==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-JAN-05 1YNS . COMPND 2 MOLECULE: E-1 ENZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.WANG,H.PANG,M.BARTLAM,Z.RAO . 254 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12771.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 11.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 2 0.8 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 . 14 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 39.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.1 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 0 0 2 0 0 2 1 1 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 . 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 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 4 A L 0 0 130 0, 0.0 252,-4.7 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 -68.2 40.3 -15.0 -5.5 2 5 A S B -a 253 0A 88 250,-0.2 252,-0.2 252,-0.0 3,-0.1 -0.870 360.0-133.0-102.1 113.2 40.7 -15.9 -1.8 3 6 A V - 0 0 16 250,-2.8 202,-0.0 -2,-0.7 249,-0.0 -0.331 26.8-104.7 -64.6 138.0 41.8 -12.9 0.3 4 7 A P > - 0 0 47 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.342 28.4-118.5 -62.7 145.6 44.7 -13.5 2.7 5 8 A A T 3 S+ 0 0 111 1,-0.3 -2,-0.1 -3,-0.1 198,-0.0 0.765 110.1 63.3 -55.5 -28.9 43.6 -13.8 6.4 6 9 A E T 3 S+ 0 0 87 196,-0.1 2,-0.3 198,-0.0 -1,-0.3 0.609 78.3 106.7 -75.1 -12.0 45.6 -10.7 7.3 7 10 A V < + 0 0 3 -3,-1.9 197,-0.2 1,-0.2 196,-0.1 -0.532 27.3 156.3 -74.5 130.5 43.6 -8.4 5.1 8 11 A T + 0 0 67 195,-2.5 137,-2.0 -2,-0.3 2,-0.4 0.363 62.2 56.7-127.6 -6.2 41.2 -6.1 7.0 9 12 A V E -bc 145 204B 0 194,-2.3 196,-2.4 135,-0.2 2,-0.6 -0.995 59.0-157.9-135.9 135.1 41.0 -3.3 4.3 10 13 A I E -bc 146 205B 0 135,-2.6 137,-2.2 -2,-0.4 2,-0.6 -0.948 12.9-160.2-111.6 118.9 39.9 -3.3 0.6 11 14 A L E -bc 147 206B 1 194,-2.7 196,-2.6 -2,-0.6 2,-0.5 -0.880 12.1-155.5-101.2 124.9 41.3 -0.3 -1.3 12 15 A L E -bc 148 207B 3 135,-3.2 137,-2.5 -2,-0.6 196,-0.1 -0.871 12.8-154.4-113.4 129.2 39.4 0.5 -4.6 13 16 A D - 0 0 7 194,-2.1 5,-0.2 -2,-0.5 137,-0.2 -0.417 16.0-151.9 -78.7 164.9 40.5 2.2 -7.8 14 17 A I >>> + 0 0 6 135,-0.3 3,-2.4 3,-0.2 5,-2.2 0.779 66.4 64.7-106.4 -75.4 37.5 3.7 -9.7 15 18 A E B 345S+g 19 0C 72 1,-0.3 194,-0.4 2,-0.2 -1,-0.1 -0.261 121.7 3.5 -57.0 127.1 38.0 4.0 -13.5 16 19 A G T 345S+ 0 0 0 3,-3.3 -1,-0.3 1,-0.1 213,-0.1 0.398 133.6 59.7 79.0 -3.5 38.3 0.6 -15.1 17 20 A T T <45S+ 0 0 0 -3,-2.4 -2,-0.2 2,-0.4 -3,-0.2 0.728 124.8 0.4-118.7 -63.5 37.6 -1.0 -11.7 18 21 A T T <5S+ 0 0 1 -4,-2.1 111,-2.2 1,-0.2 114,-0.2 0.654 136.4 41.4-100.0 -21.5 34.3 -0.0 -10.2 19 22 A T B > - 0 0 11 0, 0.0 4,-1.4 0, 0.0 3,-0.6 -0.249 21.3-128.7 -62.5 146.7 33.7 1.7 -16.9 21 24 A I H 3> S+ 0 0 36 209,-0.4 4,-3.2 1,-0.2 5,-0.4 0.872 107.0 65.2 -59.7 -37.3 36.3 3.8 -18.7 22 25 A A H 3> S+ 0 0 53 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.859 100.2 50.5 -55.2 -38.7 33.7 4.8 -21.2 23 26 A F H <>>S+ 0 0 3 -3,-0.6 5,-2.8 3,-0.2 4,-1.4 0.949 116.5 39.5 -66.2 -48.3 31.8 6.7 -18.5 24 27 A V H <>S+ 0 0 13 -4,-1.4 5,-1.8 3,-0.2 -2,-0.2 0.973 125.1 35.7 -65.5 -55.1 34.8 8.6 -17.3 25 28 A K H <5S+ 0 0 127 -4,-3.2 -3,-0.2 1,-0.2 -2,-0.2 0.866 129.1 30.6 -69.8 -38.4 36.4 9.3 -20.7 26 29 A D H <5S+ 0 0 94 -4,-2.1 -3,-0.2 -5,-0.4 -1,-0.2 0.527 133.6 18.1-103.0 -5.7 33.2 9.8 -22.8 27 30 A I T X5S+ 0 0 78 -4,-1.4 4,-1.7 -5,-0.3 -3,-0.2 0.641 117.4 48.3-126.1 -61.4 30.7 11.2 -20.3 28 31 A L H >> S+ 0 0 34 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.841 96.9 69.8 -57.4 -27.9 33.3 15.8 -22.0 31 34 A Y H 3X S+ 0 0 23 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.871 94.0 56.2 -54.4 -39.2 30.4 17.2 -19.9 32 35 A I H XX S+ 0 0 0 -3,-1.4 4,-2.1 -4,-0.5 3,-0.5 0.953 106.2 47.1 -60.4 -52.8 32.8 19.9 -18.7 33 36 A E H 3< S+ 0 0 92 -4,-1.0 4,-0.4 1,-0.2 -1,-0.2 0.873 113.4 50.6 -58.4 -35.9 33.6 21.2 -22.2 34 37 A E H 3< S+ 0 0 154 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.781 121.7 30.2 -73.5 -26.4 29.9 21.1 -23.2 35 38 A N H S+ 0 0 87 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.962 116.2 44.1 -64.3 -50.1 30.3 28.5 -21.0 38 41 A E H > S+ 0 0 104 -4,-0.3 4,-2.5 1,-0.2 5,-0.2 0.919 114.8 50.9 -57.5 -46.2 26.6 28.1 -19.9 39 42 A Y H X S+ 0 0 20 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.936 112.8 44.1 -58.2 -50.6 27.8 27.5 -16.3 40 43 A L H X S+ 0 0 0 -4,-2.6 4,-0.9 -5,-0.2 -1,-0.2 0.887 112.8 52.6 -64.5 -38.2 30.0 30.6 -16.2 41 44 A Q H < S+ 0 0 113 -4,-2.6 3,-0.3 -5,-0.2 -1,-0.2 0.928 115.5 40.7 -61.6 -46.7 27.3 32.7 -17.8 42 45 A T H < S+ 0 0 92 -4,-2.5 3,-0.3 -5,-0.2 -2,-0.2 0.869 125.6 31.4 -71.4 -40.3 24.7 31.7 -15.3 43 46 A H H >< S+ 0 0 50 -4,-2.5 3,-1.6 -5,-0.2 6,-0.3 0.183 76.4 118.3-109.7 18.7 26.8 31.7 -12.1 44 47 A W T 3< S+ 0 0 44 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.1 0.843 76.9 53.6 -52.1 -39.5 29.3 34.5 -12.8 45 48 A E T 3 S+ 0 0 155 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.666 83.2 110.6 -72.3 -17.7 28.0 36.5 -9.8 46 49 A E S <> S- 0 0 84 -3,-1.6 4,-2.6 1,-0.1 5,-0.2 -0.354 71.7-134.7 -61.1 135.6 28.5 33.7 -7.3 47 50 A E H > S+ 0 0 156 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.874 107.9 52.0 -56.0 -40.3 31.3 34.3 -4.9 48 51 A E H > S+ 0 0 48 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.888 109.4 48.4 -65.6 -39.8 32.5 30.7 -5.5 49 52 A C H > S+ 0 0 0 -6,-0.3 4,-2.9 2,-0.2 5,-0.3 0.915 109.5 52.3 -67.0 -41.8 32.5 31.2 -9.2 50 53 A Q H X S+ 0 0 92 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.899 110.9 48.4 -60.7 -38.8 34.5 34.5 -8.8 51 54 A Q H X S+ 0 0 114 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.875 110.8 51.0 -68.5 -38.6 37.0 32.6 -6.7 52 55 A D H X S+ 0 0 1 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.938 111.3 46.5 -64.3 -46.5 37.2 29.8 -9.3 53 56 A V H X S+ 0 0 4 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.858 109.0 57.3 -64.0 -34.0 37.9 32.3 -12.1 54 57 A S H X S+ 0 0 59 -4,-1.8 4,-2.2 -5,-0.3 -1,-0.2 0.932 107.5 46.7 -61.2 -47.1 40.4 34.1 -9.9 55 58 A L H X S+ 0 0 55 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.914 111.6 51.2 -61.8 -43.3 42.4 30.8 -9.6 56 59 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.838 108.2 52.6 -64.6 -32.2 42.2 30.2 -13.3 57 60 A R H X S+ 0 0 52 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.929 109.2 48.8 -68.6 -43.9 43.5 33.7 -14.0 58 61 A K H X S+ 0 0 133 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.938 113.3 47.3 -59.3 -47.3 46.4 33.1 -11.7 59 62 A Q H X S+ 0 0 32 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.893 107.8 55.7 -61.5 -41.5 47.1 29.8 -13.4 60 63 A A H < S+ 0 0 7 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.866 106.5 51.9 -59.8 -36.1 46.8 31.4 -16.9 61 64 A E H >< S+ 0 0 138 -4,-1.9 3,-0.7 1,-0.2 -1,-0.2 0.886 108.6 50.1 -68.0 -38.5 49.5 33.9 -15.9 62 65 A E H 3< S+ 0 0 130 -4,-1.7 3,-0.4 1,-0.2 -1,-0.2 0.771 113.1 46.0 -71.1 -26.1 51.8 31.1 -14.8 63 66 A D T >< S+ 0 0 9 -4,-1.7 3,-2.4 1,-0.2 -1,-0.2 0.413 78.7 108.9 -95.1 0.3 51.3 29.3 -18.1 64 67 A A T < S+ 0 0 75 -3,-0.7 -1,-0.2 -4,-0.4 5,-0.1 0.737 75.4 56.2 -48.3 -28.4 51.7 32.4 -20.2 65 68 A H T 3 S+ 0 0 150 -3,-0.4 -1,-0.3 -4,-0.2 2,-0.1 0.684 84.5 101.6 -80.0 -20.2 55.1 31.1 -21.4 66 69 A L S X S- 0 0 62 -3,-2.4 3,-1.9 1,-0.1 2,-0.3 -0.423 82.8-110.2 -69.6 137.8 53.7 27.9 -22.8 67 70 A D T 3 S+ 0 0 166 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 -0.512 105.9 17.4 -68.1 129.1 53.2 27.7 -26.6 68 71 A G T 3 S+ 0 0 47 1,-0.3 -1,-0.3 -2,-0.3 -2,-0.1 0.419 89.0 155.8 88.4 -1.3 49.5 27.6 -27.3 69 72 A A < - 0 0 25 -3,-1.9 -1,-0.3 -6,-0.2 24,-0.1 -0.319 38.6-135.9 -61.0 139.6 48.6 29.0 -23.8 70 73 A V - 0 0 31 23,-0.1 2,-0.1 -3,-0.1 -7,-0.1 -0.868 18.6-140.7-100.2 121.9 45.3 30.8 -23.7 71 74 A P - 0 0 80 0, 0.0 22,-0.1 0, 0.0 21,-0.1 -0.457 9.5-150.7 -82.3 155.8 45.3 34.0 -21.7 72 75 A I - 0 0 10 -15,-0.2 3,-0.1 -2,-0.1 -11,-0.1 -0.700 31.4-162.0-122.0 73.9 42.6 35.2 -19.4 73 76 A P - 0 0 74 0, 0.0 2,-0.1 0, 0.0 3,-0.1 -0.067 29.7 -85.9 -55.2 154.9 43.2 39.0 -19.8 74 77 A A - 0 0 87 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.433 60.0 -94.3 -63.6 135.6 42.0 41.6 -17.5 75 78 A A - 0 0 51 1,-0.1 -1,-0.1 -2,-0.1 3,-0.1 0.012 22.0-136.3 -48.8 158.1 38.4 42.5 -18.4 76 79 A S S S- 0 0 82 1,-0.2 2,-0.3 6,-0.1 -1,-0.1 0.623 76.5 -38.4 -92.9 -16.8 37.9 45.5 -20.7 77 80 A G - 0 0 34 2,-0.1 -1,-0.2 3,-0.0 -2,-0.0 -0.919 64.1 -91.3-179.4-164.0 35.0 46.8 -18.6 78 81 A N S S+ 0 0 161 -2,-0.3 2,-0.1 -3,-0.1 -3,-0.0 0.088 78.3 116.8-122.1 23.9 32.0 45.5 -16.7 79 82 A G S > S- 0 0 25 1,-0.1 4,-2.4 4,-0.0 5,-0.2 -0.388 81.4-104.3 -84.2 168.4 29.4 45.6 -19.4 80 83 A V H > S+ 0 0 127 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.784 123.3 54.5 -63.9 -25.7 27.7 42.5 -20.7 81 84 A D H > S+ 0 0 94 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.926 108.5 46.7 -72.5 -44.3 29.8 42.8 -23.8 82 85 A D H > S+ 0 0 27 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.907 112.3 52.0 -62.4 -40.0 33.0 42.8 -21.8 83 86 A L H X S+ 0 0 56 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.888 105.0 54.4 -64.5 -39.7 31.7 39.9 -19.8 84 87 A Q H X S+ 0 0 142 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.926 110.5 47.2 -60.6 -41.9 31.0 37.8 -22.9 85 88 A Q H X S+ 0 0 116 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.899 112.1 49.9 -65.1 -42.3 34.6 38.3 -24.0 86 89 A M H X S+ 0 0 20 -4,-2.2 4,-2.2 2,-0.2 3,-0.2 0.960 109.3 51.2 -60.0 -53.4 35.9 37.4 -20.6 87 90 A I H X S+ 0 0 6 -4,-3.0 4,-2.9 1,-0.2 5,-0.2 0.904 107.1 53.7 -51.1 -47.1 33.8 34.2 -20.4 88 91 A Q H X S+ 0 0 69 -4,-2.1 4,-3.1 1,-0.2 -1,-0.2 0.905 107.3 51.9 -57.5 -42.7 35.0 33.1 -23.8 89 92 A A H X S+ 0 0 17 -4,-1.8 4,-2.5 -3,-0.2 -1,-0.2 0.935 111.4 46.0 -60.7 -45.5 38.6 33.5 -22.6 90 93 A V H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.926 113.7 49.6 -63.6 -43.4 38.0 31.4 -19.6 91 94 A V H X S+ 0 0 13 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.946 112.3 47.4 -58.9 -49.5 36.2 28.8 -21.7 92 95 A D H X S+ 0 0 72 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.879 112.3 49.9 -60.2 -40.0 39.0 28.6 -24.2 93 96 A N H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.924 110.8 49.5 -65.8 -43.9 41.6 28.3 -21.4 94 97 A V H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.941 112.1 46.8 -60.8 -49.4 39.7 25.5 -19.8 95 98 A C H X S+ 0 0 35 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.883 110.9 53.8 -62.3 -36.1 39.3 23.5 -23.0 96 99 A W H X S+ 0 0 34 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.960 108.2 48.4 -62.2 -51.0 43.0 24.1 -23.7 97 100 A Q H X>S+ 0 0 0 -4,-2.5 5,-2.1 1,-0.2 4,-1.7 0.873 113.7 48.4 -57.4 -37.5 44.1 22.7 -20.4 98 101 A M H <5S+ 0 0 25 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.827 100.9 63.6 -73.6 -30.9 41.8 19.7 -20.9 99 102 A S H <5S+ 0 0 87 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.899 113.1 36.3 -61.9 -44.2 43.1 19.1 -24.5 100 103 A L H <5S- 0 0 93 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.803 111.8-112.0 -82.1 -21.3 46.5 18.3 -23.0 101 104 A D T <5 + 0 0 116 -4,-1.7 2,-1.0 1,-0.3 -3,-0.2 0.762 56.0 161.8 98.4 34.4 45.6 16.6 -19.7 102 105 A R < - 0 0 43 -5,-2.1 2,-0.9 -6,-0.2 -1,-0.3 -0.825 18.2-171.2 -73.9 100.0 46.8 19.4 -17.6 103 106 A K + 0 0 91 -2,-1.0 2,-0.1 -3,-0.1 -1,-0.0 -0.580 16.8 165.3-103.8 74.2 45.1 18.7 -14.3 104 107 A T > - 0 0 24 -2,-0.9 4,-2.8 1,-0.1 5,-0.2 -0.329 50.1-112.0 -79.5 164.7 45.9 21.9 -12.3 105 108 A T H > S+ 0 0 85 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.880 118.1 57.1 -66.7 -34.9 44.1 22.7 -9.1 106 109 A A H > S+ 0 0 4 2,-0.2 4,-1.6 1,-0.2 -50,-0.2 0.946 112.1 41.0 -60.4 -47.2 42.5 25.7 -10.8 107 110 A L H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.956 115.7 48.7 -65.6 -50.3 41.0 23.4 -13.4 108 111 A K H X S+ 0 0 36 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.867 107.9 56.8 -58.7 -37.7 40.0 20.6 -11.0 109 112 A Q H X S+ 0 0 63 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.929 109.9 42.7 -61.1 -47.6 38.3 23.1 -8.7 110 113 A L H X S+ 0 0 1 -4,-1.6 4,-2.2 1,-0.2 5,-0.2 0.920 112.2 54.4 -65.8 -42.7 36.0 24.5 -11.4 111 114 A Q H X S+ 0 0 7 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.920 106.6 52.3 -56.7 -44.2 35.3 21.0 -12.7 112 115 A G H X S+ 0 0 2 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.870 109.8 47.4 -60.7 -39.1 34.2 19.9 -9.2 113 116 A H H X S+ 0 0 15 -4,-1.5 4,-1.0 2,-0.2 -1,-0.2 0.844 113.1 49.1 -72.3 -32.3 31.8 22.7 -8.8 114 117 A M H X S+ 0 0 2 -4,-2.2 4,-1.8 1,-0.2 3,-0.4 0.909 110.1 50.7 -72.1 -42.5 30.3 22.1 -12.3 115 118 A W H X S+ 0 0 16 -4,-2.9 4,-2.9 1,-0.2 5,-0.4 0.850 100.8 64.0 -64.3 -32.1 29.9 18.4 -11.6 116 119 A R H X S+ 0 0 90 -4,-1.7 4,-2.1 1,-0.2 5,-0.3 0.907 105.9 44.9 -58.1 -38.6 28.1 19.2 -8.3 117 120 A A H X S+ 0 0 25 -4,-1.0 4,-1.9 -3,-0.4 6,-0.3 0.911 112.1 51.7 -71.0 -41.7 25.4 20.8 -10.4 118 121 A A H <>S+ 0 0 0 -4,-1.8 5,-2.1 2,-0.2 6,-1.3 0.946 119.1 33.6 -60.8 -50.8 25.3 17.9 -12.9 119 122 A F H ><5S+ 0 0 3 -4,-2.9 3,-1.5 3,-0.2 -2,-0.2 0.929 118.0 50.6 -74.2 -44.4 24.9 15.2 -10.3 120 123 A T H 3<5S+ 0 0 93 -4,-2.1 -3,-0.2 -5,-0.4 -2,-0.2 0.882 111.3 49.7 -61.1 -38.7 22.9 17.1 -7.7 121 124 A A T 3<5S- 0 0 64 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.447 114.6-118.9 -79.3 -0.7 20.4 18.2 -10.3 122 125 A G T < 5S+ 0 0 54 -3,-1.5 -3,-0.2 2,-0.2 -2,-0.1 0.702 78.0 125.8 71.9 19.3 20.1 14.6 -11.6 123 126 A R S > - 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