==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-AUG-06 2J0S . COMPND 2 MOLECULE: ATP-DEPENDENT RNA HELICASE DDX48; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.BONO,J.EBERT,E.LORENTZEN,E.CONTI . 667 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27209.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 453 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 63 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 69 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 38 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 166 24.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 1 0 0 2 2 3 3 0 3 2 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 6 2 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 PARALLEL BRIDGES PER LADDER . 2 1 0 1 0 4 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 0 0 3 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 21 A E 0 0 95 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 66.3 13.9 74.8 21.5 2 22 A D + 0 0 80 2,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.566 360.0 67.8 40.6 74.7 16.0 77.0 21.0 3 23 A M S S+ 0 0 70 -2,-0.2 3,-0.2 0, 0.0 204,-0.0 -0.401 90.5 62.8 135.6 -48.6 17.0 74.1 18.7 4 24 A T S S+ 0 0 36 1,-0.2 200,-0.1 203,-0.0 199,-0.1 0.537 111.5 39.1 -72.9 -12.9 13.8 74.8 16.7 5 25 A K S S+ 0 0 158 198,-0.0 -1,-0.2 428,-0.0 2,-0.0 0.386 86.9 127.4-116.0 -2.2 15.4 78.2 16.0 6 26 A V - 0 0 58 -3,-0.2 2,-1.1 1,-0.1 201,-0.0 -0.308 58.1-132.5 -60.1 134.1 19.1 77.1 15.5 7 27 A E - 0 0 115 425,-0.0 2,-0.2 -2,-0.0 -1,-0.1 -0.784 23.2-156.6 -86.6 95.4 20.8 78.3 12.3 8 28 A F + 0 0 30 -2,-1.1 2,-0.3 3,-0.0 198,-0.0 -0.524 17.4 177.8 -72.1 136.5 22.4 75.2 10.9 9 29 A E - 0 0 115 -2,-0.2 2,-0.2 213,-0.0 209,-0.1 -0.882 38.9 -85.2-133.4 162.3 25.4 75.9 8.6 10 30 A T - 0 0 63 -2,-0.3 209,-0.2 210,-0.2 50,-0.0 -0.487 63.5 -93.4 -66.6 142.4 27.9 73.9 6.7 11 31 A S > - 0 0 20 207,-3.2 3,-1.4 -2,-0.2 -1,-0.1 -0.293 25.1-129.6 -66.7 145.9 30.9 73.1 9.0 12 32 A E T 3 S+ 0 0 178 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.795 104.7 57.6 -66.9 -30.1 33.8 75.5 8.9 13 33 A E T 3 S+ 0 0 102 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.372 78.8 111.7 -85.1 5.0 36.4 72.7 8.4 14 34 A V < + 0 0 23 -3,-1.4 2,-0.3 204,-0.1 34,-0.1 -0.608 47.8 178.8 -73.9 136.4 34.8 71.4 5.2 15 35 A D - 0 0 64 32,-0.4 2,-0.6 -2,-0.3 35,-0.1 -0.875 30.0-101.1-135.9 172.7 37.0 72.1 2.2 16 36 A V - 0 0 69 -2,-0.3 31,-0.2 32,-0.0 30,-0.1 -0.842 21.8-169.8-100.8 119.4 37.1 71.5 -1.5 17 37 A T - 0 0 13 29,-2.6 32,-0.1 -2,-0.6 6,-0.1 -0.944 11.4-159.6-106.2 109.5 39.1 68.7 -2.9 18 38 A P + 0 0 76 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.629 65.9 34.2 -70.6 -23.7 39.1 69.4 -6.8 19 39 A T S > S- 0 0 54 21,-0.1 3,-0.7 1,-0.1 4,-0.2 -0.960 72.5-125.0-132.7 152.3 40.0 65.9 -8.1 20 40 A F G > S+ 0 0 0 -2,-0.3 3,-1.5 1,-0.2 5,-0.5 0.867 109.5 62.5 -56.8 -35.4 39.4 62.3 -7.1 21 41 A D G > S+ 0 0 86 1,-0.3 3,-0.6 2,-0.1 -1,-0.2 0.738 98.7 52.2 -68.2 -28.9 43.2 61.7 -7.1 22 42 A T G < S+ 0 0 91 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.315 88.8 82.0 -92.6 10.9 44.0 64.2 -4.3 23 43 A M G < S- 0 0 14 -3,-1.5 -1,-0.2 -4,-0.2 -2,-0.1 0.368 105.6-113.6 -91.0 1.9 41.4 62.6 -1.9 24 44 A G < + 0 0 56 -3,-0.6 2,-0.3 1,-0.2 -2,-0.1 0.909 56.1 169.2 64.9 42.5 43.8 59.9 -0.9 25 45 A L - 0 0 17 -5,-0.5 -1,-0.2 -4,-0.2 50,-0.0 -0.653 42.2-101.1 -87.9 142.2 41.8 57.2 -2.4 26 46 A R >> - 0 0 65 -2,-0.3 4,-2.3 1,-0.1 3,-0.8 -0.352 33.8-117.3 -62.1 144.8 43.2 53.6 -2.8 27 47 A E H 3> S+ 0 0 164 1,-0.3 4,-2.2 2,-0.2 -1,-0.1 0.773 112.4 53.8 -60.3 -32.1 44.4 53.0 -6.3 28 48 A D H 3> S+ 0 0 53 2,-0.2 4,-1.2 1,-0.2 84,-0.4 0.846 110.6 47.0 -70.5 -35.1 41.9 50.2 -7.0 29 49 A L H <> S+ 0 0 0 -3,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.922 111.2 51.3 -71.8 -45.8 39.0 52.4 -6.1 30 50 A L H X S+ 0 0 25 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.905 108.6 51.0 -56.7 -45.1 40.3 55.3 -8.2 31 51 A R H X S+ 0 0 152 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.842 110.8 50.2 -62.9 -34.1 40.7 53.0 -11.2 32 52 A G H X S+ 0 0 1 -4,-1.2 4,-2.0 77,-0.2 -2,-0.2 0.885 108.0 52.5 -68.6 -43.0 37.0 51.9 -10.6 33 53 A I H X>S+ 0 0 0 -4,-2.4 5,-1.4 2,-0.2 4,-0.8 0.940 114.4 41.4 -56.8 -51.2 35.8 55.4 -10.4 34 54 A Y H ><5S+ 0 0 89 -4,-2.3 3,-0.6 1,-0.2 -2,-0.2 0.883 113.8 51.9 -69.6 -38.8 37.4 56.4 -13.7 35 55 A A H 3<5S+ 0 0 65 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.812 103.5 59.6 -66.8 -30.2 36.4 53.1 -15.5 36 56 A Y H 3<5S- 0 0 115 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.749 125.0-105.0 -66.5 -26.3 32.8 53.7 -14.3 37 57 A G T <<5S+ 0 0 47 -4,-0.8 -3,-0.2 -3,-0.6 -2,-0.1 0.291 72.9 138.7 119.5 -6.3 33.0 57.0 -16.3 38 58 A F < + 0 0 55 -5,-1.4 -1,-0.4 1,-0.1 -2,-0.1 -0.403 20.8 175.4 -64.9 143.6 33.3 59.7 -13.7 39 59 A E + 0 0 168 1,-0.5 -19,-0.2 -2,-0.1 -1,-0.1 0.695 63.2 10.5-115.2 -35.6 35.8 62.4 -14.7 40 60 A K S S- 0 0 121 -21,-0.1 -1,-0.5 -20,-0.1 2,-0.2 -0.988 82.1-100.8-147.3 142.2 35.7 65.0 -12.0 41 61 A P - 0 0 2 0, 0.0 26,-0.1 0, 0.0 0, 0.0 -0.515 33.9-125.9 -70.0 139.4 34.0 65.2 -8.6 42 62 A S > - 0 0 0 -2,-0.2 4,-2.4 24,-0.2 493,-0.2 -0.167 38.2 -93.2 -66.7 169.8 30.8 67.1 -8.3 43 63 A A H > S+ 0 0 9 491,-2.6 4,-0.6 1,-0.2 -26,-0.2 0.908 127.2 47.5 -59.0 -44.7 30.6 69.8 -5.6 44 64 A I H >> S+ 0 0 4 490,-0.5 4,-3.1 1,-0.2 3,-0.9 0.893 112.4 50.7 -62.9 -38.2 29.2 67.5 -2.9 45 65 A Q H 3> S+ 0 0 4 21,-0.3 4,-1.1 1,-0.2 5,-0.4 0.887 104.3 58.3 -64.4 -38.1 31.9 64.9 -3.7 46 66 A Q H 3< S+ 0 0 20 -4,-2.4 -29,-2.6 1,-0.2 -1,-0.2 0.672 120.4 28.3 -63.5 -19.3 34.5 67.6 -3.5 47 67 A R H << S+ 0 0 35 -3,-0.9 4,-0.5 -4,-0.6 -32,-0.4 0.750 122.0 41.4-111.1 -38.5 33.4 68.2 0.1 48 68 A A H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 5,-0.2 0.796 97.4 66.6 -92.7 -32.8 32.0 65.1 1.7 49 69 A I H X S+ 0 0 0 -4,-1.1 4,-2.5 -5,-0.4 5,-0.2 0.937 102.9 48.7 -60.6 -50.1 34.2 62.2 0.6 50 70 A K H > S+ 0 0 64 -5,-0.4 4,-0.7 1,-0.2 -1,-0.2 0.820 113.3 48.1 -55.1 -39.0 37.2 63.4 2.6 51 71 A Q H 4>S+ 0 0 2 -4,-0.5 5,-1.6 2,-0.2 3,-0.2 0.877 112.6 47.1 -75.2 -39.7 35.1 63.9 5.7 52 72 A I H ><5S+ 0 0 0 -4,-2.5 3,-1.9 1,-0.2 -2,-0.2 0.921 109.3 53.7 -67.1 -43.0 33.4 60.5 5.6 53 73 A I H 3<5S+ 0 0 40 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.672 102.3 58.5 -73.1 -16.1 36.6 58.6 5.0 54 74 A K T 3<5S- 0 0 123 -4,-0.7 -1,-0.3 -3,-0.2 -2,-0.2 0.415 119.4-109.7 -90.2 2.6 38.2 60.1 8.0 55 75 A G T < 5 + 0 0 43 -3,-1.9 2,-0.2 1,-0.3 -3,-0.2 0.599 66.0 146.8 85.5 10.5 35.4 58.7 10.2 56 76 A R < - 0 0 59 -5,-1.6 -1,-0.3 137,-0.1 2,-0.3 -0.529 58.9-107.0 -68.7 144.5 33.5 61.8 11.1 57 77 A D - 0 0 12 157,-0.5 160,-3.5 158,-0.2 2,-0.4 -0.593 48.4-159.6 -62.5 136.2 29.8 61.6 11.5 58 78 A V E -ab 195 217A 0 136,-1.7 138,-3.0 -2,-0.3 2,-0.5 -0.990 28.1-171.7-135.4 128.7 28.5 63.4 8.4 59 79 A I E -ab 196 218A 0 158,-3.5 160,-2.5 -2,-0.4 2,-0.4 -0.980 27.2-178.2-115.5 114.1 25.2 65.0 7.5 60 80 A A E -ab 197 219A 0 136,-2.8 138,-1.5 -2,-0.5 2,-0.3 -0.949 12.7-177.5-128.1 137.5 25.4 65.8 3.8 61 81 A Q E +a 198 0A 14 158,-2.4 2,-0.3 -2,-0.4 138,-0.2 -0.957 9.8 155.8-129.3 145.4 23.0 67.6 1.3 62 82 A S - 0 0 4 136,-0.8 3,-0.1 -2,-0.3 5,-0.1 -0.971 45.2 -81.7-160.3 160.2 23.1 68.3 -2.4 63 83 A Q > - 0 0 9 -2,-0.3 3,-1.1 1,-0.2 5,-0.2 -0.131 66.5 -72.5 -58.6 154.6 20.7 69.0 -5.3 64 84 A S T 3 S+ 0 0 6 162,-0.4 -1,-0.2 1,-0.2 287,-0.1 -0.163 114.6 9.8 -47.1 137.6 19.0 66.1 -7.1 65 85 A G T 3 S+ 0 0 10 285,-0.1 286,-1.5 -3,-0.1 -1,-0.2 0.701 89.1 120.1 70.3 24.4 21.2 63.9 -9.4 66 86 A T S < S- 0 0 2 -3,-1.1 -21,-0.3 285,-0.1 -22,-0.2 0.453 89.9 -87.3-104.4 -2.7 24.5 65.5 -8.3 67 87 A G S > S+ 0 0 17 -4,-0.1 4,-2.4 -23,-0.1 -25,-0.1 0.701 77.2 138.2 104.8 24.0 26.3 62.3 -6.9 68 88 A K H > S+ 0 0 17 -5,-0.2 4,-1.6 2,-0.2 5,-0.2 0.904 81.4 44.6 -59.4 -44.8 25.2 62.0 -3.2 69 89 A T H > S+ 0 0 32 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.914 114.0 49.4 -72.6 -38.6 24.8 58.3 -3.5 70 90 A A H > S+ 0 0 18 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.889 105.8 61.7 -60.0 -40.7 28.1 58.0 -5.4 71 91 A T H X S+ 0 0 1 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.930 111.5 33.5 -50.5 -59.0 29.7 60.1 -2.7 72 92 A F H X S+ 0 0 1 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.791 115.2 60.0 -73.6 -27.2 29.0 57.6 0.2 73 93 A S H X S+ 0 0 3 -4,-1.8 4,-2.0 -5,-0.2 -2,-0.2 0.957 109.5 41.5 -63.9 -49.6 29.4 54.7 -2.1 74 94 A I H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.910 115.5 51.6 -58.9 -46.5 33.0 55.7 -2.9 75 95 A S H X S+ 0 0 0 -4,-1.9 4,-0.9 -5,-0.3 -2,-0.2 0.855 108.3 51.2 -64.5 -37.0 33.6 56.6 0.7 76 96 A V H >< S+ 0 0 0 -4,-2.5 3,-0.6 1,-0.2 4,-0.4 0.928 109.8 49.2 -65.2 -47.5 32.4 53.2 2.0 77 97 A L H >< S+ 0 0 0 -4,-2.0 3,-1.0 1,-0.2 -2,-0.2 0.854 105.3 59.2 -59.8 -38.2 34.6 51.3 -0.4 78 98 A Q H 3< S+ 0 0 40 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.822 106.5 47.9 -58.3 -32.4 37.6 53.4 0.7 79 99 A C T << S+ 0 0 39 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.464 85.9 117.1 -92.7 -2.1 37.2 52.2 4.3 80 100 A L < - 0 0 6 -3,-1.0 2,-0.9 -4,-0.4 3,-0.1 -0.423 56.7-148.2 -76.4 134.5 36.8 48.5 3.6 81 101 A D > - 0 0 76 -2,-0.2 3,-1.6 3,-0.2 -1,-0.1 -0.890 16.3-169.2 -93.0 100.7 39.3 46.0 4.9 82 102 A I T 3 S+ 0 0 37 -2,-0.9 -1,-0.2 1,-0.3 34,-0.1 0.815 78.4 69.7 -66.0 -27.6 38.9 43.6 2.0 83 103 A Q T 3 S+ 0 0 175 -3,-0.1 2,-0.7 1,-0.1 -1,-0.3 0.654 90.1 65.9 -62.3 -21.8 40.8 41.0 3.9 84 104 A V S < S- 0 0 51 -3,-1.6 2,-1.6 2,-0.1 -3,-0.2 -0.926 73.6-156.0-108.8 113.3 38.0 40.5 6.4 85 105 A R + 0 0 56 -2,-0.7 2,-0.3 2,-0.1 52,-0.2 -0.325 58.0 102.6 -86.5 51.8 35.0 39.0 4.7 86 106 A E S S- 0 0 34 -2,-1.6 2,-0.3 50,-0.2 -2,-0.1 -0.928 83.7 -80.2-133.7 165.5 32.4 40.3 7.2 87 107 A T + 0 0 10 70,-0.4 73,-0.3 -2,-0.3 51,-0.2 -0.412 50.6 157.1 -75.7 120.3 30.0 43.2 7.1 88 108 A Q + 0 0 3 50,-2.9 74,-2.4 1,-0.3 75,-0.9 0.454 63.3 45.0-125.2 -5.1 31.6 46.5 7.9 89 109 A A E -cd 139 163A 0 49,-1.1 51,-2.2 72,-0.2 2,-0.5 -0.986 61.0-166.4-137.4 132.2 29.3 49.0 6.2 90 110 A L E -cd 140 164A 0 73,-2.9 75,-3.2 -2,-0.3 2,-0.5 -0.978 5.9-171.1-116.0 123.0 25.5 49.0 6.4 91 111 A I E -cd 141 165A 0 49,-2.8 51,-2.6 -2,-0.5 2,-0.4 -0.963 4.1-164.7-115.5 120.2 23.5 51.2 4.0 92 112 A L E +cd 142 166A 0 73,-3.3 75,-2.2 -2,-0.5 51,-0.2 -0.885 8.7 177.7-108.5 140.1 19.7 51.6 4.5 93 113 A A - 0 0 1 49,-2.2 75,-0.1 -2,-0.4 6,-0.1 -0.928 35.7-119.8-137.6 153.1 17.3 53.1 1.9 94 114 A P S S+ 0 0 14 0, 0.0 2,-0.3 0, 0.0 49,-0.1 0.583 91.8 38.9 -70.6 -16.3 13.5 53.6 1.8 95 115 A T S > S- 0 0 18 47,-0.1 4,-1.8 1,-0.1 5,-0.1 -0.956 75.1-124.9-139.2 155.3 12.7 51.4 -1.2 96 116 A R H > S+ 0 0 72 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.870 109.4 53.3 -66.8 -40.6 13.9 48.1 -2.6 97 117 A E H > S+ 0 0 10 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.839 108.4 52.4 -63.6 -35.4 14.8 49.4 -6.1 98 118 A L H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.936 108.0 49.1 -69.1 -47.2 17.0 52.0 -4.4 99 119 A A H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.917 112.0 49.6 -56.6 -44.5 18.9 49.5 -2.3 100 120 A V H X S+ 0 0 40 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.906 109.9 51.2 -62.4 -40.7 19.5 47.4 -5.4 101 121 A Q H X S+ 0 0 31 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.864 108.5 51.7 -63.4 -40.4 20.7 50.5 -7.3 102 122 A I H X S+ 0 0 1 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.944 109.8 50.1 -57.8 -49.8 23.1 51.3 -4.4 103 123 A Q H X S+ 0 0 36 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.907 109.6 49.7 -56.5 -46.5 24.5 47.8 -4.6 104 124 A K H X S+ 0 0 102 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.880 110.9 50.1 -64.0 -38.4 25.1 47.9 -8.3 105 125 A G H X S+ 0 0 11 -4,-1.9 4,-2.9 2,-0.2 5,-0.3 0.907 110.6 49.4 -66.0 -43.7 26.9 51.2 -8.0 106 126 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.905 111.9 48.3 -58.1 -46.2 29.1 49.8 -5.3 107 127 A L H < S+ 0 0 64 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.849 114.9 46.3 -66.0 -34.0 29.9 46.7 -7.3 108 128 A A H >< S+ 0 0 30 -4,-1.9 3,-1.0 -5,-0.2 -2,-0.2 0.923 117.1 41.0 -73.9 -46.7 30.7 48.9 -10.4 109 129 A L H 3< S+ 0 0 3 -4,-2.9 3,-0.3 1,-0.2 -77,-0.2 0.804 120.8 45.8 -70.6 -30.3 32.9 51.4 -8.5 110 130 A G T >X>S+ 0 0 2 -4,-2.5 3,-1.5 -5,-0.3 5,-0.7 0.022 76.2 121.2 -98.5 27.0 34.5 48.5 -6.5 111 131 A D T <45S+ 0 0 105 -3,-1.0 3,-0.2 1,-0.3 -1,-0.2 0.751 77.4 43.6 -62.5 -30.1 35.0 46.3 -9.6 112 132 A Y T 345S+ 0 0 94 -84,-0.4 -1,-0.3 -3,-0.3 -83,-0.1 0.363 105.4 64.9 -98.6 4.4 38.8 46.2 -9.1 113 133 A M T <45S- 0 0 7 -3,-1.5 -2,-0.2 -6,-0.1 -1,-0.2 0.504 96.0-128.1-105.7 -8.0 38.6 45.6 -5.3 114 134 A N T <5 + 0 0 126 -4,-0.6 2,-0.3 -3,-0.2 -3,-0.1 0.977 46.8 171.8 55.2 59.6 36.9 42.2 -5.2 115 135 A V < - 0 0 12 -5,-0.7 2,-0.7 -8,-0.1 -1,-0.2 -0.782 32.3-137.3-105.5 142.3 34.3 43.4 -2.8 116 136 A Q + 0 0 66 -2,-0.3 23,-2.1 -34,-0.1 22,-1.1 -0.912 27.6 175.1-102.2 111.0 31.2 41.4 -1.8 117 137 A C E -e 139 0A 7 -2,-0.7 2,-0.4 21,-0.2 23,-0.2 -0.983 7.8-167.7-120.6 127.5 28.1 43.7 -1.7 118 138 A H E -e 140 0A 10 21,-2.2 23,-2.8 -2,-0.5 2,-0.6 -0.931 17.6-139.0-119.5 139.8 24.7 42.2 -1.0 119 139 A A E -e 141 0A 13 -2,-0.4 2,-0.9 21,-0.2 23,-0.2 -0.876 14.2-166.8 -93.8 113.9 21.2 43.7 -1.4 120 140 A C E +e 142 0A 0 21,-2.2 23,-1.8 -2,-0.6 27,-0.3 -0.801 31.3 146.1-104.2 90.4 19.0 42.8 1.6 121 141 A I > - 0 0 7 -2,-0.9 3,-0.6 21,-0.2 -2,-0.0 -0.883 47.0-104.9-128.5 153.8 15.5 43.7 0.4 122 142 A G T 3 S+ 0 0 10 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 -0.140 94.9 48.7 -71.1 172.0 12.0 42.3 0.9 123 143 A G T 3 S+ 0 0 53 1,-0.3 2,-0.2 170,-0.0 -1,-0.2 0.453 92.5 103.8 75.0 4.2 10.1 40.3 -1.7 124 144 A T S < S- 0 0 43 -3,-0.6 2,-0.3 1,-0.1 -1,-0.3 -0.639 89.5 -72.1-111.8 168.3 13.1 38.0 -2.3 125 145 A N > - 0 0 106 -2,-0.2 4,-0.7 1,-0.2 5,-0.1 -0.462 41.1-160.0 -62.3 117.2 13.9 34.5 -1.3 126 146 A V H >> S+ 0 0 46 -2,-0.3 4,-1.9 1,-0.2 3,-1.0 0.946 87.1 54.8 -65.3 -50.9 14.7 34.7 2.5 127 147 A G H 3> S+ 0 0 41 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.892 108.8 45.6 -49.0 -49.6 16.7 31.5 2.5 128 148 A E H 3> S+ 0 0 108 1,-0.3 4,-0.9 2,-0.2 -1,-0.3 0.587 104.8 62.2 -82.9 -6.6 19.1 32.5 -0.2 129 149 A D H < S+ 0 0 13 -4,-1.9 3,-1.0 1,-0.2 4,-0.2 0.927 110.8 52.8 -69.1 -45.5 25.2 36.6 4.4 134 154 A D H 3< S+ 0 0 113 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.890 103.7 59.2 -55.2 -41.2 26.6 33.3 5.8 135 155 A Y H 3< S- 0 0 169 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.758 122.0 -99.4 -60.1 -28.9 29.3 33.4 2.9 136 156 A G << - 0 0 8 -3,-1.0 2,-0.4 -4,-0.7 -50,-0.2 0.344 37.6-157.4 107.8 124.7 30.5 36.8 4.1 137 157 A Q - 0 0 11 -4,-0.2 -20,-0.2 -52,-0.2 3,-0.1 -0.995 12.9-158.0-140.4 123.7 29.7 40.2 2.8 138 158 A H S S+ 0 0 6 -22,-1.1 -50,-2.9 -2,-0.4 -49,-1.1 0.889 85.1 24.5 -68.8 -44.4 31.8 43.4 3.1 139 159 A V E -ce 89 117A 0 -23,-2.1 -21,-2.2 -52,-0.2 2,-0.5 -0.985 64.1-162.5-124.5 135.8 28.8 45.8 2.5 140 160 A V E -ce 90 118A 0 -51,-2.2 -49,-2.8 -2,-0.4 2,-0.4 -0.988 8.2-176.1-113.3 126.2 25.1 45.3 3.0 141 161 A A E +ce 91 119A 2 -23,-2.8 -21,-2.2 -2,-0.5 2,-0.3 -0.985 29.3 121.1-116.4 128.4 22.7 47.6 1.2 142 162 A G E -ce 92 120A 0 -51,-2.6 -49,-2.2 -2,-0.4 -21,-0.2 -0.925 58.5 -78.3-165.2-172.6 19.0 47.2 2.0 143 163 A T > - 0 0 12 -23,-1.8 4,-2.2 -2,-0.3 5,-0.2 -0.800 46.2-114.4-106.1 148.2 15.6 48.2 3.2 144 164 A P H > S+ 0 0 3 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.692 107.2 56.2 -62.0 -26.5 14.9 48.3 7.0 145 165 A G H > S+ 0 0 42 2,-0.2 4,-1.6 1,-0.1 5,-0.1 0.971 115.3 35.6 -69.4 -53.9 12.4 45.5 7.2 146 166 A R H > S+ 0 0 22 2,-0.2 4,-2.1 1,-0.2 -25,-0.2 0.832 115.3 55.6 -69.8 -36.7 14.5 42.8 5.6 147 167 A V H X S+ 0 0 0 -4,-2.2 4,-1.6 -27,-0.3 -1,-0.2 0.953 110.5 45.4 -61.1 -48.4 17.7 44.0 7.2 148 168 A F H X S+ 0 0 37 -4,-1.6 4,-3.0 1,-0.2 -2,-0.2 0.822 108.9 57.8 -64.8 -31.9 16.2 43.8 10.7 149 169 A D H X S+ 0 0 22 -4,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.934 108.1 45.6 -60.7 -45.0 14.8 40.4 9.8 150 170 A M H <>S+ 0 0 0 -4,-2.1 6,-2.3 2,-0.2 5,-2.1 0.747 113.2 49.9 -73.9 -26.3 18.4 39.1 9.0 151 171 A I H ><5S+ 0 0 7 -4,-1.6 3,-1.9 4,-0.2 -2,-0.2 0.930 108.4 53.6 -69.6 -49.9 19.7 40.7 12.2 152 172 A R H 3<5S+ 0 0 151 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.820 113.0 43.2 -54.5 -34.6 16.9 39.0 14.2 153 173 A R T 3<5S- 0 0 125 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.246 112.8-116.6-102.0 14.4 17.8 35.6 12.7 154 174 A R T < 5S+ 0 0 128 -3,-1.9 -3,-0.2 2,-0.2 3,-0.1 0.699 84.5 115.5 64.6 25.6 21.6 36.1 13.1 155 175 A S S + 0 0 0 -2,-0.4 3,-2.8 29,-0.2 512,-0.1 0.301 49.4 114.4-121.3 -2.2 27.4 43.1 12.9 159 179 A R T 3 S+ 0 0 112 510,-1.8 -1,-0.1 1,-0.3 511,-0.1 0.776 86.8 48.1 -57.5 -28.7 30.5 43.1 15.1 160 180 A A T 3 S+ 0 0 21 -73,-0.3 2,-0.4 509,-0.2 -1,-0.3 0.389 81.5 126.4 -90.4 3.5 32.7 44.4 12.3 161 181 A I < + 0 0 6 -3,-2.8 -72,-0.2 1,-0.2 -73,-0.2 -0.499 21.7 161.3 -70.7 118.5 30.3 47.3 11.3 162 182 A K + 0 0 86 -74,-2.4 31,-2.6 -2,-0.4 2,-0.4 0.545 60.9 45.2-106.4 -19.0 32.1 50.7 11.3 163 183 A M E -df 89 193A 5 -75,-0.9 -73,-2.9 29,-0.2 2,-0.5 -0.985 52.2-169.4-142.2 121.8 29.6 52.7 9.2 164 184 A L E -df 90 194A 2 29,-3.7 31,-2.3 -2,-0.4 2,-0.5 -0.973 16.1-168.6-104.2 122.0 25.8 53.1 9.1 165 185 A V E -df 91 195A 0 -75,-3.2 -73,-3.3 -2,-0.5 2,-0.6 -0.955 9.3-166.7-111.0 127.0 24.6 55.1 6.0 166 186 A L E > -df 92 196A 1 29,-2.4 31,-2.2 -2,-0.5 3,-0.6 -0.941 10.2-164.0-106.8 103.4 21.0 56.3 5.7 167 187 A D E 3 S+ f 0 197A 0 -75,-2.2 31,-0.2 -2,-0.6 5,-0.2 -0.646 82.5 21.3 -82.8 145.6 20.4 57.4 2.1 168 188 A E T >> S+ 0 0 7 29,-1.1 4,-2.0 -2,-0.3 3,-0.9 0.923 87.5 178.2 57.2 46.5 17.2 59.5 1.8 169 189 A A H <> + 0 0 0 28,-2.5 4,-1.1 -3,-0.6 29,-0.1 0.733 67.2 58.3 -60.7 -33.8 17.9 60.2 5.5 170 190 A D H 34 S+ 0 0 11 30,-0.5 -1,-0.3 2,-0.2 3,-0.2 0.900 110.8 43.9 -62.8 -40.4 15.0 62.6 6.0 171 191 A E H X4 S+ 0 0 56 -3,-0.9 3,-1.6 1,-0.2 6,-0.5 0.912 110.7 56.1 -64.9 -42.1 12.5 59.9 4.8 172 192 A M H 3< S+ 0 0 0 -4,-2.0 9,-0.3 1,-0.3 -2,-0.2 0.712 110.1 45.5 -66.9 -19.6 14.4 57.3 7.0 173 193 A L T 3< S+ 0 0 5 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.306 90.5 109.3-107.4 7.3 13.9 59.4 10.1 174 194 A N S X> S- 0 0 54 -3,-1.6 4,-2.9 -4,-0.1 3,-1.3 -0.338 90.9 -93.2 -73.3 164.5 10.2 60.2 9.4 175 195 A K T 34 S+ 0 0 106 1,-0.3 4,-0.4 2,-0.2 -1,-0.1 0.808 125.1 56.5 -50.5 -38.8 7.4 58.6 11.6 176 196 A G T 34 S+ 0 0 51 1,-0.1 -1,-0.3 -5,-0.1 4,-0.1 0.863 123.8 19.5 -59.5 -37.5 7.0 55.8 9.1 177 197 A F T X> S+ 0 0 30 -3,-1.3 4,-2.1 -6,-0.5 3,-0.9 0.702 97.3 88.4-110.0 -25.0 10.7 54.7 9.3 178 198 A K H 3X S+ 0 0 56 -4,-2.9 4,-2.2 1,-0.3 5,-0.1 0.852 93.7 44.8 -52.3 -48.5 12.4 56.1 12.5 179 199 A E H 3> S+ 0 0 119 -4,-0.4 4,-1.7 1,-0.2 -1,-0.3 0.765 112.1 54.1 -71.7 -23.5 11.5 53.2 14.8 180 200 A Q H <> S+ 0 0 72 -3,-0.9 4,-0.9 2,-0.2 -1,-0.2 0.847 109.7 47.1 -72.8 -38.2 12.6 50.7 12.1 181 201 A I H X S+ 0 0 1 -4,-2.1 4,-2.6 -9,-0.3 3,-0.3 0.865 111.5 51.2 -67.7 -39.7 16.0 52.4 11.8 182 202 A Y H X S+ 0 0 29 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.907 101.5 61.3 -68.4 -38.1 16.3 52.4 15.6 183 203 A D H < S+ 0 0 59 -4,-1.7 4,-0.3 1,-0.2 -1,-0.2 0.816 112.7 38.7 -52.0 -35.7 15.5 48.7 15.7 184 204 A V H >< S+ 0 0 0 -4,-0.9 3,-1.7 -3,-0.3 -2,-0.2 0.925 110.9 58.4 -78.2 -50.7 18.7 48.2 13.5 185 205 A Y H >< S+ 0 0 12 -4,-2.6 3,-2.6 1,-0.3 -2,-0.2 0.872 97.0 60.3 -46.5 -51.7 20.8 50.8 15.2 186 206 A R T 3< S+ 0 0 74 -4,-2.4 477,-1.4 1,-0.3 478,-0.9 0.682 102.5 53.3 -60.6 -20.2 20.6 49.2 18.7 187 207 A Y T < S+ 0 0 51 -3,-1.7 -1,-0.3 -4,-0.3 -29,-0.2 0.230 92.5 99.1 -90.8 9.1 22.2 46.0 17.4 188 208 A L S < S- 0 0 0 -3,-2.6 476,-0.2 1,-0.1 -29,-0.1 -0.622 83.4 -91.7 -98.5 159.3 25.2 47.8 15.9 189 209 A P > - 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0 0 153 -2,-0.3 4,-0.3 -478,-0.2 3,-0.2 -0.868 25.6-152.8-146.7 106.3 26.9 41.9 22.2 666 225 T E S > S+ 0 0 123 -2,-0.3 3,-1.0 1,-0.2 4,-0.2 0.809 96.8 57.6 -47.0 -39.7 30.3 41.1 20.6 667 226 T D G > S+ 0 0 130 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.963 113.9 34.4 -57.3 -59.6 30.0 37.5 21.8 668 227 T E G 3 S+ 0 0 76 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.2 0.219 114.5 65.4 -80.1 17.8 26.7 36.7 20.0 669 228 T Q G < S+ 0 0 9 -3,-1.0 -510,-1.8 -4,-0.3 -509,-0.2 0.262 75.2 93.0-131.5 12.2 27.7 38.9 17.1 670 229 T A < 0 0 24 -3,-0.7 -512,-0.1 -4,-0.2 -3,-0.0 -0.481 360.0 360.0 -96.9 172.0 30.7 37.4 15.3 671 230 T P 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.771 360.0 360.0 -72.2 360.0 30.6 34.9 12.4