==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-JUN-08 3DCP . COMPND 2 MOLECULE: HISTIDINOL-PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES STR. 4B H7858; . AUTHOR S.M.VOROBIEV,M.SU,J.SEETHARAMAN,L.ZHAO,L.MAO,E.L.FOOTE, . 821 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33456.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 589 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 100 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 2.6 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 . 3 0.4 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 . 45 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 123 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 248 30.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.6 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 6 1 0 4 1 2 3 3 0 0 3 0 1 5 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 4 3 3 3 0 3 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 . 3 0 0 3 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 3 0 0 0 0 0 3 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 X 0 0 129 0, 0.0 2,-0.5 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 143.6 -42.2 56.1 40.0 2 2 A K + 0 0 52 29,-0.2 31,-2.9 2,-0.0 32,-1.4 -0.958 360.0 172.2-130.3 113.8 -44.0 58.9 38.2 3 3 A R E -a 34 0A 62 -2,-0.5 2,-0.5 29,-0.2 252,-0.3 -0.956 21.8-164.5-127.6 142.2 -47.7 59.3 38.4 4 4 A D E -a 35 0A 0 30,-1.9 32,-2.6 -2,-0.4 252,-0.2 -0.977 7.2-178.9-121.8 114.1 -50.3 61.8 37.3 5 5 A G E + 0 0 0 250,-3.4 2,-0.2 -2,-0.5 251,-0.2 0.154 65.8 56.5-101.2 22.5 -53.7 61.4 39.0 6 6 A H E + 0 0 0 249,-0.2 252,-1.8 2,-0.0 253,-1.0 -0.650 61.5 135.8-157.1 93.6 -55.6 64.2 37.3 7 7 A T E -ab 37 259A 0 29,-0.9 31,-1.9 251,-0.2 2,-0.2 -0.955 29.8-148.3-137.5 159.2 -56.1 64.5 33.5 8 8 A H - 0 0 0 251,-2.8 2,-0.2 -2,-0.3 31,-0.1 -0.651 9.4-150.8-121.8 177.1 -58.8 65.3 31.1 9 9 A T > - 0 0 0 -2,-0.2 3,-1.6 251,-0.0 8,-0.3 -0.668 43.0 -77.7-136.2-171.4 -59.9 64.4 27.5 10 10 A E T 3 S+ 0 0 44 1,-0.3 9,-0.1 -2,-0.2 5,-0.1 0.596 117.6 74.8 -68.8 -10.8 -61.6 65.5 24.3 11 11 A F T 3 S+ 0 0 41 60,-0.1 -1,-0.3 3,-0.0 52,-0.2 0.397 74.5 96.9 -82.3 2.8 -64.8 64.6 26.2 12 12 A C X - 0 0 1 -3,-1.6 3,-1.8 1,-0.1 5,-0.3 -0.849 67.6-151.6 -96.5 115.5 -64.4 67.9 28.2 13 13 A P T 3 S+ 0 0 44 0, 0.0 -1,-0.1 0, 0.0 48,-0.1 0.798 96.7 40.1 -55.2 -33.4 -66.4 70.7 26.7 14 14 A H T 3 S+ 0 0 82 46,-0.6 47,-0.1 47,-0.2 246,-0.1 0.275 97.2 102.9-101.6 10.5 -64.0 73.4 27.9 15 15 A G S < S- 0 0 12 -3,-1.8 246,-0.1 -6,-0.2 -5,-0.1 -0.115 91.0 -99.2 -79.8-173.9 -60.8 71.5 27.1 16 16 A T - 0 0 75 244,-2.3 245,-0.1 2,-0.1 -6,-0.1 0.549 49.6-127.5 -82.2 -8.2 -58.5 72.0 24.2 17 17 A H + 0 0 118 243,-0.4 -7,-0.2 -8,-0.3 244,-0.1 0.555 54.6 154.3 70.5 9.9 -60.2 69.0 22.5 18 18 A D - 0 0 46 242,-0.5 2,-0.3 -9,-0.1 -1,-0.2 -0.304 54.2 -97.1 -61.5 155.7 -56.9 67.3 21.9 19 19 A D >> - 0 0 63 1,-0.1 4,-1.4 -10,-0.1 3,-1.0 -0.599 22.1-131.7 -79.7 134.8 -57.2 63.6 21.7 20 20 A V H 3> S+ 0 0 0 -2,-0.3 4,-2.6 1,-0.3 5,-0.2 0.824 105.9 63.2 -52.6 -34.2 -56.5 61.7 24.9 21 21 A E H 3> S+ 0 0 40 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.896 101.6 48.7 -61.0 -39.7 -54.2 59.4 22.9 22 22 A E H <> S+ 0 0 113 -3,-1.0 4,-1.6 1,-0.2 -1,-0.2 0.823 111.1 51.8 -68.9 -30.9 -51.9 62.2 22.0 23 23 A X H X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.886 109.5 49.3 -71.2 -39.5 -51.9 63.2 25.7 24 24 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.897 108.6 52.4 -66.5 -41.1 -51.0 59.6 26.7 25 25 A L H X S+ 0 0 86 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.904 110.5 48.8 -61.8 -39.9 -48.1 59.5 24.1 26 26 A K H X S+ 0 0 54 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.900 109.0 52.6 -66.2 -40.7 -46.7 62.7 25.6 27 27 A A H <>S+ 0 0 0 -4,-2.1 5,-2.3 2,-0.2 -2,-0.2 0.894 109.9 48.6 -62.1 -39.1 -47.0 61.3 29.1 28 28 A I H ><5S+ 0 0 40 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.924 107.6 55.0 -65.9 -42.1 -45.1 58.2 28.0 29 29 A E H 3<5S+ 0 0 129 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.869 107.3 51.4 -56.7 -37.3 -42.5 60.5 26.4 30 30 A L T 3<5S- 0 0 46 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.177 120.4-109.9 -88.6 17.7 -42.1 62.2 29.8 31 31 A D T < 5 + 0 0 127 -3,-2.0 2,-0.2 1,-0.2 -3,-0.2 0.683 59.8 157.7 65.3 24.1 -41.6 58.9 31.6 32 32 A F < - 0 0 5 -5,-2.3 -1,-0.2 1,-0.1 -29,-0.2 -0.574 20.1-175.1 -75.4 142.0 -44.9 58.7 33.5 33 33 A D + 0 0 68 -31,-2.9 54,-1.9 1,-0.3 2,-0.4 0.456 69.4 43.3-116.4 -3.6 -45.7 55.1 34.5 34 34 A E E +ac 3 87A 47 -32,-1.4 -30,-1.9 52,-0.2 2,-0.4 -0.992 65.3 176.6-142.7 132.9 -49.1 55.7 36.0 35 35 A Y E -ac 4 88A 0 52,-3.0 54,-2.8 -2,-0.4 2,-0.5 -0.980 13.3-156.2-145.5 126.6 -51.8 57.9 34.5 36 36 A S E - c 0 89A 0 -32,-2.6 -29,-0.9 -2,-0.4 2,-0.8 -0.900 4.8-157.1-111.4 128.9 -55.4 58.6 35.6 37 37 A I E +ac 7 90A 0 52,-2.8 54,-3.2 -2,-0.5 2,-0.4 -0.878 21.5 167.8 -99.6 105.2 -58.2 59.8 33.3 38 38 A V E - c 0 91A 0 -31,-1.9 54,-0.3 -2,-0.8 55,-0.1 -0.675 13.1-174.4-122.5 75.3 -60.7 61.6 35.5 39 39 A E E - c 0 92A 0 52,-1.0 54,-2.2 -2,-0.4 2,-0.2 -0.271 39.3 -82.4 -68.2 156.1 -63.0 63.4 33.2 40 40 A H E - c 0 93A 13 52,-0.2 23,-0.7 21,-0.1 54,-0.2 -0.402 45.2-128.5 -61.8 126.5 -65.8 65.7 34.5 41 41 A A - 0 0 5 52,-1.7 54,-0.2 -2,-0.2 -1,-0.1 -0.475 35.7 -90.9 -74.8 145.6 -68.9 63.8 35.6 42 42 A P - 0 0 6 0, 0.0 22,-0.1 0, 0.0 -1,-0.1 -0.253 45.6-120.0 -56.3 140.2 -72.2 65.0 34.1 43 43 A L - 0 0 10 20,-0.3 2,-0.3 15,-0.1 22,-0.1 -0.366 33.3 -89.2 -78.9 163.4 -73.9 67.6 36.4 44 44 A S > - 0 0 4 1,-0.2 4,-2.3 -2,-0.1 5,-0.2 -0.567 25.9-140.6 -72.9 131.7 -77.3 67.1 37.9 45 45 A S H > S+ 0 0 85 -2,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.871 106.8 52.0 -59.7 -36.2 -80.1 68.4 35.5 46 46 A E H >> S+ 0 0 94 1,-0.2 3,-1.5 2,-0.2 4,-0.5 0.946 107.4 51.9 -63.2 -49.1 -81.8 69.7 38.7 47 47 A F H >4 S+ 0 0 1 1,-0.3 3,-1.8 2,-0.2 -2,-0.2 0.898 103.2 58.8 -54.2 -43.9 -78.7 71.5 39.8 48 48 A X H >< S+ 0 0 81 -4,-2.3 3,-0.6 1,-0.3 -1,-0.3 0.658 98.1 59.6 -64.2 -16.1 -78.4 73.2 36.4 49 49 A K H << S+ 0 0 152 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.621 103.0 54.7 -84.7 -14.0 -81.8 74.8 36.8 50 50 A N T << S+ 0 0 73 -3,-1.8 81,-2.6 -4,-0.5 2,-0.3 -0.064 85.6 105.3-112.3 33.6 -80.6 76.6 39.9 51 51 A T B < -i 131 0B 35 -3,-0.6 2,-0.2 79,-0.3 81,-0.2 -0.730 40.5-174.9-112.5 161.7 -77.5 78.4 38.7 52 52 A A + 0 0 25 79,-2.2 81,-0.2 -2,-0.3 77,-0.1 -0.650 45.5 59.0-134.0-170.2 -76.7 82.0 38.0 53 53 A G S S- 0 0 28 -2,-0.2 5,-0.1 75,-0.1 2,-0.1 -0.137 103.3 -2.8 75.1-176.0 -73.7 83.7 36.5 54 54 A D > - 0 0 74 1,-0.2 3,-1.4 2,-0.1 4,-0.4 -0.263 61.7-148.1 -53.4 118.6 -72.1 83.0 33.1 55 55 A K T >> S+ 0 0 168 1,-0.3 4,-2.8 2,-0.2 3,-1.8 0.801 93.7 69.9 -59.1 -31.5 -74.1 80.2 31.6 56 56 A E H 3> S+ 0 0 100 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.847 88.5 64.5 -56.5 -32.8 -70.9 79.0 29.8 57 57 A A H <4 S+ 0 0 11 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.779 115.1 30.6 -60.8 -25.8 -69.6 78.0 33.3 58 58 A V H X> S+ 0 0 13 -3,-1.8 3,-0.6 -4,-0.4 4,-0.5 0.862 119.5 47.4 -99.0 -51.7 -72.5 75.4 33.4 59 59 A T H 3< S+ 0 0 102 -4,-2.8 3,-0.2 1,-0.2 -3,-0.2 0.840 121.2 41.6 -60.3 -32.6 -73.2 74.4 29.8 60 60 A T T 3< S+ 0 0 31 -4,-2.0 -46,-0.6 -5,-0.4 -1,-0.2 0.546 88.7 97.0 -92.6 -9.1 -69.4 73.9 29.4 61 61 A A T <4 S- 0 0 11 -3,-0.6 2,-0.3 -5,-0.2 -47,-0.2 0.867 94.3 -27.5 -49.5 -51.6 -68.9 72.2 32.8 62 62 A S S < S- 0 0 17 -4,-0.5 -21,-0.1 -3,-0.2 -50,-0.1 -0.960 71.8 -71.2-159.2 176.6 -69.0 68.6 31.6 63 63 A X - 0 0 9 -23,-0.7 -20,-0.3 -2,-0.3 2,-0.2 -0.136 53.4 -98.6 -69.8 169.4 -70.2 66.0 29.1 64 64 A A >> - 0 0 46 -22,-0.1 3,-1.5 1,-0.1 4,-0.5 -0.522 28.3-111.6 -89.2 157.8 -73.8 64.8 28.9 65 65 A X G >4 S+ 0 0 84 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.864 118.0 60.8 -54.5 -38.0 -75.0 61.5 30.5 66 66 A S G 34 S+ 0 0 84 1,-0.3 4,-0.4 2,-0.1 -1,-0.3 0.755 96.1 60.7 -63.7 -23.7 -75.5 60.1 26.9 67 67 A D G <> S+ 0 0 62 -3,-1.5 4,-2.4 1,-0.2 3,-0.3 0.665 81.3 88.4 -77.7 -15.3 -71.8 60.5 26.3 68 68 A L H S+ 0 0 84 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.904 114.5 45.3 -53.9 -41.3 -71.0 54.9 27.1 70 70 A Y H > S+ 0 0 152 -4,-0.4 4,-2.6 -3,-0.3 -2,-0.2 0.859 109.6 55.4 -70.4 -38.0 -68.7 56.5 24.5 71 71 A Y H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.965 111.2 42.8 -59.6 -54.7 -66.3 57.9 27.2 72 72 A F H X S+ 0 0 6 -4,-2.4 4,-2.9 1,-0.2 5,-0.3 0.905 112.8 53.8 -60.3 -42.1 -65.7 54.5 28.8 73 73 A K H X S+ 0 0 161 -4,-1.9 4,-1.6 -5,-0.3 -1,-0.2 0.961 112.6 42.8 -57.0 -52.6 -65.4 52.8 25.4 74 74 A K H X S+ 0 0 44 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.938 117.1 45.7 -59.5 -51.5 -62.7 55.2 24.2 75 75 A X H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.873 110.7 52.4 -62.6 -39.8 -60.8 55.3 27.5 76 76 A N H X S+ 0 0 58 -4,-2.9 4,-1.7 -5,-0.3 -1,-0.2 0.845 109.3 52.5 -65.7 -29.4 -60.9 51.5 27.9 77 77 A H H X S+ 0 0 101 -4,-1.6 4,-2.3 -5,-0.3 -2,-0.2 0.933 111.3 44.3 -68.8 -45.7 -59.4 51.3 24.4 78 78 A I H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.874 109.2 58.8 -66.7 -36.8 -56.6 53.7 25.3 79 79 A K H < S+ 0 0 56 -4,-2.6 4,-0.5 1,-0.2 9,-0.2 0.945 112.9 36.9 -56.9 -52.1 -55.9 51.8 28.6 80 80 A K H >< S+ 0 0 159 -4,-1.7 3,-0.8 1,-0.2 4,-0.4 0.892 111.6 59.6 -69.2 -42.1 -55.3 48.5 26.8 81 81 A K H 3< S+ 0 0 110 -4,-2.3 3,-0.2 1,-0.2 -1,-0.2 0.871 120.3 26.8 -56.3 -38.1 -53.5 49.9 23.8 82 82 A Y T >X S+ 0 0 23 -4,-1.9 4,-3.0 1,-0.1 3,-1.8 0.283 82.3 113.6-110.8 11.0 -50.8 51.4 26.1 83 83 A A T <4 S+ 0 0 64 -3,-0.8 -1,-0.1 -4,-0.5 -2,-0.1 0.800 75.9 62.4 -50.9 -30.0 -50.9 49.1 29.1 84 84 A S T 34 S+ 0 0 114 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 0.819 117.8 24.3 -66.7 -33.0 -47.4 48.1 28.0 85 85 A D T <4 S+ 0 0 94 -3,-1.8 2,-0.3 1,-0.3 -2,-0.2 0.665 130.3 26.3-105.1 -23.4 -46.0 51.6 28.6 86 86 A L < - 0 0 3 -4,-3.0 2,-0.8 -7,-0.2 -1,-0.3 -0.997 63.5-132.6-147.2 139.7 -48.4 53.0 31.1 87 87 A L E -c 34 0A 82 -54,-1.9 -52,-3.0 -2,-0.3 2,-0.5 -0.815 36.4-163.8 -88.8 110.4 -50.8 51.9 33.8 88 88 A I E -c 35 0A 1 -2,-0.8 2,-0.3 -9,-0.2 -52,-0.2 -0.857 9.0-162.4-103.8 131.1 -53.9 53.9 33.0 89 89 A H E -c 36 0A 21 -54,-2.8 -52,-2.8 -2,-0.5 2,-0.5 -0.829 8.4-149.0-106.2 148.3 -56.8 54.4 35.5 90 90 A I E +c 37 0A 5 -2,-0.3 26,-3.5 -54,-0.2 27,-0.8 -0.974 39.6 106.6-122.5 128.1 -60.2 55.4 34.4 91 91 A G E -cd 38 117A 0 -54,-3.2 -52,-1.0 -2,-0.5 2,-0.3 -0.816 53.4 -82.8-165.2-153.8 -62.6 57.5 36.5 92 92 A F E -cd 39 118A 6 25,-0.6 27,-2.2 -54,-0.3 2,-1.1 -0.963 18.8-128.5-136.7 152.3 -64.2 60.9 37.1 93 93 A E E -cd 40 119A 2 -54,-2.2 -52,-1.7 -2,-0.3 2,-0.5 -0.895 45.8-150.9 -92.5 102.7 -63.5 64.2 38.6 94 94 A V E - d 0 120A 6 25,-3.6 27,-2.9 -2,-1.1 2,-0.4 -0.710 4.5-132.6 -86.6 126.3 -66.7 64.2 40.6 95 95 A D E - d 0 121A 8 -2,-0.5 2,-0.9 25,-0.2 27,-0.2 -0.593 11.5-138.7 -74.7 126.0 -68.4 67.5 41.4 96 96 A Y - 0 0 8 25,-2.9 2,-0.8 -2,-0.4 28,-0.4 -0.798 22.5-162.3 -84.2 110.8 -69.4 67.8 45.0 97 97 A L > - 0 0 3 -2,-0.9 3,-2.6 3,-0.1 7,-0.2 -0.862 16.5-129.6-101.8 106.5 -72.8 69.5 44.6 98 98 A I T 3 S+ 0 0 19 -2,-0.8 64,-0.0 26,-0.4 -2,-0.0 -0.327 93.5 12.1 -55.9 119.0 -73.9 71.0 47.9 99 99 A G T 3 S+ 0 0 70 -2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.402 113.7 81.6 93.2 -1.8 -77.5 69.9 48.5 100 100 A Y <> + 0 0 41 -3,-2.6 4,-1.9 1,-0.1 3,-0.3 -0.054 42.7 128.9-125.5 33.5 -77.5 67.3 45.8 101 101 A E H > S+ 0 0 58 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.838 71.2 60.5 -58.1 -35.3 -75.7 64.3 47.5 102 102 A D H > S+ 0 0 105 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.950 105.9 46.7 -57.9 -49.6 -78.5 62.0 46.5 103 103 A F H > S+ 0 0 60 -3,-0.3 4,-2.9 1,-0.2 -2,-0.2 0.949 115.3 45.7 -55.2 -52.9 -77.9 62.6 42.9 104 104 A T H X S+ 0 0 3 -4,-1.9 4,-2.8 1,-0.2 -1,-0.2 0.900 112.4 50.3 -59.2 -44.5 -74.1 62.2 43.3 105 105 A R H X S+ 0 0 42 -4,-3.1 4,-2.7 2,-0.2 -1,-0.2 0.908 112.1 47.8 -62.6 -41.9 -74.5 59.0 45.4 106 106 A D H X S+ 0 0 104 -4,-2.7 4,-2.1 -5,-0.2 -2,-0.2 0.939 112.1 49.6 -64.7 -46.0 -76.9 57.5 42.8 107 107 A F H X S+ 0 0 9 -4,-2.9 4,-2.8 -5,-0.2 5,-0.4 0.940 113.8 45.7 -56.7 -49.0 -74.5 58.4 39.9 108 108 A L H X S+ 0 0 7 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.892 109.9 53.4 -63.5 -41.5 -71.5 56.9 41.8 109 109 A N H < S+ 0 0 68 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.872 115.4 41.9 -63.1 -33.7 -73.5 53.7 42.7 110 110 A E H < S+ 0 0 122 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.949 130.2 21.7 -78.0 -50.6 -74.3 53.2 39.0 111 111 A Y H >< S+ 0 0 35 -4,-2.8 3,-1.8 -5,-0.2 4,-0.3 0.598 98.1 90.8 -95.8 -12.6 -71.1 54.1 37.3 112 112 A G G >< S+ 0 0 2 -4,-2.4 3,-2.1 -5,-0.4 -1,-0.2 0.872 80.0 62.5 -50.5 -41.7 -68.6 53.6 40.1 113 113 A P G 3 S+ 0 0 86 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.722 100.7 53.3 -59.0 -22.2 -68.1 49.9 39.2 114 114 A Q G < S+ 0 0 98 -3,-1.8 2,-0.2 -4,-0.1 -2,-0.2 0.416 98.8 84.5 -93.0 2.5 -66.7 50.9 35.8 115 115 A T < - 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