==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 05-JUL-09 3I5J . COMPND 2 MOLECULE: TOLUENE-4-MONOOXYGENASE SYSTEM PROTEIN A; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS MENDOCINA; . AUTHOR L.J.BAILEY,B.G.FOX . 980 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33297.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 723 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 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 0.4 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 . 30 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 133 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 428 43.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 43 4.4 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 7 1 2 5 6 3 4 1 0 3 0 0 0 1 1 0 0 1 1 0 1 0 1 1 2 0 2 RESIDUES PER ALPHA HELIX . 1 0 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 0 PARALLEL BRIDGES PER LADDER . 5 2 1 3 3 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 1 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 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 A 0 0 45 0, 0.0 2,-0.3 0, 0.0 592,-0.2 0.000 360.0 360.0 360.0 153.0 -39.0 -10.3 -10.0 2 3 A M - 0 0 73 591,-0.1 585,-0.0 0, 0.0 584,-0.0 -0.775 360.0-124.5-107.3 149.6 -36.9 -7.7 -11.9 3 4 A H - 0 0 31 -2,-0.3 5,-0.1 1,-0.0 660,-0.1 -0.844 32.3-103.7 -96.3 141.6 -36.9 -7.5 -15.7 4 5 A P >> - 0 0 40 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.313 25.3-117.4 -71.2 152.3 -33.6 -7.6 -17.5 5 6 A R H >> S+ 0 0 41 1,-0.3 4,-2.4 2,-0.2 3,-1.4 0.865 110.7 65.4 -58.2 -36.5 -32.1 -4.4 -18.9 6 7 A K H 34 S+ 0 0 134 1,-0.3 4,-0.4 2,-0.2 -1,-0.3 0.824 98.3 55.6 -54.7 -29.5 -32.3 -5.7 -22.5 7 8 A D H <4 S+ 0 0 70 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.716 123.4 19.6 -79.2 -22.8 -36.1 -5.7 -22.3 8 9 A W H XX S+ 0 0 16 -3,-1.4 4,-0.9 -4,-0.6 3,-0.7 0.394 94.0 97.4-126.3 -7.7 -36.6 -2.1 -21.3 9 10 A Y H >X S+ 0 0 9 -4,-2.4 3,-1.3 1,-0.2 4,-0.8 0.919 79.4 61.2 -53.8 -39.6 -33.3 -0.4 -22.4 10 11 A E H >4 S+ 0 0 114 -4,-0.4 3,-1.1 1,-0.3 -1,-0.2 0.880 98.9 55.6 -61.6 -34.0 -34.8 0.8 -25.7 11 12 A L H X4 S+ 0 0 21 -3,-0.7 3,-1.0 1,-0.2 -1,-0.3 0.803 96.9 64.6 -68.3 -28.4 -37.5 2.9 -23.9 12 13 A T H << S+ 0 0 6 -3,-1.3 -1,-0.2 -4,-0.9 -2,-0.2 0.777 112.7 33.7 -64.9 -24.7 -34.7 4.8 -22.0 13 14 A R T << S+ 0 0 26 -3,-1.1 2,-1.7 -4,-0.8 3,-0.4 0.165 84.9 106.6-116.4 17.6 -33.4 6.3 -25.3 14 15 A A < + 0 0 31 -3,-1.0 -1,-0.1 1,-0.2 -3,-0.0 -0.589 47.5 115.7 -85.8 67.7 -36.7 6.6 -27.1 15 16 A T + 0 0 0 -2,-1.7 2,-0.3 606,-0.1 -1,-0.2 0.373 32.4 107.9-126.4 4.4 -36.6 10.3 -26.6 16 17 A N + 0 0 5 -3,-0.4 2,-0.3 24,-0.0 102,-0.0 -0.657 41.3 169.9 -75.6 141.7 -36.4 11.9 -30.0 17 18 A W - 0 0 6 -2,-0.3 23,-0.1 601,-0.1 662,-0.0 -0.940 40.0 -98.3-143.6 165.8 -39.5 13.7 -31.2 18 19 A T - 0 0 72 -2,-0.3 5,-0.0 660,-0.1 -2,-0.0 -0.769 41.0-131.1 -88.9 113.2 -40.4 16.0 -34.1 19 20 A P + 0 0 18 0, 0.0 5,-0.2 0, 0.0 673,-0.1 -0.245 34.9 163.6 -64.3 146.4 -40.3 19.6 -33.0 20 21 A S S S+ 0 0 73 3,-0.1 3,-0.1 671,-0.1 672,-0.1 0.527 70.2 51.3-131.5 -27.4 -43.3 21.8 -33.8 21 22 A Y S S+ 0 0 74 1,-0.2 2,-0.3 670,-0.1 671,-0.1 0.689 125.7 19.0 -95.8 -17.3 -43.3 24.9 -31.7 22 23 A V S S- 0 0 14 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.900 97.1 -98.3-129.2 163.0 -39.7 25.7 -32.6 23 24 A T > - 0 0 77 -2,-0.3 4,-1.8 1,-0.1 5,-0.2 -0.315 28.2-113.6 -77.4 164.8 -37.8 24.3 -35.6 24 25 A E H > S+ 0 0 62 1,-0.2 4,-2.7 -5,-0.2 -1,-0.1 0.942 119.0 51.6 -61.5 -45.2 -35.4 21.4 -35.5 25 26 A E H 4 S+ 0 0 90 1,-0.2 -1,-0.2 2,-0.2 5,-0.1 0.852 108.4 50.4 -62.3 -36.8 -32.5 23.7 -36.3 26 27 A Q H 4 S+ 0 0 103 1,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.865 113.8 45.1 -64.5 -41.0 -33.5 26.1 -33.5 27 28 A L H < S+ 0 0 1 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.869 128.8 26.9 -74.5 -33.4 -33.6 23.2 -31.0 28 29 A F S < S- 0 0 4 -4,-2.7 -1,-0.3 -5,-0.2 7,-0.2 -0.627 84.9-165.1-122.8 64.3 -30.3 21.7 -32.3 29 30 A P >> - 0 0 20 0, 0.0 4,-2.7 0, 0.0 3,-1.6 -0.380 23.6-127.8 -57.3 136.7 -28.4 24.7 -33.7 30 31 A E H 3> S+ 0 0 64 1,-0.3 4,-2.0 2,-0.2 6,-0.1 0.830 105.3 61.0 -53.9 -38.7 -25.5 23.5 -35.9 31 32 A R H 34 S+ 0 0 113 1,-0.2 -1,-0.3 2,-0.2 511,-0.0 0.810 120.0 27.4 -65.5 -22.1 -22.9 25.6 -34.1 32 33 A M H <4 S+ 0 0 1 -3,-1.6 152,-2.8 151,-0.1 -2,-0.2 0.747 132.4 35.3-103.2 -27.1 -23.7 23.8 -30.8 33 34 A S H < S- 0 0 0 -4,-2.7 152,-1.6 150,-0.3 -3,-0.2 0.830 77.9-157.8 -96.5 -44.0 -24.9 20.5 -32.2 34 35 A G < + 0 0 0 -4,-2.0 -4,-0.1 -5,-0.3 -3,-0.1 0.788 35.0 151.0 66.0 32.2 -22.6 19.9 -35.3 35 36 A H > - 0 0 6 -7,-0.2 3,-2.1 1,-0.1 -1,-0.1 0.539 50.6-137.0 -68.3 -6.5 -25.1 17.5 -36.9 36 37 A M T 3 - 0 0 35 1,-0.3 -1,-0.1 -6,-0.1 -6,-0.0 0.777 65.7 -58.5 49.4 34.2 -23.8 18.6 -40.4 37 38 A G T 3 S+ 0 0 58 1,-0.3 -1,-0.3 -12,-0.0 -2,-0.0 0.459 95.6 146.5 81.0 1.5 -27.4 18.8 -41.7 38 39 A I < - 0 0 6 -3,-2.1 -1,-0.3 1,-0.1 5,-0.1 -0.631 51.0-119.3 -73.0 122.5 -28.0 15.1 -40.9 39 40 A P >> - 0 0 70 0, 0.0 3,-1.7 0, 0.0 4,-0.9 -0.246 18.7-106.9 -70.3 151.8 -31.8 14.9 -39.9 40 41 A L H >> S+ 0 0 9 1,-0.3 3,-0.7 2,-0.2 4,-0.6 0.763 114.2 61.1 -43.7 -42.1 -33.0 13.7 -36.6 41 42 A E H >4 S+ 0 0 151 1,-0.3 3,-0.8 2,-0.2 4,-0.3 0.845 98.9 56.0 -67.2 -29.9 -34.3 10.4 -37.9 42 43 A K H X4 S+ 0 0 107 -3,-1.7 3,-1.1 1,-0.2 -1,-0.3 0.830 101.5 59.3 -69.7 -25.6 -30.9 9.3 -39.1 43 44 A W H X< S+ 0 0 1 -4,-0.9 3,-1.5 -3,-0.7 -1,-0.2 0.697 85.1 76.8 -77.8 -18.7 -29.5 9.8 -35.5 44 45 A E T << S+ 0 0 66 -3,-0.8 -1,-0.2 -4,-0.6 -2,-0.2 0.718 83.2 66.8 -66.0 -19.7 -31.9 7.4 -34.0 45 46 A S T < S+ 0 0 78 -3,-1.1 -1,-0.2 -4,-0.3 -2,-0.2 0.624 72.1 120.3 -75.1 -11.5 -29.8 4.5 -35.3 46 47 A Y < - 0 0 8 -3,-1.5 2,-0.5 -4,-0.2 75,-0.3 -0.333 44.0-172.2 -48.0 128.3 -26.9 5.5 -32.9 47 48 A D - 0 0 80 74,-0.1 -1,-0.1 -2,-0.0 -2,-0.0 -0.858 17.2-143.9-136.5 94.3 -26.2 2.5 -30.6 48 49 A E - 0 0 2 -2,-0.5 3,-0.2 1,-0.2 188,-0.1 -0.401 8.6-154.0 -55.6 126.6 -23.8 3.1 -27.8 49 50 A P S S+ 0 0 33 0, 0.0 2,-0.7 0, 0.0 921,-0.7 0.723 84.0 54.6 -82.9 -18.3 -21.8 -0.2 -27.4 50 51 A Y S S- 0 0 16 182,-0.2 2,-0.1 185,-0.2 185,-0.1 -0.788 80.9-176.4-115.8 88.8 -21.0 0.2 -23.7 51 52 A K + 0 0 40 -2,-0.7 2,-0.3 -3,-0.2 182,-0.0 -0.415 13.4 170.5 -83.8 159.7 -24.4 0.7 -22.0 52 53 A T - 0 0 2 -2,-0.1 2,-0.3 180,-0.0 76,-0.1 -0.936 17.6-145.6-150.2 172.9 -25.3 1.4 -18.4 53 54 A S > - 0 0 6 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.923 32.3-100.4-137.9 164.4 -28.5 2.4 -16.6 54 55 A Y H > S+ 0 0 1 -2,-0.3 4,-2.3 1,-0.2 5,-0.3 0.901 116.8 46.6 -61.8 -44.9 -29.1 4.7 -13.7 55 56 A P H > S+ 0 0 22 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.912 116.7 46.1 -65.4 -34.8 -29.6 2.2 -10.9 56 57 A E H > S+ 0 0 51 1,-0.2 4,-2.7 -3,-0.2 5,-0.3 0.904 110.5 55.1 -68.3 -39.1 -26.5 0.2 -12.0 57 58 A Y H X S+ 0 0 3 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.948 109.1 43.5 -56.9 -56.3 -24.5 3.4 -12.4 58 59 A V H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 521,-0.2 0.904 116.4 49.4 -63.1 -35.3 -25.0 4.7 -8.8 59 60 A S H X S+ 0 0 46 -4,-1.5 4,-1.7 -5,-0.3 -2,-0.2 0.936 115.8 40.3 -64.6 -47.7 -24.4 1.3 -7.4 60 61 A I H X S+ 0 0 13 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.891 115.1 50.2 -73.6 -43.8 -21.2 0.5 -9.3 61 62 A Q H X S+ 0 0 1 -4,-2.9 4,-2.2 -5,-0.3 5,-0.2 0.845 105.9 58.1 -65.6 -31.9 -19.7 4.0 -9.0 62 63 A R H X S+ 0 0 110 -4,-1.7 4,-2.5 -5,-0.3 -2,-0.2 0.949 109.4 45.5 -55.6 -46.5 -20.4 3.9 -5.2 63 64 A E H X S+ 0 0 92 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.871 109.6 54.4 -65.8 -42.1 -18.2 0.7 -5.1 64 65 A K H X S+ 0 0 4 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.930 113.1 42.1 -58.2 -47.3 -15.4 2.3 -7.3 65 66 A D H X S+ 0 0 4 -4,-2.2 4,-3.1 2,-0.2 5,-0.4 0.885 107.5 60.8 -69.5 -38.4 -15.1 5.3 -5.0 66 67 A A H X S+ 0 0 56 -4,-2.5 4,-2.1 -5,-0.2 5,-0.2 0.956 110.3 42.4 -53.3 -49.0 -15.3 3.1 -1.8 67 68 A G H X S+ 0 0 34 -4,-1.9 4,-2.0 2,-0.2 5,-0.2 0.921 113.5 51.3 -65.3 -44.3 -12.2 1.3 -3.0 68 69 A A H X S+ 0 0 2 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.940 115.3 41.2 -58.9 -49.4 -10.3 4.5 -4.1 69 70 A Y H X S+ 0 0 37 -4,-3.1 4,-2.8 2,-0.2 -1,-0.2 0.846 112.4 55.4 -68.6 -36.5 -10.8 6.3 -0.9 70 71 A S H X S+ 0 0 75 -4,-2.1 4,-2.5 -5,-0.4 -1,-0.2 0.883 109.2 46.7 -60.3 -46.5 -10.2 3.2 1.3 71 72 A V H X S+ 0 0 45 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.941 111.6 50.5 -63.1 -44.0 -6.8 2.7 -0.3 72 73 A K H >X S+ 0 0 20 -4,-2.1 4,-0.7 -5,-0.2 3,-0.5 0.952 113.7 46.7 -53.9 -49.8 -5.9 6.4 0.1 73 74 A A H >< S+ 0 0 66 -4,-2.8 3,-0.7 1,-0.2 -1,-0.2 0.902 110.7 51.1 -61.9 -43.1 -6.9 6.2 3.7 74 75 A A H 3< S+ 0 0 84 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.735 115.6 42.0 -67.2 -25.8 -5.0 2.9 4.4 75 76 A L H X< S+ 0 0 62 -4,-1.5 3,-2.1 -3,-0.5 5,-0.3 0.393 74.3 110.9-107.0 9.0 -1.7 4.2 2.9 76 77 A E T << S+ 0 0 59 -3,-0.7 3,-0.4 -4,-0.7 -1,-0.2 0.763 83.1 47.3 -52.2 -30.3 -1.6 7.8 4.2 77 78 A R T 3 S+ 0 0 221 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.494 77.1 102.2 -96.2 5.0 1.4 6.8 6.5 78 79 A A S < S- 0 0 51 -3,-2.1 -1,-0.2 1,-0.1 -2,-0.1 0.583 86.2-130.3 -61.4 -5.3 3.4 5.0 3.8 79 80 A K >> + 0 0 105 -3,-0.4 4,-4.8 -4,-0.2 5,-0.6 0.752 52.3 153.2 63.6 26.2 5.6 8.3 3.5 80 81 A I H >5S+ 0 0 27 -5,-0.3 4,-3.2 1,-0.2 9,-0.1 0.980 74.3 50.1 -47.7 -60.4 5.4 8.5 -0.3 81 82 A Y H 45S+ 0 0 56 1,-0.2 -1,-0.2 2,-0.2 8,-0.1 0.883 122.7 31.6 -49.4 -44.9 5.9 12.2 -0.1 82 83 A E H 45S+ 0 0 90 1,-0.1 -1,-0.2 4,-0.0 -2,-0.2 0.826 126.9 38.5 -82.6 -34.2 9.0 11.8 2.2 83 84 A N H <5S+ 0 0 122 -4,-4.8 -3,-0.2 -5,-0.1 -2,-0.2 0.734 94.1 95.9 -96.2 -20.9 10.4 8.5 0.9 84 85 A S S <> - 0 0 55 1,-0.1 4,-1.6 129,-0.1 3,-1.1 -0.456 36.0-121.5 -63.3 138.2 12.4 9.9 -5.3 86 87 A P H 3> S+ 0 0 47 0, 0.0 4,-2.3 0, 0.0 258,-0.2 0.770 112.0 62.6 -60.6 -25.4 11.8 13.6 -5.9 87 88 A G H 3> S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 259,-0.1 0.855 103.9 50.4 -64.2 -32.7 11.3 13.0 -9.7 88 89 A W H <> S+ 0 0 2 -3,-1.1 4,-2.0 2,-0.2 -1,-0.2 0.924 108.4 50.8 -67.9 -48.5 8.3 10.8 -8.7 89 90 A I H X S+ 0 0 10 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.906 109.6 51.3 -55.2 -43.9 6.9 13.6 -6.5 90 91 A S H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.3 0.852 105.0 56.4 -59.2 -36.4 7.3 16.0 -9.5 91 92 A T H X S+ 0 0 0 -4,-1.5 4,-2.8 1,-0.2 -2,-0.2 0.933 107.6 48.5 -62.1 -43.2 5.4 13.6 -11.6 92 93 A L H X S+ 0 0 3 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.860 111.4 50.8 -57.8 -47.9 2.5 13.7 -9.1 93 94 A K H X S+ 0 0 7 -4,-1.8 4,-2.1 2,-0.2 5,-0.2 0.902 113.9 41.8 -64.6 -43.9 2.6 17.5 -9.1 94 95 A S H X S+ 0 0 6 -4,-2.6 4,-3.7 2,-0.2 5,-0.3 0.966 113.6 53.4 -70.1 -43.8 2.5 17.9 -12.9 95 96 A H H X S+ 0 0 1 -4,-2.8 4,-1.7 -5,-0.3 5,-0.3 0.966 114.5 39.7 -51.9 -59.4 -0.1 15.3 -13.3 96 97 A Y H X S+ 0 0 10 -4,-2.5 4,-2.2 1,-0.2 5,-0.4 0.914 118.9 47.7 -61.1 -41.9 -2.6 16.9 -10.8 97 98 A G H < S+ 0 0 0 -4,-2.1 4,-0.4 -5,-0.2 64,-0.2 0.945 116.8 42.1 -60.8 -46.8 -1.8 20.4 -11.9 98 99 A A H < S+ 0 0 7 -4,-3.7 -1,-0.2 -5,-0.2 -2,-0.2 0.697 128.4 26.5 -77.9 -14.6 -2.2 19.5 -15.7 99 100 A I H X S+ 0 0 17 -4,-1.7 4,-2.6 -5,-0.3 5,-0.2 0.782 95.9 76.1-117.0 -40.4 -5.3 17.3 -15.2 100 101 A A H X S+ 0 0 0 -4,-2.2 4,-1.5 -5,-0.3 41,-0.1 0.902 108.0 31.4 -53.9 -54.1 -7.6 18.0 -12.2 101 102 A V H > S+ 0 0 0 56,-0.4 4,-1.9 -5,-0.4 -1,-0.2 0.768 114.5 62.4 -79.1 -19.1 -9.4 21.1 -13.4 102 103 A G H > S+ 0 0 4 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.882 103.1 51.7 -66.2 -39.1 -9.2 19.8 -17.1 103 104 A E H X S+ 0 0 19 -4,-2.6 4,-0.7 1,-0.2 34,-0.2 0.929 108.1 50.3 -59.0 -48.7 -11.3 16.8 -15.9 104 105 A Y H >X S+ 0 0 2 -4,-1.5 3,-0.9 -5,-0.2 4,-0.5 0.894 107.7 53.7 -61.4 -36.5 -13.8 19.2 -14.5 105 106 A A H >X S+ 0 0 6 -4,-1.9 3,-1.6 1,-0.2 4,-1.0 0.878 98.5 65.2 -59.3 -35.6 -13.8 21.1 -17.9 106 107 A A H 3X S+ 0 0 4 -4,-1.8 4,-2.2 1,-0.3 -1,-0.2 0.747 85.4 70.4 -64.3 -25.2 -14.6 17.8 -19.5 107 108 A V H - 0 0 0 1,-0.2 4,-2.2 -6,-0.1 3,-0.4 -0.738 66.9-155.4 -85.7 117.0 -28.5 11.0 -31.0 120 121 A P H > S+ 0 0 7 0, 0.0 4,-1.6 0, 0.0 5,-0.2 0.873 94.1 50.8 -59.4 -40.3 -30.7 10.0 -28.0 121 122 A G H > S+ 0 0 2 -75,-0.3 4,-2.5 1,-0.2 5,-0.2 0.856 109.1 53.8 -64.0 -31.4 -28.4 7.3 -26.8 122 123 A N H > S+ 0 0 0 -3,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.929 104.2 54.1 -65.4 -44.4 -25.6 9.8 -26.9 123 124 A R H X S+ 0 0 0 -4,-2.2 4,-0.7 1,-0.2 -1,-0.2 0.854 113.6 42.5 -61.1 -38.3 -27.5 12.3 -24.8 124 125 A N H >X S+ 0 0 2 -4,-1.6 4,-1.8 2,-0.2 3,-0.5 0.912 114.1 48.3 -73.6 -45.8 -27.9 9.6 -22.0 125 126 A M H 3X S+ 0 0 8 -4,-2.5 4,-1.9 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0.801 129.5 48.7 -92.8 -44.9 -6.3 23.7 -8.1 159 160 A R H >< S+ 0 0 9 -4,-2.7 3,-1.9 1,-0.2 4,-0.3 0.794 85.5 81.9 -74.5 -31.9 -4.4 26.8 -9.3 160 161 A A G >< S+ 0 0 0 -4,-1.9 3,-2.2 1,-0.3 5,-0.3 0.873 93.5 46.5 -51.3 -49.8 -2.9 25.8 -12.7 161 162 A Y G 3 S+ 0 0 1 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.706 109.7 57.8 -66.5 -15.8 -6.0 26.3 -14.9 162 163 A H G < S+ 0 0 39 -3,-1.9 -1,-0.3 -4,-0.3 2,-0.2 0.389 102.5 74.7 -87.3 1.3 -6.5 29.7 -13.2 163 164 A S S < S- 0 0 5 -3,-2.2 308,-0.1 -4,-0.3 307,-0.1 -0.655 75.6-133.1-108.7 172.8 -2.9 30.8 -14.2 164 165 A N + 0 0 49 305,-0.5 307,-0.2 -2,-0.2 306,-0.1 -0.020 54.5 143.7-108.6 25.8 -1.1 32.0 -17.3 165 166 A E >> - 0 0 0 305,-0.6 4,-2.2 -5,-0.3 3,-0.6 -0.414 63.1-113.9 -64.8 144.8 1.8 29.6 -16.7 166 167 A W H 3> S+ 0 0 27 174,-0.3 4,-2.2 1,-0.3 -1,-0.1 0.839 112.9 44.3 -60.4 -39.3 3.0 28.4 -20.1 167 168 A A H 3> S+ 0 0 2 173,-0.3 4,-2.7 2,-0.2 -1,-0.3 0.818 110.6 54.1 -76.9 -30.3 2.1 24.7 -19.7 168 169 A A H <> S+ 0 0 1 -3,-0.6 4,-2.7 2,-0.2 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4,-2.6 2,-0.2 5,-0.2 0.906 94.6 58.8 -82.9 -42.2 -17.4 8.5 -30.3 238 239 A G H > S+ 0 0 7 -4,-0.5 4,-2.7 1,-0.2 5,-0.2 0.912 107.5 47.2 -50.7 -54.1 -17.2 5.2 -32.4 239 240 A P H > S+ 0 0 6 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.848 111.9 51.1 -65.1 -29.9 -21.0 5.1 -33.0 240 241 A A H X S+ 0 0 0 -4,-0.8 4,-2.3 2,-0.2 -2,-0.2 0.932 111.5 47.7 -71.2 -44.0 -21.0 8.9 -33.9 241 242 A L H X S+ 0 0 1 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.927 110.3 51.8 -61.1 -43.8 -18.1 8.3 -36.4 242 243 A Q H X S+ 0 0 69 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.917 110.8 48.4 -58.9 -45.6 -19.9 5.3 -37.9 243 244 A L H X S+ 0 0 3 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.889 110.0 51.1 -59.8 -46.0 -23.0 7.4 -38.4 244 245 A L H <>S+ 0 0 0 -4,-2.3 5,-2.7 1,-0.2 3,-0.2 0.922 112.1 47.9 -58.3 -43.3 -21.1 10.3 -40.0 245 246 A I H ><5S+ 0 0 39 -4,-2.8 3,-1.4 1,-0.2 5,-0.3 0.915 109.8 51.9 -66.4 -39.7 -19.5 7.8 -42.4 246 247 A E H 3<5S+ 0 0 135 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.772 109.8 51.9 -66.2 -25.5 -22.8 6.2 -43.2 247 248 A N T 3<5S- 0 0 44 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15.9 -37.1 411 412 A W < + 0 0 44 -3,-2.1 2,-0.3 -6,-0.1 -3,-0.1 -0.067 12.3 166.2 -38.8 121.9 21.4 19.1 -36.0 412 413 A N E +H 406 0D 80 -6,-2.5 -6,-3.0 398,-0.2 2,-0.3 -0.956 4.5 160.9-143.1 132.1 18.1 19.7 -37.6 413 414 A I E -H 405 0D 4 -2,-0.3 2,-0.4 -8,-0.3 -8,-0.2 -0.995 10.9-172.8-144.6 143.3 15.3 22.1 -36.7 414 415 A E - 0 0 67 -10,-0.6 2,-0.4 -2,-0.3 -10,-0.1 -0.979 10.2-164.2-143.3 129.3 12.4 23.5 -38.6 415 416 A V - 0 0 7 -2,-0.4 2,-0.6 -12,-0.1 13,-0.2 -0.910 14.2-149.9-103.8 135.4 9.8 26.2 -38.0 416 417 A F E -I 427 0E 22 11,-2.8 11,-2.6 -2,-0.4 2,-0.2 -0.943 23.2-167.9-107.3 108.5 6.7 26.3 -40.2 417 418 A S E -I 426 0E 42 -2,-0.6 2,-0.3 9,-0.2 9,-0.2 -0.605 11.8-170.5-104.5 162.7 5.5 29.8 -40.5 418 419 A L E -I 425 0E 30 7,-2.1 7,-3.5 -2,-0.2 2,-0.5 -0.976 15.4-147.7-150.7 128.2 2.3 31.4 -41.9 419 420 A E E +I 424 0E 162 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.853 30.1 167.0 -89.3 135.8 1.1 34.9 -42.7 420 421 A H E > -I 423 0E 40 3,-2.5 3,-0.8 -2,-0.5 -2,-0.1 -0.921 60.6 -14.6-154.5 124.4 -2.5 35.4 -42.1 421 422 A N T 3 S- 0 0 119 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.933 128.5 -48.6 53.5 46.5 -4.6 38.5 -41.9 422 423 A G T 3 S+ 0 0 90 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.733 117.4 105.5 69.3 22.5 -1.6 40.7 -41.6 423 424 A R E < -I 420 0E 59 -3,-0.8 -3,-2.5 2,-0.0 2,-0.6 -0.995 64.4-131.7-134.8 145.4 0.1 38.7 -38.8 424 425 A L E -I 419 0E 44 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.829 27.5-174.8 -95.6 116.3 3.1 36.4 -38.7 425 426 A Y E -I 418 0E 4 -7,-3.5 -7,-2.1 -2,-0.6 2,-0.5 -0.805 10.2-152.3-108.1 152.2 2.6 33.0 -37.0 426 427 A H E -I 417 0E 10 -2,-0.3 -29,-2.7 -9,-0.2 2,-0.3 -0.980 9.9-170.8-127.8 138.0 5.0 30.2 -36.2 427 428 A F E -I 416 0E 0 -11,-2.6 -11,-2.8 -2,-0.5 -31,-0.0 -0.854 26.0-137.7-128.9 150.8 4.4 26.5 -35.8 428 429 A G S S+ 0 0 12 -2,-0.3 2,-0.3 -13,-0.2 -14,-0.2 0.459 85.0 17.6 -88.1 2.7 6.4 23.6 -34.6 429 430 A S S > S- 0 0 10 -13,-0.2 4,-1.6 1,-0.1 5,-0.2 -0.978 75.8-108.6-158.1 166.5 5.3 21.1 -37.3 430 431 A E H > S+ 0 0 84 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.860 120.4 53.2 -59.1 -35.8 3.6 20.9 -40.7 431 432 A V H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.892 103.2 53.0 -75.2 -43.3 0.7 19.4 -38.9 432 433 A D H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.912 110.8 48.5 -59.3 -42.4 0.3 22.3 -36.4 433 434 A R H X S+ 0 0 58 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.933 111.6 50.8 -56.8 -47.3 0.2 24.8 -39.3 434 435 A W H X S+ 0 0 52 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.909 105.7 54.8 -59.0 -42.9 -2.4 22.6 -41.1 435 436 A V H X S+ 0 0 1 -4,-2.9 4,-0.8 1,-0.2 3,-0.3 0.923 109.2 48.5 -56.1 -44.3 -4.6 22.4 -37.9 436 437 A F H >< S+ 0 0 2 -4,-1.8 3,-1.2 1,-0.2 -1,-0.2 0.940 109.6 51.6 -60.8 -43.1 -4.6 26.2 -37.9 437 438 A Q H 3< S+ 0 0 97 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.776 100.2 65.1 -69.6 -16.5 -5.5 26.4 -41.5 438 439 A Q H 3< S+ 0 0 79 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.742 125.2 6.4 -76.5 -24.1 -8.4 24.0 -41.0 439 440 A D XX + 0 0 46 -3,-1.2 3,-1.2 -4,-0.8 4,-0.7 -0.389 66.5 170.3-158.3 69.1 -10.2 26.5 -38.8 440 441 A P H >> S+ 0 0 40 0, 0.0 4,-2.9 0, 0.0 3,-1.0 0.831 76.8 63.8 -62.6 -27.1 -8.6 29.9 -38.6 441 442 A V H 34 S+ 0 0 71 1,-0.3 4,-0.3 2,-0.2 98,-0.1 0.845 99.0 56.7 -68.0 -25.7 -11.6 31.6 -36.8 442 443 A Q H <4 S+ 0 0 2 -3,-1.2 95,-2.9 -6,-0.1 -1,-0.3 0.807 127.0 13.3 -66.2 -32.4 -10.9 29.3 -33.8 443 444 A Y H X< S+ 0 0 4 -3,-1.0 3,-2.2 -4,-0.7 -2,-0.2 0.649 91.5 100.2-119.3 -23.8 -7.2 30.5 -33.5 444 445 A Q T 3< S+ 0 0 33 -4,-2.9 -3,-0.1 1,-0.3 -2,-0.1 0.733 93.0 34.1 -56.0 -37.5 -6.4 33.6 -35.4 445 446 A N T 3 S+ 0 0 74 -4,-0.3 -1,-0.3 -5,-0.2 2,-0.2 0.332 88.6 117.4-102.6 6.3 -6.5 36.3 -32.7 446 447 A H < - 0 0 9 -3,-2.2 2,-0.5 91,-0.1 91,-0.1 -0.525 55.4-148.9 -67.6 138.0 -5.2 34.0 -29.9 447 448 A M - 0 0 53 89,-0.2 -2,-0.1 -2,-0.2 -3,-0.0 -0.961 5.3-142.1-111.9 118.3 -1.8 35.4 -28.6 448 449 A N > - 0 0 2 -2,-0.5 4,-2.1 1,-0.1 5,-0.2 -0.226 37.9 -95.5 -73.0 176.3 0.8 32.8 -27.3 449 450 A I H > S+ 0 0 9 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.881 127.0 49.5 -63.1 -33.4 2.8 33.9 -24.1 450 451 A V H > S+ 0 0 2 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.869 107.3 54.1 -72.8 -42.5 5.7 35.2 -26.2 451 452 A D H > S+ 0 0 33 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.919 111.5 47.2 -50.9 -44.5 3.3 37.1 -28.5 452 453 A R H <>S+ 0 0 21 -4,-2.1 5,-1.9 2,-0.2 6,-0.6 0.904 108.5 53.5 -65.1 -46.5 2.0 38.7 -25.2 453 454 A F H ><5S+ 0 0 20 -4,-2.5 3,-0.9 1,-0.2 5,-0.3 0.909 113.6 43.3 -52.0 -48.0 5.6 39.4 -23.9 454 455 A L H 3<5S+ 0 0 50 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.792 107.5 60.8 -73.5 -25.9 6.4 41.3 -27.2 455 456 A A T 3<5S- 0 0 58 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.401 117.1-105.8 -82.6 2.3 3.1 43.1 -27.2 456 457 A G T < 5S+ 0 0 33 -3,-0.9 -3,-0.2 -4,-0.3 -2,-0.1 0.435 88.6 116.7 95.8 -0.5 3.6 44.9 -23.9 457 458 A Q < + 0 0 90 -5,-1.9 2,-0.7 -6,-0.2 -4,-0.2 0.633 62.0 67.5 -82.4 -12.2 1.2 42.8 -21.8 458 459 A I S S- 0 0 0 -6,-0.6 8,-0.2 -5,-0.3 -2,-0.1 -0.930 85.2-135.3-113.7 116.2 3.8 41.3 -19.5 459 460 A Q S S+ 0 0 127 -2,-0.7 2,-0.2 6,-0.3 10,-0.0 -0.977 83.8 24.7-130.9 134.3 5.4 43.9 -17.2 460 461 A P S S- 0 0 77 0, 0.0 2,-2.2 0, 0.0 6,-0.1 0.641 90.4-131.2 -70.8 166.5 8.0 44.4 -16.5 461 462 A M S S+ 0 0 81 -2,-0.2 2,-0.3 4,-0.1 -2,-0.1 -0.513 71.7 104.8 -86.2 70.2 9.2 42.8 -19.7 462 463 A T S > S- 0 0 64 -2,-2.2 4,-2.8 1,-0.1 5,-0.2 -0.884 88.4 -99.5-144.3 165.0 11.7 40.6 -17.9 463 464 A L H > S+ 0 0 60 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.937 127.6 48.1 -60.3 -42.6 12.0 36.9 -16.9 464 465 A E H > S+ 0 0 89 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.907 108.8 53.1 -61.2 -41.9 10.9 37.9 -13.5 465 466 A G H > S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 -6,-0.3 0.915 111.2 48.5 -58.4 -44.0 8.0 40.0 -14.9 466 467 A A H X S+ 0 0 2 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.898 107.4 53.3 -64.4 -41.5 7.0 36.8 -16.9 467 468 A L H <>S+ 0 0 9 -4,-2.6 5,-1.6 2,-0.2 -2,-0.2 0.927 111.7 47.5 -60.7 -38.3 7.2 34.5 -13.8 468 469 A K H ><5S+ 0 0 81 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.958 109.9 51.3 -66.7 -46.3 4.8 36.9 -12.0 469 470 A Y H 3<5S+ 0 0 57 -4,-2.6 -305,-0.5 1,-0.3 -1,-0.2 0.846 102.2 62.4 -54.1 -39.0 2.5 37.0 -14.9 470 471 A M T 3<5S- 0 0 6 -4,-2.2 -305,-0.6 -5,-0.2 -1,-0.3 0.487 121.1-105.9 -71.3 -1.9 2.4 33.2 -14.9 471 472 A G T < 5 + 0 0 23 -3,-1.9 2,-0.2 1,-0.3 -3,-0.2 0.525 62.5 155.4 98.6 -0.4 0.9 33.3 -11.5 472 473 A F < - 0 0 4 -5,-1.6 -1,-0.3 1,-0.1 3,-0.1 -0.489 18.5-174.3 -66.5 131.8 3.8 32.2 -9.2 473 474 A Q + 0 0 77 -2,-0.2 22,-0.3 1,-0.2 2,-0.3 0.506 61.0 16.8-109.3 -6.6 3.1 33.6 -5.7 474 475 A S S >> S- 0 0 0 20,-0.1 3,-1.0 1,-0.1 4,-0.5 -0.980 76.8-106.5-154.8 168.2 6.3 32.7 -3.8 475 476 A I G >4 S+ 0 0 96 20,-2.2 3,-0.9 -2,-0.3 21,-0.1 0.836 114.8 62.0 -65.7 -33.1 9.9 31.6 -4.5 476 477 A E G 34 S+ 0 0 72 19,-0.3 -1,-0.3 1,-0.2 -323,-0.1 0.738 93.8 63.6 -62.4 -27.3 9.1 28.0 -3.4 477 478 A E G <4 S+ 0 0 0 -3,-1.0 -1,-0.2 -325,-0.1 -2,-0.2 0.771 81.6 91.1 -73.0 -24.9 6.6 27.5 -6.1 478 479 A M S << S- 0 0 18 -3,-0.9 -139,-0.2 -4,-0.5 -136,-0.2 -0.484 86.4 -99.4 -78.0 143.2 9.0 27.9 -9.1 479 480 A G - 0 0 5 -138,-2.0 2,-0.3 -141,-0.8 -135,-0.2 -0.221 39.8-179.0 -64.3 149.7 10.6 24.7 -10.4 480 481 A K - 0 0 129 -142,-0.1 2,-0.1 -141,-0.1 -1,-0.0 -0.836 48.4 -70.2-134.1 166.1 14.1 23.6 -9.5 481 482 A D > - 0 0 3 -2,-0.3 3,-2.0 1,-0.1 -135,-0.2 -0.426 51.2-126.5 -56.4 134.3 16.2 20.7 -10.5 482 483 A A T 3 S+ 0 0 12 -137,-2.8 -136,-0.2 1,-0.3 -1,-0.1 0.833 105.7 31.7 -58.6 -32.5 14.4 17.7 -8.7 483 484 A H T > S- 0 0 54 -138,-0.2 3,-2.2 -397,-0.1 -1,-0.3 0.071 110.6-111.8-110.0 20.6 17.6 16.5 -6.9 484 485 A D T < S- 0 0 111 -3,-2.0 -2,-0.1 1,-0.3 -138,-0.1 0.909 75.3 -59.5 44.0 43.9 19.3 19.8 -6.5 485 486 A F T > S+ 0 0 45 1,-0.1 3,-1.6 3,-0.0 4,-0.4 0.587 98.6 136.5 68.9 11.5 21.9 18.6 -9.1 486 487 A A G X + 0 0 49 -3,-2.2 3,-1.4 1,-0.3 4,-0.4 0.777 61.7 72.1 -63.1 -22.0 23.0 15.7 -6.9 487 488 A W G > S+ 0 0 12 1,-0.3 3,-1.4 2,-0.2 4,-0.4 0.798 81.1 70.9 -62.0 -30.9 22.9 13.7 -10.2 488 489 A A G X S+ 0 0 4 -3,-1.6 3,-1.3 1,-0.3 -1,-0.3 0.822 89.9 62.7 -53.2 -31.6 26.1 15.5 -11.3 489 490 A D G < S+ 0 0 137 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.781 95.3 58.5 -63.8 -31.3 27.9 13.5 -8.6 490 491 A K G < 0 0 142 -3,-1.4 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23.3 -20.5 630 139 B V H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 3,-0.4 0.953 110.8 56.7 -59.1 -40.0 -27.8 25.2 -17.2 631 140 B Q H < S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.912 109.1 42.7 -49.3 -51.3 -24.7 23.1 -16.1 632 141 B Q H < S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.772 122.0 39.0 -77.9 -23.0 -22.6 24.1 -19.0 633 142 B M H < S+ 0 0 0 -4,-1.7 -1,-0.2 -3,-0.4 -2,-0.2 0.584 83.5 113.2 -99.1 -18.5 -23.6 27.8 -18.9 634 143 B A < - 0 0 0 -4,-2.5 6,-0.1 -5,-0.2 -84,-0.1 -0.244 66.4-132.2 -61.9 144.6 -23.8 28.6 -15.2 635 144 B P S S+ 0 0 11 0, 0.0 2,-0.3 0, 0.0 -74,-0.2 0.285 83.9 48.2 -88.3 16.0 -21.1 31.1 -14.0 636 145 B A S > S- 0 0 0 -76,-0.1 4,-2.6 1,-0.1 3,-0.4 -0.977 73.4-133.5-147.3 141.3 -19.8 29.1 -10.9 637 146 B S H > S+ 0 0 0 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.828 107.5 60.2 -65.1 -30.6 -18.9 25.5 -10.5 638 147 B T H > S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.891 109.4 43.7 -67.4 -32.2 -20.9 25.2 -7.3 639 148 B I H > S+ 0 0 0 -3,-0.4 4,-1.7 2,-0.2 -2,-0.2 0.937 114.0 50.3 -67.0 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43.3 -60.7 -49.0 -38.9 0.5 -16.6 660 169 B R H X S+ 0 0 7 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.794 110.2 56.0 -71.6 -31.4 -42.6 0.7 -15.4 661 170 B T H X S+ 0 0 1 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.946 112.4 42.7 -61.4 -52.0 -43.9 1.3 -18.9 662 171 B H H X S+ 0 0 30 -4,-2.4 4,-0.7 -5,-0.2 -2,-0.2 0.937 116.7 47.6 -60.1 -47.5 -42.3 -1.9 -20.1 663 172 B E H >X S+ 0 0 5 -4,-2.8 3,-1.3 1,-0.2 4,-0.8 0.936 110.3 50.4 -62.4 -47.9 -43.4 -3.8 -16.9 664 173 B L H >X S+ 0 0 4 -4,-2.7 4,-3.0 1,-0.2 3,-0.7 0.876 103.3 62.1 -53.0 -40.1 -47.0 -2.6 -17.0 665 174 B S H 3< S+ 0 0 23 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.728 94.1 63.5 -62.8 -19.5 -47.1 -3.7 -20.7 666 175 B L H << S+ 0 0 92 -3,-1.3 -1,-0.2 -4,-0.7 -2,-0.2 0.861 112.8 32.7 -75.2 -40.1 -46.5 -7.3 -19.7 667 176 B T H << S+ 0 0 48 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.783 132.8 35.4 -78.8 -33.0 -49.8 -7.4 -17.7 668 177 B Y >< + 0 0 40 -4,-3.0 3,-0.8 -5,-0.2 5,-0.4 -0.618 65.1 160.9-121.6 78.8 -51.5 -5.1 -20.2 669 178 B P T 3 + 0 0 82 0, 0.0 3,-0.3 0, 0.0 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6 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.928 112.6 46.0 -67.8 -38.9 -44.4 20.1 -25.3 692 201 B E H X S+ 0 0 40 -4,-2.6 4,-2.2 -5,-0.2 5,-0.2 0.934 112.3 53.3 -62.8 -46.6 -44.7 23.7 -26.4 693 202 B L H X S+ 0 0 0 -4,-3.0 4,-2.7 -5,-0.2 -2,-0.2 0.944 113.4 40.4 -52.8 -53.6 -43.3 24.8 -23.0 694 203 B M H X S+ 0 0 0 -4,-3.0 4,-3.1 2,-0.2 -1,-0.2 0.869 111.3 54.9 -72.6 -35.4 -40.2 22.6 -23.1 695 204 B E H < S+ 0 0 0 -4,-2.3 4,-0.4 -5,-0.3 -1,-0.2 0.925 115.0 40.9 -62.5 -44.0 -39.4 23.2 -26.8 696 205 B K H >< S+ 0 0 72 -4,-2.2 3,-1.1 -5,-0.2 -2,-0.2 0.901 115.2 51.4 -68.1 -38.5 -39.4 27.0 -26.2 697 206 B Q H >< S+ 0 0 2 -4,-2.7 3,-1.9 1,-0.3 -2,-0.2 0.888 104.0 58.3 -65.0 -39.3 -37.6 26.6 -22.8 698 207 B L T 3< S+ 0 0 5 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.661 104.4 52.5 -66.3 -10.5 -34.9 24.5 -24.5 699 208 B T T < S+ 0 0 38 -3,-1.1 2,-0.9 -4,-0.4 -1,-0.3 0.189 78.9 104.8-110.5 17.0 -34.1 27.4 -26.8 700 209 B A < + 0 0 9 -3,-1.9 9,-0.1 1,-0.2 -3,-0.0 -0.838 46.5 175.5 -91.8 102.8 -33.7 30.0 -24.0 701 210 B F + 0 0 28 -2,-0.9 2,-0.2 4,-0.1 -1,-0.2 0.663 41.7 103.3 -94.6 -19.4 -29.9 30.3 -24.2 702 211 B D S > S- 0 0 21 1,-0.1 4,-2.9 -150,-0.1 5,-0.2 -0.490 72.5-135.7 -56.4 130.6 -29.2 33.0 -21.6 703 212 B W H > S+ 0 0 2 -154,-3.0 4,-2.9 1,-0.2 5,-0.2 0.897 101.7 49.1 -62.2 -37.5 -27.9 31.1 -18.5 704 213 B G H > S+ 0 0 0 -155,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.916 114.0 42.8 -66.4 -46.2 -30.1 33.2 -16.1 705 214 B E H > S+ 0 0 22 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.844 113.5 54.2 -69.3 -35.3 -33.2 32.8 -18.1 706 215 B A H X S+ 0 0 1 -4,-2.9 4,-2.5 2,-0.2 5,-0.3 0.964 112.7 42.9 -61.5 -52.8 -32.5 29.1 -18.6 707 216 B F H X>S+ 0 0 1 -4,-2.9 4,-2.8 -5,-0.2 5,-0.6 0.930 116.8 46.5 -59.2 -46.4 -32.1 28.6 -14.8 708 217 B V H X>S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 5,-0.8 0.925 115.8 43.6 -66.2 -45.5 -35.1 30.7 -13.9 709 218 B S H X>S+ 0 0 0 -4,-2.6 5,-2.7 3,-0.2 4,-0.5 0.903 120.9 40.9 -69.4 -41.4 -37.5 29.2 -16.4 710 219 B L H <>S+ 0 0 0 -4,-2.5 5,-2.7 -5,-0.3 -2,-0.2 0.967 128.0 25.6 -68.5 -55.9 -36.3 25.6 -15.7 711 220 B N H <5S+ 0 0 5 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.795 128.5 36.7 -87.7 -29.0 -36.0 25.6 -12.0 712 221 B L H < S+ 0 0 49 0, 0.0 4,-2.2 0, 0.0 -1,-0.3 0.795 109.6 54.1 -64.0 -29.9 -42.4 23.5 -9.5 717 226 B M H X S+ 0 0 4 -4,-1.2 4,-3.2 -3,-0.5 5,-0.4 0.894 105.2 53.4 -70.0 -34.8 -45.3 23.2 -12.0 718 227 B I H X>S+ 0 0 2 -4,-2.1 5,-3.1 1,-0.2 4,-1.5 0.867 110.1 48.5 -65.0 -39.1 -44.4 19.5 -12.6 719 228 B V H <>S+ 0 0 33 -4,-1.4 5,-2.3 3,-0.2 -1,-0.2 0.961 121.6 32.8 -65.5 -50.9 -44.5 18.8 -8.8 720 229 B E H <5S+ 0 0 122 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.830 130.2 31.9 -81.2 -28.7 -47.8 20.5 -8.2 721 230 B S H <5S+ 0 0 15 -4,-3.2 -3,-0.2 -5,-0.2 -1,-0.2 0.598 132.8 19.2-107.4 -14.1 -49.6 19.7 -11.5 722 231 B I T X5S+ 0 0 0 -4,-1.5 4,-2.2 -5,-0.4 -3,-0.2 0.688 123.2 42.2-118.0 -59.4 -48.2 16.4 -12.6 723 232 B F H > S+ 0 0 30 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.897 109.1 55.1 -64.8 -34.4 -52.3 14.8 -9.1 726 235 B L H X S+ 0 0 1 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.893 105.8 51.6 -62.4 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