==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 08-MAR-05 1VRL . COMPND 2 MOLECULE: 5'-D(*AP*AP*GP*AP*CP*(8OG)P*TP*GP*GP*AP*C)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.C.FROMME,A.BANERJEE,S.J.HUANG,G.L.VERDINE . 346 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16203.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 239 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 7.5 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 1 0.3 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 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 35.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 1 1 1 0 2 0 2 0 1 1 3 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 9 A P >> 0 0 123 0, 0.0 4,-2.3 0, 0.0 3,-0.8 0.000 360.0 360.0 360.0 37.6 11.7 -10.1 -16.9 2 10 A A H 3> + 0 0 29 1,-0.3 4,-1.2 2,-0.2 167,-0.0 0.730 360.0 38.5 -30.5 -41.5 12.4 -6.5 -15.8 3 11 A R H 3> S+ 0 0 188 2,-0.2 4,-1.6 3,-0.1 -1,-0.3 0.831 111.0 53.2 -87.5 -35.8 9.0 -5.5 -17.0 4 12 A E H <> S+ 0 0 48 -3,-0.8 4,-1.9 2,-0.2 -2,-0.2 0.930 112.2 49.9 -64.1 -42.1 6.8 -8.4 -16.1 5 13 A F H X S+ 0 0 8 -4,-2.3 4,-3.0 2,-0.2 3,-0.4 0.978 106.6 50.1 -58.5 -65.7 8.1 -8.0 -12.5 6 14 A Q H X S+ 0 0 16 -4,-1.2 4,-3.5 163,-0.3 5,-0.4 0.905 111.4 50.9 -39.4 -59.0 7.6 -4.3 -12.0 7 15 A R H X S+ 0 0 51 -4,-1.6 4,-1.8 1,-0.2 -1,-0.3 0.884 113.0 44.2 -49.0 -49.1 4.0 -4.6 -13.2 8 16 A D H X S+ 0 0 74 -4,-1.9 4,-1.8 -3,-0.4 -1,-0.2 0.902 120.0 42.6 -65.3 -40.4 3.2 -7.5 -10.8 9 17 A L H X S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 -2,-0.2 0.987 112.8 49.2 -68.6 -62.0 4.9 -5.8 -7.9 10 18 A L H X S+ 0 0 36 -4,-3.5 4,-2.4 1,-0.2 -3,-0.2 0.838 112.2 50.5 -46.9 -41.3 3.7 -2.2 -8.4 11 19 A D H X S+ 0 0 94 -4,-1.8 4,-1.7 -5,-0.4 5,-0.3 0.975 108.2 49.8 -63.5 -57.1 0.1 -3.5 -8.7 12 20 A W H X S+ 0 0 14 -4,-1.8 4,-2.0 1,-0.2 5,-0.3 0.886 111.1 53.4 -47.7 -40.4 0.2 -5.5 -5.6 13 21 A F H X S+ 0 0 10 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.950 102.3 57.1 -61.0 -49.5 1.6 -2.4 -3.9 14 22 A A H < S+ 0 0 77 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.836 118.5 30.3 -52.0 -39.4 -1.3 -0.3 -5.1 15 23 A R H < S+ 0 0 162 -4,-1.7 -1,-0.2 -3,-0.1 -2,-0.2 0.658 127.3 39.2 -99.2 -15.0 -3.9 -2.4 -3.4 16 24 A E H < S+ 0 0 94 -4,-2.0 -3,-0.2 -5,-0.3 -2,-0.2 0.624 78.4 120.2-108.8 -13.9 -2.0 -3.7 -0.5 17 25 A R < - 0 0 75 -4,-2.8 164,-0.0 -5,-0.3 -4,-0.0 -0.255 66.0-117.4 -56.8 129.2 0.1 -0.8 0.7 18 26 A R - 0 0 65 1,-0.1 2,-1.5 0, 0.0 -1,-0.1 -0.295 19.5-117.1 -65.5 152.1 -0.6 0.2 4.3 19 27 A D + 0 0 160 3,-0.0 -1,-0.1 5,-0.0 5,-0.1 -0.589 49.5 175.5 -90.7 71.4 -2.1 3.7 4.9 20 28 A L > - 0 0 14 -2,-1.5 3,-2.6 1,-0.1 4,-0.2 -0.534 41.1-114.3 -83.1 148.0 0.9 4.9 7.0 21 29 A P G > S+ 0 0 16 0, 0.0 3,-1.8 0, 0.0 4,-0.3 0.872 115.2 51.6 -43.7 -54.8 1.2 8.5 8.4 22 30 A W G 3 S+ 0 0 7 1,-0.3 3,-0.2 2,-0.1 12,-0.1 0.471 99.9 67.7 -68.4 2.3 4.3 9.4 6.3 23 31 A R G < S+ 0 0 24 -3,-2.6 -1,-0.3 1,-0.2 3,-0.1 0.359 71.0 91.5-102.2 4.6 2.4 8.2 3.2 24 32 A K S < S- 0 0 173 -3,-1.8 2,-0.3 -4,-0.2 -1,-0.2 0.884 104.5 -4.1 -64.0 -40.4 -0.2 11.0 3.3 25 33 A D - 0 0 60 -4,-0.3 -1,-0.1 -3,-0.2 102,-0.0 -0.834 67.2-116.1-141.6 179.1 2.0 13.1 1.0 26 34 A R + 0 0 78 -2,-0.3 -3,-0.1 101,-0.1 -4,-0.0 -0.048 53.4 153.7-110.4 28.3 5.5 13.0 -0.6 27 35 A D > - 0 0 55 1,-0.1 4,-2.6 -5,-0.1 5,-0.2 -0.434 45.2-137.3 -62.3 122.2 6.9 16.0 1.3 28 36 A P H > S+ 0 0 23 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.824 101.9 52.0 -49.7 -39.2 10.7 15.6 1.5 29 37 A Y H > S+ 0 0 5 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.975 111.6 44.6 -65.1 -52.5 10.8 16.6 5.1 30 38 A K H > S+ 0 0 41 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.909 116.1 47.2 -55.8 -49.3 8.2 14.1 6.2 31 39 A V H X S+ 0 0 1 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.946 111.3 50.2 -58.8 -52.4 9.7 11.3 4.2 32 40 A W H X S+ 0 0 1 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.893 111.7 48.9 -54.5 -45.1 13.2 12.0 5.4 33 41 A V H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.885 113.4 45.2 -65.2 -40.5 12.1 12.1 9.1 34 42 A S H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.912 110.1 54.6 -71.4 -40.6 10.1 8.8 8.9 35 43 A E H < S+ 0 0 9 -4,-3.1 4,-0.3 1,-0.2 -1,-0.2 0.874 111.4 45.9 -60.7 -34.9 12.9 7.1 7.0 36 44 A V H >< S+ 0 0 6 -4,-1.8 3,-1.0 -5,-0.2 -1,-0.2 0.899 112.2 49.8 -74.5 -38.3 15.3 8.1 9.8 37 45 A M H 3< S+ 0 0 0 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.829 105.4 59.4 -67.2 -31.8 12.9 7.0 12.6 38 46 A L T >< S+ 0 0 37 -4,-2.4 3,-1.4 -5,-0.1 2,-0.4 0.549 73.8 116.7 -76.5 -7.6 12.4 3.6 10.9 39 47 A Q T < S- 0 0 42 -3,-1.0 3,-0.1 -4,-0.3 44,-0.1 -0.483 101.4 -19.3 -66.3 118.1 16.1 2.6 11.0 40 48 A Q T 3 S+ 0 0 151 -2,-0.4 2,-0.3 1,-0.1 -1,-0.3 0.844 121.3 103.1 49.6 40.6 16.2 -0.5 13.3 41 49 A T S < S- 0 0 29 -3,-1.4 -1,-0.1 38,-0.0 2,-0.1 -0.980 74.2-111.6-150.5 136.2 12.8 0.4 14.7 42 50 A R >> - 0 0 80 -2,-0.3 4,-2.2 1,-0.1 3,-0.6 -0.416 20.4-124.1 -75.7 145.7 9.4 -1.2 13.9 43 51 A V H 3> S+ 0 0 22 1,-0.3 4,-2.6 2,-0.2 -1,-0.1 0.857 110.6 55.7 -50.7 -46.5 6.6 0.7 12.2 44 52 A E H 34 S+ 0 0 131 1,-0.2 -1,-0.3 2,-0.2 -2,-0.0 0.867 111.6 44.3 -57.6 -38.6 4.1 0.2 15.0 45 53 A T H <> S+ 0 0 71 -3,-0.6 4,-0.8 1,-0.2 -1,-0.2 0.869 114.6 50.3 -73.2 -36.4 6.6 1.7 17.4 46 54 A V H X S+ 0 0 0 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.840 91.8 74.8 -72.2 -35.3 7.4 4.6 15.0 47 55 A I H X S+ 0 0 45 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.905 98.9 43.7 -45.8 -56.0 3.8 5.7 14.2 48 56 A P H > S+ 0 0 75 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.945 116.3 47.4 -56.4 -51.1 3.2 7.4 17.5 49 57 A Y H X S+ 0 0 63 -4,-0.8 4,-3.2 1,-0.2 -2,-0.2 0.879 110.1 52.8 -58.1 -41.7 6.6 9.1 17.6 50 58 A F H X S+ 0 0 11 -4,-3.0 4,-2.9 2,-0.2 5,-0.3 0.960 110.0 48.1 -60.8 -49.3 6.3 10.3 14.0 51 59 A E H X S+ 0 0 97 -4,-2.3 4,-2.0 -5,-0.3 -2,-0.2 0.917 115.5 42.9 -59.3 -45.1 2.9 11.9 14.6 52 60 A Q H X S+ 0 0 62 -4,-2.4 4,-2.8 -5,-0.2 5,-0.3 0.972 113.5 53.7 -64.7 -49.2 4.1 13.7 17.7 53 61 A F H X S+ 0 0 1 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.885 113.0 41.0 -52.2 -48.7 7.4 14.7 16.0 54 62 A I H < S+ 0 0 24 -4,-2.9 -1,-0.2 2,-0.2 -2,-0.2 0.832 111.4 56.7 -70.9 -33.3 5.7 16.3 13.0 55 63 A D H < S+ 0 0 79 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.950 117.4 35.5 -61.1 -47.4 3.0 17.9 15.2 56 64 A R H < S+ 0 0 58 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.785 130.2 33.5 -76.3 -30.2 5.8 19.6 17.2 57 65 A F S < S+ 0 0 4 -4,-2.3 -1,-0.2 -5,-0.3 6,-0.2 -0.564 71.0 172.7-129.1 68.1 8.2 20.1 14.2 58 66 A P + 0 0 65 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.737 64.5 20.0 -43.5 -41.3 5.7 20.8 11.2 59 67 A T S > S- 0 0 71 1,-0.1 4,-2.0 -30,-0.1 5,-0.2 -0.863 83.1-103.5-133.9 167.9 8.5 21.7 8.7 60 68 A L H > S+ 0 0 12 -2,-0.3 4,-2.9 1,-0.2 35,-0.1 0.888 122.4 52.2 -57.2 -38.4 12.2 21.3 8.1 61 69 A E H > S+ 0 0 37 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.917 105.3 52.7 -65.7 -43.3 12.6 24.9 9.2 62 70 A A H > S+ 0 0 34 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.872 113.8 44.5 -60.1 -36.5 10.7 24.4 12.5 63 71 A L H >< S+ 0 0 0 -4,-2.0 3,-0.5 2,-0.2 -2,-0.2 0.923 109.5 56.4 -71.4 -45.2 13.0 21.5 13.2 64 72 A A H 3< S+ 0 0 2 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.895 111.3 43.5 -52.8 -43.6 16.0 23.6 12.2 65 73 A D H 3< S+ 0 0 103 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.704 90.4 106.0 -78.6 -21.1 15.2 26.3 14.7 66 74 A A S << S- 0 0 10 -4,-1.1 2,-0.0 -3,-0.5 -9,-0.0 -0.267 79.4-106.4 -65.6 144.1 14.3 24.1 17.7 67 75 A D >> - 0 0 120 1,-0.1 4,-1.7 4,-0.0 3,-0.6 -0.413 29.6-125.2 -63.1 142.5 16.7 23.8 20.6 68 76 A E H 3> S+ 0 0 54 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.833 107.8 65.4 -63.7 -30.0 18.3 20.4 20.5 69 77 A D H 3> S+ 0 0 60 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.903 104.1 46.2 -57.2 -40.2 17.1 19.5 24.0 70 78 A E H <> S+ 0 0 95 -3,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.952 109.2 55.6 -65.7 -47.4 13.5 19.7 22.7 71 79 A V H X S+ 0 0 0 -4,-1.7 4,-0.9 1,-0.2 -2,-0.2 0.921 108.8 47.0 -50.7 -49.8 14.5 17.6 19.7 72 80 A L H >X S+ 0 0 1 -4,-3.0 3,-2.0 1,-0.2 4,-1.2 0.952 107.1 56.7 -59.0 -48.6 15.9 14.9 22.0 73 81 A K H >< S+ 0 0 62 -4,-2.2 3,-0.6 1,-0.3 -1,-0.2 0.868 104.4 53.7 -49.4 -39.8 12.8 15.0 24.2 74 82 A A H 3< S+ 0 0 27 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.731 112.3 44.4 -68.1 -21.8 10.7 14.3 21.0 75 83 A W H X< S+ 0 0 0 -3,-2.0 3,-3.0 -4,-0.9 4,-0.4 0.504 81.4 138.2 -99.3 -8.0 12.9 11.2 20.4 76 84 A E T << S+ 0 0 36 -4,-1.2 -3,-0.1 -3,-0.6 -4,-0.0 -0.131 75.4 12.1 -46.3 118.5 12.9 10.0 24.0 77 85 A G T 3 S+ 0 0 26 255,-0.1 -1,-0.3 254,-0.0 -2,-0.1 0.265 98.9 101.2 97.1 -10.4 12.4 6.3 24.1 78 86 A L S < S- 0 0 13 -3,-3.0 -2,-0.1 1,-0.1 -33,-0.0 0.804 76.0-139.7 -78.6 -28.5 13.1 5.7 20.4 79 87 A G S S+ 0 0 24 -4,-0.4 4,-0.1 -38,-0.0 -1,-0.1 0.028 75.1 62.0 89.8 161.0 16.7 4.5 20.8 80 88 A Y > - 0 0 113 1,-0.1 3,-2.3 2,-0.1 4,-0.3 0.940 64.4-175.4 46.6 52.4 19.9 5.1 18.8 81 89 A Y T >> + 0 0 19 1,-0.3 4,-1.3 2,-0.2 3,-0.9 0.653 68.1 79.7 -53.5 -21.6 19.4 8.8 19.8 82 90 A S H 3> S+ 0 0 60 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.797 81.9 69.8 -58.7 -26.8 22.4 9.8 17.6 83 91 A R H <> S+ 0 0 18 -3,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.894 99.9 43.7 -58.0 -44.9 20.0 9.6 14.7 84 92 A V H <> S+ 0 0 1 -3,-0.9 4,-2.4 -4,-0.3 -1,-0.2 0.823 110.7 54.5 -74.7 -30.2 18.0 12.6 15.7 85 93 A R H X S+ 0 0 50 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.939 110.7 47.2 -66.4 -43.5 21.1 14.6 16.5 86 94 A N H X S+ 0 0 52 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.873 113.7 47.5 -62.8 -38.5 22.3 13.8 12.9 87 95 A L H X S+ 0 0 3 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.862 108.6 54.7 -72.2 -34.4 19.0 14.8 11.5 88 96 A H H X S+ 0 0 1 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.916 113.4 42.4 -65.2 -39.9 18.9 18.0 13.5 89 97 A A H X S+ 0 0 44 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.967 111.6 53.1 -68.7 -54.3 22.3 19.0 12.1 90 98 A A H X S+ 0 0 1 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.876 112.3 47.1 -47.9 -43.1 21.4 17.9 8.5 91 99 A V H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.947 108.6 51.9 -66.9 -49.9 18.3 20.1 8.7 92 100 A K H X S+ 0 0 85 -4,-2.2 4,-2.2 1,-0.2 5,-0.3 0.873 111.5 50.8 -53.9 -36.1 20.1 23.1 10.1 93 101 A E H X S+ 0 0 66 -4,-2.7 4,-1.6 1,-0.2 5,-0.3 0.925 108.9 49.6 -68.6 -43.0 22.5 22.6 7.2 94 102 A V H X S+ 0 0 0 -4,-2.2 6,-1.7 -5,-0.2 4,-0.5 0.830 112.7 47.4 -66.3 -31.6 19.7 22.5 4.7 95 103 A K H X S+ 0 0 76 -4,-2.5 4,-0.8 4,-0.2 5,-0.4 0.972 121.4 34.4 -71.5 -55.3 18.1 25.7 6.1 96 104 A T H >< S+ 0 0 84 -4,-2.2 3,-0.5 -5,-0.2 -2,-0.2 0.995 131.9 24.4 -64.2 -69.4 21.3 27.7 6.2 97 105 A R H 3< S+ 0 0 172 -4,-1.6 -1,-0.2 -5,-0.3 -3,-0.2 0.344 130.0 39.3 -85.7 10.0 23.3 26.5 3.2 98 106 A Y H >< S- 0 0 81 -4,-0.5 3,-1.2 -5,-0.3 -1,-0.2 0.339 104.4-109.2-138.2 9.0 20.4 25.3 1.0 99 107 A G T << S- 0 0 68 -4,-0.8 -4,-0.2 -3,-0.5 -3,-0.2 0.869 70.8 -67.7 65.1 37.3 17.5 27.7 1.4 100 108 A G T 3 S+ 0 0 36 -6,-1.7 2,-0.7 -5,-0.4 -1,-0.2 0.549 107.6 123.2 61.1 8.2 15.4 25.2 3.4 101 109 A K < - 0 0 116 -3,-1.2 -1,-0.2 -7,-0.5 3,-0.1 -0.885 65.0-127.7-108.0 109.0 15.1 23.1 0.3 102 110 A V - 0 0 6 -2,-0.7 7,-0.1 1,-0.1 -11,-0.0 -0.289 35.2-105.7 -54.2 123.4 16.3 19.5 0.7 103 111 A P - 0 0 6 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.076 23.3-161.6 -48.7 148.1 18.8 18.7 -2.1 104 112 A D + 0 0 82 -3,-0.1 3,-0.1 24,-0.0 -2,-0.1 0.176 66.8 95.0-117.9 12.3 17.4 16.4 -4.9 105 113 A D S >> S- 0 0 60 1,-0.2 4,-2.4 25,-0.0 3,-0.9 -0.930 72.5-141.7-108.6 114.5 20.9 15.6 -6.0 106 114 A P H 3> S+ 0 0 32 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.862 102.4 49.3 -35.6 -62.4 22.3 12.3 -4.5 107 115 A D H 3> S+ 0 0 128 1,-0.2 4,-0.6 2,-0.2 13,-0.0 0.877 116.7 44.4 -49.9 -42.3 25.8 13.6 -4.1 108 116 A E H X4 S+ 0 0 77 -3,-0.9 3,-1.5 2,-0.2 4,-0.5 0.979 115.7 42.0 -67.9 -60.6 24.4 16.7 -2.4 109 117 A F H >< S+ 0 0 0 -4,-2.4 3,-1.3 1,-0.3 -2,-0.2 0.855 109.4 64.3 -55.9 -35.1 21.8 15.2 -0.1 110 118 A S H 3< S+ 0 0 51 -4,-3.2 -1,-0.3 -5,-0.4 -2,-0.2 0.731 90.3 62.9 -64.0 -25.0 24.4 12.5 0.7 111 119 A R T << S+ 0 0 85 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.696 82.4 99.9 -76.0 -17.1 26.8 14.9 2.3 112 120 A L S X S- 0 0 10 -3,-1.3 3,-1.4 -4,-0.5 -25,-0.1 -0.327 88.8 -91.5 -67.7 148.9 24.3 15.7 5.1 113 121 A K T 3 S+ 0 0 63 1,-0.2 -23,-0.2 -27,-0.2 -1,-0.1 -0.326 108.1 17.8 -62.9 143.3 24.8 14.0 8.5 114 122 A G T 3 S+ 0 0 35 1,-0.1 2,-1.1 -3,-0.1 -1,-0.2 0.276 91.5 120.7 82.0 -9.6 22.9 10.8 9.0 115 123 A V < + 0 0 10 -3,-1.4 -1,-0.1 -5,-0.2 -3,-0.0 -0.701 35.6 167.9 -94.5 92.5 22.3 10.2 5.3 116 124 A G > - 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