==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHEMOTAXIS 05-NOV-96 1UDR . COMPND 2 MOLECULE: CHEY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.PARRAGA,M.COLL . 502 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23351.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 376 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 80 15.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 37 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 185 36.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 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 0 0 0 0 2 7 3 0 0 3 1 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 16 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 K 0 0 145 0, 0.0 27,-0.7 0, 0.0 28,-0.6 0.000 360.0 360.0 360.0 -23.4 21.3 62.8 36.0 2 5 A E + 0 0 120 25,-0.1 25,-0.1 26,-0.1 24,-0.0 0.533 360.0 124.5 -91.0 -8.5 19.3 61.3 33.2 3 6 A L - 0 0 44 1,-0.1 2,-0.6 46,-0.1 26,-0.4 -0.218 67.4-118.0 -53.1 135.7 22.5 60.8 31.1 4 7 A K - 0 0 23 43,-0.4 45,-2.8 24,-0.1 46,-1.5 -0.711 32.6-164.2 -85.7 117.7 23.1 57.2 30.0 5 8 A F E -ab 30 50A 0 24,-2.8 26,-2.6 -2,-0.6 2,-0.5 -0.746 11.6-157.1-100.1 149.0 26.3 55.7 31.4 6 9 A L E -ab 31 51A 0 44,-1.8 46,-2.7 -2,-0.3 2,-0.6 -0.997 9.7-159.7-124.7 121.3 28.1 52.6 30.3 7 10 A V E -ab 32 52A 3 24,-2.6 26,-2.2 -2,-0.5 2,-0.5 -0.944 9.2-164.7-105.7 122.8 30.3 51.0 32.9 8 11 A V E +ab 33 53A 3 44,-2.9 46,-1.8 -2,-0.6 2,-0.3 -0.937 29.3 122.0-116.1 125.3 33.0 48.7 31.5 9 12 A D - 0 0 6 24,-1.9 48,-0.1 -2,-0.5 24,-0.1 -0.907 53.5-133.1-171.0 146.4 35.0 46.1 33.5 10 13 A D S S+ 0 0 55 46,-0.4 2,-0.7 -2,-0.3 24,-0.1 0.568 90.7 79.6 -85.0 -8.1 35.5 42.4 33.2 11 14 A F > - 0 0 140 1,-0.2 4,-1.7 -3,-0.0 3,-0.3 -0.898 69.2-156.2-102.9 108.1 34.9 41.9 37.0 12 15 A S H > S+ 0 0 57 -2,-0.7 4,-2.2 1,-0.2 5,-0.2 0.822 90.0 58.0 -50.1 -41.0 31.2 42.0 37.7 13 16 A T H > S+ 0 0 99 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.950 106.0 47.4 -60.1 -47.1 31.8 43.0 41.3 14 17 A M H > S+ 0 0 28 -3,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.871 111.4 52.5 -64.0 -33.9 33.7 46.2 40.4 15 18 A R H X S+ 0 0 31 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.895 109.2 49.0 -66.4 -40.7 31.0 47.1 37.8 16 19 A R H X S+ 0 0 154 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.844 110.0 52.7 -68.1 -31.8 28.3 46.7 40.5 17 20 A I H X S+ 0 0 80 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.958 111.6 44.4 -67.5 -49.8 30.3 48.9 42.8 18 21 A V H X S+ 0 0 3 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.927 112.0 53.3 -61.7 -42.9 30.6 51.7 40.2 19 22 A R H X S+ 0 0 92 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.893 112.0 45.5 -58.8 -41.0 26.9 51.4 39.3 20 23 A N H X S+ 0 0 97 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.874 109.2 52.7 -73.1 -36.1 25.9 51.8 42.9 21 24 A L H X S+ 0 0 36 -4,-2.4 4,-1.0 2,-0.2 -1,-0.2 0.851 110.0 51.3 -66.4 -31.8 28.2 54.7 43.6 22 25 A L H >X>S+ 0 0 0 -4,-2.0 5,-2.4 -5,-0.2 3,-0.6 0.931 108.9 49.8 -67.3 -44.7 26.6 56.4 40.6 23 26 A K H ><5S+ 0 0 116 -4,-1.9 3,-1.6 1,-0.3 -2,-0.2 0.919 105.3 57.6 -58.4 -43.2 23.2 55.7 42.0 24 27 A E H 3<5S+ 0 0 149 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.800 107.5 48.8 -58.1 -30.8 24.3 57.2 45.3 25 28 A L H <<5S- 0 0 23 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.538 127.6 -97.2 -88.2 -8.0 25.1 60.4 43.3 26 29 A G T <<5S+ 0 0 29 -3,-1.6 2,-0.9 -4,-0.6 -3,-0.2 0.438 84.5 126.2 107.2 0.6 21.8 60.5 41.6 27 30 A F < + 0 0 15 -5,-2.4 -1,-0.2 1,-0.1 -2,-0.2 -0.811 20.3 159.9 -97.2 103.3 22.7 58.8 38.2 28 31 A N + 0 0 103 -2,-0.9 2,-1.2 -27,-0.7 -1,-0.1 0.528 48.2 88.4-100.5 -8.8 20.3 55.9 37.7 29 32 A N + 0 0 25 -28,-0.6 -24,-2.8 -26,-0.4 2,-0.4 -0.731 60.1 145.4 -93.0 88.3 20.6 55.3 33.9 30 33 A V E -a 5 0A 8 -2,-1.2 2,-0.3 -26,-0.2 -24,-0.2 -0.991 26.8-175.0-133.2 136.7 23.5 52.9 33.8 31 34 A E E -a 6 0A 73 -26,-2.6 -24,-2.6 -2,-0.4 2,-0.3 -0.792 16.7-136.5-121.6 164.5 24.4 49.9 31.6 32 35 A E E -a 7 0A 35 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.933 14.9-174.9-128.0 151.3 27.3 47.4 31.9 33 36 A A E -a 8 0A 1 -26,-2.2 -24,-1.9 -2,-0.3 3,-0.1 -0.986 22.1-140.5-142.1 146.8 29.8 45.8 29.5 34 37 A E S S- 0 0 112 -2,-0.3 2,-0.3 -26,-0.2 -26,-0.1 0.678 75.3 -16.8 -81.2 -28.9 32.4 43.1 30.0 35 38 A D S > S- 0 0 14 22,-0.1 4,-2.3 -26,-0.1 5,-0.2 -0.949 83.3 -73.0-161.5-177.5 35.3 44.3 27.9 36 39 A G H > S+ 0 0 0 24,-2.1 4,-2.1 22,-0.5 5,-0.2 0.831 126.4 50.7 -57.2 -34.7 36.2 46.7 25.0 37 40 A V H > S+ 0 0 7 21,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.965 111.5 44.5 -68.1 -54.7 34.5 44.5 22.4 38 41 A D H > S+ 0 0 36 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.888 114.4 52.7 -56.9 -38.9 31.2 44.1 24.3 39 42 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.921 107.4 48.7 -66.6 -46.5 31.2 47.8 25.0 40 43 A L H X S+ 0 0 3 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.884 108.8 55.2 -61.7 -35.8 31.8 48.9 21.4 41 44 A N H < S+ 0 0 80 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.893 112.4 43.0 -63.4 -38.4 28.9 46.6 20.4 42 45 A K H >< S+ 0 0 69 -4,-1.7 3,-1.0 1,-0.2 4,-0.5 0.902 111.3 53.0 -74.6 -41.5 26.7 48.4 22.9 43 46 A L H >< S+ 0 0 9 -4,-2.9 3,-1.1 1,-0.3 5,-0.2 0.806 101.4 60.8 -64.1 -31.8 27.8 51.9 22.0 44 47 A Q T 3< S+ 0 0 105 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.750 94.2 63.7 -68.5 -20.7 27.1 51.3 18.3 45 48 A A T < S- 0 0 63 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.751 107.4-143.7 -72.3 -22.1 23.5 50.7 19.3 46 49 A G < + 0 0 23 -3,-1.1 -1,-0.1 -4,-0.5 -2,-0.1 -0.042 65.8 99.7 85.6 169.8 23.5 54.4 20.4 47 50 A G + 0 0 18 1,-0.3 -43,-0.4 408,-0.2 2,-0.2 0.179 53.8 128.4 99.4 -13.8 22.0 56.5 23.2 48 51 A Y + 0 0 19 -5,-0.2 -1,-0.3 1,-0.1 -43,-0.2 -0.489 30.0 177.3 -81.2 141.4 25.0 56.6 25.5 49 52 A G + 0 0 3 -45,-2.8 2,-0.3 1,-0.3 -44,-0.2 0.488 67.1 25.7-118.6 -5.6 26.4 59.9 27.0 50 53 A F E -b 5 0A 0 -46,-1.5 -44,-1.8 28,-0.1 2,-0.4 -0.973 57.7-158.6-161.3 138.6 29.2 58.8 29.2 51 54 A V E -bc 6 80A 0 28,-2.1 30,-2.6 -2,-0.3 2,-0.5 -0.978 1.6-169.1-124.0 133.9 31.6 55.8 29.5 52 55 A I E +bc 7 81A 2 -46,-2.7 -44,-2.9 -2,-0.4 2,-0.4 -0.993 22.9 179.1-118.2 121.6 33.5 54.7 32.6 53 56 A S E -bc 8 82A 1 28,-2.6 30,-3.3 -2,-0.5 -44,-0.2 -0.978 27.1-126.2-134.8 140.7 36.1 52.1 31.7 54 57 A D E - c 0 83A 8 -46,-1.8 8,-0.3 -2,-0.4 30,-0.2 -0.488 21.9-128.9 -78.8 150.2 38.8 50.1 33.4 55 58 A W S S+ 0 0 55 28,-2.2 7,-1.5 1,-0.2 8,-0.6 0.894 91.7 48.7 -64.1 -42.6 42.3 50.2 32.2 56 59 A N + 0 0 112 5,-0.2 -46,-0.4 27,-0.2 -1,-0.2 -0.887 66.8 134.6-113.9 117.0 42.8 46.4 32.0 57 60 A M - 0 0 11 -2,-0.6 -22,-0.1 -48,-0.1 2,-0.1 -0.971 50.7 -91.7-150.5 160.9 40.4 44.0 30.3 58 61 A P S S+ 0 0 56 0, 0.0 2,-2.6 0, 0.0 -22,-0.5 -0.339 97.8 7.1 -75.8 158.5 40.5 41.1 27.9 59 62 A N S S+ 0 0 31 -24,-0.1 2,-0.3 -23,-0.1 88,-0.1 -0.297 140.6 15.0 70.3 -55.0 40.2 41.3 24.1 60 63 A M S S- 0 0 7 -2,-2.6 -24,-2.1 173,-0.0 -23,-0.2 -0.927 81.4-152.6-150.1 117.7 40.3 45.1 24.0 61 64 A D > - 0 0 42 -2,-0.3 4,-2.2 -26,-0.1 -5,-0.2 -0.184 35.7 -86.5 -83.6-173.8 41.5 47.0 27.1 62 65 A G H > S+ 0 0 0 -7,-1.5 4,-2.6 -8,-0.3 -7,-0.2 0.875 124.5 46.8 -62.0 -45.2 40.6 50.5 28.2 63 66 A L H > S+ 0 0 25 -8,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.898 115.0 47.7 -66.1 -39.1 43.2 52.5 26.2 64 67 A E H > S+ 0 0 15 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.879 112.5 49.5 -68.6 -38.2 42.4 50.5 23.1 65 68 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.931 111.4 49.7 -64.6 -46.1 38.7 51.1 23.6 66 69 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.919 110.0 49.3 -59.3 -48.7 39.3 54.8 24.1 67 70 A K H X S+ 0 0 80 -4,-2.4 4,-0.9 1,-0.2 -1,-0.2 0.885 111.6 50.0 -60.7 -36.9 41.4 55.2 21.0 68 71 A T H < S+ 0 0 29 -4,-1.9 4,-0.4 2,-0.2 3,-0.3 0.892 110.5 48.7 -69.6 -39.9 38.7 53.3 19.0 69 72 A I H >< S+ 0 0 0 -4,-2.2 3,-1.5 1,-0.2 6,-0.3 0.932 108.7 54.3 -64.3 -46.2 35.8 55.6 20.3 70 73 A R H 3< S+ 0 0 61 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.715 109.0 48.8 -60.8 -24.7 37.9 58.7 19.6 71 74 A A T 3< S+ 0 0 66 -4,-0.9 2,-0.7 -3,-0.3 -1,-0.3 0.465 91.0 94.0 -94.9 -4.8 38.3 57.6 15.9 72 75 A D X> - 0 0 43 -3,-1.5 3,-1.8 -4,-0.4 4,-0.9 -0.816 65.5-151.3 -94.6 117.5 34.6 56.8 15.4 73 76 A G T 34 S+ 0 0 49 -2,-0.7 -1,-0.1 1,-0.3 4,-0.1 0.656 94.1 59.8 -59.3 -20.8 32.6 59.7 13.9 74 77 A A T 34 S+ 0 0 19 402,-0.2 -1,-0.3 1,-0.1 403,-0.1 0.677 127.9 10.4 -81.2 -17.3 29.4 58.6 15.6 75 78 A M T X4 S+ 0 0 14 -3,-1.8 3,-1.5 -6,-0.3 -2,-0.2 0.103 82.1 130.4-149.6 27.6 30.9 58.9 19.1 76 79 A S T 3< S+ 0 0 29 -4,-0.9 374,-0.2 1,-0.3 -3,-0.1 0.775 80.1 41.3 -60.3 -29.1 34.2 60.7 18.8 77 80 A A T 3 S+ 0 0 22 372,-1.0 -1,-0.3 374,-0.1 378,-0.1 0.375 80.4 136.9-102.9 8.9 33.6 63.2 21.5 78 81 A L < - 0 0 5 -3,-1.5 -28,-0.1 -9,-0.2 23,-0.1 -0.221 62.5-109.1 -56.4 130.9 31.9 60.9 24.0 79 82 A P - 0 0 0 0, 0.0 -28,-2.1 0, 0.0 2,-0.4 -0.418 37.0-170.3 -64.8 135.1 33.2 61.5 27.6 80 83 A V E -c 51 0A 1 19,-0.2 21,-2.3 -30,-0.2 22,-1.1 -0.963 10.2-167.1-133.3 116.0 35.4 58.6 28.8 81 84 A L E -cd 52 102A 0 -30,-2.6 -28,-2.6 -2,-0.4 2,-0.5 -0.914 18.1-147.1-100.8 119.5 36.6 58.4 32.5 82 85 A M E -cd 53 103A 0 20,-2.7 22,-2.4 -2,-0.6 2,-0.5 -0.795 2.4-149.8 -93.8 129.7 39.3 55.8 32.8 83 86 A V E +cd 54 104A 5 -30,-3.3 -28,-2.2 -2,-0.5 2,-0.3 -0.841 23.4 173.4 -96.9 129.0 39.6 53.7 36.0 84 87 A T E - d 0 105A 6 20,-2.6 22,-2.2 -2,-0.5 3,-0.1 -0.962 36.9-138.3-135.2 152.7 43.1 52.7 36.9 85 88 A A S S+ 0 0 69 -2,-0.3 2,-0.3 20,-0.2 20,-0.1 0.646 92.0 22.1 -85.4 -13.0 44.7 51.0 39.9 86 89 A E S S- 0 0 129 18,-0.1 2,-1.7 2,-0.1 -1,-0.2 -0.974 72.8-127.9-154.7 136.7 47.8 53.2 40.0 87 90 A A - 0 0 47 -2,-0.3 2,-0.3 -3,-0.1 18,-0.0 -0.533 38.2-178.8 -86.3 72.7 48.5 56.8 38.7 88 91 A D > - 0 0 49 -2,-1.7 4,-3.2 1,-0.1 5,-0.3 -0.571 33.1-128.5 -75.8 135.0 51.7 56.0 36.7 89 92 A A H > S+ 0 0 64 -2,-0.3 4,-1.8 1,-0.2 -1,-0.1 0.837 111.3 45.9 -48.7 -43.2 53.3 59.0 35.0 90 93 A E H > S+ 0 0 147 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.920 113.3 50.4 -67.7 -44.5 53.5 57.2 31.7 91 94 A N H > S+ 0 0 32 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.956 109.2 49.8 -56.3 -55.1 49.9 56.0 32.1 92 95 A I H X S+ 0 0 57 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.883 114.8 45.4 -53.6 -40.6 48.6 59.5 32.9 93 96 A K H X S+ 0 0 152 -4,-1.8 4,-3.2 -5,-0.3 -1,-0.2 0.896 112.2 50.1 -70.4 -42.0 50.5 60.8 29.7 94 97 A A H X S+ 0 0 36 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.963 111.5 49.6 -59.7 -49.6 49.2 57.9 27.6 95 98 A L H <>S+ 0 0 7 -4,-3.4 5,-2.3 1,-0.2 4,-0.5 0.853 112.1 48.1 -56.3 -40.7 45.7 58.6 28.8 96 99 A A H ><5S+ 0 0 67 -4,-1.8 3,-1.2 -5,-0.3 -1,-0.2 0.941 111.9 48.7 -67.0 -46.4 46.2 62.3 28.0 97 100 A Q H 3<5S+ 0 0 177 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.871 109.3 53.9 -62.1 -36.9 47.6 61.5 24.5 98 101 A A T 3<5S- 0 0 14 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.530 118.2-107.0 -77.1 -7.9 44.7 59.2 23.8 99 102 A G T < 5 + 0 0 29 -3,-1.2 -19,-0.2 -4,-0.5 -3,-0.2 0.724 53.2 170.6 90.4 23.2 42.0 61.7 24.6 100 103 A A < - 0 0 21 -5,-2.3 -1,-0.2 -6,-0.1 -19,-0.2 -0.372 34.0-140.4 -65.4 143.4 40.6 60.5 27.9 101 104 A S S S- 0 0 16 -21,-2.3 2,-0.3 1,-0.3 -20,-0.2 0.761 72.3 -47.3 -77.3 -23.6 38.2 62.9 29.6 102 105 A G E -d 81 0A 21 -22,-1.1 -20,-2.7 -7,-0.1 2,-0.3 -0.957 54.8-122.0 173.1 178.3 39.8 62.1 33.0 103 106 A Y E -d 82 0A 68 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.976 9.9-161.7-144.1 157.7 40.9 59.2 35.2 104 107 A V E -d 83 0A 1 -22,-2.4 -20,-2.6 -2,-0.3 2,-0.4 -0.999 19.4-130.8-142.2 135.0 40.2 57.9 38.7 105 108 A V E -d 84 0A 55 -2,-0.4 -20,-0.2 -22,-0.2 -22,-0.1 -0.753 42.1 -97.3 -87.5 132.1 42.3 55.5 40.9 106 109 A K S S+ 0 0 56 -22,-2.2 2,-0.1 -2,-0.4 3,-0.0 -0.707 99.7 47.9 -96.4 150.2 40.5 52.5 42.4 107 110 A P S S+ 0 0 130 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.529 83.0 164.4 -76.7 144.7 39.2 51.9 45.0 108 111 A F - 0 0 21 -2,-0.1 2,-0.2 -4,-0.1 -2,-0.1 -0.863 30.4-123.7-127.2 163.6 37.5 55.2 45.0 109 112 A T > - 0 0 80 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.525 31.2-106.3-100.6 168.4 34.6 56.7 47.0 110 113 A A H > S+ 0 0 21 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.826 122.3 55.6 -62.6 -28.6 31.3 58.3 45.8 111 114 A A H > S+ 0 0 65 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.912 106.7 45.8 -71.2 -44.9 32.9 61.6 46.8 112 115 A T H > S+ 0 0 54 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.917 113.9 51.1 -63.9 -40.4 36.0 61.2 44.6 113 116 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.923 107.6 53.2 -62.4 -44.0 33.8 60.1 41.7 114 117 A E H X S+ 0 0 94 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.926 108.7 47.9 -59.3 -47.6 31.6 63.1 42.2 115 118 A E H X S+ 0 0 128 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.896 112.5 50.0 -61.0 -39.7 34.4 65.6 41.9 116 119 A K H X S+ 0 0 52 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.920 111.8 47.5 -65.4 -44.4 35.8 63.8 38.8 117 120 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.921 110.3 51.8 -64.2 -43.4 32.4 63.8 37.1 118 121 A N H X S+ 0 0 90 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.874 107.7 52.2 -62.6 -39.1 31.8 67.5 37.9 119 122 A K H X S+ 0 0 135 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.911 112.4 45.4 -63.6 -41.0 35.2 68.5 36.4 120 123 A I H X S+ 0 0 5 -4,-1.7 4,-2.2 2,-0.2 5,-0.3 0.940 112.1 50.6 -67.6 -47.3 34.5 66.7 33.2 121 124 A F H X>S+ 0 0 25 -4,-2.7 5,-2.6 1,-0.2 4,-1.5 0.899 112.9 47.0 -58.7 -40.2 30.9 68.1 32.9 122 125 A E H <5S+ 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1.1 466 90 D A + 0 0 54 -2,-0.3 2,-0.4 -3,-0.1 18,-0.0 -0.554 42.4 174.9 -84.3 76.3 13.5 54.9 3.2 467 91 D D >> - 0 0 67 -2,-1.8 4,-2.5 1,-0.1 3,-0.6 -0.741 36.8-130.0 -86.0 129.1 16.4 53.9 0.9 468 92 D A H 3> S+ 0 0 77 -2,-0.4 4,-1.9 1,-0.2 5,-0.1 0.755 107.9 53.6 -47.6 -34.6 18.7 51.1 2.3 469 93 D E H 3> S+ 0 0 103 2,-0.2 4,-2.0 3,-0.1 -1,-0.2 0.909 110.8 44.8 -68.9 -46.0 21.8 53.2 1.5 470 94 D N H <> S+ 0 0 31 -3,-0.6 4,-3.0 2,-0.2 -2,-0.2 0.951 112.6 52.1 -61.9 -51.9 20.5 56.3 3.4 471 95 D I H X S+ 0 0 50 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.903 110.4 46.9 -53.5 -47.1 19.4 54.2 6.3 472 96 D K H X S+ 0 0 71 -4,-1.9 4,-2.5 -5,-0.2 -1,-0.2 0.911 111.9 51.7 -64.3 -38.9 22.8 52.6 6.7 473 97 D A H X S+ 0 0 16 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.942 110.5 49.0 -61.3 -45.7 24.4 56.0 6.4 474 98 D L H X>S+ 0 0 6 -4,-3.0 5,-2.4 1,-0.2 4,-0.7 0.906 111.3 48.4 -59.0 -48.0 22.2 57.3 9.1 475 99 D A H ><5S+ 0 0 71 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.904 111.6 49.8 -60.8 -43.5 22.9 54.4 11.5 476 100 D Q H 3<5S+ 0 0 100 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.809 109.8 51.6 -65.7 -33.9 26.6 54.7 10.9 477 101 D A H 3<5S- 0 0 6 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.588 120.1-108.1 -80.5 -9.9 26.5 58.5 11.7 478 102 D G T <<5 + 0 0 21 -3,-0.8 -3,-0.2 -4,-0.7 -19,-0.2 0.776 52.2 171.4 91.1 27.4 24.6 57.9 14.9 479 103 D A < - 0 0 12 -5,-2.4 -1,-0.2 1,-0.1 -19,-0.1 -0.461 35.3-136.9 -68.1 141.4 21.1 59.1 14.1 480 104 D S S S- 0 0 15 -21,-2.0 2,-0.3 1,-0.3 -20,-0.2 0.762 72.3 -52.9 -71.6 -23.0 18.6 58.3 16.9 481 105 D G E -p 460 0D 21 -22,-1.0 -20,-2.5 -7,-0.1 2,-0.3 -0.963 53.7-119.3 171.8-174.5 16.2 57.3 14.2 482 106 D Y E -p 461 0D 69 -2,-0.3 2,-0.3 -22,-0.2 -20,-0.2 -0.956 10.9-161.5-148.1 162.1 14.4 58.3 11.0 483 107 D V E -p 462 0D 2 -22,-2.3 -20,-2.4 -2,-0.3 2,-0.4 -0.987 19.4-130.0-148.3 138.1 10.9 58.9 9.7 484 108 D V E -p 463 0D 50 -2,-0.3 -20,-0.2 -22,-0.2 -22,-0.1 -0.773 40.6 -96.8 -92.8 133.5 9.7 59.2 6.1 485 109 D K S S+ 0 0 59 -22,-2.3 2,-0.1 -2,-0.4 3,-0.0 -0.696 99.1 49.6 -96.5 150.4 7.5 62.1 5.1 486 110 D P S S+ 0 0 132 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.525 81.8 162.9 -76.8 145.2 4.7 62.7 4.9 487 111 D F - 0 0 22 -2,-0.1 2,-0.2 -4,-0.1 -2,-0.1 -0.845 30.5-126.3-127.6 164.7 3.9 61.3 8.3 488 112 D T > - 0 0 81 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.574 31.5-105.3-105.2 170.5 1.1 61.5 10.8 489 113 D A H > S+ 0 0 23 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.857 122.4 55.5 -63.3 -33.0 1.0 62.4 14.5 490 114 D A H > S+ 0 0 65 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.956 108.8 45.2 -63.7 -50.7 0.6 58.7 15.3 491 115 D T H > S+ 0 0 51 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.906 112.4 51.8 -59.7 -43.9 3.7 57.8 13.3 492 116 D L H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.866 108.4 52.1 -62.2 -35.9 5.7 60.6 14.9 493 117 D E H X S+ 0 0 91 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.878 108.2 50.6 -67.5 -37.9 4.7 59.4 18.4 494 118 D E H X S+ 0 0 114 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.928 112.5 46.3 -64.6 -46.6 5.8 55.9 17.7 495 119 D K H X S+ 0 0 37 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.908 112.8 50.5 -63.5 -43.3 9.2 57.1 16.5 496 120 D L H X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.930 110.1 49.6 -62.7 -44.0 9.5 59.5 19.5 497 121 D N H X S+ 0 0 88 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.913 108.2 52.5 -62.6 -42.1 8.7 56.7 22.0 498 122 D K H X S+ 0 0 104 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.893 113.2 45.0 -60.9 -39.4 11.3 54.3 20.5 499 123 D I H X S+ 0 0 5 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.859 112.4 51.5 -73.0 -36.1 14.0 57.0 20.8 500 124 D F H X>S+ 0 0 10 -4,-2.5 5,-2.5 2,-0.2 4,-1.2 0.929 111.4 46.8 -66.8 -41.8 12.8 57.8 24.3 501 125 D E H <5S+ 0 0 165 -4,-2.9 3,-0.3 1,-0.2 -2,-0.2 0.901 109.3 56.3 -65.5 -38.4 13.0 54.2 25.4 502 126 D K H <5S+ 0 0 70 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.792 112.6 40.2 -62.8 -33.4 16.4 53.9 23.7 503 127 D L H <5S- 0 0 18 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.597 116.0-109.4 -92.9 -12.7 17.8 56.8 25.8 504 128 D G T <5 0 0 28 -4,-1.2 -3,-0.2 -3,-0.3 -2,-0.1 0.876 360.0 360.0 85.9 41.6 16.1 55.8 29.1 505 129 D M < 0 0 92 -5,-2.5 -4,-0.2 -6,-0.1 -5,-0.1 0.688 360.0 360.0-115.3 360.0 13.6 58.7 29.3