==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 22-APR-11 3RNF . COMPND 2 MOLECULE: TOLUENE O-XYLENE MONOOXYGENASE COMPONENT; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS SP. OX1; . AUTHOR G.GUCINSKI,W.J.SONG,S.J.LIPPARD,M.H.SAZINSKY . 899 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32068.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 665 74.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 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 . 2 0.2 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 . 22 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 123 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 426 47.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 40 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 5 1 2 5 3 5 4 2 0 3 1 0 0 1 1 0 0 0 2 0 1 1 1 0 1 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 . 4 1 1 0 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 . 1 0 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 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 S 0 0 71 0, 0.0 2,-0.4 0, 0.0 589,-0.2 0.000 360.0 360.0 360.0 160.8 -97.9 5.2 1.6 2 3 A M - 0 0 85 588,-0.1 2,-0.1 586,-0.0 581,-0.0 -0.879 360.0-118.7-108.4 142.0 -95.8 2.1 2.5 3 4 A L - 0 0 33 -2,-0.4 2,-0.3 1,-0.1 584,-0.0 -0.347 34.6-104.7 -60.1 160.5 -95.9 0.0 5.7 4 5 A K >> - 0 0 128 1,-0.1 3,-1.4 -2,-0.1 4,-0.6 -0.702 29.0-117.5 -86.4 144.3 -92.7 -0.3 7.8 5 6 A R H >> S+ 0 0 81 -2,-0.3 4,-1.8 1,-0.3 3,-1.3 0.847 110.6 56.5 -48.8 -49.3 -90.9 -3.6 7.5 6 7 A E H 34 S+ 0 0 113 1,-0.3 4,-0.4 2,-0.2 -1,-0.3 0.747 97.1 63.5 -59.6 -28.7 -91.4 -4.5 11.2 7 8 A D H <4 S+ 0 0 79 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.750 122.0 15.6 -72.5 -22.6 -95.2 -4.1 11.1 8 9 A W H XX S+ 0 0 14 -3,-1.3 3,-1.3 -4,-0.6 4,-0.7 0.459 95.2 100.0-125.9 -6.8 -95.7 -7.0 8.6 9 10 A Y H >X S+ 0 0 7 -4,-1.8 3,-1.4 1,-0.3 4,-0.6 0.867 77.6 60.4 -54.5 -45.4 -92.4 -9.0 8.6 10 11 A D H >4 S+ 0 0 92 -4,-0.4 3,-0.8 1,-0.3 -1,-0.3 0.767 95.5 61.7 -54.4 -33.9 -93.7 -11.7 11.0 11 12 A L H X4 S+ 0 0 6 -3,-1.3 3,-1.1 1,-0.2 -1,-0.3 0.771 92.5 66.1 -64.6 -27.9 -96.5 -12.7 8.6 12 13 A T H << S+ 0 0 6 -3,-1.4 -1,-0.2 -4,-0.7 -2,-0.2 0.834 111.7 34.5 -62.3 -29.0 -93.8 -13.7 5.9 13 14 A R T << S+ 0 0 36 -3,-0.8 2,-0.9 -4,-0.6 3,-0.3 -0.008 86.2 101.9-114.6 26.6 -92.7 -16.5 8.3 14 15 A T < + 0 0 56 -3,-1.1 -1,-0.1 1,-0.2 -3,-0.1 -0.689 50.5 118.1-100.3 73.4 -96.1 -17.5 9.8 15 16 A T + 0 0 0 -2,-0.9 2,-0.2 603,-0.1 -1,-0.2 0.360 29.7 109.6-127.4 -3.6 -96.1 -20.5 7.5 16 17 A N + 0 0 6 -3,-0.3 2,-0.3 24,-0.0 599,-0.0 -0.568 39.8 172.4 -78.1 145.9 -96.2 -23.6 9.6 17 18 A W - 0 0 7 -2,-0.2 -2,-0.0 598,-0.1 658,-0.0 -0.900 39.9-100.4-145.3 171.2 -99.4 -25.7 9.7 18 19 A T - 0 0 76 -2,-0.3 5,-0.0 2,-0.0 -2,-0.0 -0.867 41.4-136.0-103.0 104.1 -100.5 -29.1 11.1 19 20 A P + 0 0 17 0, 0.0 5,-0.2 0, 0.0 670,-0.1 -0.229 30.8 168.9 -64.9 152.1 -100.5 -31.6 8.2 20 21 A K S S+ 0 0 143 668,-0.1 3,-0.1 3,-0.1 669,-0.1 0.550 70.0 55.3-134.7 -28.5 -103.4 -33.9 8.0 21 22 A Y S S+ 0 0 54 667,-0.2 2,-0.3 1,-0.1 668,-0.1 0.629 124.0 18.6 -89.8 -9.2 -103.4 -35.7 4.6 22 23 A V S S- 0 0 11 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.906 96.2 -99.8-144.9 165.1 -99.8 -37.0 5.3 23 24 A T > - 0 0 78 -2,-0.3 4,-2.4 1,-0.1 3,-0.2 -0.465 27.3-111.8 -89.6 168.2 -98.0 -37.2 8.7 24 25 A E H > S+ 0 0 66 1,-0.2 4,-2.7 2,-0.2 -1,-0.1 0.895 118.5 51.6 -60.7 -40.1 -95.5 -34.7 10.1 25 26 A N H 4 S+ 0 0 112 1,-0.2 -1,-0.2 2,-0.2 5,-0.2 0.770 109.7 49.7 -72.3 -29.6 -92.7 -37.3 9.8 26 27 A E H 4 S+ 0 0 93 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.2 0.896 114.1 43.9 -68.9 -46.3 -93.6 -37.9 6.2 27 28 A L H < S+ 0 0 2 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.839 128.6 29.8 -66.8 -34.8 -93.6 -34.2 5.3 28 29 A F S < S- 0 0 6 -4,-2.7 -1,-0.3 -5,-0.2 7,-0.2 -0.670 84.3-158.5-124.0 72.6 -90.4 -33.6 7.4 29 30 A P >> - 0 0 16 0, 0.0 4,-2.4 0, 0.0 3,-1.9 -0.284 20.9-129.1 -57.1 133.7 -88.4 -36.9 7.2 30 31 A E H 3> S+ 0 0 86 1,-0.3 4,-2.1 2,-0.2 6,-0.2 0.841 105.8 60.1 -56.7 -34.8 -86.0 -36.8 10.2 31 32 A E H 34 S+ 0 0 98 1,-0.2 -1,-0.3 2,-0.2 508,-0.1 0.700 116.6 33.4 -67.4 -22.5 -82.9 -37.7 8.0 32 33 A M H <4 S+ 0 0 1 -3,-1.9 152,-3.0 151,-0.1 -2,-0.2 0.755 128.0 35.4 -97.9 -31.3 -83.5 -34.4 6.0 33 34 A S H < S- 0 0 1 -4,-2.4 152,-1.1 150,-0.3 85,-0.3 0.798 75.8-157.3 -95.7 -38.9 -84.9 -32.1 8.8 34 35 A G < + 0 0 0 -4,-2.1 -4,-0.1 -5,-0.3 -3,-0.1 0.780 30.6 157.6 64.0 33.0 -83.0 -33.0 11.8 35 36 A A > - 0 0 2 -7,-0.2 3,-1.9 1,-0.1 -1,-0.1 0.707 37.7-149.9 -64.0 -22.1 -85.7 -31.7 14.2 36 37 A R T 3 - 0 0 54 1,-0.3 3,-0.1 -6,-0.2 -1,-0.1 0.796 61.1 -56.3 63.5 35.2 -84.2 -34.1 16.8 37 38 A G T 3 S+ 0 0 85 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.364 105.0 130.1 76.5 -2.9 -87.5 -34.8 18.8 38 39 A I < - 0 0 11 -3,-1.9 -1,-0.3 1,-0.1 206,-0.0 -0.694 61.4-114.1 -81.7 130.5 -87.9 -31.0 19.4 39 40 A S > - 0 0 66 -2,-0.4 4,-2.3 -3,-0.1 3,-0.4 -0.198 13.8-112.4 -70.1 157.3 -91.5 -30.0 18.4 40 41 A M H > S+ 0 0 16 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.921 119.0 54.2 -45.3 -50.4 -92.7 -27.7 15.6 41 42 A E H 4 S+ 0 0 154 1,-0.2 -1,-0.2 2,-0.2 4,-0.2 0.876 107.8 47.7 -57.1 -40.9 -93.8 -25.2 18.3 42 43 A A H >4 S+ 0 0 19 -3,-0.4 3,-1.1 1,-0.2 -1,-0.2 0.845 108.5 55.9 -70.9 -35.5 -90.3 -25.0 19.9 43 44 A W H >< S+ 0 0 3 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.789 93.8 69.5 -64.7 -28.1 -88.7 -24.6 16.4 44 45 A E T 3< S+ 0 0 74 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.557 79.7 76.3 -67.9 -8.9 -90.9 -21.5 15.8 45 46 A K T < + 0 0 173 -3,-1.1 -1,-0.3 -4,-0.2 -2,-0.2 0.708 68.3 120.7 -70.5 -14.8 -88.9 -19.7 18.5 46 47 A Y < + 0 0 9 -3,-1.8 2,-0.4 -4,-0.2 75,-0.2 -0.259 40.7 178.4 -51.8 124.4 -86.2 -19.4 15.8 47 48 A D - 0 0 83 74,-0.1 -1,-0.1 75,-0.0 -2,-0.0 -0.798 19.7-148.3-138.9 95.8 -85.6 -15.7 15.2 48 49 A E - 0 0 1 -2,-0.4 188,-0.1 1,-0.1 3,-0.0 -0.305 8.1-147.3 -62.0 135.8 -83.0 -14.6 12.7 49 50 A P S S+ 0 0 79 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.815 84.2 60.1 -80.9 -24.1 -81.4 -11.4 13.8 50 51 A Y S S- 0 0 143 181,-0.2 2,-0.2 182,-0.1 185,-0.1 -0.896 76.8-166.4-103.1 112.5 -80.8 -9.9 10.3 51 52 A K + 0 0 60 -2,-0.6 2,-0.3 -3,-0.0 181,-0.0 -0.637 14.8 162.1-101.5 150.2 -84.1 -9.5 8.5 52 53 A I - 0 0 17 -2,-0.2 2,-0.3 -43,-0.1 76,-0.1 -0.955 20.0-146.2-160.8 156.1 -84.8 -8.9 4.8 53 54 A T >> - 0 0 5 -2,-0.3 4,-2.6 1,-0.1 3,-0.6 -0.850 34.5 -97.6-125.2 163.0 -87.7 -9.2 2.4 54 55 A Y H 3> S+ 0 0 3 -2,-0.3 4,-2.2 1,-0.2 5,-0.3 0.849 119.1 45.6 -46.4 -54.5 -88.1 -10.0 -1.3 55 56 A P H 3> S+ 0 0 19 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.843 113.9 49.2 -65.6 -34.9 -88.3 -6.5 -2.7 56 57 A E H <> S+ 0 0 63 -3,-0.6 4,-2.5 2,-0.2 5,-0.3 0.900 111.6 52.1 -62.6 -40.8 -85.4 -5.3 -0.6 57 58 A Y H X S+ 0 0 3 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.969 110.3 43.9 -61.4 -54.9 -83.3 -8.3 -1.7 58 59 A V H X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.2 518,-0.2 0.833 117.3 46.6 -66.0 -31.8 -83.8 -7.9 -5.5 59 60 A S H X S+ 0 0 53 -4,-1.4 4,-1.9 -5,-0.3 -1,-0.2 0.962 115.7 42.8 -73.2 -51.0 -83.2 -4.1 -5.3 60 61 A I H X S+ 0 0 82 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.909 118.6 46.4 -63.0 -37.2 -80.0 -4.3 -3.1 61 62 A Q H X S+ 0 0 0 -4,-2.9 4,-1.8 -5,-0.3 -1,-0.2 0.806 106.2 57.5 -81.4 -30.2 -78.6 -7.3 -5.1 62 63 A R H X S+ 0 0 83 -4,-1.4 4,-2.5 -5,-0.3 -1,-0.2 0.948 107.8 48.9 -56.6 -50.5 -79.3 -5.7 -8.5 63 64 A E H X S+ 0 0 121 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.892 106.5 57.4 -62.6 -35.3 -77.1 -2.8 -7.4 64 65 A K H X S+ 0 0 41 -4,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.925 110.7 41.8 -59.5 -48.2 -74.3 -5.2 -6.3 65 66 A D H X S+ 0 0 4 -4,-1.8 4,-2.8 2,-0.2 5,-0.5 0.899 109.2 58.6 -67.1 -41.1 -74.0 -6.8 -9.7 66 67 A S H X S+ 0 0 48 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.942 112.9 41.4 -48.4 -50.4 -74.3 -3.5 -11.5 67 68 A G H X S+ 0 0 36 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.908 117.6 43.8 -65.3 -52.5 -71.2 -2.3 -9.5 68 69 A A H X S+ 0 0 6 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.874 117.2 44.7 -63.9 -45.3 -69.1 -5.5 -9.7 69 70 A Y H X S+ 0 0 33 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.853 112.4 53.2 -71.9 -31.8 -69.8 -6.2 -13.4 70 71 A S H X S+ 0 0 77 -4,-1.8 4,-2.2 -5,-0.5 -2,-0.2 0.883 109.5 48.2 -63.8 -44.5 -69.2 -2.5 -14.3 71 72 A I H X S+ 0 0 59 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.927 112.2 50.1 -59.1 -46.7 -65.8 -2.6 -12.5 72 73 A K H X S+ 0 0 17 -4,-2.0 4,-0.9 1,-0.2 3,-0.4 0.924 112.4 45.9 -62.9 -48.8 -64.9 -5.7 -14.3 73 74 A A H < S+ 0 0 72 -4,-2.4 4,-0.4 1,-0.2 3,-0.4 0.851 111.4 51.7 -62.8 -37.2 -65.8 -4.3 -17.8 74 75 A A H < S+ 0 0 87 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.753 118.4 37.2 -67.9 -31.1 -64.0 -1.0 -17.2 75 76 A L H >< S+ 0 0 60 -4,-1.5 3,-0.6 -3,-0.4 5,-0.5 0.441 91.0 92.6 -98.6 -6.0 -60.7 -2.7 -16.2 76 77 A E G >< S+ 0 0 92 -4,-0.9 3,-1.2 -3,-0.4 -2,-0.1 0.879 83.1 50.0 -67.9 -40.2 -60.8 -5.7 -18.6 77 78 A R G 3 S+ 0 0 242 -4,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.745 97.1 70.4 -69.9 -20.3 -58.8 -4.2 -21.5 78 79 A D G < S- 0 0 90 -3,-0.6 -1,-0.2 -4,-0.1 -2,-0.2 0.712 91.0-149.2 -69.5 -17.4 -56.0 -3.1 -19.1 79 80 A G X + 0 0 11 -3,-1.2 3,-1.2 -4,-0.4 4,-0.4 0.865 29.1 169.6 51.6 45.7 -55.1 -6.7 -18.7 80 81 A F G >> S+ 0 0 38 -5,-0.5 3,-1.7 1,-0.2 4,-1.2 0.829 70.6 68.0 -51.7 -36.5 -53.8 -6.5 -15.2 81 82 A V G 34 S+ 0 0 22 1,-0.2 3,-0.4 2,-0.2 -1,-0.2 0.876 92.6 61.3 -56.2 -36.2 -53.6 -10.3 -14.9 82 83 A D G <4 S+ 0 0 109 -3,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.584 115.0 31.7 -69.2 -9.7 -50.7 -10.3 -17.6 83 84 A R T <4 S+ 0 0 148 -3,-1.7 -1,-0.2 -4,-0.4 -2,-0.2 0.413 91.3 119.1-127.6 1.9 -48.4 -8.2 -15.3 84 85 A A S < S- 0 0 13 -4,-1.2 131,-0.1 -3,-0.4 5,-0.1 -0.225 80.0 -86.7 -59.6 148.6 -49.5 -9.4 -11.8 85 86 A D >> - 0 0 58 129,-0.3 4,-2.0 1,-0.1 3,-1.1 -0.372 38.5-128.0 -50.7 133.8 -47.1 -11.0 -9.5 86 87 A P H 3> S+ 0 0 50 0, 0.0 4,-2.3 0, 0.0 258,-0.2 0.803 110.2 60.9 -70.9 -21.6 -47.2 -14.7 -10.4 87 88 A G H 3> S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 259,-0.1 0.833 107.3 48.5 -60.0 -35.9 -47.8 -15.6 -6.7 88 89 A W H <> S+ 0 0 12 -3,-1.1 4,-2.0 2,-0.2 5,-0.2 0.906 108.8 50.7 -67.0 -46.3 -51.0 -13.5 -7.2 89 90 A V H X S+ 0 0 27 -4,-2.0 4,-2.4 1,-0.2 3,-0.2 0.958 111.7 49.0 -56.4 -45.5 -52.0 -15.2 -10.4 90 91 A S H X S+ 0 0 3 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.894 105.8 57.2 -62.3 -40.8 -51.6 -18.5 -8.6 91 92 A T H X S+ 0 0 2 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.899 110.7 44.1 -56.7 -41.1 -53.7 -17.3 -5.7 92 93 A M H X S+ 0 0 5 -4,-2.0 4,-2.8 -3,-0.2 5,-0.3 0.890 111.0 51.8 -73.9 -38.8 -56.6 -16.6 -8.0 93 94 A Q H X S+ 0 0 13 -4,-2.4 4,-2.0 -5,-0.2 -2,-0.2 0.922 113.5 45.6 -65.7 -40.6 -56.3 -19.9 -10.0 94 95 A L H X S+ 0 0 9 -4,-2.7 4,-2.7 -5,-0.2 5,-0.3 0.966 113.2 51.3 -59.9 -51.7 -56.3 -21.8 -6.8 95 96 A H H X S+ 0 0 13 -4,-2.4 4,-1.8 -5,-0.2 5,-0.4 0.938 112.0 43.9 -53.0 -57.0 -59.3 -19.8 -5.5 96 97 A F H X S+ 0 0 6 -4,-2.8 4,-1.9 1,-0.2 5,-0.3 0.895 115.5 48.1 -59.6 -42.7 -61.5 -20.2 -8.5 97 98 A G H < S+ 0 0 1 -4,-2.0 4,-0.3 -5,-0.3 64,-0.3 0.918 116.6 41.3 -64.9 -46.7 -60.8 -23.9 -8.9 98 99 A A H < S+ 0 0 6 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.755 127.4 26.9 -70.9 -26.7 -61.4 -24.8 -5.2 99 100 A I H X S+ 0 0 27 -4,-1.8 4,-3.0 -5,-0.3 3,-0.5 0.781 94.1 77.6-114.0 -38.2 -64.5 -22.6 -4.6 100 101 A A H X S+ 0 0 0 -4,-1.9 4,-1.8 -5,-0.4 40,-0.1 0.879 105.1 37.1 -53.5 -49.8 -66.7 -21.8 -7.7 101 102 A L H > S+ 0 0 1 -4,-0.3 4,-2.2 -5,-0.3 -1,-0.3 0.720 115.8 54.5 -74.6 -23.0 -68.5 -25.1 -7.9 102 103 A E H > S+ 0 0 2 -3,-0.5 4,-1.6 2,-0.2 -2,-0.2 0.872 106.1 52.2 -75.4 -37.9 -68.7 -25.5 -4.1 103 104 A E H X S+ 0 0 23 -4,-3.0 4,-1.1 2,-0.2 3,-0.5 0.959 113.8 45.0 -54.0 -51.5 -70.3 -22.1 -3.8 104 105 A Y H >X S+ 0 0 1 -4,-1.8 3,-0.8 -5,-0.3 4,-0.6 0.929 110.1 52.7 -61.8 -43.5 -72.8 -23.4 -6.4 105 106 A A H >X S+ 0 0 6 -4,-2.2 4,-1.2 1,-0.2 3,-0.8 0.785 99.9 66.3 -60.5 -26.7 -73.2 -26.7 -4.6 106 107 A A H 3X S+ 0 0 5 -4,-1.6 4,-3.0 -3,-0.5 3,-0.3 0.897 85.1 68.8 -61.9 -41.9 -74.0 -24.6 -1.5 107 108 A S H > - 0 0 1 1,-0.2 4,-1.7 2,-0.0 3,-0.7 -0.710 69.6-156.1 -81.8 111.4 -88.2 -23.3 11.7 120 121 A P H 3> S+ 0 0 9 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.824 92.7 54.2 -65.4 -31.9 -90.2 -21.1 9.2 121 122 A G H 3> S+ 0 0 2 -75,-0.2 4,-2.1 1,-0.2 5,-0.2 0.832 107.2 52.9 -66.6 -32.1 -87.8 -18.1 9.5 122 123 A N H <> S+ 0 0 2 -3,-0.7 4,-2.4 2,-0.2 -1,-0.2 0.883 105.4 55.5 -66.6 -40.5 -84.9 -20.6 8.7 123 124 A R 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A R H X S+ 0 0 3 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.871 113.5 51.2 -64.8 -38.3 -62.6 -30.0 9.4 264 265 A S H X S+ 0 0 0 -4,-2.3 4,-3.3 -5,-0.2 5,-0.2 0.933 108.8 51.5 -56.8 -52.3 -62.9 -26.3 8.4 265 266 A W H X S+ 0 0 1 -4,-2.4 4,-3.1 1,-0.2 5,-0.3 0.898 106.3 53.4 -56.6 -42.5 -59.5 -25.6 9.9 266 267 A K H X S+ 0 0 10 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.959 114.4 41.0 -66.3 -42.1 -57.8 -28.4 8.1 267 268 A L H X S+ 0 0 16 -4,-1.8 4,-1.9 1,-0.2 3,-0.4 0.945 116.9 50.1 -64.8 -44.6 -59.0 -27.2 4.7 268 269 A F H X>S+ 0 0 8 -4,-3.3 4,-2.3 1,-0.2 5,-1.5 0.890 109.1 50.1 -63.8 -39.6 -58.3 -23.6 5.6 269 270 A S H <5S+ 0 0 0 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.752 112.1 49.7 -71.4 -21.0 -54.8 -24.2 6.8 270 271 A A H <5S+ 0 0 5 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.870 125.4 22.5 -81.9 -35.5 -54.0 -26.1 3.6 271 272 A L H <5S+ 0 0 27 -4,-1.9 4,-0.4 -5,-0.1 -3,-0.2 0.807 131.6 31.2-107.8 -34.0 -55.3 -23.5 1.1 272 273 A T T X5S+ 0 0 20 -4,-2.3 4,-1.7 -5,-0.3 3,-0.2 0.885 110.1 62.0 -90.0 -45.2 -55.3 -20.1 2.8 273 274 A G H >>S+ 0 0 4 0, 0.0 4,-1.9 0, 0.0 5,-1.1 0.868 108.3 60.0 -64.3 -30.2 -49.7 -20.9 2.6 275 276 A I H >>S+ 0 0 19 -4,-0.4 5,-2.1 -3,-0.2 4,-1.0 0.946 109.0 40.6 -59.7 -46.8 -51.2 -18.0 0.6 276 277 A M H <5S+ 0 0 20 -4,-1.7 -1,-0.2 1,-0.2 -3,-0.1 0.875 122.6 38.3 -70.8 -40.1 -50.6 -15.5 3.3 277 278 A D H <5S+ 0 0 0 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.594 134.0 12.7 -91.4 -9.1 -47.2 -16.7 4.5 278 279 A Y H <5S+ 0 0 2 -4,-1.9 -3,-0.2 -5,-0.2 -2,-0.2 0.629 120.4 46.8-139.4 -34.1 -45.7 -17.6 1.0 279 280 A Y T < - 0 0 29 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.222 32.0-110.9 -58.4 148.5 -45.0 -10.8 -1.8 282 283 A L G > S+ 0 0 50 1,-0.3 3,-1.8 2,-0.2 -2,-0.1 0.851 114.9 52.7 -45.8 -51.8 -43.0 -9.9 1.4 283 284 A E G 3 S+ 0 0 158 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.549 106.3 56.8 -73.4 -4.9 -43.6 -6.2 1.4 284 285 A S G < S+ 0 0 24 -3,-1.9 2,-0.9 -70,-0.0 -1,-0.3 0.342 76.5 114.6 -99.9 5.0 -47.4 -6.8 1.0 285 286 A R < + 0 0 25 -3,-1.8 3,-0.1 -4,-0.2 -8,-0.0 -0.671 38.0 179.6 -90.6 109.5 -47.8 -8.9 4.2 286 287 A N S S- 0 0 133 -2,-0.9 2,-0.3 1,-0.2 -1,-0.2 0.900 70.5 -22.7 -68.7 -45.6 -49.9 -7.1 6.6 287 288 A Q S S- 0 0 18 -11,-0.1 -1,-0.2 0, 0.0 2,-0.2 -0.925 76.9 -85.1-157.8 172.2 -49.6 -9.9 9.2 288 289 A S > - 0 0 1 -2,-0.3 4,-3.3 -3,-0.1 5,-0.2 -0.486 38.5-109.1 -84.7 160.5 -48.9 -13.6 9.4 289 290 A F H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.907 123.1 48.9 -47.5 -50.0 -51.3 -16.5 8.9 290 291 A K H > S+ 0 0 54 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.889 110.9 49.4 -61.0 -46.3 -51.1 -17.2 12.7 291 292 A E H > S+ 0 0 71 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.894 110.2 51.9 -55.7 -43.3 -51.6 -13.5 13.5 292 293 A F H X S+ 0 0 9 -4,-3.3 4,-3.0 1,-0.2 5,-0.5 0.946 110.8 48.7 -58.5 -47.1 -54.6 -13.4 11.2 293 294 A M H X>S+ 0 0 0 -4,-2.3 5,-3.1 -5,-0.2 4,-1.3 0.867 113.8 44.3 -59.6 -45.1 -56.0 -16.5 13.0 294 295 A L H <>S+ 0 0 78 -4,-2.3 5,-0.8 3,-0.2 -1,-0.2 0.901 120.9 39.2 -71.9 -39.4 -55.5 -15.1 16.5 295 296 A E H <5S+ 0 0 98 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.923 130.8 19.7 -74.4 -45.8 -56.9 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110.6 51.6 -67.0 -19.7 -72.7 -16.4 24.1 308 309 A L T 3<5S- 0 0 12 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.401 113.2-113.0 -96.5 0.3 -74.3 -19.7 23.1 309 310 A G T < 5S+ 0 0 46 -3,-1.7 -3,-0.2 -4,-0.3 2,-0.2 0.712 77.8 126.5 76.5 15.9 -73.8 -21.6 26.4 310 311 A L < - 0 0 10 -5,-2.5 -1,-0.3 -6,-0.2 2,-0.2 -0.574 54.7-120.2-101.6 169.7 -71.3 -23.9 24.6 311 312 A D - 0 0 103 -2,-0.2 3,-0.1 -3,-0.1 -1,-0.0 -0.713 31.7 -91.5-103.9 158.5 -67.6 -24.9 25.5 312 313 A K - 0 0 125 -2,-0.2 -1,-0.1 1,-0.1 -54,-0.1 -0.492 61.8 -96.6 -55.0 132.3 -64.3 -24.5 23.7 313 314 A P > - 0 0 3 0, 0.0 3,-2.4 0, 0.0 -1,-0.1 -0.261 33.4-108.4 -53.2 146.7 -63.9 -27.8 21.7 314 315 A W T 3 S+ 0 0 126 1,-0.3 3,-0.4 2,-0.1 4,-0.2 0.750 118.1 53.1 -46.8 -25.3 -61.7 -30.4 23.5 315 316 A Y T 3> S+ 0 0 6 1,-0.2 4,-2.7 2,-0.1 -1,-0.3 0.321 72.5 113.3-102.0 6.6 -58.8 -29.9 21.0 316 317 A W H <> S+ 0 0 7 -3,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.839 76.7 47.6 -49.4 -45.1 -58.6 -26.1 21.4 317 318 A D H > S+ 0 0 125 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.910 113.7 47.5 -64.8 -41.9 -55.1 -26.0 23.0 318 319 A Q H > S+ 0 0 79 -3,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.924 109.9 55.0 -60.3 -42.1 -53.7 -28.4 20.4 319 320 A F H X S+ 0 0 1 -4,-2.7 4,-1.0 1,-0.2 -2,-0.2 0.931 106.7 50.0 -63.7 -44.9 -55.4 -26.2 17.7 320 321 A M H >< S+ 0 0 51 -4,-2.5 3,-0.7 1,-0.2 -1,-0.2 0.905 110.8 48.6 -55.0 -48.6 -53.6 -23.1 19.1 321 322 A Q H >< S+ 0 0 117 -4,-2.0 3,-2.2 1,-0.2 4,-0.2 0.934 104.0 62.0 -58.0 -44.4 -50.2 -24.9 19.0 322 323 A D H >X S+ 0 0 10 -4,-2.9 3,-2.2 1,-0.3 4,-2.0 0.739 83.4 78.6 -59.6 -22.8 -50.9 -26.0 15.4 323 324 A L T << S+ 0 0 1 -4,-1.0 -1,-0.3 -3,-0.7 -33,-0.2 0.731 93.2 51.2 -53.9 -23.7 -51.0 -22.4 14.3 324 325 A D T <4 S+ 0 0 48 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.533 127.6 16.0 -87.3 -9.2 -47.2 -22.4 14.3 325 326 A E T X> S+ 0 0 40 -3,-2.2 4,-1.6 -4,-0.2 3,-0.6 0.746 97.1 74.3-129.2 -53.8 -47.0 -25.6 12.2 326 327 A T H >X S+ 0 0 11 -4,-2.0 4,-1.8 1,-0.3 3,-0.7 0.914 101.6 45.7 -52.6 -51.6 -49.8 -27.1 10.1 327 328 A H H 3> S+ 0 0 0 -5,-0.4 4,-2.6 1,-0.3 -1,-0.3 0.796 106.1 60.1 -68.9 -29.1 -49.8 -24.7 7.2 328 329 A H H <> S+ 0 0 0 -3,-0.6 4,-2.2 1,-0.2 -1,-0.3 0.900 109.0 46.7 -60.1 -38.8 -46.0 -24.7 6.9 329 330 A G H < S+ 0 0 0 -4,-3.1 3,-1.8 -5,-0.2 -2,-0.2 0.959 115.5 45.6 -64.6 -47.2 -44.7 -27.0 -3.4 336 337 A Y H 3< S+ 0 0 0 -4,-3.1 -2,-0.2 -5,-0.3 -1,-0.2 0.935 121.9 38.3 -64.6 -41.6 -42.8 -30.3 -3.3 337 338 A W T >< S+ 0 0 16 -4,-2.8 3,-2.9 -5,-0.2 -1,-0.3 -0.002 81.2 139.4 -89.0 29.6 -45.7 -32.1 -5.0 338 339 A R G X + 0 0 2 -3,-1.8 3,-1.5 1,-0.3 140,-0.9 0.725 58.7 64.3 -52.7 -32.4 -46.3 -29.1 -7.3 339 340 A P G 3 S+ 0 0 30 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.696 95.2 65.2 -67.3 -8.2 -46.9 -31.1 -10.5 340 341 A T G < S+ 0 0 19 -3,-2.9 -173,-0.4 -6,-0.2 -174,-0.3 0.365 93.7 66.1 -94.5 7.7 -50.0 -32.4 -8.7 341 342 A V S < S- 0 0 0 -3,-1.5 137,-1.6 2,-0.2 -247,-0.0 -0.786 79.6-126.0-121.0 168.8 -51.9 -29.1 -8.4 342 343 A W S S+ 0 0 2 -2,-0.3 2,-0.2 135,-0.2 -186,-0.1 0.335 89.1 57.5-102.3 6.1 -53.4 -26.9 -11.1 343 344 A W S S- 0 0 2 -5,-0.1 -2,-0.2 -250,-0.0 -253,-0.1 -0.791 91.1-102.2-121.4 172.0 -51.7 -23.6 -10.1 344 345 A D - 0 0 41 -2,-0.2 -254,-0.2 134,-0.2 136,-0.1 -0.833 36.0-138.3 -98.8 111.3 -48.0 -22.8 -9.7 345 346 A P - 0 0 0 0, 0.0 136,-2.6 0, 0.0 2,-0.7 -0.362 9.7-133.1 -65.4 139.1 -46.9 -22.8 -6.0 346 347 A A - 0 0 2 134,-0.2 -11,-0.1 135,-0.2 134,-0.1 -0.827 6.6-150.4 -91.5 120.7 -44.6 -20.0 -4.9 347 348 A A - 0 0 1 -2,-0.7 -1,-0.2 1,-0.1 -68,-0.1 0.899 16.9-167.4 -52.6 -48.5 -41.7 -21.4 -2.8 348 349 A G + 0 0 4 1,-0.1 -1,-0.1 -3,-0.1 -69,-0.1 0.820 44.8 119.5 64.6 33.9 -41.4 -18.2 -0.7 349 350 A V + 0 0 0 4,-0.1 -1,-0.1 23,-0.0 -71,-0.0 -0.227 27.5 139.5-128.9 43.9 -38.0 -19.0 0.9 350 351 A S S > S- 0 0 18 1,-0.1 4,-3.0 139,-0.0 5,-0.2 -0.388 71.2 -98.7 -71.2 165.2 -35.7 -16.1 -0.2 351 352 A P H > S+ 0 0 48 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.914 126.5 45.6 -55.4 -42.9 -33.3 -14.8 2.4 352 353 A E H > S+ 0 0 105 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.925 112.5 50.3 -70.7 -39.7 -35.6 -11.9 3.2 353 354 A E H > S+ 0 0 30 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.918 109.1 53.9 -60.6 -37.9 -38.7 -14.1 3.3 354 355 A R H X S+ 0 0 22 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.834 106.6 49.9 -71.6 -31.7 -36.9 -16.5 5.7 355 356 A E H X S+ 0 0 127 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.898 110.7 49.9 -69.8 -36.6 -36.1 -13.7 8.1 356 357 A W H X S+ 0 0 26 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.973 111.7 49.4 -59.1 -49.2 -39.8 -12.6 8.0 357 358 A L H X S+ 0 0 0 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.896 109.5 51.9 -56.6 -42.7 -40.7 -16.3 8.7 358 359 A E H < S+ 0 0 62 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.875 111.7 45.8 -65.0 -38.4 -38.2 -16.4 11.6 359 360 A E H < S+ 0 0 147 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.916 117.4 43.9 -65.8 -46.9 -39.7 -13.2 13.2 360 361 A K H < S+ 0 0 46 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.771 130.7 22.4 -69.3 -29.1 -43.3 -14.5 12.7 361 362 A Y S >< S- 0 0 7 -4,-2.4 3,-2.0 -5,-0.3 -1,-0.3 -0.709 81.2-146.7-141.9 84.7 -42.5 -18.0 13.9 362 363 A P T 3 S+ 0 0 110 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.336 88.6 32.5 -56.0 128.2 -39.3 -18.3 16.1 363 364 A G T 3> S+ 0 0 18 -5,-0.1 4,-1.2 4,-0.0 5,-0.2 0.261 81.2 120.1 108.7 -7.4 -37.7 -21.7 15.4 364 365 A W T <4>S+ 0 0 2 -3,-2.0 5,-3.4 1,-0.2 3,-0.3 0.892 74.9 46.8 -59.5 -42.8 -38.7 -21.8 11.7 365 366 A N T 45S+ 0 0 42 1,-0.2 -1,-0.2 3,-0.2 5,-0.2 0.870 111.6 52.0 -70.1 -36.1 -35.2 -22.0 10.2 366 367 A D T 45S+ 0 0 63 3,-0.2 43,-2.5 -3,-0.1 -1,-0.2 0.626 128.6 18.9 -68.5 -22.7 -34.2 -24.7 12.7 367 368 A T T >X5S+ 0 0 6 -4,-1.2 3,-0.7 -3,-0.3 4,-0.6 0.684 138.1 20.0-110.4 -84.5 -37.2 -26.7 11.7 368 369 A W H >>5S+ 0 0 2 -4,-0.3 4,-1.5 1,-0.2 3,-0.7 0.869 119.0 65.0 -51.9 -46.7 -38.9 -26.0 8.4 369 370 A G H 3> S+ 0 0 38 -3,-0.7 4,-1.9 -6,-0.3 -1,-0.2 0.923 103.7 42.9 -55.5 -49.1 -33.8 -27.5 7.3 371 372 A C H S+ 0 0 14 -4,-2.1 5,-3.4 -5,-0.2 -1,-0.2 0.863 111.0 46.5 -60.6 -37.6 -30.0 -29.1 -4.9 379 380 A L H ><5S+ 0 0 24 -4,-1.6 3,-1.3 -3,-0.2 -2,-0.2 0.940 113.2 48.9 -71.0 -43.9 -31.3 -26.2 -7.0 380 381 A V H 3<5S+ 0 0 51 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.927 114.6 47.8 -55.7 -44.7 -28.0 -24.2 -6.6 381 382 A N T 3<5S- 0 0 110 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.201 118.8-107.4 -88.5 12.7 -26.0 -27.4 -7.6 382 383 A G T < 5S+ 0 0 55 -3,-1.3 -3,-0.2 1,-0.1 3,-0.1 0.852 81.8 122.2 66.8 38.5 -28.1 -28.4 -10.6 383 384 A K > < + 0 0 99 -5,-3.4 3,-1.8 -6,-0.1 4,-0.2 -0.495 19.4 153.4-122.6 60.3 -30.0 -31.4 -9.2 384 385 A P G > + 0 0 66 0, 0.0 3,-2.1 0, 0.0 4,-0.2 0.773 64.0 73.6 -62.3 -22.6 -33.6 -30.2 -9.8 385 386 A E G > S+ 0 0 106 1,-0.3 3,-0.8 2,-0.2 -6,-0.0 0.740 87.7 60.4 -64.2 -22.3 -34.8 -33.8 -10.0 386 387 A L G < S+ 0 0 38 -3,-1.8 -1,-0.3 1,-0.2 -8,-0.1 0.515 96.3 64.1 -82.8 -0.9 -34.3 -34.2 -6.2 387 388 A T G < S+ 0 0 0 -3,-2.1 -1,-0.2 -4,-0.2 -2,-0.2 0.314 96.4 62.3-102.8 4.5 -36.9 -31.3 -5.7 388 389 A V S < S- 0 0 48 -3,-0.8 -51,-0.1 -4,-0.2 -52,-0.1 -0.967 88.8-109.4-127.4 150.0 -39.8 -33.4 -7.2 389 390 A P - 0 0 21 0, 0.0 -2,-0.1 0, 0.0 463,-0.0 -0.299 17.7-165.7 -87.4 162.8 -41.2 -36.6 -5.8 390 391 A E S S+ 0 0 91 462,-0.1 2,-0.3 -2,-0.1 73,-0.1 0.148 78.9 37.5-123.5 12.1 -41.1 -40.3 -6.9 391 392 A T S S- 0 0 11 461,-0.1 443,-0.1 71,-0.1 71,-0.0 -0.900 85.8 -97.3-146.1 178.3 -43.7 -41.5 -4.5 392 393 A L - 0 0 22 -2,-0.3 441,-2.5 441,-0.2 2,-0.1 -0.788 35.8-121.4 -95.1 141.7 -47.1 -40.4 -3.0 393 394 A P B -A 832 0A 17 0, 0.0 439,-0.3 0, 0.0 2,-0.2 -0.502 38.2 -95.2 -72.7 155.6 -47.3 -38.9 0.5 394 395 A T - 0 0 0 437,-3.0 9,-2.0 9,-0.2 2,-0.4 -0.527 45.8-144.7 -62.1 136.7 -49.4 -40.7 3.0 395 396 A I B -F 402 0B 11 7,-0.2 31,-0.3 -2,-0.2 2,-0.2 -0.860 12.5-113.5-112.2 139.6 -52.9 -39.1 3.1 396 397 A C > - 0 0 0 5,-3.3 4,-1.2 -2,-0.4 31,-0.3 -0.454 16.4-143.5 -62.2 127.6 -55.2 -38.5 6.0 397 398 A N T 4 S+ 0 0 10 29,-3.7 30,-0.1 -2,-0.2 -1,-0.1 0.642 97.9 41.4 -68.4 -14.4 -58.4 -40.7 5.7 398 399 A M T 4 S+ 0 0 1 28,-0.3 -1,-0.1 3,-0.1 29,-0.1 0.864 129.0 20.8 -93.0 -66.0 -60.5 -37.8 7.2 399 400 A C T 4 S- 0 0 5 2,-0.1 -225,-0.2 1,-0.1 -2,-0.1 0.615 90.7-135.8 -84.3 -10.3 -59.2 -34.5 5.7 400 401 A N < + 0 0 4 -4,-1.2 -230,-0.3 1,-0.2 -3,-0.1 0.820 64.4 123.1 59.0 31.0 -57.6 -36.2 2.6 401 402 A L S S- 0 0 1 -231,-0.1 -5,-3.3 1,-0.1 -1,-0.2 -0.823 74.0 -82.8-114.1 160.8 -54.5 -34.0 3.0 402 403 A P B -F 395 0B 10 0, 0.0 2,-0.8 0, 0.0 -7,-0.2 -0.265 42.4-115.9 -59.5 145.7 -50.9 -35.2 3.4 403 404 A I + 0 0 2 -9,-2.0 428,-1.9 428,-0.3 2,-0.3 -0.849 59.4 150.2 -88.5 110.9 -49.9 -36.2 7.0 404 405 A A B +G 830 0C 14 -2,-0.8 2,-0.3 426,-0.2 426,-0.2 -0.950 12.8 143.4-146.1 153.1 -47.2 -33.6 7.7 405 406 A H - 0 0 31 424,-2.8 8,-0.2 -2,-0.3 6,-0.0 -0.953 53.1 -13.7-175.3-166.9 -45.8 -31.7 10.7 406 407 A T + 0 0 8 6,-0.3 6,-3.2 -2,-0.3 7,-0.3 -0.175 59.1 176.7 -60.1 126.7 -42.6 -30.2 12.3 407 408 A P > + 0 0 0 0, 0.0 3,-1.1 0, 0.0 421,-0.2 -0.382 40.6 40.9-109.8-170.5 -39.3 -31.5 10.7 408 409 A G G > S- 0 0 1 419,-2.3 3,-1.1 1,-0.2 -41,-0.3 -0.372 119.6 -4.2 71.7-140.1 -35.6 -30.6 11.3 409 410 A N G 3 S+ 0 0 78 -43,-2.5 -1,-0.2 1,-0.3 -42,-0.2 0.569 139.3 44.0 -73.8 -8.1 -34.3 -30.1 14.8 410 411 A K G < S- 0 0 137 -3,-1.1 -1,-0.3 -44,-0.2 -2,-0.1 -0.223 82.5-172.5-126.6 51.9 -37.7 -30.5 16.5 411 412 A W < + 0 0 53 -3,-1.1 -5,-0.1 1,-0.1 418,-0.1 -0.078 19.9 153.0 -51.3 125.9 -39.0 -33.5 14.6 412 413 A N + 0 0 70 -6,-3.2 2,-0.4 2,-0.0 -6,-0.3 -0.017 8.9 145.9-148.8 36.9 -42.7 -34.1 15.5 413 414 A V + 0 0 4 -7,-0.3 2,-0.4 -8,-0.2 417,-0.1 -0.677 24.2 178.3 -86.7 128.9 -44.5 -35.9 12.6 414 415 A K - 0 0 96 -2,-0.4 2,-0.5 14,-0.2 417,-0.1 -0.985 25.3-149.6-133.4 149.7 -47.1 -38.3 13.8 415 416 A D - 0 0 8 -2,-0.4 2,-1.2 -12,-0.0 13,-0.2 -0.979 10.2-151.6-118.0 126.6 -49.7 -40.7 12.3 416 417 A Y - 0 0 56 11,-2.6 13,-0.2 -2,-0.5 12,-0.0 -0.678 29.4-168.8 -96.7 74.2 -52.9 -41.3 14.3 417 418 A Q - 0 0 5 -2,-1.2 2,-0.3 9,-0.2 9,-0.2 -0.216 11.5-168.8 -72.7 154.7 -53.5 -44.8 13.0 418 419 A L E -H 425 0D 20 7,-2.3 7,-3.2 2,-0.1 2,-0.6 -0.951 13.7-153.0-145.2 124.8 -56.7 -46.7 13.5 419 420 A E E +H 424 0D 107 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.885 27.6 168.4 -92.5 126.7 -57.5 -50.3 12.8 420 421 A Y E > -H 423 0D 64 3,-2.7 3,-1.6 -2,-0.6 -2,-0.1 -0.955 61.2 -18.5-148.9 118.7 -61.2 -50.8 12.1 421 422 A E T 3 S- 0 0 137 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.884 127.0 -48.8 48.0 45.7 -63.1 -53.8 10.7 422 423 A G T 3 S+ 0 0 70 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.394 118.3 103.8 86.9 -3.7 -59.9 -55.3 9.3 423 424 A R E < -H 420 0D 60 -3,-1.6 -3,-2.7 2,-0.0 2,-0.5 -0.886 64.9-133.8-116.6 141.4 -58.7 -52.2 7.5 424 425 A L E -H 419 0D 17 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.858 23.5-165.6 -93.8 124.2 -55.9 -49.8 8.6 425 426 A Y E -H 418 0D 9 -7,-3.2 -7,-2.3 -2,-0.5 2,-0.4 -0.824 7.2-148.4-109.1 147.5 -56.7 -46.0 8.5 426 427 A H - 0 0 3 -2,-0.3 -29,-3.7 -31,-0.3 2,-0.4 -0.944 14.0-173.1-116.8 139.4 -54.2 -43.2 8.7 427 428 A F - 0 0 0 -2,-0.4 -11,-2.6 -31,-0.3 -31,-0.1 -0.985 24.9-143.6-138.4 143.1 -55.0 -39.8 10.2 428 429 A G S S+ 0 0 17 -2,-0.4 2,-0.3 -13,-0.2 -14,-0.2 0.484 81.8 12.1 -89.1 -4.4 -53.1 -36.6 10.3 429 430 A S S > S- 0 0 11 -13,-0.2 4,-1.8 1,-0.1 5,-0.2 -0.971 77.2-104.3-159.4 167.4 -54.2 -35.4 13.9 430 431 A E H > S+ 0 0 85 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.883 121.1 51.3 -64.4 -36.7 -55.9 -36.7 17.0 431 432 A A H > S+ 0 0 3 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.855 105.5 55.2 -73.6 -31.3 -59.1 -34.7 16.0 432 433 A D H > S+ 0 0 0 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.937 110.1 45.4 -64.9 -48.7 -59.1 -36.2 12.5 433 434 A R H X S+ 0 0 49 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.898 111.8 53.8 -57.9 -43.0 -59.1 -39.7 13.9 434 435 A W H X S+ 0 0 59 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.875 101.2 57.8 -63.2 -37.7 -61.8 -38.7 16.5 435 436 A C H < S+ 0 0 1 -4,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.880 111.1 45.8 -60.9 -34.3 -64.2 -37.3 13.7 436 437 A F H >< S+ 0 0 2 -4,-1.2 3,-1.1 -3,-0.2 -2,-0.2 0.942 111.5 49.0 -72.7 -48.0 -64.0 -40.8 12.3 437 438 A Q H 3< S+ 0 0 105 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.779 105.9 56.4 -69.4 -27.0 -64.6 -42.8 15.5 438 439 A I T 3< S+ 0 0 46 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.715 129.1 15.3 -73.8 -16.7 -67.6 -40.8 16.6 439 440 A D S X> S+ 0 0 51 -3,-1.1 3,-2.0 -4,-0.4 4,-0.5 -0.276 71.3 163.3-152.5 60.6 -69.3 -41.6 13.4 440 441 A P H >> S+ 0 0 27 0, 0.0 4,-2.6 0, 0.0 3,-1.4 0.832 72.3 60.4 -60.1 -34.5 -67.5 -44.5 11.6 441 442 A E H 34 S+ 0 0 133 1,-0.2 95,-0.2 2,-0.2 4,-0.2 0.627 96.5 62.9 -69.8 -8.8 -70.3 -45.4 9.2 442 443 A R H <4 S+ 0 0 16 -3,-2.0 92,-2.5 -6,-0.2 -1,-0.2 0.768 123.6 15.7 -78.6 -22.0 -70.2 -41.9 7.6 443 444 A Y H X< S+ 0 0 12 -3,-1.4 3,-2.0 -4,-0.5 -2,-0.2 0.594 91.9 107.3-124.1 -18.0 -66.6 -42.5 6.5 444 445 A K T 3< S+ 0 0 57 -4,-2.6 -3,-0.1 1,-0.3 -2,-0.1 0.727 88.5 30.7 -46.8 -55.4 -65.8 -46.3 6.6 445 446 A N T 3 S+ 0 0 49 -4,-0.2 -1,-0.3 2,-0.1 2,-0.1 0.360 89.3 115.7 -96.1 8.5 -65.7 -47.4 3.0 446 447 A H < - 0 0 8 -3,-2.0 2,-0.4 -49,-0.1 88,-0.1 -0.463 54.4-151.5 -62.8 146.1 -64.5 -44.0 1.6 447 448 A T - 0 0 15 86,-0.1 2,-0.1 -2,-0.1 -2,-0.1 -0.991 2.0-143.1-124.1 136.6 -61.0 -44.4 -0.0 448 449 A N > - 0 0 2 -2,-0.4 4,-2.1 -53,-0.1 5,-0.2 -0.320 39.7 -92.9 -84.7 174.8 -58.4 -41.8 -0.3 449 450 A L H > S+ 0 0 13 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.858 128.1 50.8 -60.9 -36.1 -56.1 -41.4 -3.4 450 451 A V H > S+ 0 0 1 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.957 107.7 52.1 -63.4 -54.3 -53.4 -43.6 -1.7 451 452 A D H > S+ 0 0 22 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.883 112.4 47.6 -41.7 -47.3 -56.0 -46.4 -0.8 452 453 A R H X>S+ 0 0 16 -4,-2.1 5,-1.8 2,-0.2 4,-0.7 0.924 110.2 50.2 -70.7 -46.9 -57.0 -46.3 -4.6 453 454 A F H ><5S+ 0 0 35 -4,-2.6 3,-1.0 1,-0.2 5,-0.3 0.938 114.8 45.2 -52.1 -50.6 -53.4 -46.5 -5.8 454 455 A L H 3<5S+ 0 0 66 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.755 108.8 56.2 -67.1 -27.4 -52.8 -49.5 -3.5 455 456 A K H 3<5S- 0 0 128 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.542 117.2-106.5 -83.7 -10.7 -56.1 -51.2 -4.4 456 457 A G T <<5S+ 0 0 33 -3,-1.0 -3,-0.2 -4,-0.7 -2,-0.1 0.444 85.9 121.4 98.7 4.0 -55.3 -51.3 -8.2 457 458 A E < + 0 0 90 -5,-1.8 2,-0.6 -6,-0.2 -4,-0.2 0.626 60.6 67.8 -77.8 -11.7 -57.7 -48.6 -9.2 458 459 A I S S- 0 0 0 -6,-0.6 8,-0.1 -5,-0.3 -2,-0.1 -0.956 82.8-145.1-114.7 117.7 -55.1 -46.3 -10.7 459 460 A Q S S+ 0 0 130 -2,-0.6 2,-0.2 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