==== 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 11-JAN-10 3LCL . COMPND 2 MOLECULE: N-ACETYLNEURAMINATE LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.-Y.CHOU,A.H.-J.WANG,T.-P.KO . 1178 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41755.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 904 76.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 150 12.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.7 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 84 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 489 41.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 2.3 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 4 0 0 4 4 0 4 4 0 5 10 5 3 1 0 0 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 4 12 12 4 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 . 4 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 4 A N 0 0 137 0, 0.0 71,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 124.0 4.4 11.2 34.2 2 5 A L + 0 0 22 157,-0.2 2,-0.2 2,-0.0 96,-0.0 0.434 360.0 117.0 -98.8 -1.4 5.0 14.6 32.5 3 6 A R + 0 0 90 198,-0.1 2,-0.3 2,-0.0 198,-0.1 -0.451 48.0 74.2 -69.6 137.7 6.9 16.2 35.4 4 7 A G S S- 0 0 9 -2,-0.2 198,-2.4 196,-0.1 2,-0.7 -0.956 82.4 -58.7 155.2-174.0 10.5 17.2 34.5 5 8 A V E +a 202 0A 2 -2,-0.3 32,-2.2 196,-0.2 33,-0.7 -0.931 54.3 176.1-107.5 110.6 13.0 19.4 32.8 6 9 A M E -ab 203 38A 0 196,-2.8 198,-1.3 -2,-0.7 33,-0.2 -0.961 26.0-125.1-125.6 135.9 12.4 19.4 29.1 7 10 A A E -ab 204 39A 0 31,-1.7 33,-2.8 -2,-0.4 2,-0.9 -0.524 16.8-129.2 -79.1 138.7 14.1 21.3 26.3 8 11 A A E - b 0 40A 2 196,-2.2 200,-0.2 -2,-0.2 33,-0.2 -0.794 41.4-126.9 -83.5 108.3 12.1 23.5 23.9 9 12 A L - 0 0 4 31,-1.9 33,-0.3 -2,-0.9 34,-0.2 -0.316 14.7-141.4 -67.3 137.6 13.6 22.1 20.6 10 13 A L - 0 0 0 36,-0.1 36,-0.2 195,-0.1 35,-0.1 -0.556 14.9-128.5 -89.4 158.6 15.1 24.3 18.0 11 14 A T - 0 0 4 34,-0.6 2,-0.1 -2,-0.2 13,-0.1 -0.913 20.5-143.5-112.7 105.7 14.6 23.5 14.3 12 15 A P - 0 0 0 0, 0.0 8,-2.5 0, 0.0 2,-0.3 -0.448 20.3-170.4 -67.9 139.2 17.9 23.4 12.3 13 16 A F B -I 19 0B 1 251,-0.7 253,-0.4 253,-0.5 251,-0.3 -0.853 16.0-124.7-125.2 161.9 17.7 24.8 8.8 14 17 A D > - 0 0 47 4,-2.7 3,-2.1 -2,-0.3 6,-0.1 -0.284 46.7 -79.8 -94.7-173.2 20.2 24.7 5.9 15 18 A Q T 3 S+ 0 0 118 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.752 132.4 52.0 -60.0 -24.6 21.6 27.7 3.9 16 19 A Q T 3 S- 0 0 153 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.226 119.7-109.1 -96.9 14.5 18.4 27.8 1.9 17 20 A Q S < S+ 0 0 43 -3,-2.1 2,-0.2 1,-0.3 -2,-0.1 0.580 76.1 132.8 70.8 13.2 16.2 27.8 5.0 18 21 A A S S- 0 0 43 1,-0.1 -4,-2.7 250,-0.0 -1,-0.3 -0.596 70.5 -78.8 -91.0 156.9 14.9 24.3 4.5 19 22 A L B -I 13 0B 25 -6,-0.2 2,-1.0 -2,-0.2 -6,-0.3 -0.271 35.6-144.7 -55.0 133.5 14.8 21.7 7.3 20 23 A D > - 0 0 23 -8,-2.5 4,-2.0 1,-0.2 3,-0.2 -0.832 17.9-173.8-101.8 90.9 18.3 20.2 7.9 21 24 A K H > S+ 0 0 96 -2,-1.0 4,-2.6 1,-0.2 5,-0.2 0.895 78.8 52.5 -54.3 -47.2 17.2 16.7 8.9 22 25 A A H > S+ 0 0 41 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.890 111.5 46.4 -59.9 -40.2 20.6 15.4 9.9 23 26 A S H > S+ 0 0 0 2,-0.2 4,-2.5 -3,-0.2 -1,-0.2 0.838 109.5 55.1 -71.9 -31.4 21.2 18.3 12.3 24 27 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.955 109.9 46.1 -64.4 -48.3 17.7 17.9 13.7 25 28 A R H X S+ 0 0 88 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.911 112.8 51.0 -60.2 -42.1 18.5 14.2 14.5 26 29 A R H X S+ 0 0 98 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.892 109.1 50.2 -63.3 -39.9 21.8 15.3 15.9 27 30 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.879 109.4 51.3 -67.3 -37.3 20.2 17.9 18.2 28 31 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.958 113.4 44.1 -63.6 -48.8 17.7 15.4 19.5 29 32 A Q H X S+ 0 0 53 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.892 109.9 56.6 -62.4 -39.2 20.5 12.9 20.3 30 33 A F H X S+ 0 0 54 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.903 108.9 46.8 -58.5 -43.0 22.6 15.7 21.8 31 34 A N H <>S+ 0 0 0 -4,-2.1 5,-1.8 2,-0.2 -1,-0.2 0.915 111.6 49.9 -66.2 -44.0 19.7 16.6 24.2 32 35 A I H ><5S+ 0 0 31 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.905 108.1 55.4 -61.2 -40.6 19.2 12.9 25.2 33 36 A Q H 3<5S+ 0 0 152 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.837 102.7 54.6 -62.3 -35.9 22.9 12.6 25.8 34 37 A Q T 3<5S- 0 0 23 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.409 121.7-105.0 -81.6 5.1 22.9 15.5 28.3 35 38 A G T < 5 + 0 0 43 -3,-1.5 -3,-0.2 -4,-0.2 -2,-0.1 0.715 55.4 170.8 83.9 22.5 20.2 13.8 30.3 36 39 A I < - 0 0 7 -5,-1.8 -1,-0.2 1,-0.1 -30,-0.2 -0.349 34.7-136.1 -64.9 145.7 17.2 15.9 29.4 37 40 A D S S- 0 0 64 -32,-2.2 35,-2.1 1,-0.2 2,-0.3 0.746 71.5 -41.8 -75.2 -24.4 13.8 14.5 30.7 38 41 A G E -bc 6 72A 0 -33,-0.7 -31,-1.7 33,-0.2 2,-0.4 -0.980 58.0 -96.4 179.2-176.0 12.1 15.2 27.4 39 42 A L E -bc 7 73A 0 33,-2.2 35,-2.9 -2,-0.3 2,-0.7 -0.980 11.7-149.0-131.6 141.3 11.5 17.5 24.5 40 43 A Y E -bc 8 74A 4 -33,-2.8 -31,-1.9 -2,-0.4 2,-0.4 -0.943 31.6-164.4-107.3 109.5 8.8 20.1 23.7 41 44 A V E + c 0 75A 1 33,-3.2 35,-3.8 -2,-0.7 -31,-0.1 -0.830 55.4 17.8-108.6 136.2 8.5 20.1 19.9 42 45 A G S S+ 0 0 6 -2,-0.4 -1,-0.2 -33,-0.3 33,-0.1 0.658 88.9 123.5 88.8 16.2 6.9 22.6 17.5 43 46 A G S > >S- 0 0 3 -3,-0.3 5,-1.6 -34,-0.2 3,-0.8 -0.032 83.9 -66.2 -92.2-160.7 6.7 25.5 19.9 44 47 A S G > 5S+ 0 0 7 1,-0.2 3,-2.0 2,-0.2 5,-0.2 0.928 133.4 54.0 -52.2 -49.7 8.0 29.1 19.7 45 48 A T G 3 5S+ 0 0 6 1,-0.3 -34,-0.6 2,-0.1 -1,-0.2 0.723 99.9 59.2 -60.9 -26.7 11.6 27.8 19.8 46 49 A G G < 5S- 0 0 1 -3,-0.8 -1,-0.3 -36,-0.2 -2,-0.2 0.400 111.7-120.8 -83.9 5.5 11.1 25.4 16.9 47 50 A E T X 5 + 0 0 0 -3,-2.0 3,-2.0 -4,-0.2 -3,-0.2 0.810 58.1 157.9 58.4 32.6 10.2 28.4 14.8 48 51 A A G > < + 0 0 1 -5,-1.6 3,-1.6 1,-0.3 -4,-0.1 0.802 61.4 63.7 -57.1 -32.4 6.8 26.7 14.2 49 52 A F G 3 S+ 0 0 27 1,-0.3 920,-0.3 -6,-0.2 -1,-0.3 0.435 103.2 47.4 -78.8 3.9 5.1 30.0 13.4 50 53 A V G < S+ 0 0 0 -3,-2.0 2,-0.3 918,-0.1 -1,-0.3 -0.020 104.4 82.3-124.9 23.6 7.3 30.5 10.3 51 54 A Q S < S- 0 0 15 -3,-1.6 2,-0.1 217,-0.0 918,-0.1 -0.894 78.0-118.6-125.0 156.9 6.7 26.9 9.2 52 55 A S > - 0 0 36 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.385 34.3-104.2 -86.6 170.1 3.8 25.3 7.3 53 56 A L H > S+ 0 0 36 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.933 122.7 49.8 -61.1 -46.7 1.7 22.5 8.8 54 57 A S H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.871 110.1 51.2 -61.5 -36.9 3.4 19.8 6.7 55 58 A E H > S+ 0 0 52 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.913 110.3 48.4 -67.0 -41.3 6.8 21.2 7.8 56 59 A R H X S+ 0 0 10 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.905 111.9 50.1 -64.4 -40.0 5.8 21.0 11.5 57 60 A E H X S+ 0 0 31 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.905 106.5 55.6 -63.9 -41.4 4.5 17.5 11.0 58 61 A Q H X S+ 0 0 62 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.918 109.2 47.0 -57.1 -44.4 7.8 16.5 9.3 59 62 A V H X S+ 0 0 5 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.936 110.8 51.6 -64.2 -45.4 9.7 17.7 12.4 60 63 A L H X S+ 0 0 2 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.932 111.5 47.5 -56.4 -47.7 7.3 15.9 14.8 61 64 A E H X S+ 0 0 85 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.917 112.2 48.0 -61.3 -46.7 7.8 12.6 12.9 62 65 A I H X S+ 0 0 8 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.924 111.3 50.6 -62.4 -43.6 11.6 12.8 12.7 63 66 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.4 0.908 109.7 51.1 -61.0 -41.6 11.8 13.6 16.4 64 67 A A H X S+ 0 0 6 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.913 107.7 52.3 -62.0 -43.3 9.6 10.7 17.3 65 68 A E H < S+ 0 0 122 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.898 116.8 40.9 -59.2 -39.6 11.8 8.3 15.2 66 69 A E H < S+ 0 0 42 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.800 133.2 14.4 -79.1 -32.6 14.8 9.6 17.1 67 70 A A H >X S+ 0 0 0 -4,-2.7 3,-2.7 -5,-0.2 4,-1.5 0.583 76.9 129.9-125.0 -11.3 13.5 9.7 20.6 68 71 A K T 3< S+ 0 0 127 -4,-2.5 4,-0.1 -5,-0.4 29,-0.1 -0.212 88.6 10.9 -50.0 129.8 10.2 7.9 21.1 69 72 A G T 34 S+ 0 0 78 2,-0.5 -1,-0.3 27,-0.2 3,-0.1 0.202 118.6 74.1 87.1 -17.7 10.5 5.6 24.1 70 73 A K T <4 S+ 0 0 128 -3,-2.7 2,-0.3 1,-0.3 -2,-0.2 0.860 109.5 0.1 -93.1 -46.1 13.8 7.2 25.2 71 74 A I S < S- 0 0 17 -4,-1.5 -2,-0.5 -32,-0.0 -1,-0.3 -0.898 90.0 -81.5-137.7 166.0 12.6 10.5 26.7 72 75 A K E -c 38 0A 81 -35,-2.1 -33,-2.2 -2,-0.3 2,-0.4 -0.444 42.1-154.3 -71.2 144.6 9.2 12.2 27.0 73 76 A L E -c 39 0A 0 -35,-0.2 25,-2.1 23,-0.1 26,-1.0 -0.981 11.8-174.7-126.9 123.5 7.9 13.9 23.9 74 77 A I E -cd 40 99A 0 -35,-2.9 -33,-3.2 -2,-0.4 2,-0.6 -0.972 13.2-151.7-117.2 125.1 5.4 16.8 24.0 75 78 A A E -cd 41 100A 0 24,-2.8 26,-1.9 -2,-0.5 2,-0.9 -0.851 4.9-149.4-100.0 116.0 4.1 18.1 20.6 76 79 A H E + d 0 101A 1 -35,-3.8 26,-0.2 -2,-0.6 24,-0.1 -0.763 25.7 167.8 -83.1 112.6 3.1 21.7 20.5 77 80 A V + 0 0 0 24,-2.8 11,-0.3 -2,-0.9 12,-0.2 0.298 23.2 138.5-107.3 6.4 0.3 21.6 17.9 78 81 A G + 0 0 0 23,-0.9 2,-0.3 10,-0.1 26,-0.1 -0.270 17.2 157.9 -62.9 135.5 -1.0 25.1 18.5 79 82 A C - 0 0 5 2,-0.3 859,-0.1 24,-0.2 6,-0.1 -0.862 55.0-108.5-141.1 170.0 -2.1 27.3 15.6 80 83 A V S S+ 0 0 12 -2,-0.3 2,-0.2 857,-0.3 858,-0.1 0.931 106.4 72.0 -68.7 -40.8 -4.4 30.3 15.5 81 84 A S S > S- 0 0 4 856,-0.3 4,-1.7 1,-0.1 -2,-0.3 -0.495 73.1-151.2 -76.1 136.7 -6.8 28.0 13.6 82 85 A T H > S+ 0 0 4 1075,-1.2 4,-2.8 -2,-0.2 5,-0.2 0.926 97.5 53.6 -72.0 -44.5 -8.5 25.2 15.5 83 86 A A H > S+ 0 0 59 1074,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.913 110.5 46.5 -56.0 -46.6 -8.7 23.0 12.4 84 87 A E H > S+ 0 0 40 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.920 111.5 51.4 -63.5 -43.4 -5.0 23.2 11.8 85 88 A S H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.908 109.2 51.6 -59.8 -41.6 -4.2 22.6 15.5 86 89 A Q H X S+ 0 0 55 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.881 106.3 53.9 -62.7 -40.3 -6.4 19.5 15.3 87 90 A Q H X S+ 0 0 86 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.934 111.2 45.0 -60.9 -45.9 -4.6 18.2 12.3 88 91 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 -11,-0.3 -1,-0.2 0.873 111.1 54.4 -66.3 -35.4 -1.2 18.5 14.1 89 92 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.917 108.3 48.4 -64.0 -42.7 -2.8 16.9 17.2 90 93 A A H X S+ 0 0 33 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.884 112.4 49.3 -64.6 -38.3 -3.9 13.9 15.2 91 94 A S H X S+ 0 0 1 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.906 106.9 54.9 -67.3 -41.2 -0.5 13.6 13.6 92 95 A A H X>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 4,-0.6 0.888 108.6 49.9 -58.2 -39.9 1.2 13.8 17.1 93 96 A K H ><5S+ 0 0 85 -4,-1.8 3,-1.1 1,-0.2 -1,-0.2 0.949 110.6 49.2 -63.3 -49.1 -1.0 10.9 18.1 94 97 A R H 3<5S+ 0 0 155 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.867 109.5 51.8 -58.8 -39.4 0.0 8.9 15.1 95 98 A Y H 3<5S- 0 0 33 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.585 118.0-110.4 -76.8 -9.9 3.7 9.5 15.6 96 99 A G T <<5 + 0 0 27 -3,-1.1 -3,-0.2 -4,-0.6 -27,-0.2 0.769 53.5 167.1 90.2 26.4 3.5 8.3 19.2 97 100 A F < - 0 0 5 -5,-2.4 -23,-0.2 1,-0.1 -1,-0.2 -0.298 38.5-132.5 -69.7 160.8 4.0 11.5 21.2 98 101 A D S S- 0 0 62 -25,-2.1 2,-0.3 1,-0.2 -24,-0.2 0.639 79.7 -10.4 -88.0 -17.4 3.3 11.4 25.0 99 102 A A E -d 74 0A 0 -26,-1.0 -24,-2.8 30,-0.2 2,-0.3 -0.979 59.7-128.9-170.4 166.6 1.2 14.6 24.9 100 103 A V E -de 75 131A 0 30,-2.4 32,-1.8 -2,-0.3 2,-0.3 -0.779 18.5-166.5-121.5 167.1 0.2 17.7 22.9 101 104 A S E -de 76 132A 0 -26,-1.9 -24,-2.8 -2,-0.3 -23,-0.9 -0.986 2.2-164.3-152.8 153.1 0.2 21.4 23.8 102 105 A A E - e 0 133A 0 30,-1.3 32,-1.6 -2,-0.3 2,-0.1 -0.971 17.2-134.2-149.0 130.7 -1.2 24.5 22.4 103 106 A V E - e 0 134A 0 -2,-0.3 -24,-0.2 30,-0.2 32,-0.2 -0.496 48.8 -89.4 -75.5 148.8 -0.6 28.2 22.8 104 107 A T - 0 0 0 30,-1.2 38,-0.1 -2,-0.1 -1,-0.1 -0.431 57.2 -98.3 -57.8 127.1 -3.7 30.3 23.3 105 108 A P - 0 0 0 0, 0.0 5,-0.3 0, 0.0 2,-0.1 -0.207 55.3-164.3 -51.4 138.8 -4.7 31.3 19.8 106 109 A F + 0 0 10 -3,-0.1 2,-2.3 3,-0.1 35,-0.1 -0.442 48.0 44.4-120.1-170.8 -3.5 34.8 19.0 107 110 A Y S S+ 0 0 13 33,-0.7 922,-0.1 920,-0.2 -1,-0.0 -0.492 102.9 67.2 73.0 -70.8 -3.6 37.9 16.8 108 111 A Y S S- 0 0 6 -2,-2.3 2,-0.6 1,-0.1 919,-0.0 -0.556 95.6-114.9 -76.4 141.6 -7.4 38.0 16.7 109 112 A P - 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0 0 28 -2,-0.3 3,-2.2 1,-0.1 -217,-0.0 -0.523 60.5 -64.2 -82.1 147.2 -13.6 29.7 11.0 1157 272 D K T 3 S+ 0 0 105 1,-0.4 -1075,-1.2 -2,-0.2 -1074,-0.4 -0.359 120.4 43.8 -61.7 148.6 -12.9 28.2 14.5 1158 273 D P T 3 S+ 0 0 6 0, 0.0 -1,-0.4 0, 0.0 2,-0.2 -0.982 102.6 87.8 -68.7 0.3 -11.8 29.4 17.0 1159 274 D F S < S- 0 0 22 -3,-2.2 -4,-0.1 -1049,-0.1 -1049,-0.1 -0.468 74.2-145.9 -63.5 131.8 -14.4 32.1 16.0 1160 275 D G - 0 0 16 -2,-0.2 -5,-0.2 1,-0.2 -22,-0.1 -0.357 21.3 -87.5 -92.9 176.7 -17.7 31.1 17.5 1161 276 D P - 0 0 95 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.282 53.9 -85.1 -77.3 169.9 -21.2 31.6 16.0 1162 277 D V - 0 0 23 -24,-0.1 2,-0.3 1,-0.1 -27,-0.1 -0.546 46.4-108.7 -75.1 140.7 -23.2 34.8 16.6 1163 278 D D > - 0 0 84 -29,-0.3 3,-2.3 -2,-0.2 4,-0.3 -0.560 24.9-132.1 -69.8 127.3 -25.2 34.8 19.9 1164 279 D E G > S+ 0 0 153 -2,-0.3 3,-1.6 1,-0.3 -1,-0.2 0.736 100.0 75.1 -54.6 -24.8 -28.9 34.5 18.8 1165 280 D K G 3 S+ 0 0 134 1,-0.3 -1,-0.3 2,-0.1 4,-0.3 0.671 95.3 52.7 -63.8 -13.9 -29.8 37.3 21.2 1166 281 D Y G <> S+ 0 0 38 -3,-2.3 4,-2.2 1,-0.1 -1,-0.3 0.523 81.9 89.9 -98.1 -8.5 -28.3 39.7 18.6 1167 282 D L H <> S+ 0 0 45 -3,-1.6 4,-2.9 -4,-0.3 5,-0.3 0.884 80.9 58.5 -58.1 -40.7 -30.2 38.4 15.6 1168 283 D P H > S+ 0 0 88 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.937 111.5 40.6 -55.7 -47.6 -33.1 40.9 16.0 1169 284 D E H > S+ 0 0 93 -4,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.873 115.3 51.5 -68.5 -37.6 -30.8 43.9 15.8 1170 285 D L H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.879 111.9 45.9 -68.0 -37.5 -28.7 42.4 13.0 1171 286 D K H X S+ 0 0 122 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.911 113.2 49.5 -70.3 -41.9 -31.8 41.6 10.9 1172 287 D A H X S+ 0 0 59 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.879 110.6 51.5 -63.7 -37.1 -33.2 45.1 11.5 1173 288 D L H X S+ 0 0 10 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.931 108.1 50.7 -65.6 -44.8 -29.9 46.6 10.5 1174 289 D A H X S+ 0 0 1 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.921 111.7 48.5 -58.4 -43.5 -29.8 44.6 7.3 1175 290 D Q H X S+ 0 0 105 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.916 111.8 49.1 -62.9 -44.1 -33.3 45.8 6.5 1176 291 D Q H X S+ 0 0 86 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.921 111.3 48.9 -62.2 -45.3 -32.4 49.4 7.2 1177 292 D L H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.879 110.8 49.7 -64.2 -38.2 -29.2 49.3 5.1 1178 293 D M H < S+ 0 0 76 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.883 111.2 49.9 -67.8 -36.7 -31.1 47.8 2.1 1179 294 D Q H < S+ 0 0 147 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.911 113.5 47.1 -63.9 -43.5 -33.8 50.5 2.5 1180 295 D E H < 0 0 82 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.897 360.0 360.0 -65.7 -45.2 -31.0 53.1 2.6 1181 296 D R < 0 0 101 -4,-2.7 -2,-0.2 -5,-0.1 -3,-0.2 0.965 360.0 360.0 -71.6 360.0 -29.1 51.7 -0.4