -35.4 -5.2 -12.6 29.3 160 161 A F H ><5S+ 0 0 0 -4,-2.2 3,-1.8 1,-0.2 10,-0.4 0.932 105.8 51.4 -64.8 -47.3 -1.7 -11.5 30.3 161 162 A M H 3<5S+ 0 0 7 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.818 111.8 48.9 -60.7 -30.0 -0.5 -15.1 31.0 162 163 A Q T 3<5S- 0 0 92 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.383 113.5-118.5 -90.4 3.6 -1.9 -16.1 27.6 163 164 A G T < 5 + 0 0 11 -3,-1.8 2,-1.1 5,-0.2 -146,-0.3 0.727 67.8 142.9 67.0 21.2 -0.2 -13.2 25.8 164 165 A Q < + 0 0 75 -5,-2.9 -1,-0.2 -6,-0.2 -4,-0.1 -0.374 43.7 83.8 -93.2 57.2 -3.5 -11.8 24.8 165 166 A V S > S- 0 0 0 -2,-1.1 3,-2.2 -5,-0.1 -148,-0.2 -0.923 96.0 -59.0-146.5 164.4 -2.7 -8.2 25.2 166 167 A P T 3 S+ 0 0 0 0, 0.0 -148,-0.2 0, 0.0 -149,-0.1 -0.249 125.2 18.5 -54.4 134.5 -0.9 -5.6 23.0 167 168 A Y T 3 S- 0 0 3 -150,-2.9 -149,-0.1 -123,-0.1 -3,-0.1 0.409 110.6-122.9 80.6 4.7 2.6 -6.7 22.0 168 169 A G < + 0 0 4 -3,-2.2 -5,-0.2 -151,-0.3 2,-0.2 -0.160 67.4 17.9 69.9-156.0 1.8 -10.2 22.9 169 170 A S > - 0 0 23 -6,-0.2 4,-2.1 -7,-0.2 5,-0.1 -0.335 49.4-159.1 -58.8 120.7 3.4 -12.6 25.4 170 171 A W H > S+ 0 0 0 -10,-0.4 4,-2.7 2,-0.2 5,-0.3 0.897 95.3 58.0 -65.0 -38.7 5.6 -10.9 27.9 171 172 A Y H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.936 110.6 39.2 -57.7 -49.6 7.3 -14.3 28.4 172 173 A K H > S+ 0 0 137 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.867 113.5 58.2 -69.7 -34.7 8.4 -14.6 24.7 173 174 A H H X S+ 0 0 2 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.960 111.6 37.6 -59.8 -56.0 9.2 -10.9 24.6 174 175 A V H X S+ 0 0 1 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.850 117.1 52.3 -68.8 -32.4 11.8 -10.9 27.4 175 176 A K H X S+ 0 0 57 -4,-1.8 4,-1.6 -5,-0.3 -2,-0.2 0.918 111.3 45.8 -69.7 -41.9 13.2 -14.3 26.3 176 177 A S H X S+ 0 0 30 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.911 115.1 46.4 -67.0 -43.4 13.7 -13.3 22.7 177 178 A W H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.801 105.8 61.9 -68.8 -26.9 15.3 -10.0 23.7 178 179 A W H < S+ 0 0 57 -4,-1.5 4,-0.2 2,-0.2 -1,-0.2 0.922 104.5 47.2 -63.7 -42.9 17.5 -11.9 26.2 179 180 A E H >< S+ 0 0 99 -4,-1.6 3,-1.8 1,-0.2 4,-0.2 0.931 112.2 49.4 -63.1 -44.9 19.0 -13.9 23.4 180 181 A K H >< S+ 0 0 90 -4,-1.8 3,-2.2 1,-0.3 -1,-0.2 0.850 99.5 69.1 -61.7 -32.7 19.6 -10.7 21.4 181 182 A G T 3< S+ 0 0 20 -4,-2.1 7,-0.3 1,-0.3 -1,-0.3 0.575 80.8 74.6 -63.6 -9.6 21.1 -9.2 24.6 182 183 A K T < S+ 0 0 137 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.677 79.1 92.1 -76.8 -15.7 24.1 -11.6 24.2 183 184 A S S X S- 0 0 49 -3,-2.2 3,-1.4 -4,-0.2 -3,-0.0 -0.502 85.8-125.7 -76.2 146.8 25.3 -9.3 21.4 184 185 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.734 108.0 55.9 -66.1 -19.8 27.7 -6.6 22.3 185 186 A R T 3 S+ 0 0 77 -5,-0.1 -62,-2.7 1,-0.1 2,-0.5 0.397 95.2 71.7 -94.5 4.2 25.4 -3.9 20.7 186 187 A V E < -e 123 0B 9 -3,-1.4 2,-0.6 -6,-0.2 -62,-0.2 -0.946 69.2-157.3-122.0 108.7 22.3 -4.8 22.7 187 188 A L E -e 124 0B 29 -64,-2.8 -62,-3.2 -2,-0.5 2,-0.7 -0.770 6.9-154.2 -90.1 118.7 22.4 -3.8 26.4 188 189 A F E +e 125 0B 25 -2,-0.6 2,-0.3 -7,-0.3 -62,-0.2 -0.828 19.9 177.9 -98.0 114.4 20.0 -5.8 28.5 189 190 A L E -e 126 0B 0 -64,-3.5 -62,-2.6 -2,-0.7 2,-0.4 -0.763 21.4-139.0-116.0 160.9 18.8 -4.0 31.7 190 191 A F E >> -e 127 0B 26 -2,-0.3 4,-1.7 -64,-0.2 3,-0.9 -0.971 12.1-142.5-121.8 132.3 16.5 -4.7 34.6 191 192 A Y H 3> S+ 0 0 11 -64,-3.8 4,-1.8 -2,-0.4 -63,-0.2 0.894 106.2 57.5 -55.6 -42.0 14.1 -2.2 36.1 192 193 A E H 3> S+ 0 0 29 -65,-0.3 4,-2.6 1,-0.2 -1,-0.3 0.804 103.2 53.2 -61.2 -30.8 14.9 -3.8 39.5 193 194 A D H <> S+ 0 0 52 -3,-0.9 4,-2.7 2,-0.2 8,-0.3 0.883 106.2 52.1 -72.2 -38.0 18.6 -3.0 39.0 194 195 A L H < S+ 0 0 1 -4,-1.7 4,-0.3 1,-0.2 -2,-0.2 0.854 113.9 45.2 -65.1 -32.6 17.8 0.6 38.3 195 196 A K H < S+ 0 0 90 -4,-1.8 3,-0.4 -5,-0.2 -2,-0.2 0.920 115.6 45.8 -74.7 -44.7 15.8 0.6 41.6 196 197 A E H < S+ 0 0 167 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.891 136.4 0.8 -66.8 -43.8 18.5 -1.2 43.6 197 198 A D X + 0 0 72 -4,-2.7 4,-1.7 -5,-0.1 -1,-0.2 -0.565 62.7 172.9-151.4 79.5 21.6 0.7 42.4 198 199 A I H > S+ 0 0 36 -3,-0.4 4,-2.8 -4,-0.3 5,-0.3 0.879 80.9 58.5 -57.3 -40.4 20.8 3.5 40.0 199 200 A R H > S+ 0 0 110 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.943 105.2 50.4 -57.0 -47.2 24.4 4.9 40.0 200 201 A K H > S+ 0 0 124 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.911 113.9 43.8 -56.8 -45.8 25.7 1.5 38.8 201 202 A E H X S+ 0 0 4 -4,-1.7 4,-2.4 -8,-0.3 -1,-0.2 0.889 112.0 52.3 -70.2 -37.8 23.2 1.3 35.9 202 203 A V H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.938 110.8 47.6 -63.1 -44.5 23.7 5.0 34.9 203 204 A I H X S+ 0 0 61 -4,-2.6 4,-2.0 -5,-0.3 -1,-0.2 0.896 111.1 52.2 -62.0 -39.5 27.5 4.5 34.8 204 205 A K H X S+ 0 0 72 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.902 110.2 48.4 -62.6 -42.1 26.9 1.3 32.7 205 206 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.878 107.5 55.1 -66.7 -39.2 24.7 3.3 30.3 206 207 A I H <>S+ 0 0 0 -4,-2.4 5,-2.5 1,-0.2 -1,-0.2 0.922 111.3 44.1 -60.7 -44.1 27.3 6.0 30.0 207 208 A H H ><5S+ 0 0 110 -4,-2.0 3,-1.3 1,-0.2 -1,-0.2 0.856 110.3 55.0 -69.7 -35.2 30.0 3.6 28.9 208 209 A F H 3<5S+ 0 0 31 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.873 109.8 47.6 -64.2 -35.8 27.6 1.7 26.6 209 210 A L T 3<5S- 0 0 3 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.259 115.5-119.4 -88.9 11.0 26.9 5.0 24.9 210 211 A E T < 5 + 0 0 156 -3,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.852 66.6 135.8 53.1 43.7 30.7 5.8 24.7 211 212 A R < - 0 0 98 -5,-2.5 -1,-0.2 -6,-0.1 -2,-0.1 -0.730 60.9-100.8-112.7 165.2 30.5 9.0 26.8 212 213 A K - 0 0 81 -2,-0.3 2,-0.2 -5,-0.0 -5,-0.0 -0.766 33.6-137.6 -91.5 122.9 32.8 10.1 29.6 213 214 A P + 0 0 58 0, 0.0 2,-0.3 0, 0.0 3,-0.1 -0.571 26.6 173.5 -80.4 141.4 31.5 9.5 33.1 214 215 A S > - 0 0 58 -2,-0.2 4,-2.8 1,-0.1 5,-0.3 -0.983 41.7-118.7-142.9 149.4 32.0 12.2 35.7 215 216 A E H > S+ 0 0 71 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.888 115.1 50.5 -56.0 -42.1 30.7 12.5 39.2 216 217 A E H > S+ 0 0 144 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.879 112.0 46.0 -65.8 -39.6 28.8 15.7 38.3 217 218 A L H > S+ 0 0 12 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.946 114.9 46.7 -68.1 -48.7 27.1 14.2 35.3 218 219 A V H X S+ 0 0 5 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.926 112.2 51.4 -58.1 -46.0 26.2 11.0 37.1 219 220 A D H X S+ 0 0 78 -4,-2.7 4,-1.8 -5,-0.3 5,-0.3 0.887 109.8 49.1 -59.3 -42.4 24.8 13.1 40.0 220 221 A R H X S+ 0 0 81 -4,-1.9 4,-2.1 1,-0.2 5,-0.2 0.925 111.6 48.8 -64.8 -44.2 22.7 15.2 37.8 221 222 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.933 108.1 56.4 -60.9 -45.0 21.2 12.2 36.0 222 223 A I H < S+ 0 0 38 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.916 114.8 33.0 -56.6 -51.0 20.4 10.5 39.3 223 224 A 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S+ 0 0 63 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.914 111.1 50.4 -58.6 -40.9 -8.7 -4.2 53.2 443 156 B E H > S+ 0 0 119 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.908 111.4 47.7 -62.3 -43.1 -10.6 -1.6 55.2 444 157 B F H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.908 107.7 54.9 -65.7 -41.7 -12.9 -4.1 56.6 445 158 B V H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.842 105.2 54.7 -60.5 -33.1 -10.1 -6.5 57.5 446 159 B E H X S+ 0 0 67 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.946 108.3 47.8 -64.7 -46.9 -8.6 -3.6 59.4 447 160 B K H <>S+ 0 0 23 -4,-1.8 5,-2.6 1,-0.2 4,-0.4 0.914 112.4 51.5 -57.3 -42.4 -11.8 -3.3 61.4 448 161 B F H ><5S+ 0 0 0 -4,-2.7 3,-1.4 1,-0.2 10,-0.4 0.923 107.0 50.5 -62.7 -46.9 -11.7 -7.0 61.9 449 162 B M H 3<5S+ 0 0 6 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.849 113.4 47.2 -62.2 -31.0 -8.2 -7.1 63.2 450 163 B Q T 3<5S- 0 0 103 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.442 112.4-118.5 -89.7 -0.2 -9.1 -4.3 65.7 451 164 B G T < 5 + 0 0 9 -3,-1.4 2,-1.1 -4,-0.4 -146,-0.4 0.708 67.5 142.3 71.1 19.8 -12.3 -6.0 66.8 452 165 B Q < + 0 0 57 -5,-2.6 -1,-0.1 -6,-0.2 -4,-0.1 -0.376 44.3 85.1 -92.0 57.4 -14.3 -3.1 65.6 453 166 B V S > S- 0 0 0 -2,-1.1 3,-2.3 -5,-0.1 -148,-0.3 -0.930 95.6 -58.8-145.8 163.8 -17.2 -5.2 64.3 454 167 B P T 3 S+ 0 0 0 0, 0.0 -148,-0.2 0, 0.0 -149,-0.1 -0.227 125.1 17.2 -51.7 133.7 -20.4 -6.6 65.9 455 168 B Y T 3 S- 0 0 3 -150,-2.6 -149,-0.1 -123,-0.1 -3,-0.1 0.434 109.7-120.5 80.6 4.9 -19.5 -9.0 68.7 456 169 B G < + 0 0 3 -3,-2.3 2,-0.3 -151,-0.4 -5,-0.2 -0.197 68.6 16.4 71.3-155.1 -16.0 -7.6 69.0 457 170 B S > - 0 0 22 -7,-0.2 4,-2.4 1,-0.2 5,-0.1 -0.401 49.2-158.3 -63.9 118.5 -12.6 -9.3 68.7 458 171 B W H > S+ 0 0 0 -10,-0.4 4,-3.0 -2,-0.3 5,-0.3 0.887 96.4 56.8 -59.7 -39.0 -12.7 -12.7 67.0 459 172 B Y H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.932 109.6 40.7 -60.8 -50.2 -9.4 -13.3 68.8 460 173 B K H > S+ 0 0 138 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.877 114.7 56.2 -66.0 -36.1 -10.7 -12.7 72.3 461 174 B H H X S+ 0 0 2 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.963 112.9 36.9 -60.7 -55.7 -13.9 -14.6 71.4 462 175 B V H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.851 116.3 53.6 -70.2 -32.7 -12.2 -17.8 70.3 463 176 B K H X S+ 0 0 62 -4,-2.1 4,-1.6 -5,-0.3 -1,-0.2 0.908 111.1 45.8 -68.2 -39.7 -9.5 -17.7 73.0 464 177 B S H X S+ 0 0 27 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.928 115.0 45.9 -69.1 -44.6 -12.1 -17.3 75.8 465 178 B W H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.805 106.0 61.5 -67.6 -27.0 -14.3 -20.0 74.5 466 179 B W H < S+ 0 0 55 -4,-1.7 4,-0.3 2,-0.2 -1,-0.2 0.928 105.3 47.3 -63.6 -43.2 -11.2 -22.2 74.0 467 180 B E H >< S+ 0 0 94 -4,-1.6 3,-1.5 1,-0.2 4,-0.3 0.928 112.3 48.8 -63.2 -44.3 -10.6 -22.0 77.7 468 181 B K H >< S+ 0 0 90 -4,-1.9 3,-1.8 1,-0.3 6,-0.3 0.871 103.1 65.1 -61.6 -35.7 -14.3 -22.8 78.4 469 182 B G T 3< S+ 0 0 18 -4,-2.4 7,-0.4 1,-0.3 -1,-0.3 0.546 79.4 78.3 -65.6 -9.7 -13.9 -25.7 76.0 470 183 B K T < S+ 0 0 135 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.764 80.7 85.9 -70.7 -21.1 -11.4 -27.5 78.3 471 184 B S S X S- 0 0 49 -3,-1.8 3,-1.5 -4,-0.3 -3,-0.0 -0.545 85.5-132.5 -77.7 141.9 -14.5 -28.5 80.3 472 185 B P T 3 S+ 0 0 122 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.678 104.9 67.3 -68.2 -12.2 -16.3 -31.7 79.0 473 186 B R T 3 S+ 0 0 81 1,-0.2 -62,-2.0 -5,-0.2 2,-0.5 0.608 95.7 57.0 -81.6 -15.0 -19.5 -29.7 79.3 474 187 B V E < S-m 411 0G 8 -3,-1.5 2,-0.7 -6,-0.3 -62,-0.2 -0.945 77.8-151.0-122.5 106.7 -18.5 -27.3 76.5 475 188 B L E -m 412 0G 29 -64,-2.3 -62,-3.0 -2,-0.5 2,-0.7 -0.704 8.5-153.9 -82.9 115.8 -17.8 -29.1 73.2 476 189 B F E +m 413 0G 27 -2,-0.7 2,-0.3 -7,-0.4 -62,-0.2 -0.810 20.6 179.1 -94.2 112.4 -15.3 -27.1 71.1 477 190 B L E -m 414 0G 0 -64,-3.4 -62,-2.8 -2,-0.7 2,-0.4 -0.753 21.1-138.6-114.4 159.4 -15.6 -27.7 67.4 478 191 B F E >> -m 415 0G 24 -2,-0.3 4,-1.7 -64,-0.2 3,-0.9 -0.960 11.8-143.5-118.8 133.8 -13.9 -26.5 64.2 479 192 B Y H 3> S+ 0 0 11 -64,-3.3 4,-2.1 -2,-0.4 -63,-0.2 0.893 106.3 58.0 -55.6 -42.8 -15.7 -25.7 60.9 480 193 B E H 3> S+ 0 0 34 -65,-0.3 4,-2.3 1,-0.2 -1,-0.3 0.762 103.2 52.1 -60.4 -28.5 -12.6 -27.1 59.2 481 194 B D H <> S+ 0 0 54 -3,-0.9 4,-2.5 2,-0.2 8,-0.2 0.880 107.4 51.1 -76.5 -39.6 -13.2 -30.5 60.9 482 195 B L H < S+ 0 0 2 -4,-1.7 4,-0.2 1,-0.2 -2,-0.2 0.876 114.2 46.6 -62.3 -37.4 -16.8 -30.6 59.8 483 196 B K H < S+ 0 0 87 -4,-2.1 3,-0.4 -5,-0.2 -2,-0.2 0.924 114.0 46.1 -69.7 -46.3 -15.5 -29.9 56.3 484 197 B E H < S- 0 0 168 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.875 137.0 -1.1 -66.7 -42.2 -12.7 -32.5 56.4 485 198 B D X + 0 0 73 -4,-2.5 4,-1.4 -5,-0.1 3,-0.5 -0.595 62.5 176.9-153.3 82.7 -14.7 -35.4 57.9 486 199 B I H > S+ 0 0 35 -3,-0.4 4,-2.8 -4,-0.2 5,-0.2 0.884 81.1 60.1 -57.4 -39.8 -18.3 -34.6 58.6 487 200 B R H > S+ 0 0 90 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.892 103.1 51.1 -56.7 -42.6 -19.1 -38.2 59.8 488 201 B K H > S+ 0 0 126 -3,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.889 113.8 43.8 -63.6 -39.1 -16.5 -38.0 62.6 489 202 B E H X S+ 0 0 4 -4,-1.4 4,-2.4 -8,-0.2 -2,-0.2 0.875 110.9 53.8 -75.4 -36.3 -17.9 -34.8 63.9 490 203 B V H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.918 109.9 48.0 -63.3 -42.9 -21.5 -35.9 63.6 491 204 B I H X S+ 0 0 45 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.903 110.6 52.0 -64.1 -40.2 -20.7 -39.0 65.7 492 205 B K H X S+ 0 0 69 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.896 110.0 49.1 -62.3 -41.3 -18.9 -36.8 68.2 493 206 B L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.874 108.2 53.3 -67.7 -36.6 -22.0 -34.6 68.5 494 207 B I H <>S+ 0 0 0 -4,-2.2 5,-2.7 2,-0.2 -2,-0.2 0.942 112.7 44.0 -63.6 -45.9 -24.4 -37.5 68.9 495 208 B H H ><5S+ 0 0 106 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.887 111.5 53.3 -66.0 -39.2 -22.3 -38.8 71.8 496 209 B F H 3<5S+ 0 0 30 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.893 110.8 47.9 -62.9 -36.6 -21.9 -35.3 73.3 497 210 B L T 3<5S- 0 0 0 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.262 115.5-117.7 -87.6 11.8 -25.7 -35.1 73.2 498 211 B E T < 5 + 0 0 144 -3,-1.6 2,-0.2 1,-0.2 -3,-0.2 0.829 67.6 136.4 57.9 37.5 -26.1 -38.5 74.8 499 212 B R < - 0 0 91 -5,-2.7 -1,-0.2 -6,-0.1 -151,-0.1 -0.656 62.6 -94.9-109.8 169.2 -28.0 -40.0 71.8 500 213 B K - 0 0 67 -2,-0.2 2,-1.6 1,-0.1 5,-0.1 -0.745 31.3-141.2 -87.3 120.5 -27.6 -43.4 70.0 501 214 B P + 0 0 56 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.505 32.8 169.8 -81.9 73.1 -25.3 -43.2 67.0 502 215 B S > - 0 0 54 -2,-1.6 4,-2.3 1,-0.1 5,-0.2 -0.399 44.1-121.8 -80.8 161.3 -27.0 -45.4 64.4 503 216 B E H > S+ 0 0 101 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.898 113.2 56.4 -68.1 -38.9 -26.0 -45.5 60.8 504 217 B E H > S+ 0 0 116 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.899 109.7 44.9 -58.5 -43.3 -29.4 -44.4 59.7 505 218 B L H > S+ 0 0 2 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.960 114.8 47.2 -66.1 -51.8 -29.2 -41.3 61.8 506 219 B V H X S+ 0 0 1 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.918 111.3 52.6 -56.1 -45.8 -25.7 -40.5 60.7 507 220 B D H X S+ 0 0 90 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.937 111.2 45.2 -57.0 -50.9 -26.6 -41.1 57.0 508 221 B R H X S+ 0 0 84 -4,-2.1 4,-3.2 -5,-0.2 5,-0.3 0.905 113.6 49.5 -62.8 -40.6 -29.6 -38.7 57.1 509 222 B I H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.960 111.0 49.0 -63.1 -49.8 -27.7 -36.0 59.0 510 223 B I H < S+ 0 0 51 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.907 118.5 40.5 -56.5 -42.9 -24.7 -36.1 56.6 511 224 B H H >< S+ 0 0 111 -4,-2.3 3,-1.3 -5,-0.2 6,-0.3 0.961 117.1 45.8 -71.4 -52.0 -27.1 -35.9 53.6 512 225 B H H 3< S+ 0 0 10 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.809 115.1 47.5 -62.6 -32.3 -29.6 -33.4 54.9 513 226 B T T 3< S+ 0 0 1 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.295 80.7 121.3 -96.9 13.0 -26.9 -31.0 56.2 514 227 B S S <> S- 0 0 44 -3,-1.3 4,-2.6 -4,-0.2 5,-0.3 -0.360 76.0-112.2 -69.8 156.8 -24.6 -31.0 53.1 515 228 B F H > S+ 0 0 71 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.899 115.5 52.6 -56.9 -45.2 -24.1 -27.5 51.6 516 229 B Q H > S+ 0 0 58 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.925 113.3 43.2 -59.0 -47.3 -26.1 -28.3 48.5 517 230 B E H >> S+ 0 0 82 -6,-0.3 4,-0.8 1,-0.2 3,-0.7 0.961 116.8 44.6 -65.4 -51.7 -29.1 -29.5 50.4 518 231 B M H 3< S+ 0 0 4 -4,-2.6 6,-0.3 1,-0.2 3,-0.2 0.810 108.2 59.9 -63.9 -28.5 -29.1 -26.7 53.0 519 232 B K H 3< S+ 0 0 66 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.813 113.7 36.1 -68.8 -29.8 -28.5 -24.1 50.3 520 233 B N H << S+ 0 0 123 -4,-1.1 -1,-0.2 -3,-0.7 -2,-0.2 0.435 93.9 99.9-101.9 -1.9 -31.7 -25.1 48.6 521 234 B N >X - 0 0 25 -4,-0.8 4,-2.1 -3,-0.2 3,-1.9 -0.767 60.7-157.4 -87.6 107.6 -33.7 -25.8 51.8 522 235 B P T 34 S+ 0 0 72 0, 0.0 6,-0.4 0, 0.0 4,-0.2 0.686 91.5 64.1 -58.7 -16.1 -35.9 -22.7 52.4 523 236 B S T 34 S+ 0 0 9 1,-0.1 -162,-3.5 -163,-0.1 -161,-0.2 0.757 117.4 23.0 -78.5 -24.6 -36.0 -23.7 56.0 524 237 B T T <4 S+ 0 0 0 -3,-1.9 -1,-0.1 -6,-0.3 -6,-0.1 0.562 110.0 68.4-118.4 -13.9 -32.2 -23.2 56.5 525 238 B N S < S- 0 0 10 -4,-2.1 16,-0.4 17,-0.0 17,-0.3 0.268 94.2-126.4 -94.0 12.7 -31.1 -20.8 53.7 526 239 B Y > + 0 0 18 -4,-0.2 3,-1.5 -5,-0.2 -3,-0.1 0.589 67.6 134.3 55.3 14.4 -32.9 -17.8 55.2 527 240 B T T 3 + 0 0 70 1,-0.3 -1,-0.1 -6,-0.2 -4,-0.1 0.554 57.4 72.4 -70.7 -5.9 -34.6 -17.1 51.9 528 241 B T T 3 S+ 0 0 76 -6,-0.4 -1,-0.3 2,-0.1 -2,-0.1 0.677 78.3 96.0 -81.1 -16.1 -38.0 -16.6 53.7 529 242 B L S < S- 0 0 33 -3,-1.5 5,-0.0 1,-0.1 0, 0.0 -0.541 85.3-110.6 -75.6 137.9 -36.7 -13.3 55.0 530 243 B P >> - 0 0 51 0, 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