==== 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 3LCH . 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) . 41953.0 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 . 152 12.9 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 . 2 0.2 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 . 85 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 109 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 4 11 5 3 1 0 0 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 0 140 0, 0.0 71,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 118.8 5.3 11.6 34.3 2 5 A L + 0 0 22 157,-0.2 2,-0.2 2,-0.0 35,-0.0 0.313 360.0 117.0 -98.7 8.4 5.8 15.0 32.6 3 6 A R + 0 0 89 198,-0.1 2,-0.3 2,-0.0 198,-0.1 -0.497 48.5 68.4 -75.2 145.3 7.6 16.7 35.4 4 7 A G S S- 0 0 12 196,-0.2 198,-2.4 -2,-0.2 2,-0.7 -0.913 84.1 -48.6 146.4-172.8 11.2 17.8 34.7 5 8 A V E +a 202 0A 2 -2,-0.3 32,-1.9 196,-0.2 33,-0.6 -0.907 54.5 177.1-105.3 112.5 13.7 19.9 32.9 6 9 A M E -ab 203 38A 1 196,-3.0 198,-1.2 -2,-0.7 33,-0.2 -0.964 24.6-128.1-128.5 127.8 13.0 20.0 29.2 7 10 A A E -ab 204 39A 0 31,-1.3 33,-2.7 -2,-0.5 2,-0.9 -0.419 17.0-129.2 -72.4 137.0 14.7 21.9 26.4 8 11 A A E - b 0 40A 2 196,-2.2 200,-0.2 31,-0.2 33,-0.2 -0.788 39.7-127.7 -82.5 110.6 12.8 24.1 24.0 9 12 A L - 0 0 4 31,-2.0 33,-0.3 -2,-0.9 34,-0.3 -0.363 14.8-141.5 -68.9 138.7 14.2 22.7 20.7 10 13 A L - 0 0 1 -2,-0.1 36,-0.2 195,-0.1 35,-0.1 -0.583 13.5-129.1 -91.9 158.9 15.7 25.0 18.0 11 14 A T - 0 0 3 34,-0.5 2,-0.2 -2,-0.2 242,-0.0 -0.929 20.7-144.6-112.8 107.3 15.1 24.3 14.3 12 15 A P - 0 0 0 0, 0.0 8,-2.5 0, 0.0 2,-0.3 -0.484 18.1-169.4 -72.9 140.6 18.4 24.3 12.3 13 16 A F B -I 19 0B 1 251,-0.6 253,-0.3 253,-0.5 251,-0.3 -0.839 15.7-123.7-123.8 162.6 18.3 25.7 8.8 14 17 A D > - 0 0 47 4,-2.6 3,-2.0 -2,-0.3 6,-0.1 -0.270 46.0 -80.3 -94.9-173.1 20.8 25.7 5.9 15 18 A Q T 3 S+ 0 0 121 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.714 132.0 52.2 -62.3 -21.0 22.2 28.7 4.0 16 19 A Q T 3 S- 0 0 152 2,-0.1 -1,-0.3 3,-0.1 3,-0.1 0.183 119.9-108.3-100.7 16.6 19.0 28.8 1.9 17 20 A Q S < S+ 0 0 46 -3,-2.0 2,-0.2 1,-0.2 -2,-0.1 0.563 76.6 131.0 70.6 12.8 16.8 28.9 5.0 18 21 A A S S- 0 0 42 1,-0.1 -4,-2.6 250,-0.0 -1,-0.2 -0.604 70.7 -77.9 -94.3 157.8 15.5 25.4 4.5 19 22 A L B -I 13 0B 24 -6,-0.2 2,-0.8 -2,-0.2 -6,-0.3 -0.228 36.1-145.0 -52.7 136.7 15.3 22.8 7.3 20 23 A D > - 0 0 23 -8,-2.5 4,-2.3 1,-0.2 3,-0.3 -0.818 18.4-176.2-107.3 86.4 18.7 21.2 8.0 21 24 A K H > S+ 0 0 98 -2,-0.8 4,-2.6 1,-0.2 5,-0.2 0.878 78.4 52.9 -51.0 -48.5 17.6 17.6 8.8 22 25 A A H > S+ 0 0 42 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.881 112.3 44.7 -60.0 -39.8 21.1 16.4 9.7 23 26 A S H > S+ 0 0 0 -3,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.858 109.8 56.7 -72.7 -33.9 21.7 19.2 12.2 24 27 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.962 110.0 44.7 -59.7 -49.7 18.2 18.7 13.6 25 28 A R H X S+ 0 0 87 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.917 112.1 52.9 -61.0 -42.6 19.1 15.1 14.3 26 29 A R H X S+ 0 0 98 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.900 109.5 48.3 -60.6 -40.8 22.5 16.1 15.7 27 30 A L H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.884 110.1 51.7 -68.3 -37.7 20.8 18.6 18.1 28 31 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.961 113.8 43.4 -61.8 -49.1 18.3 16.1 19.3 29 32 A Q H X S+ 0 0 55 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.842 110.3 57.3 -64.6 -33.8 21.0 13.5 20.0 30 33 A F H X S+ 0 0 56 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.927 107.7 46.8 -62.7 -45.7 23.1 16.3 21.6 31 34 A N H <>S+ 0 0 0 -4,-2.3 5,-1.9 2,-0.2 -2,-0.2 0.900 112.2 50.7 -63.0 -41.7 20.4 17.1 24.1 32 35 A I H ><5S+ 0 0 29 -4,-2.0 3,-1.6 1,-0.2 -2,-0.2 0.935 108.6 51.8 -61.8 -46.8 19.9 13.4 24.9 33 36 A Q H 3<5S+ 0 0 154 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.785 105.5 55.1 -62.5 -29.9 23.6 12.9 25.5 34 37 A Q T 3<5S- 0 0 29 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.369 120.6-104.8 -87.9 8.1 23.7 15.8 28.0 35 38 A G T < 5 + 0 0 43 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.657 55.6 167.7 84.7 18.6 21.0 14.3 30.1 36 39 A I < - 0 0 9 -5,-1.9 -1,-0.2 1,-0.1 -30,-0.2 -0.331 36.4-135.1 -64.7 146.4 17.9 16.4 29.3 37 40 A D S S- 0 0 62 -32,-1.9 35,-1.9 1,-0.2 2,-0.3 0.724 70.9 -42.8 -75.5 -22.5 14.6 15.0 30.5 38 41 A G E -bc 6 72A 0 -33,-0.6 -31,-1.3 33,-0.2 2,-0.4 -0.973 59.3 -94.2 175.0 179.9 12.7 15.7 27.3 39 42 A L E -bc 7 73A 0 33,-2.4 35,-3.0 -2,-0.3 2,-0.7 -0.953 9.6-150.2-126.9 144.0 12.1 18.1 24.4 40 43 A Y E -bc 8 74A 3 -33,-2.7 -31,-2.0 -2,-0.4 2,-0.4 -0.946 32.7-163.6-108.3 107.7 9.4 20.8 23.7 41 44 A V E + c 0 75A 1 33,-3.0 35,-3.3 -2,-0.7 -31,-0.1 -0.809 55.5 13.6-107.1 135.7 9.2 20.8 19.9 42 45 A G S S+ 0 0 5 -2,-0.4 -1,-0.2 -33,-0.3 -32,-0.1 0.727 88.4 129.2 82.9 22.7 7.7 23.4 17.6 43 46 A G S > >S- 0 0 2 -3,-0.4 5,-1.5 -34,-0.3 3,-0.7 -0.064 82.0 -69.3 -91.3-162.6 7.3 26.2 20.1 44 47 A S G > 5S+ 0 0 6 1,-0.2 3,-1.9 2,-0.2 5,-0.2 0.920 134.3 55.4 -53.6 -47.0 8.5 29.8 19.8 45 48 A T G 3 5S+ 0 0 12 1,-0.3 -34,-0.5 2,-0.1 -1,-0.2 0.762 99.8 58.5 -59.8 -30.3 12.1 28.6 20.0 46 49 A G G < 5S- 0 0 0 -3,-0.7 -1,-0.3 -36,-0.2 -2,-0.2 0.341 112.2-119.2 -84.2 9.8 11.7 26.3 17.1 47 50 A E T X 5 + 0 0 0 -3,-1.9 3,-2.1 1,-0.1 -3,-0.2 0.790 58.1 157.5 57.1 31.6 10.7 29.3 14.9 48 51 A A G > < + 0 0 1 -5,-1.5 3,-1.5 1,-0.3 -4,-0.1 0.792 62.8 63.9 -56.1 -30.4 7.3 27.6 14.3 49 52 A F G 3 S+ 0 0 25 1,-0.3 -1,-0.3 -5,-0.2 920,-0.3 0.452 102.8 46.9 -80.2 2.3 5.7 31.0 13.5 50 53 A V G < S+ 0 0 0 -3,-2.1 2,-0.3 918,-0.1 -1,-0.3 -0.030 104.8 82.8-123.8 23.8 7.9 31.5 10.4 51 54 A Q S < S- 0 0 17 -3,-1.5 2,-0.1 217,-0.0 918,-0.1 -0.875 76.9-122.0-123.9 158.5 7.2 27.9 9.3 52 55 A S > - 0 0 36 -2,-0.3 4,-1.9 1,-0.1 5,-0.2 -0.442 34.6-103.9 -90.8 171.0 4.3 26.3 7.4 53 56 A L H > S+ 0 0 33 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.931 122.4 51.9 -63.1 -45.8 2.2 23.5 8.8 54 57 A S H > S+ 0 0 79 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.887 109.5 51.2 -58.9 -37.4 3.9 20.9 6.6 55 58 A E H > S+ 0 0 51 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.878 109.6 49.0 -67.4 -38.0 7.3 22.2 7.8 56 59 A R H X S+ 0 0 10 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.891 110.6 50.6 -68.9 -38.0 6.3 21.9 11.5 57 60 A E H X S+ 0 0 34 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.893 106.0 56.4 -65.2 -39.2 5.0 18.3 10.9 58 61 A Q H X S+ 0 0 66 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.896 108.9 46.5 -58.2 -42.9 8.3 17.4 9.3 59 62 A V H X S+ 0 0 3 -4,-1.6 4,-2.5 2,-0.2 5,-0.2 0.929 111.4 50.7 -66.2 -47.2 10.2 18.5 12.4 60 63 A L H X S+ 0 0 3 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.924 111.1 49.3 -57.0 -46.0 7.9 16.7 14.7 61 64 A E H X S+ 0 0 88 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.912 111.9 47.1 -61.8 -44.7 8.3 13.5 12.7 62 65 A I H X S+ 0 0 9 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.918 111.2 50.4 -64.7 -44.9 12.1 13.6 12.6 63 66 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.910 109.8 51.9 -60.4 -41.0 12.5 14.3 16.3 64 67 A A H X S+ 0 0 5 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.912 108.2 50.6 -61.8 -43.4 10.2 11.4 17.1 65 68 A E H < S+ 0 0 125 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.899 115.7 44.7 -60.5 -39.7 12.3 9.1 15.0 66 69 A E H < S+ 0 0 38 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.831 132.7 8.7 -75.3 -35.2 15.3 10.3 16.8 67 70 A A H >X S+ 0 0 0 -4,-2.7 3,-2.5 -5,-0.1 4,-1.6 0.462 76.6 132.2-132.4 1.5 14.1 10.2 20.4 68 71 A K T 3< S+ 0 0 114 -4,-2.5 4,-0.1 -5,-0.3 29,-0.1 -0.327 87.1 15.1 -58.1 136.3 10.7 8.6 21.0 69 72 A G T 34 S+ 0 0 77 2,-0.5 -1,-0.3 27,-0.2 3,-0.1 0.340 117.9 73.7 83.1 -9.4 11.0 6.2 23.9 70 73 A K T <4 S- 0 0 131 -3,-2.5 2,-0.3 1,-0.4 -2,-0.2 0.781 109.7 -1.9-102.2 -40.0 14.3 7.7 25.0 71 74 A I S < S- 0 0 22 -4,-1.6 -2,-0.5 -32,-0.0 -1,-0.4 -0.930 89.6 -78.9-144.9 165.4 13.1 11.0 26.5 72 75 A K E -c 38 0A 73 -35,-1.9 -33,-2.4 -2,-0.3 2,-0.5 -0.440 42.9-155.6 -69.3 142.7 9.8 12.7 26.9 73 76 A L E -c 39 0A 0 -35,-0.2 25,-1.8 23,-0.1 26,-1.4 -0.975 11.1-174.9-126.5 120.2 8.5 14.5 23.8 74 77 A I E -cd 40 99A 0 -35,-3.0 -33,-3.0 -2,-0.5 2,-0.6 -0.958 12.3-152.5-114.9 125.1 6.0 17.4 23.9 75 78 A A E -cd 41 100A 0 24,-2.7 26,-1.9 -2,-0.5 2,-1.0 -0.852 5.8-148.7-101.3 118.6 4.7 18.8 20.7 76 79 A H E + d 0 101A 1 -35,-3.3 26,-0.2 -2,-0.6 24,-0.1 -0.761 25.3 168.5 -84.7 109.2 3.6 22.5 20.5 77 80 A V + 0 0 0 24,-2.7 11,-0.3 -2,-1.0 12,-0.2 0.321 23.9 139.8-102.4 5.4 0.8 22.3 18.0 78 81 A G + 0 0 0 23,-0.8 2,-0.3 10,-0.1 26,-0.1 -0.250 16.2 156.6 -62.3 133.5 -0.5 25.8 18.6 79 82 A C - 0 0 6 2,-0.3 6,-0.1 24,-0.2 859,-0.1 -0.891 55.0-109.9-141.5 165.9 -1.6 28.1 15.8 80 83 A V S S+ 0 0 12 -2,-0.3 2,-0.2 857,-0.2 858,-0.1 0.943 105.7 73.1 -65.2 -42.3 -4.0 31.1 15.7 81 84 A S S > S- 0 0 4 856,-0.3 4,-2.0 1,-0.1 -2,-0.3 -0.501 72.8-152.1 -74.5 132.2 -6.4 28.7 13.8 82 85 A T H > S+ 0 0 5 1075,-1.2 4,-2.3 -2,-0.2 5,-0.2 0.946 97.6 52.7 -67.8 -47.5 -8.1 26.0 15.7 83 86 A A H > S+ 0 0 58 1074,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.879 110.4 47.4 -55.6 -42.7 -8.3 23.8 12.6 84 87 A E H > S+ 0 0 40 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.933 110.3 52.0 -65.8 -44.5 -4.6 24.1 11.9 85 88 A S H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.864 108.0 53.4 -59.0 -37.0 -3.8 23.4 15.6 86 89 A Q H X S+ 0 0 56 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.875 104.4 54.2 -66.0 -40.1 -5.9 20.2 15.3 87 90 A Q H X S+ 0 0 91 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.944 111.4 44.9 -60.0 -47.4 -4.0 18.9 12.3 88 91 A L H X S+ 0 0 1 -4,-1.9 4,-2.5 -11,-0.3 -1,-0.2 0.865 111.3 53.7 -65.4 -35.8 -0.7 19.2 14.1 89 92 A A H X S+ 0 0 0 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.910 108.6 48.8 -64.9 -42.1 -2.2 17.6 17.2 90 93 A A H X S+ 0 0 34 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.885 112.0 49.8 -64.9 -37.9 -3.4 14.6 15.2 91 94 A S H X S+ 0 0 1 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.906 105.9 54.8 -67.7 -41.0 0.1 14.4 13.6 92 95 A A H <>S+ 0 0 0 -4,-2.5 5,-2.5 1,-0.2 4,-0.5 0.845 108.2 51.2 -60.0 -34.1 1.8 14.5 17.0 93 96 A K H ><5S+ 0 0 83 -4,-1.5 3,-1.1 3,-0.2 -1,-0.2 0.930 109.2 49.5 -68.1 -46.6 -0.4 11.5 18.0 94 97 A R H 3<5S+ 0 0 156 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.844 109.7 51.9 -61.3 -35.4 0.6 9.6 14.9 95 98 A Y T 3<5S- 0 0 31 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.556 117.2-111.3 -80.4 -8.7 4.3 10.2 15.5 96 99 A G T < 5 + 0 0 24 -3,-1.1 -27,-0.2 -4,-0.5 -3,-0.2 0.759 52.9 167.6 88.1 24.8 4.1 9.0 19.1 97 100 A F < - 0 0 4 -5,-2.5 -1,-0.2 1,-0.1 -23,-0.2 -0.333 37.2-134.6 -68.2 155.9 4.6 12.2 21.1 98 101 A D S S- 0 0 63 -25,-1.8 2,-0.3 1,-0.2 -24,-0.2 0.717 79.3 -3.5 -84.1 -22.4 3.9 12.0 24.9 99 102 A A E -d 74 0A 0 -26,-1.4 -24,-2.7 30,-0.2 2,-0.3 -0.985 60.4-133.3-161.9 166.1 1.9 15.2 25.0 100 103 A V E -de 75 131A 0 30,-2.5 32,-1.7 -2,-0.3 2,-0.3 -0.760 17.5-165.7-120.8 169.4 0.8 18.2 23.0 101 104 A S E -de 76 132A 0 -26,-1.9 -24,-2.7 -2,-0.3 -23,-0.8 -0.988 3.7-165.0-154.3 153.6 0.8 22.0 23.8 102 105 A A E - e 0 133A 0 30,-1.3 32,-1.4 -2,-0.3 2,-0.1 -0.941 16.8-136.3-151.1 126.2 -0.8 25.2 22.5 103 106 A V E - e 0 134A 0 -2,-0.3 -24,-0.2 30,-0.1 32,-0.1 -0.458 48.8 -89.0 -72.3 148.3 -0.1 28.8 23.0 104 107 A T - 0 0 0 30,-1.2 -1,-0.1 -2,-0.1 38,-0.1 -0.397 57.4 -96.6 -57.8 129.7 -3.2 31.0 23.5 105 108 A P - 0 0 0 0, 0.0 5,-0.2 0, 0.0 -25,-0.1 -0.241 55.6-163.0 -52.4 135.0 -4.3 32.0 20.0 106 109 A F + 0 0 12 -3,-0.1 2,-2.4 3,-0.1 35,-0.1 -0.405 48.5 40.3-116.1-171.6 -3.0 35.5 19.2 107 110 A Y S S+ 0 0 16 33,-0.6 922,-0.1 920,-0.2 -1,-0.0 -0.439 104.2 65.3 71.5 -69.0 -3.2 38.6 17.0 108 111 A Y S S- 0 0 6 -2,-2.4 2,-0.3 829,-0.1 919,-0.0 -0.610 95.2-113.8 -81.3 140.9 -7.0 38.6 16.9 109 112 A P - 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0 0 7 -5,-2.0 -1,-0.3 -6,-0.1 -15,-0.2 -0.271 39.0-159.9 -59.3 151.0 -5.5 61.6 6.4 1088 203 D D - 0 0 46 -17,-2.1 -196,-0.3 -196,-0.1 2,-0.3 0.035 67.2 -13.9-122.3 26.0 -6.7 61.8 2.8 1089 204 D G E - j 01072H 1 -18,-0.6 -16,-2.4 -198,-0.2 2,-0.3 -0.973 67.9-125.3 168.6-165.9 -8.7 58.6 2.7 1090 205 D G E -cj 8931073H 0 -198,-2.5 -196,-3.0 -18,-0.3 2,-0.4 -0.996 7.6-147.1-166.7 164.9 -9.3 55.4 4.6 1091 206 D I E +c 894 0H 0 -18,-1.8 2,-0.3 -2,-0.3 -196,-0.2 -0.987 36.7 147.9-138.2 124.9 -9.4 51.6 4.8 1092 207 D G E > -c 895 0H 4 -198,-1.0 -196,-1.9 -2,-0.4 3,-0.7 -0.992 50.9-126.5-160.8 153.4 -11.9 49.9 7.1 1093 208 D S T > S+ 0 0 9 -2,-0.3 3,-1.6 1,-0.2 4,-0.2 0.808 104.4 63.5 -71.7 -31.1 -14.1 46.8 7.5 1094 209 D T T >> S+ 0 0 0 1,-0.3 4,-1.4 2,-0.2 3,-1.2 0.641 82.6 80.9 -71.1 -9.9 -17.4 48.6 8.0 1095 210 D Y H <> S+ 0 0 0 -3,-0.7 4,-1.7 1,-0.3 -1,-0.3 0.741 77.3 73.5 -63.9 -23.3 -17.1 50.1 4.5 1096 211 D N H <4 S+ 0 0 0 -3,-1.6 -1,-0.3 -200,-0.2 -2,-0.2 0.824 110.3 25.5 -60.4 -34.0 -18.4 46.7 3.4 1097 212 D I H <4 S+ 0 0 0 -3,-1.2 -1,-0.2 -4,-0.2 -2,-0.2 0.610 142.2 14.4-108.3 -13.9 -21.9 47.6 4.6 1098 213 D M H >X + 0 0 0 -4,-1.4 3,-1.7 2,-0.0 4,-0.9 0.031 68.3 140.5-152.4 36.8 -22.0 51.4 4.5 1099 214 D G H 3X S+ 0 0 1 -4,-1.7 4,-1.8 1,-0.3 3,-0.3 0.789 70.5 67.3 -52.6 -31.2 -19.0 52.7 2.5 1100 215 D W H 3> S+ 0 0 50 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.833 93.5 58.4 -61.5 -32.6 -21.2 55.4 1.0 1101 216 D R H <> S+ 0 0 5 -3,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.909 106.2 48.0 -63.8 -41.1 -21.5 57.1 4.4 1102 217 D Y H X S+ 0 0 0 -4,-0.9 4,-2.0 -3,-0.3 -1,-0.2 0.866 110.8 51.0 -67.5 -35.4 -17.7 57.4 4.5 1103 218 D Q H X S+ 0 0 46 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.894 107.7 54.9 -66.0 -39.3 -17.7 58.8 1.0 1104 219 D G H X S+ 0 0 13 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.869 106.0 50.9 -61.3 -37.5 -20.4 61.2 2.2 1105 220 D I H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.928 108.2 51.5 -66.2 -45.1 -18.1 62.4 5.0 1106 221 D V H X S+ 0 0 35 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.940 114.5 44.0 -56.1 -47.7 -15.2 63.0 2.5 1107 222 D K H X S+ 0 0 124 -4,-2.4 4,-2.0 2,-0.2 6,-0.2 0.938 111.8 53.0 -62.9 -48.5 -17.6 65.1 0.3 1108 223 D A H X>S+ 0 0 4 -4,-2.9 5,-2.7 1,-0.2 4,-0.5 0.906 110.9 45.5 -54.8 -47.8 -19.1 66.9 3.3 1109 224 D L H <5S+ 0 0 16 -4,-2.7 3,-0.5 1,-0.2 -1,-0.2 0.838 110.4 55.3 -66.7 -32.5 -15.7 68.0 4.6 1110 225 D K H <5S+ 0 0 166 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.851 112.3 42.3 -68.2 -34.6 -14.6 69.0 1.1 1111 226 D E H <5S- 0 0 143 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.438 116.7-111.9 -92.4 -0.2 -17.6 71.3 0.8 1112 227 D G T <5 + 0 0 18 -4,-0.5 2,-1.4 -3,-0.5 -3,-0.2 0.662 69.3 142.7 79.9 16.7 -17.3 72.7 4.3 1113 228 D D >< + 0 0 64 -5,-2.7 4,-2.1 -6,-0.2 -1,-0.2 -0.637 14.1 165.0 -91.9 79.6 -20.5 71.0 5.5 1114 229 D I H > S+ 0 0 16 -2,-1.4 4,-3.0 1,-0.2 5,-0.3 0.866 71.2 60.6 -63.4 -38.2 -19.4 70.1 9.1 1115 230 D Q H > S+ 0 0 147 1,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.931 109.4 42.1 -54.5 -49.1 -23.0 69.5 10.2 1116 231 D T H > S+ 0 0 57 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.921 113.0 53.0 -65.9 -44.3 -23.4 66.7 7.6 1117 232 D A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.931 112.3 44.6 -56.7 -48.9 -19.9 65.3 8.3 1118 233 D Q H X S+ 0 0 57 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.890 111.6 53.7 -62.9 -41.0 -20.6 65.0 12.0 1119 234 D K H X S+ 0 0 120 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.907 110.5 46.4 -61.1 -43.7 -24.1 63.5 11.4 1120 235 D L H X S+ 0 0 36 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.912 111.7 50.1 -67.5 -42.3 -22.6 60.8 9.2 1121 236 D Q H X S+ 0 0 14 -4,-2.2 4,-2.7 -5,-0.2 -2,-0.2 0.911 109.3 53.6 -62.7 -39.9 -19.8 60.0 11.6 1122 237 D T H X S+ 0 0 39 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.916 108.8 47.5 -61.0 -44.4 -22.4 59.7 14.4 1123 238 D E H X S+ 0 0 31 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.882 111.5 51.7 -65.3 -36.9 -24.5 57.2 12.4 1124 239 D C H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.930 109.1 50.6 -64.0 -43.4 -21.4 55.2 11.6 1125 240 D N H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.799 103.1 57.6 -66.7 -28.4 -20.5 55.1 15.3 1126 241 D K H X S+ 0 0 97 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.916 111.8 44.4 -65.7 -39.5 -24.0 53.9 16.3 1127 242 D V H X S+ 0 0 8 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.929 112.2 50.4 -68.6 -45.5 -23.3 51.0 14.0 1128 243 D I H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 5,-0.2 0.867 103.8 60.0 -62.0 -36.2 -19.7 50.5 15.3 1129 244 D D H X S+ 0 0 41 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.936 110.2 42.8 -55.1 -47.0 -21.1 50.5 18.9 1130 245 D L H X S+ 0 0 16 -4,-1.4 4,-2.4 1,-0.2 3,-0.4 0.929 111.0 53.2 -65.7 -47.6 -23.2 47.5 17.9 1131 246 D L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.3 8,-0.2 0.793 105.5 55.2 -60.7 -29.3 -20.5 45.7 16.0 1132 247 D I H < S+ 0 0 84 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.862 109.9 46.7 -72.4 -33.3 -18.1 45.9 18.9 1133 248 D K H < S+ 0 0 110 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.900 121.2 36.7 -72.7 -40.7 -20.7 44.2 21.1 1134 249 D T H < S- 0 0 2 -4,-2.4 29,-0.3 1,-0.1 -2,-0.2 0.839 125.8 -90.0 -80.3 -34.1 -21.4 41.5 18.5 1135 250 D G X - 0 0 18 -4,-2.7 4,-2.2 -5,-0.2 5,-0.2 0.106 34.9-117.5 120.3 121.8 -17.9 41.0 17.2 1136 251 D R H > S+ 0 0 60 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.939 104.8 37.9 -57.4 -59.5 -16.8 43.2 14.3 1137 252 D F H > S+ 0 0 31 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.934 122.6 41.9 -60.9 -48.5 -16.0 40.7 11.5 1138 253 D R H > S+ 0 0 47 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.832 112.8 54.6 -69.6 -31.3 -18.9 38.3 12.3 1139 254 D G H X S+ 0 0 0 -4,-2.2 4,-2.0 -8,-0.2 -1,-0.2 0.908 110.4 46.6 -67.4 -40.2 -21.3 41.1 12.9 1140 255 D L H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.898 111.2 51.2 -66.9 -42.3 -20.5 42.5 9.4 1141 256 D K H X S+ 0 0 2 -4,-2.2 4,-1.6 1,-0.2 9,-0.2 0.889 109.4 51.8 -62.5 -38.2 -20.9 39.1 7.8 1142 257 D T H X S+ 0 0 5 -4,-2.1 4,-2.1 11,-0.2 -2,-0.2 0.909 109.8 47.6 -66.1 -41.9 -24.2 38.7 9.5 1143 258 D V H X S+ 0 0 0 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.919 112.4 50.0 -64.2 -42.5 -25.5 42.0 8.2 1144 259 D L H <>S+ 0 0 0 -4,-2.5 5,-2.8 1,-0.2 6,-1.1 0.797 107.0 56.6 -65.5 -28.7 -24.2 41.1 4.7 1145 260 D H H ><5S+ 0 0 64 -4,-1.6 3,-1.9 4,-0.2 -1,-0.2 0.944 106.7 47.3 -67.4 -47.1 -26.0 37.8 5.1 1146 261 D Y H 3<5S+ 0 0 56 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.702 106.4 59.5 -68.2 -16.6 -29.4 39.6 5.7 1147 262 D M T 3<5S- 0 0 14 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.332 119.6-113.4 -91.1 6.9 -28.6 41.8 2.7 1148 263 D D T < 5S+ 0 0 135 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.1 0.750 92.2 104.2 68.0 27.7 -28.4 38.6 0.6 1149 264 D V S - 0 0 26 -2,-0.2 3,-2.3 1,-0.1 -1,-0.1 -0.573 63.0 -64.7 -85.6 145.0 -13.1 30.7 11.4 1157 272 D K T 3 S+ 0 0 110 1,-0.4 -1075,-1.2 -2,-0.2 -1074,-0.4 -0.308 121.0 43.6 -57.7 147.5 -12.5 29.0 14.8 1158 273 D P T 3 S+ 0 0 6 0, 0.0 -1,-0.4 0, 0.0 2,-0.2 -0.983 103.0 88.5 -68.3 0.9 -11.5 30.1 17.4 1159 274 D F S < S- 0 0 24 -3,-2.3 -4,-0.1 -1049,-0.1 -1049,-0.1 -0.478 73.0-149.0 -63.5 128.9 -13.9 32.8 16.4 1160 275 D G - 0 0 14 -2,-0.2 -5,-0.2 1,-0.2 -22,-0.1 -0.351 21.6 -87.5 -92.0 178.3 -17.3 31.8 17.7 1161 276 D P - 0 0 88 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.295 52.3 -83.3 -80.8 170.0 -20.7 32.6 16.2 1162 277 D V - 0 0 22 -24,-0.1 2,-0.4 -9,-0.1 -27,-0.1 -0.504 49.5-105.8 -72.6 140.1 -22.7 35.8 16.9 1163 278 D D > - 0 0 83 -29,-0.3 3,-2.7 -2,-0.2 4,-0.3 -0.539 26.3-131.3 -68.0 124.3 -24.8 35.7 20.1 1164 279 D E G > S+ 0 0 156 -2,-0.4 3,-1.5 1,-0.3 -1,-0.1 0.709 100.4 74.6 -50.7 -24.9 -28.4 35.2 19.1 1165 280 D K G 3 S+ 0 0 136 1,-0.3 -1,-0.3 2,-0.1 4,-0.3 0.713 94.4 54.5 -63.9 -17.3 -29.6 38.0 21.3 1166 281 D Y G <> S+ 0 0 38 -3,-2.7 4,-2.1 1,-0.2 3,-0.3 0.547 81.1 90.4 -92.8 -9.3 -28.1 40.4 18.8 1167 282 D L H <> S+ 0 0 43 -3,-1.5 4,-3.2 -4,-0.3 5,-0.3 0.880 80.4 56.8 -57.6 -42.9 -29.9 39.2 15.7 1168 283 D P H > S+ 0 0 89 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.918 111.7 43.4 -57.0 -41.6 -32.9 41.5 16.0 1169 284 D E H > S+ 0 0 90 -3,-0.3 4,-2.3 -4,-0.3 -2,-0.2 0.900 115.0 48.7 -69.7 -40.6 -30.6 44.6 15.9 1170 285 D L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.908 113.3 47.1 -66.1 -41.8 -28.5 43.2 13.1 1171 286 D K H X S+ 0 0 118 -4,-3.2 4,-2.4 2,-0.2 -2,-0.2 0.935 112.6 49.8 -63.9 -45.2 -31.6 42.3 11.0 1172 287 D A H X S+ 0 0 61 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.884 111.0 50.2 -60.2 -39.6 -33.0 45.8 11.7 1173 288 D L H X S+ 0 0 10 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.932 108.4 51.5 -65.6 -45.3 -29.7 47.4 10.7 1174 289 D A H X S+ 0 0 1 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.925 111.7 48.0 -56.8 -45.6 -29.6 45.4 7.4 1175 290 D Q H X S+ 0 0 104 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.928 112.6 48.7 -61.4 -46.6 -33.1 46.5 6.6 1176 291 D Q H X S+ 0 0 82 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.949 111.7 48.3 -59.6 -51.3 -32.3 50.1 7.4 1177 292 D L H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.867 110.0 52.4 -59.2 -38.9 -29.1 50.2 5.3 1178 293 D M H < S+ 0 0 76 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.888 112.1 45.5 -65.9 -38.1 -30.9 48.6 2.4 1179 294 D Q H < S+ 0 0 153 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.909 113.1 50.9 -69.1 -42.1 -33.6 51.2 2.5 1180 295 D E H < 0 0 81 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.905 360.0 360.0 -61.2 -44.5 -31.1 54.0 2.9 1181 296 D R < 0 0 104 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.985 360.0 360.0 -76.6 360.0 -29.0 52.8 -0.1