==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 08-JUL-96 1FDY . COMPND 2 MOLECULE: N-ACETYLNEURAMINATE LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.C.LAWRENCE,J.A.R.G.BARBOSA,B.J.SMITH,N.E.HALL,P.A.PILLING, . 1165 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40404.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 913 78.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 152 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 0.9 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 . 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 . 88 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 123 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 481 41.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 28 2.4 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 1 3 2 2 4 7 0 6 6 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 . 5 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 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 0 146 0, 0.0 71,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -2.2 -53.2 -94.9 -33.8 2 5 A L + 0 0 7 157,-0.1 35,-0.0 2,-0.0 97,-0.0 0.478 360.0 113.0 -99.0 -5.5 -50.4 -92.9 -32.1 3 6 A R + 0 0 158 198,-0.1 2,-0.3 2,-0.0 198,-0.1 -0.371 53.2 69.7 -65.3 144.5 -49.7 -90.7 -35.1 4 7 A G S S- 0 0 10 196,-0.1 198,-2.5 2,-0.1 2,-0.6 -0.905 85.6 -49.3 145.3-176.9 -50.7 -87.1 -34.5 5 8 A V E +a 202 0A 2 -2,-0.3 32,-2.7 196,-0.3 33,-0.5 -0.934 57.2 174.5-101.0 108.6 -50.2 -83.7 -32.8 6 9 A M E -ab 203 38A 0 196,-2.8 198,-1.6 -2,-0.6 2,-0.3 -0.953 27.3-124.5-126.0 134.3 -49.8 -84.3 -29.1 7 10 A A E -ab 204 39A 0 31,-1.7 33,-2.9 -2,-0.4 2,-1.2 -0.579 15.8-130.7 -79.8 135.5 -49.0 -81.9 -26.2 8 11 A A E - b 0 40A 3 196,-2.4 200,-0.2 -2,-0.3 33,-0.2 -0.766 40.9-130.5 -81.5 96.8 -46.1 -82.5 -23.9 9 12 A L - 0 0 4 31,-1.9 34,-0.3 -2,-1.2 33,-0.3 -0.305 14.9-142.6 -58.3 138.0 -48.1 -81.9 -20.7 10 13 A L - 0 0 1 36,-0.1 36,-0.2 195,-0.1 35,-0.1 -0.661 14.3-127.3 -93.2 150.7 -46.8 -79.5 -18.0 11 14 A T - 0 0 2 34,-0.5 2,-0.1 -2,-0.2 10,-0.1 -0.901 19.1-142.8-110.6 110.3 -47.2 -80.2 -14.3 12 15 A P - 0 0 0 0, 0.0 8,-2.4 0, 0.0 2,-0.3 -0.466 18.6-169.0 -64.4 139.5 -48.8 -77.4 -12.3 13 16 A F B -I 19 0B 1 251,-0.6 253,-0.4 253,-0.5 251,-0.3 -0.858 17.5-118.5-126.1 159.6 -47.5 -76.9 -8.8 14 17 A D > - 0 0 47 4,-3.4 3,-2.3 -2,-0.3 6,-0.1 -0.309 43.7 -83.7 -89.9-178.9 -48.8 -74.7 -6.0 15 18 A Q T 3 S+ 0 0 117 1,-0.3 -1,-0.1 2,-0.1 5,-0.0 0.788 132.7 50.6 -54.6 -32.1 -47.1 -71.8 -4.2 16 19 A Q T 3 S- 0 0 158 2,-0.1 -1,-0.3 3,-0.1 3,-0.1 0.316 121.8-106.7 -90.4 10.3 -45.4 -74.3 -1.9 17 20 A Q S < S+ 0 0 36 -3,-2.3 2,-0.2 1,-0.3 -2,-0.1 0.479 77.5 131.0 79.0 8.6 -44.1 -76.4 -4.9 18 21 A A S S- 0 0 45 1,-0.1 -4,-3.4 -5,-0.1 -1,-0.3 -0.508 71.5 -81.3 -85.3 159.8 -46.5 -79.3 -4.4 19 22 A L B -I 13 0B 25 -6,-0.3 2,-0.8 -2,-0.2 -6,-0.3 -0.307 34.5-144.9 -59.5 141.7 -48.6 -80.7 -7.3 20 23 A D > - 0 0 21 -8,-2.4 4,-1.5 1,-0.2 3,-0.3 -0.829 19.9-177.6-110.8 88.6 -51.7 -78.6 -7.9 21 24 A K H > S+ 0 0 92 -2,-0.8 4,-2.7 1,-0.2 5,-0.3 0.864 77.5 55.8 -58.4 -41.0 -54.1 -81.4 -8.9 22 25 A A H > S+ 0 0 45 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.902 110.2 45.6 -61.9 -39.8 -57.0 -79.1 -9.7 23 26 A S H > S+ 0 0 0 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.793 109.8 56.9 -73.0 -25.0 -54.9 -77.2 -12.2 24 27 A L H X S+ 0 0 0 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.978 112.0 40.4 -64.8 -58.4 -53.6 -80.5 -13.6 25 28 A R H X S+ 0 0 87 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.909 115.7 52.5 -54.1 -44.8 -57.1 -81.6 -14.4 26 29 A R H X S+ 0 0 94 -4,-2.4 4,-1.9 -5,-0.3 -1,-0.2 0.897 111.9 45.5 -60.9 -40.7 -57.9 -78.0 -15.5 27 30 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.844 110.7 53.5 -72.8 -35.5 -54.9 -78.1 -17.9 28 31 A V H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.979 111.7 44.8 -61.4 -55.8 -55.8 -81.6 -19.2 29 32 A Q H X S+ 0 0 46 -4,-2.8 4,-3.1 1,-0.2 5,-0.3 0.878 110.5 54.9 -55.1 -42.5 -59.3 -80.5 -20.0 30 33 A F H X S+ 0 0 54 -4,-1.9 4,-1.2 -5,-0.2 -1,-0.2 0.906 109.3 47.3 -58.4 -45.2 -58.0 -77.3 -21.7 31 34 A N H <>S+ 0 0 0 -4,-2.1 5,-1.0 2,-0.2 3,-0.3 0.946 112.4 50.3 -62.8 -43.4 -55.8 -79.3 -23.9 32 35 A I H ><5S+ 0 0 28 -4,-2.5 3,-2.4 1,-0.3 4,-0.3 0.959 110.4 47.8 -57.2 -54.2 -58.7 -81.6 -24.8 33 36 A Q H 3<5S+ 0 0 163 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.729 102.9 65.9 -59.4 -22.2 -61.0 -78.7 -25.6 34 37 A Q T 3<5S- 0 0 25 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.384 115.4-118.2 -81.8 3.2 -58.1 -77.4 -27.7 35 38 A G T < 5 + 0 0 43 -3,-2.4 2,-0.2 1,-0.2 -3,-0.2 0.923 54.0 162.2 60.4 48.5 -58.5 -80.4 -29.9 36 39 A I < - 0 0 6 -5,-1.0 -30,-0.2 -4,-0.3 -1,-0.2 -0.589 44.0-125.7 -91.3 159.8 -55.1 -81.9 -29.4 37 40 A D S S- 0 0 59 -32,-2.7 35,-2.5 1,-0.2 2,-0.3 0.751 73.4 -44.0 -80.2 -25.5 -54.7 -85.6 -30.4 38 41 A G E -bc 6 72A 0 -33,-0.5 -31,-1.7 33,-0.2 2,-0.4 -0.968 59.9 -93.3 179.6-173.1 -53.3 -86.8 -27.1 39 42 A L E -bc 7 73A 0 33,-2.5 35,-3.2 -2,-0.3 2,-0.7 -0.971 9.6-149.2-132.1 143.0 -51.0 -86.0 -24.2 40 43 A Y E -bc 8 74A 1 -33,-2.9 -31,-1.9 -2,-0.4 2,-0.4 -0.940 31.4-167.3-107.6 108.2 -47.4 -86.9 -23.4 41 44 A V E + c 0 75A 0 33,-3.0 35,-3.5 -2,-0.7 -31,-0.1 -0.809 57.1 16.9-109.5 139.9 -47.3 -87.0 -19.6 42 45 A G S S+ 0 0 6 -2,-0.4 -1,-0.2 -33,-0.3 33,-0.1 0.592 89.9 126.6 83.8 15.1 -44.3 -87.1 -17.3 43 46 A G S >S- 0 0 1 -3,-0.3 5,-1.5 -34,-0.3 3,-0.3 -0.009 82.1 -70.3 -88.1-161.4 -41.7 -86.0 -19.8 44 47 A S T > 5S+ 0 0 6 1,-0.2 3,-1.7 2,-0.2 5,-0.1 0.893 134.6 52.1 -56.6 -44.7 -39.1 -83.2 -19.8 45 48 A T T 3 5S+ 0 0 16 1,-0.3 -34,-0.5 2,-0.1 -1,-0.2 0.824 103.0 59.7 -64.3 -29.5 -41.9 -80.6 -20.1 46 49 A G T 3 5S- 0 0 0 -3,-0.3 -1,-0.3 -36,-0.2 -2,-0.2 0.289 110.5-121.5 -83.4 12.0 -43.6 -82.2 -17.2 47 50 A E T X 5 + 0 0 0 -3,-1.7 3,-1.8 1,-0.1 -3,-0.2 0.737 57.1 154.8 52.1 34.3 -40.6 -81.5 -14.9 48 51 A A G > < + 0 0 1 -5,-1.5 3,-2.3 1,-0.3 8,-0.1 0.844 65.0 59.4 -57.6 -42.2 -40.4 -85.3 -14.2 49 52 A F G 3 S+ 0 0 22 1,-0.3 909,-0.3 -6,-0.2 -1,-0.3 0.554 104.8 51.3 -72.7 0.9 -36.7 -85.1 -13.3 50 53 A V G < S+ 0 0 0 -3,-1.8 -1,-0.3 907,-0.1 -2,-0.2 0.276 107.3 67.6-116.3 9.5 -37.5 -82.7 -10.6 51 54 A Q S < S- 0 0 15 -3,-2.3 2,-0.3 -4,-0.0 907,-0.1 -0.612 80.3-114.0-117.0 178.6 -40.3 -85.1 -9.2 52 55 A S >> - 0 0 38 -2,-0.2 4,-2.5 1,-0.1 3,-0.6 -0.784 34.1-103.3-115.5 157.0 -40.2 -88.5 -7.4 53 56 A L H 3> S+ 0 0 28 -2,-0.3 4,-2.8 1,-0.3 5,-0.2 0.909 123.8 47.7 -47.4 -55.1 -41.6 -91.7 -8.8 54 57 A S H 3> S+ 0 0 78 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.860 110.4 54.6 -61.0 -28.4 -44.7 -91.6 -6.7 55 58 A E H <> S+ 0 0 51 -3,-0.6 4,-1.9 1,-0.2 -2,-0.2 0.948 111.4 43.6 -67.1 -43.3 -45.1 -87.9 -7.7 56 59 A R H X S+ 0 0 11 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.834 111.1 55.8 -69.5 -33.4 -45.0 -88.9 -11.4 57 60 A E H X S+ 0 0 34 -4,-2.8 4,-2.5 -5,-0.3 -2,-0.2 0.954 106.7 50.7 -64.9 -42.8 -47.4 -91.9 -10.6 58 61 A Q H X S+ 0 0 59 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.894 110.2 48.4 -60.0 -46.2 -49.9 -89.5 -9.1 59 62 A V H X S+ 0 0 4 -4,-1.9 4,-2.3 2,-0.2 5,-0.3 0.947 111.5 49.6 -60.5 -48.9 -49.8 -87.2 -12.2 60 63 A L H X S+ 0 0 3 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.922 112.7 49.1 -55.5 -46.5 -50.2 -90.2 -14.6 61 64 A E H X S+ 0 0 91 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.909 109.8 49.4 -63.1 -44.3 -53.2 -91.4 -12.5 62 65 A I H X S+ 0 0 9 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.897 114.8 43.8 -64.1 -41.8 -55.0 -88.1 -12.4 63 66 A V H X S+ 0 0 0 -4,-2.3 4,-4.1 2,-0.2 -2,-0.2 0.868 107.9 57.2 -74.3 -31.0 -54.7 -87.5 -16.1 64 67 A A H < S+ 0 0 12 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.973 108.6 49.5 -61.1 -45.0 -55.7 -91.0 -17.0 65 68 A E H >< S+ 0 0 106 -4,-2.2 3,-0.9 1,-0.2 -2,-0.2 0.920 116.6 41.5 -55.0 -48.6 -58.9 -90.2 -15.0 66 69 A E H 3< S+ 0 0 42 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.909 115.5 47.9 -67.1 -44.2 -59.3 -87.0 -16.9 67 70 A G T >X S+ 0 0 0 -4,-4.1 3,-1.9 -5,-0.1 4,-1.0 0.015 72.6 173.2 -90.8 28.2 -58.5 -88.4 -20.3 68 71 A K T <4 S- 0 0 159 -3,-0.9 -3,-0.1 1,-0.3 -4,-0.1 -0.035 81.8 -52.1 -37.8 78.8 -60.7 -91.5 -20.1 69 72 A G T 34 S+ 0 0 69 -2,-0.8 -1,-0.3 2,-0.2 3,-0.1 0.861 113.8 120.3 48.7 32.4 -60.1 -92.6 -23.7 70 73 A K T <4 S- 0 0 104 -3,-1.9 2,-0.3 1,-0.3 -2,-0.2 0.693 85.3 -2.7 -92.4 -29.5 -61.2 -89.0 -24.6 71 74 A I S < S- 0 0 26 -4,-1.0 -1,-0.3 -32,-0.0 -33,-0.2 -0.914 94.9 -71.3-150.0 172.9 -57.7 -88.6 -26.2 72 75 A K E -c 38 0A 57 -35,-2.5 -33,-2.5 -2,-0.3 2,-0.5 -0.551 45.9-156.3 -73.3 139.4 -54.5 -90.5 -26.8 73 76 A L E -c 39 0A 4 -35,-0.2 25,-2.1 -2,-0.2 26,-1.5 -0.963 13.1-178.7-124.4 118.3 -52.4 -90.9 -23.6 74 77 A I E -cd 40 99A 0 -35,-3.2 -33,-3.0 -2,-0.5 2,-0.7 -0.964 14.3-151.5-118.6 127.4 -48.6 -91.5 -23.6 75 78 A A E -cd 41 100A 0 24,-2.0 26,-2.3 -2,-0.5 2,-0.8 -0.855 7.4-146.6-101.1 109.2 -46.8 -91.9 -20.3 76 79 A H E + d 0 101A 1 -35,-3.5 26,-0.2 -2,-0.7 24,-0.0 -0.670 28.6 168.4 -75.0 114.6 -43.1 -90.9 -20.2 77 80 A V + 0 0 0 24,-3.2 11,-0.3 -2,-0.8 12,-0.2 0.426 24.0 131.9-108.8 -4.0 -41.9 -93.4 -17.8 78 81 A G + 0 0 0 23,-0.7 2,-0.3 10,-0.1 24,-0.1 -0.192 19.3 156.5 -66.8 141.7 -38.2 -92.9 -18.2 79 82 A C - 0 0 8 2,-0.3 848,-0.1 24,-0.2 -2,-0.1 -0.805 56.8-103.3-142.7 175.6 -35.6 -92.6 -15.5 80 83 A V S S+ 0 0 11 -2,-0.3 2,-0.2 846,-0.2 -1,-0.1 0.963 107.5 73.7 -69.3 -44.3 -31.9 -93.2 -15.5 81 84 A T S > S- 0 0 5 845,-0.3 4,-1.9 1,-0.1 -2,-0.3 -0.420 72.5-151.5 -71.3 128.6 -32.7 -96.4 -13.5 82 85 A T H > S+ 0 0 7 1064,-1.1 4,-2.5 -2,-0.2 5,-0.2 0.932 97.8 52.8 -67.2 -39.5 -34.3 -99.3 -15.5 83 86 A A H > S+ 0 0 52 1063,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.841 108.8 47.5 -65.2 -34.3 -36.0 -100.5 -12.4 84 87 A E H > S+ 0 0 48 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.880 112.4 51.6 -72.1 -36.1 -37.6 -97.2 -11.6 85 88 A S H X S+ 0 0 0 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.863 107.9 52.2 -66.3 -38.4 -38.7 -96.9 -15.3 86 89 A Q H X S+ 0 0 48 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.923 108.0 51.0 -64.4 -44.3 -40.2 -100.4 -15.1 87 90 A Q H X S+ 0 0 89 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.895 113.5 44.0 -58.0 -48.9 -42.3 -99.4 -12.0 88 91 A L H X S+ 0 0 0 -4,-1.9 4,-2.9 -11,-0.3 -2,-0.2 0.911 112.4 54.0 -64.0 -40.2 -43.6 -96.3 -13.7 89 92 A A H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.906 108.7 49.2 -61.6 -38.7 -44.2 -98.5 -16.9 90 93 A A H X S+ 0 0 37 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.860 110.8 49.1 -69.7 -34.7 -46.2 -100.9 -14.9 91 94 A S H X S+ 0 0 0 -4,-1.6 4,-3.0 2,-0.2 5,-0.2 0.947 106.8 56.6 -69.2 -43.8 -48.3 -98.1 -13.3 92 95 A A H <>S+ 0 0 0 -4,-2.9 5,-2.3 2,-0.2 4,-0.4 0.884 110.1 44.4 -53.3 -45.2 -48.9 -96.6 -16.7 93 96 A K H ><5S+ 0 0 85 -4,-1.8 3,-2.2 1,-0.2 -1,-0.2 0.978 112.5 52.6 -62.6 -52.3 -50.4 -99.9 -17.9 94 97 A R H 3<5S+ 0 0 150 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.839 109.0 49.7 -50.5 -38.6 -52.3 -100.1 -14.6 95 98 A Y T 3<5S- 0 0 43 -4,-3.0 -1,-0.3 -5,-0.1 -2,-0.2 0.478 118.4-110.0 -81.9 -5.0 -53.8 -96.6 -15.2 96 99 A G T < 5 + 0 0 53 -3,-2.2 -3,-0.2 -4,-0.4 -27,-0.2 0.804 55.0 166.0 83.4 30.8 -54.8 -97.4 -18.8 97 100 A F < - 0 0 7 -5,-2.3 -1,-0.2 1,-0.1 -23,-0.2 -0.383 37.4-133.1 -76.0 159.4 -52.4 -95.3 -20.8 98 101 A D S S+ 0 0 57 -25,-2.1 2,-0.3 1,-0.1 -24,-0.2 0.778 80.3 5.3 -83.7 -31.3 -52.1 -96.0 -24.6 99 102 A A E -d 74 0A 0 -26,-1.5 -24,-2.0 30,-0.2 2,-0.3 -0.927 63.6-134.7-147.1 168.9 -48.3 -96.0 -24.9 100 103 A V E -de 75 131A 0 30,-3.0 32,-2.5 -2,-0.3 2,-0.3 -0.896 22.8-171.5-127.4 150.7 -45.2 -95.9 -22.7 101 104 A S E -de 76 132A 0 -26,-2.3 -24,-3.2 -2,-0.3 -23,-0.7 -0.945 8.2-178.6-143.1 163.9 -42.2 -93.7 -23.4 102 105 A A E - e 0 133A 0 30,-1.1 32,-1.6 -2,-0.3 2,-0.1 -0.911 24.2-125.2-165.8 135.9 -38.6 -93.2 -22.0 103 106 A V E - e 0 134A 0 -2,-0.3 -24,-0.2 30,-0.1 32,-0.2 -0.476 49.4 -88.5 -76.8 159.5 -35.6 -91.0 -22.7 104 107 A T - 0 0 0 30,-1.1 -1,-0.1 -2,-0.1 38,-0.1 -0.519 62.6 -96.4 -64.3 126.3 -32.3 -92.7 -23.4 105 108 A P - 0 0 1 0, 0.0 5,-0.2 0, 0.0 -25,-0.1 -0.179 55.0-157.9 -48.7 138.1 -30.9 -93.0 -19.7 106 109 A F + 0 0 11 3,-0.1 2,-2.1 -3,-0.1 35,-0.1 -0.359 50.0 38.2-116.8-173.1 -28.6 -90.1 -18.9 107 110 A Y S S+ 0 0 17 33,-0.5 911,-0.1 909,-0.2 -1,-0.0 -0.515 104.7 64.5 71.3 -72.4 -25.7 -88.7 -16.8 108 111 A Y S S- 0 0 6 -2,-2.1 2,-0.2 818,-0.1 908,-0.0 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112.2 45.8 -70.6 -38.1 -35.4 -92.5 -40.7 175 178 A R H < S+ 0 0 40 -4,-1.8 -2,-0.2 2,-0.2 6,-0.2 0.925 111.7 52.5 -68.1 -43.9 -38.6 -92.0 -42.6 176 179 A R H < S+ 0 0 73 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.971 114.4 42.0 -54.9 -52.6 -37.0 -93.5 -45.6 177 180 A E H < S+ 0 0 106 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.843 127.6 33.1 -63.5 -33.7 -35.9 -96.5 -43.6 178 181 A H >< + 0 0 23 -4,-2.2 3,-1.7 -5,-0.1 -1,-0.3 -0.604 63.5 175.2-132.0 83.8 -39.3 -96.7 -41.9 179 182 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.626 85.7 38.6 -57.1 -23.2 -42.2 -95.6 -44.1 180 183 A D T 3 S+ 0 0 138 2,-0.1 2,-0.1 -5,-0.0 -5,-0.1 0.395 84.9 125.7-111.8 3.1 -44.9 -96.5 -41.5 181 184 A L < - 0 0 14 -3,-1.7 2,-0.9 -6,-0.2 19,-0.1 -0.374 67.7-121.4 -66.2 132.2 -43.1 -95.4 -38.3 182 185 A V E -g 160 0A 14 -23,-0.7 -21,-2.0 -2,-0.1 2,-0.6 -0.700 40.3-172.7 -72.8 107.9 -45.0 -92.9 -36.1 183 186 A L E -g 161 0A 0 -2,-0.9 17,-2.0 15,-0.2 18,-0.9 -0.956 6.6-164.7-110.2 114.3 -42.3 -90.2 -36.3 184 187 A Y E -gh 162 201A 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238 B E H X S+ 0 0 49 -4,-2.0 4,-1.4 -5,-0.3 -2,-0.2 0.925 112.3 46.8 -63.2 -43.5 4.5 -66.4 -12.9 529 239 B C H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.878 112.6 52.3 -63.9 -36.2 4.3 -67.7 -16.5 530 240 B N H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.820 101.4 56.6 -72.8 -31.0 0.5 -68.0 -16.0 531 241 B K H X S+ 0 0 97 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.911 110.4 47.7 -64.2 -37.5 0.0 -64.5 -14.8 532 242 B V H X S+ 0 0 7 -4,-1.4 4,-2.5 1,-0.2 3,-0.3 0.977 110.8 50.8 -63.5 -51.8 1.7 -63.5 -18.1 533 243 B I H X S+ 0 0 5 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.835 104.2 57.4 -56.6 -36.2 -0.5 -65.9 -20.0 534 244 B D H X S+ 0 0 32 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.949 111.6 43.6 -60.8 -45.4 -3.7 -64.4 -18.4 535 245 B L H >X S+ 0 0 16 -4,-1.7 4,-2.6 -3,-0.3 3,-0.7 0.937 112.6 49.9 -63.5 -51.7 -2.7 -61.0 -19.7 536 246 B L H 3X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.3 -1,-0.2 0.867 106.9 55.4 -58.3 -38.1 -1.7 -62.2 -23.3 537 247 B I H 3< S+ 0 0 89 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.841 111.0 47.3 -65.4 -28.2 -4.9 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G << + 0 0 46 -4,-2.4 2,-0.9 -5,-0.5 -3,-0.1 0.675 58.4 138.2 77.3 14.4 -23.0 -81.0 -19.1 1019 145 D V - 0 0 23 -6,-0.3 2,-1.0 -5,-0.2 -1,-0.3 -0.850 36.0-170.0-101.7 107.8 -22.6 -77.8 -17.0 1020 146 D K - 0 0 172 -2,-0.9 2,-0.2 -3,-0.1 -1,-0.0 -0.753 10.9-177.1 -96.3 84.8 -19.9 -75.7 -18.4 1021 147 D L - 0 0 21 -2,-1.0 2,-0.1 1,-0.1 -2,-0.0 -0.539 21.4-124.6 -82.8 153.2 -19.2 -73.0 -15.9 1022 148 D T > - 0 0 67 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.358 27.9-104.8 -87.5 171.4 -16.6 -70.2 -16.5 1023 149 D L H > S+ 0 0 36 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.941 124.0 52.7 -62.2 -43.9 -13.7 -69.4 -14.2 1024 150 D D H > S+ 0 0 116 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.891 109.2 47.1 -56.3 -45.9 -15.7 -66.3 -13.1 1025 151 D Q H > S+ 0 0 51 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.929 113.1 50.4 -63.0 -40.5 -18.8 -68.4 -12.3 1026 152 D I H X S+ 0 0 4 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.909 108.2 52.0 -63.6 -41.0 -16.5 -70.8 -10.5 1027 153 D N H X S+ 0 0 19 -4,-3.1 4,-0.5 1,-0.2 -1,-0.2 0.871 111.2 48.7 -63.6 -34.7 -14.9 -67.9 -8.5 1028 154 D T H >< S+ 0 0 59 -4,-1.9 3,-1.0 2,-0.2 4,-0.5 0.954 113.9 44.1 -68.8 -52.4 -18.4 -66.8 -7.5 1029 155 D L H >< S+ 0 0 1 -4,-2.8 3,-2.2 1,-0.3 -2,-0.2 0.958 111.3 53.5 -57.0 -52.7 -19.6 -70.2 -6.4 1030 156 D V H 3< S+ 0 0 11 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.655 111.0 47.8 -60.3 -15.5 -16.4 -70.9 -4.6 1031 157 D T T << S+ 0 0 91 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.411 78.2 124.4-104.8 -1.9 -16.8 -67.6 -2.6 1032 158 D L S X S- 0 0 9 -3,-2.2 3,-2.5 -4,-0.5 -3,-0.0 -0.409 78.0-103.2 -56.8 126.8 -20.4 -68.2 -1.7 1033 159 D P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.360 111.8 35.8 -56.4 127.4 -20.6 -67.9 2.1 1034 160 D G T 3 S+ 0 0 41 1,-0.3 -26,-2.4 -3,-0.1 2,-0.4 0.054 88.1 117.5 114.9 -23.3 -20.9 -71.5 3.3 1035 161 D V E < +i 1008 0I 22 -3,-2.5 -1,-0.3 -28,-0.2 -26,-0.2 -0.645 29.8 169.6 -82.8 127.7 -18.6 -73.1 0.7 1036 162 D G E + 0 0 27 -28,-3.1 23,-0.9 -2,-0.4 2,-0.3 0.582 58.8 10.7-113.5 -8.6 -15.5 -74.7 1.9 1037 163 D A E -ij10091059I 0 -29,-1.7 -27,-2.6 21,-0.1 2,-0.4 -0.972 53.6-133.9-162.3 166.7 -14.1 -76.6 -1.1 1038 164 D L E -ij10101060I 1 21,-2.4 23,-2.9 -2,-0.3 2,-0.7 -0.992 11.2-153.0-130.4 132.5 -14.2 -77.2 -4.8 1039 165 D K E -ij10111061I 9 -29,-3.0 -27,-2.3 -2,-0.4 2,-1.1 -0.943 18.5-159.8-105.2 97.3 -14.2 -80.7 -6.2 1040 166 D Q E +ij10121062I 0 21,-2.5 23,-3.2 -2,-0.7 2,-1.4 -0.723 18.2 175.5 -84.7 93.8 -12.6 -80.1 -9.6 1041 167 D T + 0 0 7 -29,-2.8 -26,-0.4 -2,-1.1 2,-0.3 -0.671 47.3 105.5 -97.2 76.3 -13.5 -83.0 -11.9 1042 168 D S - 0 0 15 -2,-1.4 22,-0.3 -29,-0.1 21,-0.3 -0.975 65.7-143.6-153.1 144.2 -11.8 -81.4 -14.9 1043 169 D G + 0 0 30 -2,-0.3 2,-1.5 20,-0.1 -582,-0.4 0.298 67.6 113.7 -93.2 9.2 -8.6 -82.0 -16.8 1044 170 D D > + 0 0 75 1,-0.2 4,-2.2 -584,-0.1 5,-0.1 -0.638 39.3 177.0 -84.3 89.9 -8.0 -78.3 -17.5 1045 171 D L H > S+ 0 0 2 -2,-1.5 4,-1.1 -586,-0.4 -1,-0.2 0.559 75.5 63.4 -74.0 -7.1 -4.9 -77.8 -15.4 1046 172 D Y H >> S+ 0 0 24 2,-0.2 4,-2.1 3,-0.1 3,-0.6 0.953 108.8 42.2 -75.4 -52.0 -4.6 -74.2 -16.5 1047 173 D Q H 3> S+ 0 0 24 1,-0.3 4,-2.9 2,-0.2 5,-0.3 0.887 107.5 61.5 -58.5 -44.6 -7.9 -73.5 -14.8 1048 174 D M H 3X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -1,-0.3 0.890 110.6 41.0 -48.6 -42.4 -6.9 -75.7 -11.8 1049 175 D E H < + 0 0 20 -4,-2.2 3,-2.2 -5,-0.2 -1,-0.2 -0.523 64.7 173.4-134.2 69.2 -8.2 -68.8 -3.9 1056 182 D P T 3 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.700 83.5 44.0 -48.3 -25.8 -5.0 -69.6 -2.1 1057 183 D D T 3 S+ 0 0 152 -3,-0.1 -5,-0.1 2,-0.1 -2,-0.0 0.587 85.8 121.7-101.0 -5.0 -6.8 -71.0 0.8 1058 184 D L < - 0 0 19 -3,-2.2 2,-0.8 -7,-0.2 -21,-0.1 -0.237 67.8-123.6 -65.0 131.8 -9.4 -73.0 -1.1 1059 185 D V E -j 1037 0I 14 -23,-0.9 -21,-2.4 17,-0.1 2,-0.6 -0.717 37.2-168.5 -73.9 111.2 -9.6 -76.7 -0.5 1060 186 D L E -j 1038 0I 0 -2,-0.8 17,-2.4 -23,-0.2 18,-0.8 -0.935 7.5-161.1-110.4 113.1 -9.1 -77.9 -4.1 1061 187 D Y E -jk10391078I 0 -23,-2.9 -21,-2.5 -2,-0.6 2,-0.6 -0.794 17.1-133.2 -98.3 129.2 -9.8 -81.6 -4.9 1062 188 D N E -jk10401079I 0 16,-2.1 18,-1.4 -2,-0.5 -21,-0.2 -0.698 20.4-167.5 -77.5 120.7 -8.4 -83.0 -8.1 1063 189 D G + 0 0 10 -23,-3.2 2,-0.7 -2,-0.6 -22,-0.2 0.698 63.6 69.9 -86.4 -28.2 -11.2 -84.9 -9.6 1064 190 D Y > - 0 0 65 -24,-0.4 3,-1.6 -22,-0.3 7,-0.2 -0.872 61.0-161.8 -97.5 111.1 -9.6 -87.0 -12.3 1065 191 D D G > S+ 0 0 7 -2,-0.7 3,-2.2 1,-0.3 4,-0.3 0.874 85.7 68.7 -52.9 -43.0 -7.5 -89.8 -10.9 1066 192 D E G 3 S+ 0 0 33 1,-0.3 -1,-0.3 2,-0.1 -601,-0.1 0.618 110.8 31.9 -50.1 -26.0 -5.5 -90.2 -14.2 1067 193 D I G <> S+ 0 0 5 -3,-1.6 4,-3.0 1,-0.1 -1,-0.3 0.049 80.3 127.6-124.5 24.0 -3.9 -86.8 -13.7 1068 194 D F H <> S+ 0 0 0 -3,-2.2 4,-2.7 1,-0.2 5,-0.2 0.895 76.0 45.4 -46.3 -56.8 -3.6 -86.7 -9.9 1069 195 D A H > S+ 0 0 2 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.914 116.7 46.8 -57.3 -43.8 0.1 -85.9 -9.7 1070 196 D S H > S+ 0 0 3 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.877 110.8 53.1 -65.1 -40.2 -0.3 -83.2 -12.5 1071 197 D G H X>S+ 0 0 0 -4,-3.0 5,-2.3 2,-0.2 4,-1.5 0.914 109.5 47.6 -63.4 -45.1 -3.4 -81.8 -10.7 1072 198 D L H ><5S+ 0 0 19 -4,-2.7 3,-0.9 1,-0.2 -2,-0.2 0.975 110.0 52.2 -62.3 -50.4 -1.5 -81.4 -7.4 1073 199 D L H 3<5S+ 0 0 9 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.858 110.4 50.9 -53.4 -33.1 1.4 -79.8 -9.1 1074 200 D A H 3<5S- 0 0 15 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.759 137.2 -72.0 -75.4 -29.0 -1.0 -77.3 -10.7 1075 201 D G T <<5S+ 0 0 7 -4,-1.5 -3,-0.2 -3,-0.9 -15,-0.2 0.352 86.8 128.1 155.8 -17.1 -2.8 -76.3 -7.5 1076 202 D A < - 0 0 8 -5,-2.3 -1,-0.3 1,-0.1 -15,-0.2 -0.336 38.2-162.0 -63.4 145.8 -5.0 -79.1 -6.1 1077 203 D D - 0 0 29 -17,-2.4 2,-0.3 -196,-0.1 -196,-0.3 0.253 67.9 -17.0-116.8 14.3 -4.2 -79.9 -2.5 1078 204 D G E S- k 01061I 2 -18,-0.8 -16,-2.1 -198,-0.1 2,-0.3 -0.934 70.0-123.7 176.1-162.9 -5.8 -83.3 -2.3 1079 205 D G E -dk 8821062I 0 -198,-2.4 -196,-3.2 -18,-0.3 2,-0.4 -0.994 7.7-150.3-165.4 162.0 -8.3 -85.4 -4.2 1080 206 D I E +d 883 0I 1 -18,-1.4 2,-0.3 -2,-0.3 -196,-0.2 -0.988 37.3 142.0-133.8 134.4 -11.5 -87.4 -4.3 1081 207 D G E -d 884 0I 5 -198,-1.0 -196,-2.0 -2,-0.4 3,-0.5 -0.957 54.3-117.1-170.4 159.6 -11.9 -90.3 -6.7 1082 208 D S S > S+ 0 0 19 -2,-0.3 3,-1.8 1,-0.2 4,-0.2 0.832 105.9 61.1 -72.9 -36.9 -13.3 -93.8 -7.2 1083 209 D T T >> S+ 0 0 2 1,-0.3 4,-1.7 2,-0.2 3,-1.6 0.726 85.8 78.7 -66.6 -17.5 -10.0 -95.7 -7.8 1084 210 D Y H 3> S+ 0 0 0 -3,-0.5 4,-1.4 1,-0.3 -1,-0.3 0.727 79.2 72.7 -60.1 -22.7 -9.0 -94.7 -4.3 1085 211 D N H <4 S+ 0 0 0 -3,-1.8 -1,-0.3 -200,-0.2 -2,-0.2 0.803 111.2 24.7 -60.5 -35.4 -11.3 -97.5 -3.1 1086 212 D I H <4 S+ 0 0 0 -3,-1.6 -2,-0.2 -4,-0.2 -1,-0.2 0.634 141.9 16.6-106.3 -21.6 -8.8 -100.2 -4.3 1087 213 D M H >X S+ 0 0 0 -4,-1.7 3,-2.4 1,-0.1 4,-0.8 0.035 70.7 141.6-142.5 36.2 -5.4 -98.4 -4.3 1088 214 D G H >X + 0 0 0 -4,-1.4 4,-1.8 1,-0.3 3,-0.6 0.791 67.7 68.1 -50.2 -33.2 -5.8 -95.3 -2.1 1089 215 D W H 3> S+ 0 0 91 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.804 92.7 59.5 -57.9 -32.4 -2.4 -95.7 -0.7 1090 216 D R H <> S+ 0 0 21 -3,-2.4 4,-3.1 2,-0.2 -1,-0.2 0.882 104.6 49.0 -64.9 -39.8 -0.8 -94.9 -4.1 1091 217 D Y H S+ 0 0 6 -4,-2.6 5,-3.1 1,-0.3 -2,-0.2 0.909 108.8 48.7 -47.8 -50.0 6.7 -87.9 -2.9 1098 224 D L H ><5S+ 0 0 15 -4,-2.1 3,-1.1 -5,-0.2 -1,-0.3 0.897 113.3 49.0 -62.0 -33.4 5.7 -84.6 -4.3 1099 225 D K H 3<5S+ 0 0 157 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.913 110.7 49.6 -70.2 -42.0 6.1 -83.2 -0.8 1100 226 D E T 3<5S- 0 0 143 -4,-3.2 -1,-0.3 -5,-0.1 -2,-0.2 0.011 118.1-112.2 -85.8 26.4 9.5 -84.8 -0.4 1101 227 D G T < 5S+ 0 0 20 -3,-1.1 2,-0.8 -5,-0.2 -3,-0.2 0.722 73.9 137.7 50.4 27.6 10.6 -83.4 -3.8 1102 228 D D >>< + 0 0 60 -5,-3.1 4,-1.9 -6,-0.2 3,-0.6 -0.669 19.7 166.6-106.0 81.8 10.7 -86.9 -5.4 1103 229 D I H 3> S+ 0 0 35 -2,-0.8 4,-3.5 -589,-0.2 5,-0.3 0.774 71.4 69.3 -64.7 -20.8 9.1 -86.6 -8.8 1104 230 D Q H 3> S+ 0 0 136 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.914 107.0 33.8 -64.1 -48.8 10.4 -90.1 -9.7 1105 231 D T H <> S+ 0 0 47 -3,-0.6 4,-3.5 2,-0.2 5,-0.3 0.870 116.5 58.4 -76.8 -31.4 8.2 -92.0 -7.3 1106 232 D A H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.981 113.1 38.1 -57.7 -56.8 5.4 -89.5 -7.9 1107 233 D Q H X S+ 0 0 58 -4,-3.5 4,-2.4 1,-0.2 5,-0.2 0.886 116.5 52.5 -60.8 -42.2 5.5 -90.3 -11.7 1108 234 D K H X S+ 0 0 105 -4,-2.1 4,-1.7 -5,-0.3 -1,-0.2 0.942 110.6 47.1 -59.1 -49.1 6.1 -94.0 -11.1 1109 235 D L H X S+ 0 0 30 -4,-3.5 4,-1.8 1,-0.2 -2,-0.2 0.933 111.2 53.3 -59.0 -43.5 3.0 -94.1 -8.7 1110 236 D Q H X S+ 0 0 13 -4,-2.6 4,-2.9 -5,-0.3 -1,-0.2 0.893 106.8 48.8 -62.2 -42.6 1.0 -92.2 -11.3 1111 237 D T H X S+ 0 0 35 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.835 110.1 53.6 -68.4 -28.7 1.7 -94.6 -14.2 1112 238 D E H X S+ 0 0 50 -4,-1.7 4,-1.0 2,-0.2 -1,-0.2 0.847 111.5 44.3 -71.3 -35.1 0.8 -97.5 -12.0 1113 239 D C H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 3,-0.2 0.912 113.0 55.0 -70.5 -41.4 -2.5 -95.9 -11.2 1114 240 D N H X S+ 0 0 1 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.786 101.8 53.7 -64.3 -29.5 -2.8 -95.1 -14.8 1115 241 D K H X S+ 0 0 92 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.867 112.0 47.2 -73.1 -33.3 -2.4 -98.7 -16.0 1116 242 D V H X S+ 0 0 6 -4,-1.0 4,-2.6 -3,-0.2 5,-0.2 0.919 110.3 51.1 -71.0 -43.1 -5.2 -99.6 -13.7 1117 243 D I H X S+ 0 0 5 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.887 104.8 58.7 -62.7 -36.9 -7.4 -96.8 -14.9 1118 244 D D H X S+ 0 0 33 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.939 111.2 41.1 -54.4 -54.1 -6.7 -97.9 -18.5 1119 245 D L H X S+ 0 0 14 -4,-1.5 4,-3.1 2,-0.2 5,-0.2 0.920 113.4 51.6 -60.7 -51.0 -8.2 -101.4 -17.7 1120 246 D L H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.3 8,-0.2 0.824 107.0 54.7 -57.9 -36.0 -11.1 -100.0 -15.6 1121 247 D I H < S+ 0 0 90 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.912 110.7 45.8 -67.2 -34.1 -12.0 -97.8 -18.4 1122 248 D K H < S+ 0 0 117 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.957 124.0 34.1 -69.0 -45.6 -12.1 -100.9 -20.7 1123 249 D T H < S- 0 0 3 -4,-3.1 -2,-0.2 1,-0.1 29,-0.2 0.779 124.8 -88.0 -78.1 -32.0 -14.2 -102.8 -18.1 1124 250 D G X - 0 0 20 -4,-3.3 4,-3.3 -5,-0.2 5,-0.3 0.213 32.3-125.0 116.2 113.5 -16.3 -100.1 -16.6 1125 251 D V H > S+ 0 0 39 2,-0.2 4,-2.6 3,-0.2 5,-0.3 0.943 105.0 41.8 -56.1 -53.5 -14.9 -98.2 -13.6 1126 252 D F H > S+ 0 0 30 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.950 123.7 38.3 -58.9 -53.9 -17.6 -98.7 -11.0 1127 253 D R H > S+ 0 0 35 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.882 117.3 50.6 -65.9 -40.0 -18.2 -102.4 -11.9 1128 254 D G H X S+ 0 0 0 -4,-3.3 4,-2.2 -8,-0.2 -1,-0.2 0.860 112.4 47.1 -66.9 -37.8 -14.5 -103.1 -12.5 1129 255 D L H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.856 113.5 48.3 -71.4 -38.7 -13.7 -101.5 -9.1 1130 256 D K H X S+ 0 0 0 -4,-2.1 4,-2.0 -5,-0.3 9,-0.2 0.897 110.3 52.6 -67.9 -39.3 -16.4 -103.5 -7.4 1131 257 D T H X S+ 0 0 6 -4,-2.6 4,-1.8 11,-0.3 -2,-0.2 0.944 110.8 45.8 -61.6 -47.4 -15.2 -106.7 -9.2 1132 258 D V H X S+ 0 0 0 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.913 112.0 53.3 -58.7 -44.8 -11.6 -106.2 -7.9 1133 259 D L H <>S+ 0 0 0 -4,-2.1 5,-2.5 1,-0.2 6,-0.9 0.840 104.4 54.8 -59.6 -36.3 -13.2 -105.5 -4.4 1134 260 D H H ><5S+ 0 0 75 -4,-2.0 3,-1.4 4,-0.2 -1,-0.2 0.903 106.3 52.6 -64.5 -37.0 -15.0 -108.7 -4.7 1135 261 D Y H 3<5S+ 0 0 46 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.664 104.8 53.8 -71.7 -18.3 -11.7 -110.4 -5.3 1136 262 D M T 3<5S- 0 0 18 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.272 120.6-113.5 -96.8 10.4 -10.3 -108.7 -2.1 1137 263 D D T < 5S+ 0 0 127 -3,-1.4 -3,-0.2 2,-0.2 -2,-0.1 0.551 90.2 112.0 69.4 11.4 -13.2 -110.3 -0.3 1138 264 D V S - 0 0 21 -2,-0.3 3,-2.0 1,-0.1 -1,-0.0 -0.495 63.4 -62.2 -79.4 149.5 -27.7 -101.2 -11.0 1146 272 D K T 3 S+ 0 0 68 1,-0.3 -1064,-1.1 -2,-0.2 -1063,-0.4 -0.402 119.2 45.3 -66.4 149.0 -29.4 -101.3 -14.4 1147 273 D P T 3 S+ 0 0 5 0, 0.0 -1,-0.3 0, 0.0 -1036,-0.2 -0.977 103.6 86.1 -63.3 -5.6 -28.9 -99.9 -17.1 1148 274 D F S < S- 0 0 20 -3,-2.0 -4,-0.1 -1038,-0.1 -1038,-0.1 -0.408 71.0-151.6 -62.8 144.4 -25.3 -100.8 -16.2 1149 275 D G - 0 0 14 1,-0.2 -5,-0.1 -3,-0.1 -22,-0.1 -0.547 23.6 -88.0-106.8 176.2 -24.5 -104.3 -17.3 1150 276 D P - 0 0 88 0, 0.0 -1,-0.2 0, 0.0 -7,-0.1 -0.319 52.3 -81.8 -83.1 169.8 -22.0 -106.7 -15.8 1151 277 D V - 0 0 19 -9,-0.1 2,-0.4 -24,-0.1 -27,-0.1 -0.350 51.3-100.4 -66.3 148.0 -18.3 -106.9 -16.6 1152 278 D D > - 0 0 78 -29,-0.2 3,-2.6 1,-0.1 4,-0.4 -0.621 26.1-131.7 -72.4 126.7 -17.4 -108.8 -19.7 1153 279 D E G > S+ 0 0 165 -2,-0.4 3,-1.5 1,-0.3 -1,-0.1 0.799 105.1 68.3 -49.2 -32.1 -16.1 -112.3 -18.7 1154 280 D K G 3 S+ 0 0 130 1,-0.3 -1,-0.3 2,-0.1 4,-0.3 0.746 97.3 53.6 -62.1 -25.0 -13.1 -111.8 -20.9 1155 281 D Y G <> S+ 0 0 42 -3,-2.6 4,-1.8 1,-0.2 3,-0.3 0.567 83.3 89.1 -85.8 -11.7 -11.9 -109.1 -18.5 1156 282 D L H <> S+ 0 0 46 -3,-1.5 4,-2.5 -4,-0.4 5,-0.2 0.800 80.1 57.0 -58.8 -40.0 -12.0 -111.2 -15.4 1157 283 D P H > S+ 0 0 88 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.918 110.3 45.1 -60.3 -40.2 -8.4 -112.6 -15.7 1158 284 D E H > S+ 0 0 86 -3,-0.3 4,-2.9 -4,-0.3 -2,-0.2 0.889 115.6 46.7 -69.5 -37.8 -6.9 -109.1 -15.7 1159 285 D L H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.902 114.4 47.1 -70.5 -40.5 -9.2 -107.9 -12.8 1160 286 D K H X S+ 0 0 116 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.967 113.7 48.0 -63.2 -53.0 -8.5 -111.1 -10.8 1161 287 D A H X S+ 0 0 60 -4,-2.8 4,-2.3 -5,-0.2 5,-0.2 0.957 111.8 50.3 -53.6 -50.7 -4.8 -110.7 -11.4 1162 288 D L H X S+ 0 0 12 -4,-2.9 4,-3.0 1,-0.2 5,-0.3 0.891 108.1 52.7 -54.9 -44.3 -5.0 -107.0 -10.5 1163 289 D A H X S+ 0 0 1 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.921 109.4 51.5 -58.7 -40.8 -6.8 -107.8 -7.2 1164 290 D Q H < S+ 0 0 122 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.927 111.6 43.4 -64.2 -47.8 -4.0 -110.2 -6.4 1165 291 D Q H < S+ 0 0 88 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.934 111.9 52.6 -67.1 -44.1 -1.2 -107.8 -7.0 1166 292 D L H < S+ 0 0 9 -4,-3.0 2,-2.2 -5,-0.2 -1,-0.2 0.846 93.9 76.4 -59.5 -31.7 -2.9 -105.0 -5.1 1167 293 D M < 0 0 68 -4,-1.8 -1,-0.2 -5,-0.3 -4,-0.0 -0.634 360.0 360.0 -77.5 78.2 -3.3 -107.6 -2.3 1168 294 D Q 0 0 185 -2,-2.2 0, 0.0 0, 0.0 0, 0.0 -0.412 360.0 360.0 151.9 360.0 0.5 -107.0 -1.4