==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTIONAL REGULATOR 25-NOV-09 3KTS . COMPND 2 MOLECULE: GLYCEROL UPTAKE OPERON ANTITERMINATOR REGULATORY . SOURCE 2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES STR. 4B; . AUTHOR Y.PATSKOVSKY,R.TORO,J.FREEMAN,J.DO,J.M.SAUDER,S.K.BURLEY,S.C . 1474 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 65477.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1035 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 308 20.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 2 0.1 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 . 112 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 100 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 436 29.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 40 2.7 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 2 0 3 1 8 18 9 2 0 4 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 18 30 16 8 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 . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 8 0 0 0 0 0 0 8 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 1 A L 0 0 233 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 91.5 -23.7 19.4 23.9 2 2 A E - 0 0 160 1,-0.1 4,-0.1 2,-0.1 0, 0.0 -0.317 360.0 -78.3 -71.7 160.3 -25.9 16.3 24.3 3 3 A L - 0 0 25 2,-0.1 -1,-0.1 1,-0.1 125,-0.0 -0.370 41.7-113.5 -68.6 138.5 -27.8 15.6 27.6 4 4 A P S S+ 0 0 71 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 0.545 106.1 73.5 -52.5 -18.1 -25.8 14.2 30.5 5 5 A F > + 0 0 1 24,-0.1 3,-0.5 2,-0.0 2,-0.4 -0.540 63.7 150.0 -95.9 64.1 -27.6 10.8 30.4 6 6 A S T 3 S+ 0 0 62 -2,-0.9 3,-0.1 1,-0.2 167,-0.1 -0.797 71.2 13.6 -87.9 141.1 -25.9 9.6 27.3 7 7 A N T 3 S+ 0 0 168 -2,-0.4 2,-0.5 165,-0.2 -1,-0.2 0.703 100.5 110.8 57.3 25.1 -25.6 5.7 27.3 8 8 A Q < + 0 0 11 -3,-0.5 -1,-0.1 164,-0.2 166,-0.1 -0.944 37.5 171.0-123.1 108.7 -28.0 5.4 30.2 9 9 A S + 0 0 45 -2,-0.5 165,-3.1 164,-0.2 2,-0.5 0.849 63.1 52.0 -88.7 -41.2 -31.2 3.9 28.9 10 10 A I E -a 174 0A 4 163,-0.2 165,-0.2 172,-0.1 20,-0.2 -0.883 58.8-172.9-101.1 126.1 -33.1 3.2 32.1 11 11 A I E -a 175 0A 0 163,-2.6 165,-1.4 -2,-0.5 20,-0.2 -0.944 28.1-134.7-113.2 101.5 -33.6 6.1 34.5 12 12 A P E -a 176 0A 3 0, 0.0 20,-2.7 0, 0.0 2,-0.5 -0.261 11.8-144.2 -59.8 144.0 -35.2 4.5 37.6 13 13 A A E -b 32 0A 6 163,-2.2 2,-0.5 18,-0.2 20,-0.2 -0.945 9.1-151.3-118.9 113.6 -38.1 6.3 39.1 14 14 A A E +b 33 0A 1 18,-3.5 20,-2.9 -2,-0.5 21,-0.5 -0.722 23.3 171.3 -90.3 126.2 -38.5 6.2 42.9 15 15 A H S S+ 0 0 51 -2,-0.5 2,-0.2 19,-0.2 -1,-0.2 0.677 71.2 42.6 -91.0 -28.8 -42.0 6.5 44.5 16 16 A N S S- 0 0 89 1,-0.1 4,-0.5 18,-0.0 18,-0.1 -0.532 77.5-121.9-113.6 172.1 -40.6 5.7 48.0 17 17 A Q S > S+ 0 0 88 -2,-0.2 4,-0.8 2,-0.2 3,-0.4 0.805 121.7 51.6 -74.8 -36.8 -37.8 6.4 50.4 18 18 A K H > S+ 0 0 105 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.734 101.5 60.6 -69.8 -26.8 -37.3 2.6 50.2 19 19 A D H > S+ 0 0 10 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.792 101.1 53.3 -70.3 -30.4 -37.3 2.7 46.4 20 20 A M H > S+ 0 0 2 -4,-0.5 4,-0.5 -3,-0.4 -1,-0.2 0.750 104.8 55.0 -77.2 -24.6 -34.2 5.0 46.4 21 21 A E H < S+ 0 0 68 -4,-0.8 3,-0.5 2,-0.2 4,-0.5 0.888 106.4 52.3 -68.7 -41.6 -32.4 2.5 48.7 22 22 A K H >< S+ 0 0 118 -4,-1.4 3,-0.8 1,-0.2 -2,-0.2 0.897 113.4 42.9 -58.3 -43.8 -33.1 -0.2 46.0 23 23 A I H >< S+ 0 0 2 -4,-1.5 3,-0.9 1,-0.2 -1,-0.2 0.521 96.4 75.6 -86.4 -5.2 -31.6 2.0 43.3 24 24 A L T 3< S+ 0 0 42 -4,-0.5 -1,-0.2 -3,-0.5 -2,-0.2 0.676 91.7 58.1 -77.1 -16.0 -28.6 3.1 45.4 25 25 A E T < S+ 0 0 157 -3,-0.8 2,-0.3 -4,-0.5 -1,-0.3 -0.033 93.3 100.2 -98.9 27.8 -27.1 -0.3 44.8 26 26 A L S < S- 0 0 23 -3,-0.9 157,-0.1 2,-0.2 -3,-0.0 -0.866 73.7-132.3-124.3 153.6 -27.2 0.1 41.0 27 27 A D S S+ 0 0 167 -2,-0.3 2,-0.2 2,-0.0 -1,-0.1 0.657 77.2 104.6 -75.2 -17.5 -24.8 1.0 38.2 28 28 A L - 0 0 41 154,-0.2 -2,-0.2 1,-0.1 -20,-0.1 -0.483 57.2-159.1 -70.2 130.6 -27.1 3.6 36.7 29 29 A T + 0 0 61 -2,-0.2 25,-2.2 24,-0.1 2,-0.4 0.906 67.3 61.7 -83.4 -45.3 -26.1 7.2 37.5 30 30 A Y E - c 0 54A 11 23,-0.2 2,-0.3 -20,-0.2 25,-0.2 -0.693 62.1-178.5 -88.6 135.7 -29.3 9.3 37.0 31 31 A M E - c 0 55A 3 23,-2.9 25,-2.5 -2,-0.4 2,-0.4 -0.866 19.3-134.7-126.4 161.8 -32.4 8.7 39.1 32 32 A V E -bc 13 56A 1 -20,-2.7 -18,-3.5 -2,-0.3 2,-0.6 -0.973 7.9-155.2-120.8 132.0 -35.9 10.2 39.2 33 33 A M E +bc 14 57A 4 23,-2.7 25,-2.2 -2,-0.4 28,-0.2 -0.918 16.8 175.6-111.0 116.0 -37.8 11.1 42.4 34 34 A L + 0 0 11 -20,-2.9 2,-0.4 -2,-0.6 27,-0.2 0.987 61.0 20.4 -92.4 -72.3 -41.5 11.1 42.0 35 35 A E S S+ 0 0 93 -21,-0.5 -1,-0.3 -20,-0.1 2,-0.3 -0.889 74.8 162.1-102.9 134.8 -43.5 11.8 45.1 36 36 A T E -i 62 0B 3 25,-2.1 27,-2.2 -2,-0.4 2,-0.4 -0.856 35.6-120.6-142.5 172.6 -41.7 13.6 48.0 37 37 A H E > -i 63 0B 90 -2,-0.3 4,-0.8 25,-0.2 3,-0.4 -0.991 16.4-139.6-123.9 130.0 -42.2 15.5 51.2 38 38 A V T 4 S+ 0 0 49 25,-2.4 4,-0.4 -2,-0.4 26,-0.1 0.758 102.3 58.8 -58.1 -26.1 -40.9 19.1 51.5 39 39 A A T 4 S+ 0 0 96 24,-0.2 -1,-0.2 1,-0.2 4,-0.2 0.924 116.0 30.8 -68.7 -46.9 -39.9 18.3 55.2 40 40 A Q T > S+ 0 0 98 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.408 96.3 102.2 -91.8 2.7 -37.6 15.5 54.3 41 41 A L H X S+ 0 0 0 -4,-0.8 4,-1.7 1,-0.2 5,-0.2 0.870 74.6 47.0 -62.1 -54.0 -36.6 16.9 50.9 42 42 A K H > S+ 0 0 122 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.868 114.9 48.7 -58.3 -41.0 -33.1 18.5 51.3 43 43 A A H > S+ 0 0 66 -4,-0.2 4,-2.9 1,-0.2 5,-0.2 0.930 108.9 52.3 -63.8 -48.6 -31.8 15.3 53.1 44 44 A L H X S+ 0 0 16 -4,-2.0 4,-0.9 1,-0.2 -1,-0.2 0.773 112.0 46.1 -61.5 -32.4 -33.2 12.9 50.5 45 45 A V H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.915 115.5 45.0 -75.3 -45.7 -31.4 14.8 47.7 46 46 A K H X S+ 0 0 87 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.836 112.6 52.1 -68.8 -32.1 -28.1 15.1 49.5 47 47 A Y H X S+ 0 0 131 -4,-2.9 4,-0.5 2,-0.2 -1,-0.2 0.800 111.7 46.3 -71.8 -30.9 -28.3 11.5 50.6 48 48 A A H <>S+ 0 0 0 -4,-0.9 5,-1.8 -5,-0.2 3,-0.4 0.841 112.9 49.2 -78.6 -34.6 -28.8 10.4 47.0 49 49 A Q H ><5S+ 0 0 58 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.722 103.4 61.8 -74.7 -22.8 -26.0 12.6 45.8 50 50 A A H 3<5S+ 0 0 85 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.748 99.7 55.8 -70.5 -25.6 -23.8 11.2 48.5 51 51 A G T 3<5S- 0 0 39 -4,-0.5 -1,-0.2 -3,-0.4 -2,-0.2 0.087 125.1-101.8 -93.8 21.3 -24.2 7.8 46.8 52 52 A G T < 5S+ 0 0 57 -3,-1.0 2,-0.5 1,-0.2 -3,-0.2 0.630 80.9 134.5 70.1 16.8 -22.9 9.1 43.4 53 53 A K < - 0 0 14 -5,-1.8 2,-0.4 -6,-0.1 -1,-0.2 -0.853 49.7-140.9-103.6 129.8 -26.5 9.4 42.0 54 54 A K E -c 30 0A 86 -25,-2.2 -23,-2.9 -2,-0.5 2,-0.5 -0.739 23.2-135.2 -89.3 135.2 -27.7 12.4 40.1 55 55 A V E -c 31 0A 0 -2,-0.4 27,-1.8 -25,-0.2 28,-1.6 -0.793 19.4-168.6-106.1 126.8 -31.3 13.4 40.9 56 56 A L E -cd 32 83A 2 -25,-2.5 -23,-2.7 -2,-0.5 2,-0.5 -0.957 26.4-157.5-102.2 114.2 -34.1 14.5 38.6 57 57 A L E -cd 33 84A 0 26,-2.6 28,-2.8 -2,-0.6 2,-1.0 -0.836 17.6-130.3-105.8 126.6 -36.8 15.9 40.9 58 58 A H E > - d 0 85A 1 -25,-2.2 3,-0.7 -2,-0.5 28,-0.2 -0.602 19.4-169.4 -70.2 102.9 -40.5 16.2 40.2 59 59 A A G > S+ 0 0 1 26,-2.3 3,-0.6 -2,-1.0 -1,-0.2 0.770 85.2 53.3 -63.5 -29.6 -41.3 19.8 41.1 60 60 A D G 3 S+ 0 0 46 25,-0.8 -1,-0.2 1,-0.2 26,-0.1 0.682 104.0 56.2 -80.8 -19.8 -45.0 19.1 40.8 61 61 A L G < S+ 0 0 59 -3,-0.7 -25,-2.1 -27,-0.2 2,-1.1 0.103 71.0 117.6-104.5 19.6 -45.0 16.1 43.2 62 62 A V E X -i 36 0B 4 -3,-0.6 3,-2.1 3,-0.2 -25,-0.2 -0.762 63.0-136.4 -91.2 97.3 -43.4 17.8 46.3 63 63 A N E 3 S+i 37 0B 77 -27,-2.2 -25,-2.4 -2,-1.1 -24,-0.2 -0.288 87.5 20.1 -54.8 127.1 -46.1 17.5 49.0 64 64 A G T 3 S+ 0 0 79 1,-0.2 2,-0.4 -27,-0.1 -1,-0.3 0.209 110.7 90.5 96.2 -12.2 -46.4 20.8 51.0 65 65 A L < - 0 0 42 -3,-2.1 -3,-0.2 -6,-0.1 -1,-0.2 -0.961 65.1-143.3-122.1 132.0 -44.7 22.8 48.2 66 66 A K - 0 0 144 -2,-0.4 -4,-0.1 -3,-0.1 -1,-0.0 -0.001 25.3-117.8 -70.3-177.4 -46.4 24.6 45.3 67 67 A N + 0 0 46 -7,-0.1 -7,-0.1 4,-0.0 -1,-0.1 -0.004 67.9 137.4-114.4 26.9 -44.8 24.8 41.8 68 68 A D S > S- 0 0 37 1,-0.1 4,-1.9 4,-0.0 5,-0.2 -0.057 74.3-103.3 -49.2 161.7 -44.6 28.7 42.1 69 69 A D H > S+ 0 0 65 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.910 127.3 52.7 -56.2 -43.2 -41.6 30.7 41.0 70 70 A Y H > S+ 0 0 182 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.835 108.4 50.3 -61.6 -36.7 -40.7 30.9 44.7 71 71 A A H > S+ 0 0 7 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.826 111.2 47.3 -70.7 -34.4 -41.0 27.2 45.0 72 72 A I H X S+ 0 0 1 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.897 108.2 55.9 -75.1 -39.8 -38.7 26.6 42.0 73 73 A D H X S+ 0 0 43 -4,-2.8 4,-2.6 1,-0.2 5,-0.4 0.901 107.4 50.7 -49.7 -47.5 -36.3 29.2 43.5 74 74 A F H X>S+ 0 0 59 -4,-1.7 4,-1.9 1,-0.2 5,-1.1 0.863 109.5 49.6 -59.8 -42.0 -36.2 27.0 46.7 75 75 A L H <>S+ 0 0 0 -4,-1.5 5,-2.9 3,-0.2 -1,-0.2 0.845 117.3 40.6 -67.9 -34.6 -35.5 23.9 44.6 76 76 A C H <5S+ 0 0 17 -4,-2.1 -2,-0.2 3,-0.2 -1,-0.2 0.825 125.8 30.9 -85.7 -36.3 -32.6 25.5 42.8 77 77 A T H <5S+ 0 0 88 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.798 134.3 20.6 -93.5 -33.8 -31.0 27.5 45.6 78 78 A E T <5S+ 0 0 120 -4,-1.9 -3,-0.2 -5,-0.4 -2,-0.1 0.639 130.9 31.2-116.8 -18.8 -31.7 25.4 48.7 79 79 A I T - 0 0 80 1,-0.1 4,-0.9 -3,-0.1 3,-0.1 -0.580 69.8-147.2 -80.8 136.5 -45.9 23.9 34.3 89 89 A G H > S+ 0 0 7 -2,-0.3 4,-2.1 1,-0.2 3,-0.3 0.875 96.2 58.8 -71.9 -39.5 -44.2 26.2 31.8 90 90 A N H > S+ 0 0 74 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.789 103.6 53.3 -60.5 -31.1 -43.3 28.9 34.3 91 91 A A H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.833 107.0 50.7 -73.8 -34.3 -41.3 26.3 36.2 92 92 A I H X S+ 0 0 0 -4,-0.9 4,-1.6 -3,-0.3 -2,-0.2 0.884 111.7 48.8 -68.7 -39.3 -39.3 25.4 33.1 93 93 A M H X S+ 0 0 82 -4,-2.1 4,-0.9 2,-0.2 -2,-0.2 0.919 113.5 46.5 -63.4 -46.0 -38.6 29.1 32.5 94 94 A K H >X S+ 0 0 42 -4,-2.1 4,-1.2 1,-0.2 3,-0.6 0.892 109.4 52.6 -65.7 -43.0 -37.5 29.6 36.1 95 95 A A H 3<>S+ 0 0 0 -4,-2.3 5,-2.8 1,-0.3 3,-0.2 0.865 105.3 56.7 -63.0 -36.4 -35.2 26.6 36.2 96 96 A K H ><5S+ 0 0 82 -4,-1.6 3,-0.9 1,-0.2 -1,-0.3 0.771 101.1 57.1 -65.2 -27.9 -33.5 27.8 33.0 97 97 A Q H <<5S+ 0 0 140 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.856 107.8 47.3 -69.0 -35.3 -32.7 31.1 34.8 98 98 A H T 3<5S- 0 0 66 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.219 119.6-113.1 -89.1 12.1 -30.9 29.1 37.5 99 99 A K T < 5 + 0 0 203 -3,-0.9 2,-0.3 1,-0.2 -3,-0.2 0.867 65.6 154.0 54.1 43.0 -29.1 27.1 34.8 100 100 A M < - 0 0 20 -5,-2.8 2,-1.1 -8,-0.1 -1,-0.2 -0.722 57.7-102.2 -97.5 150.7 -31.0 23.9 35.9 101 101 A L E -e 83 0A 23 -19,-0.6 -17,-2.6 -2,-0.3 2,-0.8 -0.626 44.9-165.0 -71.1 101.1 -31.7 20.9 33.7 102 102 A A E -e 84 0A 0 -2,-1.1 25,-1.7 -19,-0.2 26,-1.3 -0.847 9.5-176.7 -98.0 109.0 -35.4 21.7 33.0 103 103 A I E -ef 85 128A 2 -19,-2.5 -17,-1.6 -2,-0.8 2,-0.5 -0.917 17.2-141.2-105.4 129.5 -37.3 18.7 31.5 104 104 A Q E -ef 86 129A 2 24,-2.7 26,-1.8 -2,-0.5 2,-0.4 -0.790 10.0-138.3 -97.7 127.2 -41.0 19.3 30.6 105 105 A R E - f 0 130A 22 -19,-2.4 2,-0.4 -2,-0.5 26,-0.2 -0.660 21.0-175.0 -88.4 129.9 -43.6 16.7 31.2 106 106 A L E - f 0 131A 10 24,-2.9 26,-1.9 -2,-0.4 2,-0.7 -0.979 16.0-148.0-126.6 137.2 -46.2 16.0 28.6 107 107 A F E - f 0 132A 57 -2,-0.4 2,-2.2 24,-0.2 3,-0.4 -0.909 11.1-145.1-106.9 108.2 -49.2 13.7 28.7 108 108 A M + 0 0 4 24,-3.3 186,-0.1 -2,-0.7 3,-0.1 -0.477 53.9 133.1 -67.7 79.5 -50.1 12.1 25.4 109 109 A I - 0 0 23 -2,-2.2 211,-0.3 1,-0.3 2,-0.2 0.901 67.5 -26.7 -97.1 -61.2 -53.9 12.2 26.2 110 110 A D S > S- 0 0 27 -3,-0.4 4,-1.7 231,-0.2 -1,-0.3 -0.775 70.5 -83.0-143.3-174.7 -55.6 13.6 23.1 111 111 A S H > S+ 0 0 47 -2,-0.2 4,-2.5 2,-0.2 5,-0.1 0.787 126.3 54.9 -66.4 -29.8 -55.0 15.8 20.1 112 112 A S H > S+ 0 0 21 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.893 106.7 49.9 -71.0 -40.8 -55.8 18.9 22.2 113 113 A A H > S+ 0 0 27 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.859 112.4 48.6 -64.4 -40.1 -53.1 17.9 24.7 114 114 A Y H X S+ 0 0 38 -4,-1.7 4,-3.0 2,-0.2 5,-0.3 0.981 113.6 45.5 -58.6 -59.3 -50.6 17.5 21.9 115 115 A N H X S+ 0 0 98 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.835 118.1 40.9 -58.6 -43.5 -51.4 20.9 20.3 116 116 A K H X S+ 0 0 134 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.843 116.8 51.6 -72.5 -34.4 -51.4 22.9 23.5 117 117 A G H X S+ 0 0 8 -4,-1.6 4,-2.3 -5,-0.3 -2,-0.2 0.860 108.5 47.8 -72.8 -40.7 -48.3 21.0 24.7 118 118 A V H X S+ 0 0 29 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.845 111.5 53.0 -68.0 -32.9 -46.2 21.5 21.5 119 119 A A H X S+ 0 0 61 -4,-1.2 4,-1.6 -5,-0.3 -2,-0.2 0.859 110.3 47.4 -67.2 -36.4 -47.2 25.2 21.7 120 120 A L H X S+ 0 0 58 -4,-1.5 4,-2.8 2,-0.2 5,-0.3 0.895 110.6 50.8 -71.8 -42.3 -45.9 25.2 25.3 121 121 A I H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.892 109.7 52.2 -57.1 -43.3 -42.7 23.4 24.4 122 122 A Q H < S+ 0 0 117 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.877 113.9 43.7 -61.1 -41.1 -42.2 26.0 21.6 123 123 A K H < S+ 0 0 162 -4,-1.6 -2,-0.2 1,-0.1 -1,-0.2 0.950 121.9 32.2 -71.0 -53.2 -42.7 28.9 24.1 124 124 A V H < S- 0 0 5 -4,-2.8 -2,-0.2 -5,-0.1 -3,-0.2 0.644 89.0-144.9 -90.1 -13.9 -40.6 27.8 27.1 125 125 A Q < - 0 0 79 -4,-1.8 -3,-0.1 -5,-0.3 -4,-0.1 0.959 20.4-152.6 50.1 70.4 -37.9 25.9 25.2 126 126 A P - 0 0 4 0, 0.0 -23,-0.2 0, 0.0 -1,-0.1 -0.306 20.3-127.3 -73.4 157.5 -37.2 23.1 27.7 127 127 A D S S- 0 0 59 -25,-1.7 2,-0.3 1,-0.2 -24,-0.2 0.772 91.8 -4.9 -67.4 -26.7 -33.8 21.4 27.9 128 128 A C E -f 103 0A 0 -26,-1.3 -24,-2.7 21,-0.1 2,-0.4 -0.963 65.8-134.2-158.4 161.9 -35.7 18.1 27.5 129 129 A I E -fg 104 151A 2 21,-1.7 23,-3.0 -2,-0.3 2,-0.6 -0.984 6.2-153.5-131.8 128.5 -39.2 16.6 27.3 130 130 A E E -fg 105 152A 3 -26,-1.8 -24,-2.9 -2,-0.4 2,-0.4 -0.868 17.1-158.5 -93.1 122.6 -40.6 13.6 29.2 131 131 A L E -fg 106 153A 1 21,-3.0 23,-2.8 -2,-0.6 -24,-0.2 -0.871 13.6-127.4-102.1 134.8 -43.5 11.9 27.2 132 132 A L E S+f 107 0A 2 -26,-1.9 -24,-3.3 -2,-0.4 23,-0.2 -0.990 82.0 33.9-129.9 139.6 -46.1 9.7 28.9 133 133 A P > - 0 0 2 0, 0.0 3,-0.6 0, 0.0 22,-0.3 0.634 68.3-157.8 -76.6 164.3 -47.1 7.0 28.4 134 134 A G T 3 S+ 0 0 1 21,-2.6 21,-0.2 161,-0.3 32,-0.1 0.205 78.3 79.9 -92.3 13.0 -43.9 5.4 27.1 135 135 A I T 3 + 0 0 23 20,-0.2 -1,-0.2 19,-0.2 3,-0.1 0.142 69.7 82.8-108.5 18.7 -45.7 2.7 25.2 136 136 A I X> + 0 0 9 -3,-0.6 4,-1.3 1,-0.1 3,-0.7 -0.775 52.1 173.2-116.4 86.5 -46.7 4.7 22.1 137 137 A P H 3> S+ 0 0 26 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.802 74.5 56.8 -65.7 -31.8 -43.6 4.6 20.0 138 138 A E H 3> S+ 0 0 138 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.783 105.3 50.9 -73.3 -26.8 -45.1 6.3 16.9 139 139 A Q H <> S+ 0 0 9 -3,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.810 109.5 50.6 -75.6 -32.4 -46.1 9.4 19.0 140 140 A V H X S+ 0 0 1 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.862 111.2 50.3 -69.3 -37.1 -42.5 9.6 20.3 141 141 A Q H X S+ 0 0 66 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.949 110.5 47.9 -62.7 -52.8 -41.4 9.4 16.7 142 142 A K H < S+ 0 0 94 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.858 113.6 48.9 -54.7 -41.1 -43.8 12.1 15.5 143 143 A M H >X S+ 0 0 2 -4,-1.7 3,-1.4 1,-0.2 4,-0.8 0.898 108.1 51.3 -71.8 -42.3 -42.7 14.4 18.4 144 144 A T H 3X S+ 0 0 16 -4,-2.0 4,-0.5 1,-0.3 -1,-0.2 0.830 105.9 55.6 -66.0 -33.0 -38.9 14.0 17.9 145 145 A Q H 3< S+ 0 0 147 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.265 99.3 68.7 -84.0 12.9 -39.1 14.9 14.2 146 146 A K H <4 S- 0 0 142 -3,-1.4 -2,-0.2 3,-0.1 -1,-0.2 0.906 122.9 -16.8 -97.5 -57.5 -40.9 18.1 15.1 147 147 A L H < S- 0 0 51 -4,-0.8 -2,-0.1 2,-0.2 -3,-0.1 0.698 81.0-119.0-114.6 -34.7 -38.3 20.4 16.8 148 148 A H < + 0 0 161 -4,-0.5 -4,-0.1 -5,-0.4 -3,-0.1 0.964 57.6 143.1 53.4 73.5 -35.4 18.3 18.0 149 149 A I - 0 0 17 -5,-0.1 -1,-0.4 -20,-0.0 -2,-0.2 -0.920 61.9-102.5 -99.7 148.3 -35.4 18.7 21.6 150 150 A P - 0 0 40 0, 0.0 -21,-1.7 0, 0.0 2,-0.4 -0.383 38.7-150.4 -62.2 139.5 -34.4 15.4 23.1 151 151 A V E -gh 129 171A 0 19,-0.5 21,-2.5 -23,-0.2 22,-0.6 -0.953 10.9-159.1-119.3 133.8 -37.3 13.4 24.6 152 152 A I E -gh 130 173A 1 -23,-3.0 -21,-3.0 -2,-0.4 2,-0.4 -0.790 17.1-146.9 -92.6 147.9 -37.5 10.9 27.4 153 153 A A E +gh 131 174A 0 20,-1.9 22,-2.5 -2,-0.3 2,-0.3 -0.954 24.8 163.5-115.2 145.1 -40.4 8.4 27.4 154 154 A G E + h 0 175A 0 -23,-2.8 -19,-0.2 -2,-0.4 22,-0.2 -0.976 23.0 70.9-152.9 160.4 -42.0 7.2 30.6 155 155 A G S S+ 0 0 9 20,-0.8 -21,-2.6 -2,-0.3 141,-0.2 0.483 91.3 15.0 98.1 121.7 -45.1 5.4 31.9 156 156 A L S S+ 0 0 21 1,-0.2 2,-0.9 -23,-0.2 140,-0.1 0.544 71.3 152.1 67.8 14.2 -46.4 1.9 31.6 157 157 A I + 0 0 3 18,-0.2 21,-0.2 1,-0.2 -1,-0.2 -0.684 4.1 157.2 -80.0 108.2 -43.1 0.3 30.3 158 158 A E + 0 0 83 -2,-0.9 2,-0.2 -3,-0.1 -1,-0.2 0.777 54.3 44.5 -95.1 -38.0 -43.2 -3.3 31.4 159 159 A T S > S- 0 0 48 1,-0.1 4,-1.3 21,-0.0 5,-0.1 -0.654 72.8-122.9-116.9 164.5 -40.9 -5.1 29.0 160 160 A S H > S+ 0 0 34 -2,-0.2 4,-2.3 2,-0.2 5,-0.1 0.728 113.0 63.5 -73.0 -25.3 -37.4 -4.6 27.4 161 161 A E H > S+ 0 0 57 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.932 103.9 46.9 -58.1 -48.3 -39.2 -4.9 24.0 162 162 A Q H > S+ 0 0 25 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.844 110.2 51.9 -65.4 -39.1 -41.0 -1.7 24.9 163 163 A V H X S+ 0 0 0 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.949 113.8 44.7 -60.4 -50.2 -37.8 0.1 26.0 164 164 A N H X S+ 0 0 5 -4,-2.3 4,-2.2 698,-0.3 -2,-0.2 0.888 111.4 52.3 -60.6 -46.0 -36.2 -0.8 22.8 165 165 A Q H < S+ 0 0 60 -4,-2.6 4,-0.4 697,-0.2 -1,-0.2 0.871 113.8 42.3 -59.5 -43.1 -39.1 0.2 20.6 166 166 A V H <>S+ 0 0 0 -4,-1.9 5,-1.9 2,-0.2 4,-0.5 0.840 113.9 50.7 -78.2 -32.6 -39.5 3.6 22.1 167 167 A I H ><5S+ 0 0 43 -4,-2.0 3,-0.7 1,-0.2 -2,-0.2 0.852 109.5 52.0 -72.2 -34.0 -35.7 4.3 22.1 168 168 A A T 3<5S+ 0 0 12 -4,-2.2 -1,-0.2 693,-0.2 -2,-0.2 0.626 102.9 61.0 -74.7 -14.5 -35.5 3.3 18.5 169 169 A S T 3 5S- 0 0 12 -4,-0.4 -1,-0.2 -3,-0.3 -2,-0.2 0.639 136.0 -76.0 -84.8 -17.7 -38.3 5.8 17.8 170 170 A G T < 5S+ 0 0 37 -3,-0.7 -19,-0.5 -4,-0.5 -3,-0.2 0.309 83.8 139.5 139.6 -7.3 -36.3 8.7 19.0 171 171 A A E < - 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