==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 07-APR-10 3MHG . COMPND 2 MOLECULE: TAGATOSE 1,6-DIPHOSPHATE ALDOLASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PYOGENES SEROTYPE M1; . AUTHOR C.LOWKAM,B.LIOTARD . 1292 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53067.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 937 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 161 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 1.9 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 . 8 0.6 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 . 76 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 140 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 483 37.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 1.9 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 5 4 4 1 5 4 1 0 6 0 5 4 0 0 2 0 0 4 0 0 1 0 3 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 3 10 14 0 0 4 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 . 12 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 0 0 0 0 0 0 4 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 3 A T 0 0 192 0, 0.0 2,-0.1 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 86.6 54.3 44.2 37.3 2 4 A L - 0 0 42 1,-0.1 198,-0.0 2,-0.1 2,-0.0 -0.386 360.0-116.3 -65.9 141.5 56.7 46.0 35.1 3 5 A T > - 0 0 65 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.269 37.6 -99.1 -62.7 166.8 58.0 44.4 31.9 4 6 A E H > S+ 0 0 143 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.918 123.4 45.7 -57.8 -46.1 61.7 43.7 31.9 5 7 A N H > S+ 0 0 78 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.847 111.7 50.0 -69.9 -36.3 62.4 46.8 29.8 6 8 A K H > S+ 0 0 18 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.895 110.7 51.1 -68.6 -38.3 60.2 49.2 31.8 7 9 A R H X S+ 0 0 105 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.923 109.2 50.3 -62.9 -44.1 61.9 48.0 35.0 8 10 A K H X S+ 0 0 86 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.895 112.0 48.0 -61.3 -40.7 65.3 48.6 33.6 9 11 A S H X S+ 0 0 13 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.913 109.8 52.1 -66.5 -42.0 64.2 52.1 32.5 10 12 A M H >X S+ 0 0 2 -4,-2.6 3,-0.6 1,-0.2 4,-0.5 0.886 107.8 52.8 -60.1 -39.8 62.8 52.7 36.0 11 13 A E H >< S+ 0 0 102 -4,-2.5 3,-1.1 1,-0.2 -1,-0.2 0.898 105.9 53.8 -61.0 -40.0 66.1 51.7 37.5 12 14 A K H 3< S+ 0 0 110 -4,-1.7 72,-0.6 1,-0.2 -1,-0.2 0.703 109.4 48.5 -68.7 -19.5 67.9 54.2 35.3 13 15 A L H << S+ 0 0 0 -4,-0.9 7,-0.3 -3,-0.6 -1,-0.2 0.497 114.8 46.2 -96.6 -5.8 65.7 57.0 36.5 14 16 A S << - 0 0 12 -3,-1.1 2,-0.4 -4,-0.5 5,-0.2 -0.751 64.9-136.9-129.9 170.1 66.1 56.2 40.3 15 17 A V B > S-A 18 0A 97 3,-2.3 3,-1.8 -2,-0.2 48,-0.1 -0.967 89.2 -19.3-131.1 121.5 68.6 55.3 43.0 16 18 A D T 3 S- 0 0 147 -2,-0.4 3,-0.1 1,-0.3 305,-0.1 0.875 129.1 -50.7 49.0 43.5 67.6 52.5 45.4 17 19 A G T 3 S+ 0 0 5 1,-0.2 303,-2.7 302,-0.2 2,-0.5 0.485 115.8 113.1 81.0 2.9 63.9 52.9 44.5 18 20 A V B < -A 15 0A 29 -3,-1.8 -3,-2.3 301,-0.2 2,-0.8 -0.927 58.4-143.9-114.3 130.8 63.8 56.6 45.0 19 21 A I E +b 271 0B 0 251,-2.8 253,-2.6 -2,-0.5 2,-0.4 -0.806 22.3 171.5 -93.3 111.3 63.4 59.1 42.2 20 22 A S E +b 272 0B 22 -2,-0.8 43,-1.8 -7,-0.3 44,-0.6 -0.580 25.1 167.4-116.1 66.6 65.4 62.3 42.8 21 23 A A E -bc 273 64B 4 251,-2.0 253,-2.4 -2,-0.4 2,-0.4 -0.563 34.1-138.0 -96.0 146.5 64.8 63.9 39.5 22 24 A L E -bc 274 65B 0 42,-2.5 44,-2.9 -2,-0.2 2,-0.5 -0.844 19.3-149.1 -97.7 131.0 65.5 67.4 38.2 23 25 A A E + c 0 66B 1 251,-2.2 44,-0.1 -2,-0.4 255,-0.1 -0.903 34.5 146.4-107.7 124.6 62.7 68.9 36.1 24 26 A F E + c 0 67B 0 42,-2.7 44,-0.6 -2,-0.5 -1,-0.1 -0.226 30.9 115.6-147.7 53.5 63.5 71.4 33.3 25 27 A D + 0 0 8 42,-0.3 42,-0.1 62,-0.0 45,-0.1 0.328 41.3 132.9-100.6 6.5 61.1 70.9 30.5 26 28 A Q + 0 0 32 1,-0.1 42,-0.1 2,-0.1 66,-0.0 -0.316 20.2 156.7 -59.1 134.4 59.6 74.4 31.0 27 29 A R > + 0 0 10 3,-0.1 4,-2.6 43,-0.0 5,-0.2 0.571 67.2 27.7-123.4 -81.2 59.3 76.3 27.7 28 30 A G H > S+ 0 0 18 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.887 125.0 50.7 -54.6 -42.0 56.8 79.1 27.5 29 31 A A H > S+ 0 0 41 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.864 110.7 48.8 -66.5 -36.6 57.1 79.8 31.2 30 32 A L H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.892 109.0 52.7 -69.1 -39.6 60.9 79.9 31.0 31 33 A K H X S+ 0 0 68 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.907 108.2 51.1 -64.4 -40.5 60.8 82.3 28.0 32 34 A R H X S+ 0 0 163 -4,-2.1 4,-0.8 -5,-0.2 -1,-0.2 0.877 109.0 51.5 -63.7 -38.3 58.6 84.6 30.0 33 35 A M H >< S+ 0 0 47 -4,-1.6 3,-0.9 1,-0.2 4,-0.4 0.945 111.1 47.0 -61.1 -48.7 61.0 84.5 32.9 34 36 A M H >X S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.2 4,-0.5 0.875 104.9 61.3 -61.3 -37.7 64.0 85.4 30.6 35 37 A A H 3< S+ 0 0 48 -4,-2.1 3,-0.5 1,-0.3 -1,-0.2 0.742 92.9 66.3 -62.9 -24.9 62.0 88.2 29.0 36 38 A Q T << S+ 0 0 148 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.752 105.2 43.0 -64.9 -23.1 61.7 89.9 32.4 37 39 A H T <4 S+ 0 0 48 -3,-1.7 2,-0.3 -4,-0.4 -1,-0.2 0.459 113.0 40.5-112.2 -3.2 65.4 90.6 32.5 38 40 A Q < - 0 0 38 -4,-0.5 250,-0.1 -3,-0.5 249,-0.0 -0.958 65.9-131.1-142.4 162.6 66.4 91.7 29.0 39 41 A T S S+ 0 0 155 -2,-0.3 -1,-0.1 2,-0.1 -4,-0.0 0.908 85.8 70.7 -78.7 -46.4 65.0 94.0 26.2 40 42 A K S S- 0 0 122 1,-0.1 -2,-0.1 3,-0.0 3,-0.1 -0.289 98.2 -91.4 -72.7 157.0 65.3 91.6 23.3 41 43 A E - 0 0 136 1,-0.1 -1,-0.1 -2,-0.0 -2,-0.1 -0.488 51.1-101.8 -64.7 131.5 63.2 88.5 22.8 42 44 A P - 0 0 7 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.362 45.0-131.8 -56.3 134.3 64.8 85.5 24.4 43 45 A T > - 0 0 47 1,-0.1 4,-2.2 -3,-0.1 5,-0.2 -0.451 15.4-115.5 -91.6 162.1 66.4 83.5 21.6 44 46 A V H > S+ 0 0 66 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.900 119.4 56.0 -57.0 -39.6 66.3 79.7 20.9 45 47 A E H > S+ 0 0 128 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.877 106.2 48.6 -61.4 -41.0 70.0 79.8 21.6 46 48 A Q H > S+ 0 0 24 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.904 112.5 47.9 -66.6 -42.7 69.6 81.3 25.0 47 49 A I H X S+ 0 0 2 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.942 114.2 46.5 -63.2 -46.8 66.9 78.8 26.0 48 50 A E H X S+ 0 0 60 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.884 113.4 50.3 -63.3 -38.3 68.9 75.8 24.7 49 51 A E H X S+ 0 0 80 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.918 108.2 49.2 -70.1 -44.4 72.0 77.1 26.5 50 52 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.899 111.1 51.9 -62.3 -39.0 70.5 77.7 29.9 51 53 A K H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.918 109.7 49.5 -62.5 -42.1 69.0 74.2 29.8 52 54 A S H X S+ 0 0 23 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.883 109.6 51.4 -63.9 -38.8 72.4 72.8 28.9 53 55 A L H X S+ 0 0 4 -4,-2.3 4,-2.5 2,-0.2 5,-0.3 0.927 111.9 46.3 -63.7 -45.7 74.0 74.6 31.9 54 56 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.5 0.924 115.0 47.4 -63.1 -44.0 71.5 73.3 34.3 55 57 A S H X S+ 0 0 0 -4,-2.4 4,-1.7 -5,-0.2 25,-0.5 0.953 115.4 43.8 -62.1 -51.5 71.8 69.8 33.0 56 58 A E H < S+ 0 0 87 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.897 121.0 38.9 -63.2 -41.1 75.6 69.8 33.0 57 59 A E H < S+ 0 0 26 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.850 126.1 29.0 -82.3 -35.2 76.0 71.4 36.5 58 60 A L H >< S+ 0 0 0 -4,-2.4 3,-2.0 -5,-0.3 -3,-0.2 0.675 95.3 80.7-106.5 -17.6 73.2 69.8 38.5 59 61 A T G >< S+ 0 0 0 -4,-1.7 3,-1.5 -5,-0.5 -1,-0.1 0.738 80.6 71.1 -65.7 -20.8 72.5 66.3 37.0 60 62 A P G 3 S+ 0 0 74 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.719 103.7 45.4 -63.1 -13.7 75.5 64.8 38.9 61 63 A F G < S+ 0 0 74 -3,-2.0 2,-0.3 3,-0.0 -2,-0.2 0.282 106.4 72.6-110.5 8.8 73.2 65.3 42.0 62 64 A A S < S- 0 0 10 -3,-1.5 -41,-0.2 -4,-0.1 3,-0.1 -0.922 71.0-138.8-124.9 148.6 70.0 63.9 40.4 63 65 A S S S- 0 0 5 -43,-1.8 21,-2.2 -2,-0.3 2,-0.3 0.743 89.5 -12.9 -75.0 -23.2 69.0 60.3 39.6 64 66 A S E -cd 21 84B 0 -44,-0.6 -42,-2.5 19,-0.3 2,-0.4 -0.977 62.8-130.6-165.0 167.6 67.5 61.7 36.3 65 67 A I E -cd 22 85B 0 19,-2.2 21,-2.6 -2,-0.3 2,-0.6 -0.995 9.9-145.1-131.9 138.1 66.5 64.8 34.4 66 68 A L E +cd 23 86B 0 -44,-2.9 -42,-2.7 -2,-0.4 2,-0.3 -0.898 29.3 168.1 -99.2 123.0 63.3 65.7 32.6 67 69 A L E -cd 24 87B 0 19,-2.5 21,-2.2 -2,-0.6 -42,-0.3 -0.850 34.3-114.0-127.2 165.1 63.8 67.8 29.5 68 70 A D > - 0 0 0 -44,-0.6 4,-1.5 -2,-0.3 3,-0.2 -0.757 18.5-134.5 -95.8 150.7 61.6 68.9 26.6 69 71 A P T 4 S+ 0 0 6 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.590 97.8 67.5 -79.0 -10.8 62.5 67.6 23.1 70 72 A E T 4 S- 0 0 93 -45,-0.1 -22,-0.1 1,-0.1 -45,-0.0 0.895 127.8 -4.9 -77.1 -43.3 62.0 71.1 21.6 71 73 A Y T 4 S+ 0 0 51 -3,-0.2 4,-0.4 -24,-0.1 -20,-0.1 0.483 124.3 71.7-122.5 -12.6 65.0 72.9 23.2 72 74 A G X + 0 0 0 -4,-1.5 4,-2.4 1,-0.2 5,-0.2 0.417 63.7 92.4 -96.8 0.9 66.4 70.2 25.6 73 75 A L H > S+ 0 0 40 -4,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.916 90.6 47.7 -65.1 -43.0 68.0 67.7 23.3 74 76 A P H >> S+ 0 0 38 0, 0.0 4,-0.6 0, 0.0 3,-0.6 0.944 112.7 50.1 -58.4 -46.5 71.5 69.3 23.5 75 77 A A H >4 S+ 0 0 0 -4,-0.4 3,-1.2 1,-0.2 4,-0.3 0.876 105.2 58.1 -56.8 -38.5 71.1 69.6 27.3 76 78 A S H >< S+ 0 0 5 -4,-2.4 3,-0.9 1,-0.3 -1,-0.2 0.839 101.3 56.0 -63.6 -31.4 70.2 65.9 27.4 77 79 A R H << S+ 0 0 177 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.644 107.3 48.2 -78.8 -13.1 73.5 65.0 25.7 78 80 A V T << S+ 0 0 62 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.287 83.6 121.7-107.3 10.6 75.5 66.7 28.4 79 81 A R S < S- 0 0 70 -3,-0.9 -23,-0.1 -4,-0.3 -24,-0.1 -0.292 77.7 -78.2 -67.7 157.6 73.7 65.2 31.4 80 82 A S > - 0 0 18 -25,-0.5 3,-1.8 1,-0.1 -1,-0.1 -0.250 36.7-122.1 -55.6 141.7 75.7 63.2 34.0 81 83 A E T 3 S+ 0 0 181 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.736 113.0 52.5 -57.2 -25.3 76.6 59.6 32.9 82 84 A E T 3 S+ 0 0 141 2,-0.1 2,-0.4 -20,-0.0 -1,-0.3 0.530 93.9 89.5 -89.6 -7.8 74.8 58.3 36.0 83 85 A A < - 0 0 6 -3,-1.8 -19,-0.3 1,-0.0 -70,-0.1 -0.773 67.2-138.8-100.4 135.9 71.5 60.2 35.4 84 86 A G E -d 64 0B 5 -21,-2.2 -19,-2.2 -72,-0.6 2,-0.4 -0.206 18.5-121.4 -80.4 175.8 68.6 58.9 33.3 85 87 A L E -d 65 0B 0 -21,-0.2 35,-3.4 33,-0.2 36,-0.6 -0.973 20.8-176.4-127.9 129.8 66.5 60.9 30.9 86 88 A L E -de 66 121B 1 -21,-2.6 -19,-2.5 -2,-0.4 2,-0.4 -0.951 14.2-155.4-112.4 145.1 62.8 61.7 30.7 87 89 A L E -de 67 122B 0 34,-2.0 36,-2.5 -2,-0.4 -19,-0.2 -0.980 15.9-124.3-120.9 134.2 61.3 63.7 27.7 88 90 A A E - e 0 123B 0 -21,-2.2 36,-0.2 -2,-0.4 18,-0.0 -0.416 20.0-173.8 -71.4 147.3 58.1 65.7 27.8 89 91 A Y + 0 0 0 34,-2.1 17,-2.6 -2,-0.1 2,-0.2 0.554 53.7 88.5-119.0 -17.5 55.5 64.9 25.2 90 92 A E B S-J 105 0C 11 33,-0.4 15,-0.2 15,-0.2 2,-0.1 -0.554 79.8-109.0 -89.8 149.9 52.9 67.6 25.7 91 93 A K - 0 0 71 13,-2.9 13,-0.2 -2,-0.2 34,-0.1 -0.477 50.2 -96.3 -66.6 148.2 52.7 71.1 24.1 92 94 A T S S- 0 0 68 -2,-0.1 -1,-0.1 2,-0.0 -66,-0.0 -0.296 75.5 -14.1 -72.7 149.1 53.5 73.8 26.5 93 95 A G S S- 0 0 43 -3,-0.1 2,-0.3 2,-0.0 -2,-0.1 -0.029 72.2-104.3 67.1-162.4 50.9 75.8 28.5 94 96 A Y - 0 0 110 9,-0.0 2,-0.7 7,-0.0 -2,-0.0 -0.973 32.5 -84.1-158.0 166.7 47.2 76.1 27.8 95 97 A D > - 0 0 85 -2,-0.3 3,-0.8 1,-0.2 6,-0.4 -0.693 28.5-168.9 -80.8 113.3 44.5 78.4 26.4 96 98 A A T 3 S+ 0 0 87 -2,-0.7 -1,-0.2 1,-0.2 0, 0.0 0.607 79.4 77.7 -75.1 -11.2 43.5 80.9 29.1 97 99 A T T 3 S+ 0 0 122 -3,-0.0 -1,-0.2 2,-0.0 2,-0.2 0.792 102.5 28.7 -67.7 -30.3 40.6 81.9 26.8 98 100 A T S < S- 0 0 69 -3,-0.8 3,-0.0 1,-0.0 0, 0.0 -0.655 72.9-127.1-125.3-178.7 38.6 78.8 27.8 99 101 A T S S+ 0 0 70 -2,-0.2 -3,-0.1 1,-0.1 69,-0.0 0.400 88.3 81.5-110.9 1.0 38.2 76.4 30.7 100 102 A S - 0 0 27 -5,-0.1 29,-0.1 32,-0.1 -1,-0.1 0.779 63.8-165.9 -83.8 -28.0 38.8 73.0 29.0 101 103 A R - 0 0 37 -6,-0.4 26,-0.5 1,-0.1 -5,-0.0 0.889 19.5-160.3 39.2 57.9 42.6 73.0 28.9 102 104 A L - 0 0 71 1,-0.1 -1,-0.1 24,-0.1 -7,-0.1 -0.416 14.4-114.0 -73.2 138.9 42.6 70.1 26.5 103 105 A P - 0 0 20 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.382 33.0-177.6 -73.4 149.1 45.8 68.0 26.1 104 106 A D - 0 0 70 -13,-0.2 -13,-2.9 -2,-0.1 3,-0.1 -0.900 18.9-136.0-153.3 117.1 47.8 68.1 22.9 105 107 A C B -J 90 0C 2 -2,-0.3 -15,-0.2 -15,-0.2 2,-0.1 -0.316 43.7 -84.3 -66.1 153.0 51.0 66.1 22.0 106 108 A L > - 0 0 8 -17,-2.6 3,-1.8 1,-0.1 -1,-0.1 -0.395 44.4-123.6 -58.7 132.9 53.9 67.8 20.3 107 109 A D T 3 S+ 0 0 57 1,-0.3 361,-0.1 -3,-0.1 360,-0.1 0.794 103.5 35.3 -57.6 -38.2 53.1 67.7 16.6 108 110 A V T 3 S+ 0 0 57 359,-0.1 2,-0.3 358,-0.1 -1,-0.3 0.156 105.0 88.9-106.1 24.4 56.2 65.9 15.3 109 111 A W < + 0 0 40 -3,-1.8 2,-0.3 -20,-0.1 362,-0.1 -0.789 43.0 171.3-117.8 159.2 56.7 63.6 18.2 110 112 A S > - 0 0 0 -2,-0.3 4,-2.2 360,-0.1 5,-0.2 -0.940 50.5 -99.1-151.1 166.6 55.5 60.1 19.2 111 113 A A H > S+ 0 0 0 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.897 124.8 54.9 -57.1 -38.2 56.3 57.7 22.0 112 114 A K H > S+ 0 0 34 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.911 108.1 46.1 -62.1 -45.6 58.5 55.9 19.5 113 115 A R H > S+ 0 0 35 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.847 109.9 54.9 -66.9 -35.1 60.5 59.0 18.6 114 116 A I H <>S+ 0 0 0 -4,-2.2 5,-1.8 2,-0.2 -2,-0.2 0.934 110.5 45.6 -62.5 -45.8 60.9 59.9 22.3 115 117 A K H ><5S+ 0 0 89 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.922 111.5 52.8 -58.2 -46.1 62.4 56.4 22.9 116 118 A E H 3<5S+ 0 0 113 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.755 100.7 62.5 -63.7 -23.9 64.6 56.9 19.8 117 119 A A T 3<5S- 0 0 33 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.387 126.7 -99.1 -82.6 3.1 65.8 60.2 21.2 118 120 A G T < 5S+ 0 0 37 -3,-1.9 -33,-0.2 1,-0.3 -3,-0.2 0.521 70.7 151.0 97.3 7.8 67.3 58.3 24.2 119 121 A A < - 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