==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-MAR-11 3R09 . COMPND 2 MOLECULE: HYDROLASE, HALOACID DEHALOGENASE-LIKE FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS FLUORESCENS; . AUTHOR M.W.VETTING,Y.PATSKOVSKY,R.TORO,J.FREEMAN,S.MILLER,J.M.SAUDE . 197 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10533.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 145 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 3.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 0.5 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 . 9 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 33.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.0 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 0 0 2 0 0 5 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 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 0 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 59 0, 0.0 3,-1.4 0, 0.0 4,-0.4 0.000 360.0 360.0 360.0 142.0 58.1 18.9 30.6 2 3 A L G > + 0 0 0 1,-0.3 3,-1.6 2,-0.2 192,-0.1 0.864 360.0 60.5 -62.9 -36.9 56.6 15.8 28.8 3 4 A S G 3 S+ 0 0 35 1,-0.3 -1,-0.3 191,-0.2 191,-0.1 0.630 95.0 65.2 -68.0 -12.4 55.9 14.1 32.1 4 5 A E G < S+ 0 0 137 -3,-1.4 2,-0.5 2,-0.0 -1,-0.3 0.641 80.6 92.8 -83.3 -14.7 53.6 17.1 32.9 5 6 A I < + 0 0 13 -3,-1.6 141,-0.1 -4,-0.4 3,-0.1 -0.693 46.5 171.8 -80.4 123.8 51.3 16.1 30.1 6 7 A K + 0 0 116 139,-0.6 81,-2.8 -2,-0.5 2,-0.4 0.255 60.2 69.9-118.2 10.5 48.5 13.9 31.5 7 8 A H E +ab 87 146A 43 138,-0.6 140,-1.7 79,-0.2 2,-0.4 -0.952 64.1 179.8-132.4 111.7 46.3 13.8 28.4 8 9 A W E -ab 88 147A 0 79,-2.6 81,-2.9 -2,-0.4 2,-0.4 -0.913 12.0-165.5-121.3 137.3 47.7 11.8 25.5 9 10 A V E -ab 89 148A 0 138,-2.6 140,-3.1 -2,-0.4 2,-0.4 -0.983 11.2-158.7-125.5 132.3 46.2 11.1 22.1 10 11 A F E -ab 90 149A 0 79,-2.4 81,-2.4 -2,-0.4 140,-0.2 -0.899 15.0-139.3-116.3 138.8 47.5 8.4 19.7 11 12 A D - 0 0 11 138,-2.4 5,-0.4 -2,-0.4 81,-0.2 -0.448 20.9-148.8 -71.2 162.9 47.3 7.8 16.0 12 13 A X S >>>S+ 0 0 0 79,-0.3 5,-2.1 1,-0.2 3,-1.4 0.846 70.4 59.6-100.9 -76.1 46.8 4.1 15.2 13 14 A D B 345S+f 17 0B 48 1,-0.3 138,-0.2 2,-0.2 -1,-0.2 -0.417 122.6 5.6 -64.1 120.9 48.4 3.0 11.9 14 15 A G T 345S+ 0 0 17 3,-2.7 -1,-0.3 -2,-0.3 4,-0.1 0.214 132.0 56.3 92.2 -15.9 52.2 3.6 11.9 15 16 A T T <45S+ 0 0 0 -3,-1.4 172,-0.2 2,-0.2 -3,-0.2 0.785 122.0 11.3-111.5 -67.3 52.2 4.7 15.6 16 17 A L T <5S+ 0 0 0 -4,-1.4 55,-2.5 -5,-0.4 2,-0.3 0.751 136.6 26.8 -84.3 -28.7 50.7 2.1 17.9 17 18 A T E < -fG 13 70B 2 -5,-2.1 -3,-2.7 53,-0.3 2,-0.3 -0.941 65.5-158.8-131.3 157.0 50.7 -0.6 15.2 18 19 A I E - G 0 69B 43 51,-2.8 51,-2.3 -2,-0.3 2,-0.2 -0.979 28.6-106.3-132.1 148.4 52.6 -1.4 12.0 19 20 A A E - G 0 68B 41 -2,-0.3 2,-0.3 49,-0.2 49,-0.3 -0.488 31.4-150.8 -67.6 137.7 51.8 -3.5 9.0 20 21 A V E - 0 0 33 47,-2.3 46,-2.7 -2,-0.2 2,-0.3 -0.787 11.6-150.4-104.3 158.3 53.6 -6.8 8.7 21 22 A H E - G 0 65B 52 -2,-0.3 2,-1.3 44,-0.3 44,-0.2 -0.880 28.7 -92.0-131.9 160.8 54.4 -8.4 5.3 22 23 A D > - 0 0 53 42,-2.5 4,-2.2 -2,-0.3 5,-0.2 -0.554 38.8-174.8 -74.7 93.9 54.8 -11.9 3.9 23 24 A F H > S+ 0 0 132 -2,-1.3 4,-2.8 1,-0.2 5,-0.2 0.893 80.9 51.1 -58.2 -44.9 58.6 -12.4 4.3 24 25 A A H > S+ 0 0 72 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.915 110.8 48.0 -63.3 -42.0 58.7 -15.7 2.5 25 26 A A H > S+ 0 0 32 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.902 113.0 49.6 -64.5 -39.8 56.8 -14.4 -0.5 26 27 A I H X S+ 0 0 9 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.943 110.7 48.9 -63.0 -47.8 59.1 -11.4 -0.6 27 28 A R H <>S+ 0 0 68 -4,-2.8 5,-2.5 1,-0.2 4,-0.3 0.873 114.1 46.6 -59.9 -39.5 62.2 -13.5 -0.4 28 29 A E H ><5S+ 0 0 167 -4,-2.2 3,-0.8 3,-0.2 -2,-0.2 0.946 114.7 45.3 -68.1 -49.2 60.9 -15.8 -3.3 29 30 A A H 3<5S+ 0 0 48 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.860 120.8 38.1 -64.5 -38.5 59.9 -12.9 -5.6 30 31 A L T 3<5S- 0 0 5 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.334 108.7-121.8 -97.8 6.5 63.1 -10.9 -5.1 31 32 A S T < 5 + 0 0 84 -3,-0.8 -3,-0.2 -4,-0.3 -4,-0.1 0.926 45.7 173.7 54.5 53.2 65.3 -13.9 -5.0 32 33 A I < - 0 0 14 -5,-2.5 -1,-0.2 -6,-0.2 6,-0.1 -0.781 31.9-121.0 -92.2 130.9 66.8 -13.3 -1.6 33 34 A P > - 0 0 58 0, 0.0 3,-1.9 0, 0.0 8,-0.1 -0.425 21.1-119.9 -67.2 146.4 69.1 -16.0 -0.1 34 35 A A T 3 S+ 0 0 98 1,-0.3 4,-0.1 -2,-0.1 -2,-0.0 0.795 112.3 56.4 -54.5 -32.5 67.9 -17.5 3.2 35 36 A E T 3 S+ 0 0 194 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.535 97.4 79.5 -81.9 -5.6 71.2 -16.4 4.9 36 37 A D S < S- 0 0 62 -3,-1.9 2,-0.3 4,-0.0 3,-0.0 -0.790 80.2-122.4-104.1 146.3 70.7 -12.7 3.9 37 38 A D > - 0 0 93 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.627 30.9-122.6 -76.1 142.9 68.5 -10.1 5.5 38 39 A I H > S+ 0 0 17 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.937 106.1 38.3 -55.5 -55.3 66.1 -8.7 2.8 39 40 A L H > S+ 0 0 105 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.892 115.9 51.8 -67.4 -41.2 67.0 -5.0 3.0 40 41 A T H > S+ 0 0 96 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.908 111.1 49.5 -61.4 -41.9 70.8 -5.6 3.4 41 42 A H H >X S+ 0 0 35 -4,-2.5 3,-0.6 1,-0.2 4,-0.6 0.933 111.7 47.1 -62.5 -46.7 70.7 -7.9 0.4 42 43 A L H >< S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.893 107.6 56.5 -63.3 -38.7 68.9 -5.4 -1.8 43 44 A A H 3< S+ 0 0 78 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.784 107.2 51.1 -64.5 -23.9 71.2 -2.5 -0.7 44 45 A A H << S+ 0 0 85 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.533 90.2 96.6 -93.3 -9.1 74.1 -4.6 -1.9 45 46 A L S << S- 0 0 31 -3,-1.1 -3,-0.0 -4,-0.6 5,-0.0 -0.337 94.7 -76.0 -72.5 160.0 72.8 -5.4 -5.4 46 47 A P > - 0 0 86 0, 0.0 4,-2.6 0, 0.0 3,-0.3 -0.257 52.5-109.5 -48.2 149.1 73.7 -3.4 -8.5 47 48 A A H > S+ 0 0 77 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.824 115.5 50.3 -59.8 -36.2 71.8 -0.1 -8.3 48 49 A D H > S+ 0 0 145 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.860 113.4 43.9 -73.5 -36.9 69.5 -0.9 -11.2 49 50 A E H > S+ 0 0 77 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.881 114.2 51.7 -74.1 -38.1 68.5 -4.3 -9.9 50 51 A S H X S+ 0 0 18 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.935 110.9 47.4 -62.1 -49.1 68.1 -2.8 -6.4 51 52 A A H X S+ 0 0 59 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.916 112.4 49.5 -58.4 -47.1 65.8 -0.0 -7.7 52 53 A A H X S+ 0 0 62 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.915 114.1 45.3 -60.1 -43.0 63.7 -2.5 -9.7 53 54 A K H X S+ 0 0 35 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.902 113.2 48.7 -73.4 -38.4 63.3 -4.8 -6.7 54 55 A H H X S+ 0 0 73 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.893 110.6 51.8 -63.2 -40.3 62.5 -2.0 -4.3 55 56 A A H X S+ 0 0 58 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.892 109.8 49.8 -65.0 -37.6 59.9 -0.5 -6.7 56 57 A W H X S+ 0 0 90 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.926 108.9 51.8 -65.5 -43.3 58.3 -3.9 -7.0 57 58 A L H < S+ 0 0 35 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.926 113.5 44.2 -59.1 -45.3 58.1 -4.3 -3.2 58 59 A L H >< S+ 0 0 140 -4,-2.3 3,-1.5 1,-0.2 4,-0.3 0.906 109.8 55.7 -66.8 -43.2 56.5 -0.9 -2.9 59 60 A E H 3< S+ 0 0 150 -4,-2.6 3,-0.3 1,-0.3 -1,-0.2 0.837 115.6 38.5 -57.4 -34.8 54.1 -1.5 -5.8 60 61 A H T 3X S+ 0 0 51 -4,-1.8 4,-1.9 1,-0.2 -1,-0.3 0.046 76.1 122.0-108.5 25.9 52.8 -4.7 -4.1 61 62 A E H <> S+ 0 0 56 -3,-1.5 4,-0.6 1,-0.2 -1,-0.2 0.904 80.7 43.5 -54.4 -45.4 52.8 -3.5 -0.5 62 63 A R H 4 S+ 0 0 166 -3,-0.3 3,-0.5 -4,-0.3 -1,-0.2 0.853 111.4 53.6 -73.3 -34.3 49.1 -4.3 -0.1 63 64 A D H 4 S+ 0 0 123 1,-0.2 -1,-0.2 -4,-0.1 -2,-0.2 0.824 114.3 43.1 -64.7 -31.3 49.4 -7.7 -1.8 64 65 A L H < S+ 0 0 16 -4,-1.9 -42,-2.5 -7,-0.2 -1,-0.2 0.499 89.4 113.8 -95.2 -6.9 52.1 -8.6 0.6 65 66 A A E < -G 21 0B 23 -4,-0.6 -44,-0.3 -3,-0.5 3,-0.1 -0.391 41.2-173.3 -72.6 144.6 50.5 -7.3 3.8 66 67 A Q E - 0 0 112 -46,-2.7 -45,-0.1 1,-0.6 -1,-0.1 -0.425 52.9 -84.8-133.4 57.2 49.4 -9.7 6.5 67 68 A G E - 0 0 55 -47,-0.1 -47,-2.3 -48,-0.1 -1,-0.6 -0.373 63.1 -72.6 73.9-153.2 47.6 -7.5 9.0 68 69 A S E -G 19 0B 61 -49,-0.3 -49,-0.2 -3,-0.1 -55,-0.0 -0.830 29.4-156.1-137.9 170.8 49.5 -5.7 11.7 69 70 A R E -G 18 0B 121 -51,-2.3 -51,-2.8 -2,-0.3 37,-0.1 -0.936 44.1 -74.9-142.6 163.8 51.4 -6.0 14.9 70 71 A P E -G 17 0B 49 0, 0.0 -53,-0.3 0, 0.0 3,-0.1 -0.343 51.6-115.7 -59.9 139.3 52.2 -3.7 17.8 71 72 A A >> - 0 0 2 -55,-2.5 3,-2.2 1,-0.2 4,-0.5 -0.404 50.6 -73.2 -71.4 154.4 54.9 -1.1 17.0 72 73 A P T 34 S- 0 0 60 0, 0.0 115,-1.0 0, 0.0 116,-0.7 -0.262 117.1 -2.7 -52.3 125.4 58.1 -1.4 19.0 73 74 A G T 3> S+ 0 0 5 114,-0.2 4,-2.7 113,-0.1 5,-0.2 0.384 98.7 117.7 77.0 -3.4 57.5 -0.2 22.6 74 75 A A H <> S+ 0 0 0 -3,-2.2 4,-2.4 2,-0.2 5,-0.2 0.937 76.0 43.2 -65.5 -50.3 53.9 0.8 21.9 75 76 A V H X S+ 0 0 34 -4,-0.5 4,-2.4 1,-0.2 5,-0.2 0.925 115.8 51.5 -59.2 -42.5 52.2 -1.6 24.4 76 77 A E H > S+ 0 0 109 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.907 111.0 46.7 -61.9 -45.1 54.9 -0.7 27.0 77 78 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.945 113.1 47.5 -64.0 -49.3 54.3 3.0 26.6 78 79 A V H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.893 113.1 48.6 -63.0 -40.9 50.5 2.9 26.7 79 80 A R H X S+ 0 0 158 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.887 110.3 52.1 -65.4 -39.2 50.6 0.6 29.8 80 81 A E H X S+ 0 0 62 -4,-2.0 4,-0.9 -5,-0.2 -2,-0.2 0.943 113.9 43.1 -60.5 -47.5 53.1 2.9 31.5 81 82 A L H ><>S+ 0 0 0 -4,-2.6 5,-1.8 2,-0.2 3,-0.6 0.904 114.0 49.8 -65.7 -44.7 50.8 6.0 30.9 82 83 A A H ><5S+ 0 0 32 -4,-2.8 3,-1.8 1,-0.2 -1,-0.2 0.897 106.4 57.7 -60.1 -38.9 47.6 4.1 31.8 83 84 A G H 3<5S+ 0 0 70 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.772 101.0 56.3 -63.4 -26.4 49.4 3.0 35.0 84 85 A R T <<5S- 0 0 88 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.505 118.3-113.3 -79.6 -5.7 50.0 6.7 35.9 85 86 A G T < 5 + 0 0 65 -3,-1.8 -3,-0.2 -4,-0.3 -2,-0.1 0.573 62.5 159.3 80.1 10.0 46.2 7.2 35.7 86 87 A Y < - 0 0 33 -5,-1.8 2,-0.5 1,-0.1 -1,-0.2 -0.231 46.5-110.8 -65.6 156.0 46.7 9.5 32.6 87 88 A R E -a 7 0A 122 -81,-2.8 -79,-2.6 25,-0.0 2,-0.4 -0.777 39.4-166.7 -90.4 126.0 43.8 10.1 30.2 88 89 A L E +a 8 0A 4 -2,-0.5 25,-0.5 23,-0.3 2,-0.3 -0.924 10.7 173.4-122.5 137.7 44.4 8.4 26.9 89 90 A G E -a 9 0A 0 -81,-2.9 -79,-2.4 -2,-0.4 2,-0.4 -0.825 19.1-141.0-132.9 172.8 42.7 8.8 23.5 90 91 A I E -ac 10 117A 0 26,-2.2 28,-2.8 -2,-0.3 2,-0.4 -0.996 6.2-170.0-135.8 138.8 43.0 7.7 19.9 91 92 A L E + c 0 118A 4 -81,-2.4 2,-0.3 -2,-0.4 -79,-0.3 -0.917 28.1 157.7-129.8 104.3 42.3 9.6 16.7 92 93 A T - 0 0 7 26,-2.7 31,-0.2 -2,-0.4 4,-0.1 -0.922 51.4-136.2-131.6 151.1 42.3 7.3 13.7 93 94 A R S S+ 0 0 186 -2,-0.3 27,-0.2 26,-0.1 26,-0.1 0.684 81.4 101.8 -74.1 -18.3 41.0 7.2 10.2 94 95 A N S S- 0 0 26 25,-0.1 26,-2.0 24,-0.1 -2,-0.2 -0.276 89.6 -95.2 -62.7 150.5 39.9 3.6 10.9 95 96 A A > - 0 0 19 24,-0.3 4,-2.4 25,-0.2 5,-0.2 -0.416 36.1-117.6 -60.7 143.9 36.3 2.8 11.7 96 97 A R H > S+ 0 0 74 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.876 113.1 55.9 -54.4 -43.4 35.8 2.7 15.5 97 98 A E H > S+ 0 0 114 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.927 110.3 44.4 -55.7 -49.2 34.8 -1.0 15.4 98 99 A L H > S+ 0 0 88 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.903 111.2 53.3 -63.3 -42.9 38.0 -2.0 13.7 99 100 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.919 109.7 50.5 -56.9 -41.8 40.1 0.3 16.0 100 101 A H H X S+ 0 0 71 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.941 109.8 48.6 -62.0 -49.3 38.4 -1.5 18.9 101 102 A V H X S+ 0 0 90 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.924 112.3 49.1 -56.4 -48.3 39.2 -5.0 17.5 102 103 A T H X S+ 0 0 20 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.931 109.2 52.1 -57.2 -48.3 42.9 -4.0 16.9 103 104 A L H <>S+ 0 0 3 -4,-2.6 5,-3.0 1,-0.2 6,-0.8 0.898 111.4 47.5 -57.5 -41.3 43.2 -2.6 20.5 104 105 A E H ><5S+ 0 0 110 -4,-2.3 3,-1.3 4,-0.2 -1,-0.2 0.929 109.2 54.4 -63.6 -46.4 41.9 -5.9 21.9 105 106 A A H 3<5S+ 0 0 83 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.900 112.6 41.8 -53.5 -45.2 44.2 -7.9 19.7 106 107 A I T 3<5S- 0 0 22 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.369 117.1-111.8 -92.0 5.9 47.3 -6.0 21.0 107 108 A G T < 5S+ 0 0 45 -3,-1.3 -3,-0.2 -4,-0.3 -2,-0.1 0.846 88.3 105.8 74.1 38.3 46.1 -6.1 24.6 108 109 A L > < + 0 0 0 -5,-3.0 3,-1.9 -6,-0.1 4,-0.4 0.268 35.8 108.2-129.2 6.8 45.4 -2.4 25.1 109 110 A A G > S+ 0 0 20 -6,-0.8 3,-0.9 1,-0.3 -5,-0.1 0.821 79.6 55.5 -57.3 -33.0 41.6 -2.2 25.0 110 111 A D G 3 S+ 0 0 141 1,-0.2 -1,-0.3 -7,-0.2 -2,-0.1 0.529 96.2 67.3 -79.1 -5.5 41.4 -1.6 28.8 111 112 A C G < S+ 0 0 21 -3,-1.9 2,-0.4 1,-0.1 -23,-0.3 0.557 98.1 53.8 -92.3 -9.3 43.8 1.5 28.5 112 113 A F S < S- 0 0 11 -3,-0.9 2,-0.2 -4,-0.4 -23,-0.1 -0.991 81.4-126.0-128.7 129.4 41.3 3.6 26.6 113 114 A A > - 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