==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 26-AUG-10 3OLX . COMPND 2 MOLECULE: CHEMOTAXIS PROTEIN CHEY; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.M.IMMORMINO,R.B.BOURRET . 256 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12292.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 14.8 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 . 18 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 36.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 0 0 0 1 4 1 0 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 6 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 2 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 2 A A 0 0 42 0, 0.0 2,-0.3 0, 0.0 127,-0.0 0.000 360.0 360.0 360.0 160.4 33.8 54.4 33.0 2 3 A D > - 0 0 105 126,-0.5 3,-2.0 1,-0.2 126,-0.0 -0.439 360.0-146.3 -61.4 118.7 32.5 53.3 36.4 3 4 A K T 3 S+ 0 0 93 -2,-0.3 27,-0.7 1,-0.3 28,-0.5 0.549 97.3 61.4 -70.4 -4.0 34.3 55.6 39.0 4 5 A E T 3 S+ 0 0 133 25,-0.1 -1,-0.3 26,-0.1 -2,-0.1 0.531 71.8 131.4 -93.8 -10.1 34.3 52.7 41.4 5 6 A L < - 0 0 24 -3,-2.0 2,-0.6 1,-0.1 26,-0.4 -0.164 60.2-127.3 -42.8 129.5 36.5 50.6 39.1 6 7 A K - 0 0 47 43,-0.4 45,-2.8 24,-0.1 46,-1.0 -0.794 25.2-158.5 -95.5 122.6 39.3 49.2 41.2 7 8 A F E -ab 32 52A 0 24,-2.9 26,-2.9 -2,-0.6 2,-0.5 -0.738 11.4-158.2-100.8 143.3 42.8 49.9 39.9 8 9 A L E -ab 33 53A 0 44,-2.0 46,-2.6 -2,-0.3 2,-0.6 -0.987 12.6-163.0-118.2 123.3 46.0 48.1 40.7 9 10 A V E -ab 34 54A 3 24,-2.8 26,-2.1 -2,-0.5 2,-0.5 -0.916 7.7-167.5-114.4 119.7 49.1 50.2 40.0 10 11 A V E +ab 35 55A 3 44,-2.8 46,-3.0 -2,-0.6 2,-0.3 -0.897 25.4 124.7-122.1 125.5 52.4 48.4 39.7 11 12 A D - 0 0 5 24,-2.0 48,-0.1 -2,-0.5 24,-0.1 -0.944 54.6-126.8-167.8 148.8 55.9 49.7 39.7 12 13 A D S S+ 0 0 50 46,-0.4 2,-0.4 -2,-0.3 24,-0.1 0.594 95.6 66.0 -81.9 -8.5 59.0 49.0 41.7 13 14 A F S > S- 0 0 138 1,-0.1 4,-1.2 -3,-0.0 3,-0.5 -0.960 72.9-145.6-117.2 133.5 59.4 52.8 42.4 14 15 A S H > S+ 0 0 69 -2,-0.4 4,-3.6 1,-0.2 5,-0.3 0.840 92.7 70.0 -60.1 -39.8 57.0 54.8 44.5 15 16 A T H > S+ 0 0 102 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.920 103.3 41.5 -47.6 -50.7 57.4 58.0 42.4 16 17 A M H > S+ 0 0 31 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.882 114.5 51.3 -69.1 -36.0 55.6 56.5 39.4 17 18 A R H X S+ 0 0 35 -4,-1.2 4,-3.0 2,-0.2 5,-0.2 0.916 110.7 50.1 -65.6 -40.8 52.9 54.8 41.5 18 19 A R H X S+ 0 0 178 -4,-3.6 4,-2.4 2,-0.2 5,-0.2 0.930 109.9 49.7 -64.0 -43.8 52.3 58.1 43.2 19 20 A I H X S+ 0 0 73 -4,-2.5 4,-2.3 -5,-0.3 -2,-0.2 0.941 114.9 44.5 -57.4 -47.5 52.0 60.0 39.9 20 21 A V H X S+ 0 0 3 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.912 111.6 51.4 -68.1 -43.8 49.5 57.4 38.6 21 22 A R H X S+ 0 0 85 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.943 112.0 47.5 -57.7 -47.4 47.4 57.2 41.7 22 23 A N H X S+ 0 0 89 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.918 111.2 50.5 -63.2 -40.6 47.1 61.0 41.8 23 24 A L H X S+ 0 0 35 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.925 109.6 50.5 -59.1 -46.4 46.2 61.2 38.1 24 25 A L H X>S+ 0 0 0 -4,-2.6 5,-3.4 1,-0.2 4,-0.8 0.882 109.3 52.6 -59.8 -40.2 43.5 58.5 38.6 25 26 A K H ><5S+ 0 0 129 -4,-2.2 3,-1.3 3,-0.2 -2,-0.2 0.950 106.8 51.6 -58.9 -50.2 42.2 60.6 41.5 26 27 A E H 3<5S+ 0 0 160 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.898 109.5 51.3 -52.6 -40.4 42.0 63.6 39.3 27 28 A L H 3<5S- 0 0 43 -4,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.636 127.6-100.6 -76.6 -13.8 40.0 61.5 36.8 28 29 A G T <<5S+ 0 0 26 -3,-1.3 2,-0.7 -4,-0.8 -3,-0.2 0.573 82.4 126.3 106.8 13.2 37.6 60.4 39.5 29 30 A F < + 0 0 4 -5,-3.4 -1,-0.2 -6,-0.2 -2,-0.2 -0.897 17.6 159.0-104.2 111.1 39.0 57.0 40.4 30 31 A N + 0 0 112 -27,-0.7 2,-1.7 -2,-0.7 -1,-0.1 0.581 50.7 92.3-105.2 -14.1 39.7 56.6 44.1 31 32 A N + 0 0 53 -28,-0.5 -24,-2.9 -26,-0.4 2,-0.4 -0.617 61.5 145.2 -79.3 83.8 39.6 52.8 44.4 32 33 A V E -a 7 0A 5 -2,-1.7 2,-0.3 -26,-0.2 -24,-0.2 -0.978 27.1-178.5-136.9 122.7 43.3 52.4 43.8 33 34 A E E -a 8 0A 70 -26,-2.9 -24,-2.8 -2,-0.4 2,-0.3 -0.784 15.2-141.0-114.9 161.9 45.9 50.0 45.2 34 35 A E E -a 9 0A 42 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.895 12.3-173.0-123.8 151.7 49.6 49.7 44.6 35 36 A A E -a 10 0A 2 -26,-2.1 -24,-2.0 -2,-0.3 3,-0.1 -0.975 19.3-146.8-139.5 155.2 52.1 46.8 44.2 36 37 A E S S- 0 0 107 -2,-0.3 2,-0.3 -26,-0.2 -26,-0.1 0.575 78.0 -0.1 -99.7 -16.3 55.9 46.9 44.0 37 38 A D S > S- 0 0 7 22,-0.1 4,-2.2 24,-0.1 26,-0.1 -0.943 83.2 -87.4-159.9 180.0 56.5 43.9 41.6 38 39 A G H > S+ 0 0 0 24,-2.1 4,-2.6 22,-0.5 5,-0.2 0.833 124.0 51.0 -70.0 -31.1 54.6 41.3 39.6 39 40 A V H > S+ 0 0 64 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.972 110.9 47.8 -66.1 -53.9 54.6 38.8 42.4 40 41 A D H > S+ 0 0 41 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.883 113.2 51.8 -48.9 -43.7 53.2 41.4 44.8 41 42 A A H X S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 -2,-0.2 0.933 106.9 48.9 -63.7 -52.1 50.6 42.3 42.1 42 43 A L H X S+ 0 0 29 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.911 109.1 56.0 -56.5 -42.5 49.4 38.7 41.5 43 44 A N H X S+ 0 0 82 -4,-2.6 4,-0.9 2,-0.2 -2,-0.2 0.959 111.8 41.1 -51.4 -55.1 49.0 38.4 45.3 44 45 A K H >< S+ 0 0 69 -4,-2.2 3,-0.8 1,-0.2 -2,-0.2 0.918 114.4 53.0 -61.2 -43.9 46.7 41.5 45.4 45 46 A L H >< S+ 0 0 14 -4,-3.2 3,-1.7 1,-0.3 5,-0.3 0.865 104.8 54.5 -59.6 -39.1 44.9 40.4 42.2 46 47 A Q H 3< S+ 0 0 146 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.733 94.8 69.6 -66.6 -22.7 44.2 37.0 43.7 47 48 A A T << S- 0 0 85 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.533 108.1-134.0 -72.5 -5.3 42.6 38.8 46.6 48 49 A G S < S+ 0 0 35 -3,-1.7 -1,-0.1 -4,-0.2 -2,-0.1 0.246 71.0 88.2 79.8 161.2 39.9 39.7 44.1 49 50 A G + 0 0 64 1,-0.3 -43,-0.4 -3,-0.1 2,-0.2 0.175 53.4 134.4 105.0 -15.4 38.0 42.8 43.1 50 51 A Y + 0 0 34 -5,-0.3 -1,-0.3 -6,-0.1 -43,-0.2 -0.448 25.8 175.2 -81.9 139.8 40.3 44.4 40.5 51 52 A G + 0 0 20 -45,-2.8 2,-0.3 1,-0.3 -44,-0.2 0.430 67.8 23.9-115.6 -1.2 39.0 45.9 37.2 52 53 A F E -b 7 0A 0 -46,-1.0 -44,-2.0 28,-0.1 2,-0.4 -0.963 57.8-154.8-165.3 138.9 42.2 47.4 35.7 53 54 A V E -bc 8 82A 0 28,-2.2 30,-3.0 -2,-0.3 2,-0.4 -0.980 4.6-172.7-123.5 134.5 45.9 47.0 35.9 54 55 A I E -bc 9 83A 3 -46,-2.6 -44,-2.8 -2,-0.4 2,-0.4 -0.996 24.9-176.3-118.6 130.5 48.5 49.7 35.1 55 56 A S E -bc 10 84A 1 28,-2.9 30,-3.0 -2,-0.4 -44,-0.2 -0.981 28.6-140.3-146.0 138.8 52.0 48.3 35.2 56 57 A D - 0 0 5 -46,-3.0 30,-0.2 -2,-0.4 3,-0.1 -0.141 17.9-144.2 -67.5 170.4 55.7 49.0 34.9 57 58 A W S S+ 0 0 21 28,-0.2 7,-2.2 1,-0.2 2,-0.7 0.790 78.5 61.5-106.5 -67.1 58.0 46.7 33.1 58 59 A N + 0 0 71 5,-0.2 -46,-0.4 6,-0.1 -1,-0.2 -0.532 69.6 132.4 -70.7 112.0 61.4 46.6 34.8 59 60 A M - 0 0 17 -2,-0.7 -22,-0.1 -3,-0.1 -21,-0.1 -0.975 53.2-110.3-155.8 144.6 60.8 45.2 38.3 60 61 A P S S+ 0 0 76 0, 0.0 2,-2.6 0, 0.0 -22,-0.5 -0.237 95.3 24.1 -72.0 169.4 62.5 42.6 40.4 61 62 A N S S+ 0 0 133 -24,-0.1 2,-0.2 -23,-0.1 -24,-0.1 -0.223 138.8 7.4 72.6 -51.6 60.9 39.2 41.3 62 63 A M S S- 0 0 38 -2,-2.6 -24,-2.1 -5,-0.1 -23,-0.1 -0.748 77.4-142.4-159.5 118.5 58.6 39.4 38.3 63 64 A D > - 0 0 54 -2,-0.2 4,-1.8 -26,-0.1 -5,-0.2 -0.122 31.9-102.7 -73.0 173.7 58.8 42.0 35.5 64 65 A G H > S+ 0 0 0 -7,-2.2 4,-2.3 2,-0.2 -7,-0.1 0.728 117.3 57.4 -77.9 -24.9 55.7 43.5 33.8 65 66 A L H > S+ 0 0 22 -8,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.920 110.7 45.4 -68.0 -42.5 55.9 41.4 30.6 66 67 A E H > S+ 0 0 93 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.895 112.9 51.1 -64.5 -39.5 55.8 38.2 32.7 67 68 A L H X S+ 0 0 1 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.920 110.7 48.3 -63.0 -46.7 52.9 39.7 34.9 68 69 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.930 113.0 48.3 -57.8 -49.3 51.0 40.6 31.7 69 70 A K H X S+ 0 0 79 -4,-2.6 4,-1.0 2,-0.2 -2,-0.2 0.944 112.3 48.9 -56.0 -51.8 51.6 37.1 30.4 70 71 A T H >X S+ 0 0 47 -4,-3.0 3,-1.3 1,-0.2 4,-0.8 0.953 110.8 50.3 -51.4 -54.6 50.5 35.5 33.6 71 72 A I H >< S+ 0 0 0 -4,-2.9 3,-0.9 1,-0.3 6,-0.3 0.890 110.9 48.4 -54.0 -44.5 47.4 37.6 33.8 72 73 A R H 3< S+ 0 0 61 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.626 110.8 51.8 -73.7 -15.6 46.3 36.7 30.3 73 74 A A H << S+ 0 0 88 -3,-1.3 2,-0.5 -4,-1.0 -1,-0.2 0.432 88.6 92.0-102.0 -4.9 46.9 33.0 30.9 74 75 A D S 4 S+ 0 0 31 -3,-0.5 3,-1.8 -6,-0.3 -2,-0.2 0.235 81.9 121.9-125.5 17.3 41.6 37.2 35.0 78 79 A S T 3< S+ 0 0 52 -4,-1.2 -3,-0.1 1,-0.3 -1,-0.1 0.659 81.6 41.7 -58.0 -22.6 42.4 36.7 31.3 79 80 A A T 3 S+ 0 0 81 -4,-0.1 -1,-0.3 -3,-0.1 -7,-0.1 0.372 79.8 134.2-109.6 2.6 40.5 39.7 30.0 80 81 A L < - 0 0 21 -3,-1.8 -28,-0.1 -9,-0.2 23,-0.1 -0.278 67.1-107.9 -49.0 125.2 41.6 42.1 32.8 81 82 A P - 0 0 10 0, 0.0 -28,-2.2 0, 0.0 2,-0.4 -0.380 38.5-169.0 -60.5 135.6 42.6 45.4 31.2 82 83 A V E -c 53 0A 0 19,-0.2 21,-3.1 -30,-0.2 22,-1.0 -0.953 7.2-171.9-131.6 110.8 46.4 45.8 31.4 83 84 A L E -cd 54 104A 0 -30,-3.0 -28,-2.9 -2,-0.4 2,-0.3 -0.906 16.3-144.6-100.1 114.7 48.0 49.1 30.5 84 85 A M E -cd 55 105A 0 20,-2.0 22,-3.1 -2,-0.6 2,-0.4 -0.605 16.8-176.8 -77.8 137.4 51.9 49.1 30.4 85 86 A V E + d 0 106A 3 -30,-3.0 2,-0.3 -2,-0.3 -28,-0.2 -0.914 28.2 136.2-135.8 105.7 53.5 52.2 31.6 86 87 A T E - d 0 107A 0 20,-2.4 22,-2.3 -2,-0.4 -30,-0.0 -0.981 65.4-121.7-155.8 156.3 57.3 52.0 31.2 87 88 A S S S+ 0 0 65 -2,-0.3 2,-0.6 20,-0.2 20,-0.1 0.630 80.6 108.9 -75.8 -17.1 60.6 53.6 30.2 88 89 A E + 0 0 44 1,-0.2 -2,-0.2 5,-0.1 20,-0.0 -0.512 37.1 162.3 -64.1 109.3 61.1 50.8 27.6 89 90 A A + 0 0 55 -2,-0.6 -1,-0.2 18,-0.1 18,-0.1 0.471 26.0 119.4-115.0 -5.6 60.6 52.5 24.3 90 91 A K > - 0 0 145 1,-0.1 4,-1.7 2,-0.0 3,-0.5 -0.311 68.4-125.9 -60.9 146.2 62.1 50.1 21.8 91 92 A K H > S+ 0 0 89 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.854 110.0 59.0 -64.5 -34.7 59.8 48.9 19.1 92 93 A E H > S+ 0 0 91 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.847 104.9 49.9 -63.2 -33.4 60.7 45.3 20.0 93 94 A N H > S+ 0 0 30 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.909 111.1 48.6 -69.9 -41.7 59.5 45.8 23.6 94 95 A I H X S+ 0 0 3 -4,-1.7 4,-2.6 2,-0.2 5,-0.2 0.878 111.9 49.6 -64.8 -39.8 56.2 47.3 22.4 95 96 A I H X S+ 0 0 3 -4,-2.5 4,-3.4 2,-0.2 5,-0.3 0.958 110.0 50.8 -62.5 -49.2 55.8 44.3 20.0 96 97 A A H X S+ 0 0 31 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.882 115.2 42.2 -56.5 -41.1 56.5 41.8 22.7 97 98 A A H <>S+ 0 0 0 -4,-2.0 5,-2.7 2,-0.2 4,-0.2 0.882 115.5 48.7 -77.3 -38.8 54.0 43.5 25.1 98 99 A A H ><5S+ 0 0 6 -4,-2.6 3,-2.0 3,-0.2 -2,-0.2 0.960 112.6 47.8 -63.8 -51.2 51.3 44.0 22.4 99 100 A Q H 3<5S+ 0 0 56 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.863 107.5 57.8 -58.1 -34.7 51.6 40.4 21.2 100 101 A A T 3<5S- 0 0 21 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.496 130.2 -93.6 -76.5 -4.5 51.4 39.3 24.8 101 102 A G T < 5 + 0 0 22 -3,-2.0 -19,-0.2 -4,-0.2 -3,-0.2 0.571 58.8 172.3 108.8 11.6 48.0 41.0 25.1 102 103 A A < - 0 0 2 -5,-2.7 -1,-0.2 1,-0.2 -19,-0.2 -0.225 27.4-148.9 -51.5 138.4 48.7 44.5 26.4 103 104 A S S S- 0 0 16 -21,-3.1 2,-0.3 1,-0.3 -20,-0.2 0.756 77.3 -19.5 -79.5 -25.2 45.6 46.7 26.4 104 105 A G E -d 83 0A 8 -22,-1.0 -20,-2.0 -7,-0.1 2,-0.3 -0.940 60.5-138.2-168.4 173.6 47.7 49.8 25.8 105 106 A Y E -d 84 0A 2 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.912 13.4-172.9-153.4 116.1 51.3 51.0 26.2 106 107 A V E -d 85 0A 1 -22,-3.1 -20,-2.4 -2,-0.3 2,-0.4 -0.946 17.9-137.9-114.0 135.2 52.5 54.3 27.5 107 108 A V E -d 86 0A 44 -2,-0.4 -20,-0.2 -22,-0.2 -18,-0.1 -0.788 33.5 -91.4 -94.0 129.5 56.2 55.4 27.5 108 109 A K S S+ 0 0 38 -22,-2.3 2,-0.1 -2,-0.4 3,-0.0 -0.618 105.3 47.4 -78.9 142.8 57.8 57.2 30.4 109 110 A P S S+ 0 0 134 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.539 83.2 167.8 -79.8 152.6 58.0 60.1 30.9 110 111 A F - 0 0 35 -2,-0.1 2,-0.2 -4,-0.1 -2,-0.1 -0.892 29.9-123.6-129.4 156.2 54.3 60.8 30.1 111 112 A T > - 0 0 83 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.499 30.0-111.0 -91.1 165.5 52.0 63.8 30.5 112 113 A A H > S+ 0 0 56 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.844 119.8 55.3 -61.1 -37.6 48.7 63.7 32.3 113 114 A A H > S+ 0 0 47 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.909 105.6 50.6 -63.8 -43.7 47.0 64.2 29.0 114 115 A T H > S+ 0 0 45 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.946 110.8 48.4 -59.8 -48.9 48.7 61.1 27.5 115 116 A L H X S+ 0 0 1 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.922 113.5 47.1 -60.8 -42.8 47.7 58.9 30.4 116 117 A E H X S+ 0 0 86 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.888 113.4 48.6 -66.4 -37.5 44.1 60.1 30.3 117 118 A E H X S+ 0 0 116 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.927 113.3 46.0 -68.3 -45.1 43.9 59.6 26.5 118 119 A K H X S+ 0 0 44 -4,-2.9 4,-1.5 2,-0.2 -2,-0.2 0.878 112.0 51.5 -68.1 -37.4 45.3 56.1 26.7 119 120 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.3 3,-0.3 0.945 111.1 48.0 -61.7 -44.7 43.1 55.1 29.6 120 121 A N H X S+ 0 0 82 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.791 104.7 59.7 -68.3 -27.7 40.0 56.3 27.6 121 122 A K H X S+ 0 0 114 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.902 108.6 45.1 -66.5 -37.0 41.1 54.4 24.5 122 123 A I H X S+ 0 0 6 -4,-1.5 4,-2.2 -3,-0.3 6,-0.3 0.916 109.6 54.0 -73.0 -43.8 41.0 51.2 26.5 123 124 A F H X>S+ 0 0 10 -4,-2.2 5,-2.9 1,-0.2 4,-0.6 0.960 112.2 45.8 -50.0 -53.1 37.6 52.1 28.1 124 125 A E H ><5S+ 0 0 81 -4,-2.4 3,-0.6 1,-0.2 -1,-0.2 0.862 111.3 50.8 -62.3 -40.4 36.2 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65.0-127.1-157.5 150.2 55.9 45.9 7.7 216 88 B S S S+ 0 0 82 -2,-0.3 2,-0.4 20,-0.3 20,-0.1 0.609 80.5 110.0 -77.4 -12.0 57.6 49.2 7.8 217 89 B E + 0 0 48 1,-0.1 -2,-0.2 5,-0.1 20,-0.0 -0.521 32.9 155.9 -68.1 120.6 54.7 50.4 10.0 218 90 B A + 0 0 21 -2,-0.4 2,-0.2 18,-0.1 -1,-0.1 0.248 15.3 135.6-138.3 12.5 56.0 50.9 13.5 219 91 B K >> - 0 0 113 1,-0.1 4,-2.6 2,-0.0 3,-1.0 -0.502 59.1-126.2 -62.7 130.9 53.7 53.4 15.3 220 92 B K H 3> S+ 0 0 44 1,-0.3 4,-2.3 -2,-0.2 5,-0.2 0.876 108.3 49.3 -43.5 -53.5 53.0 52.2 18.8 221 93 B E H 3> S+ 0 0 87 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.777 112.6 48.5 -67.3 -25.4 49.2 52.4 18.4 222 94 B N H <> S+ 0 0 32 -3,-1.0 4,-2.4 2,-0.2 -1,-0.2 0.871 107.2 53.8 -81.3 -37.9 49.4 50.5 15.1 223 95 B I H X S+ 0 0 0 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.916 113.5 44.4 -56.7 -45.2 51.6 47.8 16.5 224 96 B I H X S+ 0 0 17 -4,-2.3 4,-2.9 -5,-0.2 5,-0.3 0.929 109.4 56.5 -64.1 -45.4 48.9 47.4 19.2 225 97 B A H X S+ 0 0 34 -4,-1.9 4,-1.0 1,-0.2 -2,-0.2 0.892 107.6 47.8 -53.9 -42.7 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109.9-121.2 -99.6 4.8 51.3 27.2 18.1 256 128 B G T < 5 0 0 67 -3,-1.9 -3,-0.2 -4,-0.5 -4,-0.1 0.920 360.0 360.0 54.2 50.2 52.9 23.8 18.6 257 129 B M < 0 0 90 -5,-2.5 -126,-0.5 -6,-0.1 -4,-0.2 0.542 360.0 360.0-101.5 360.0 53.9 23.3 15.0