==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 12-AUG-08 3E4R . COMPND 2 MOLECULE: NITRATE TRANSPORT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOMONAS AXONOPODIS PV. CITRI; . AUTHOR A.BALAN,F.T.ARAUJO,M.SANCHES,D.Y.CHIRGADZE,T.B.BLUNDELL, . 291 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12687.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 209 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 9.6 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 . 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 . 16 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 32.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 1 1 1 1 2 3 0 0 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 0 1 0 1 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 . 1 0 0 1 2 1 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 1 0 1 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 25 A A 0 0 147 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 123.0 28.6 -4.8 52.4 2 26 A A - 0 0 87 1,-0.0 201,-0.1 201,-0.0 0, 0.0 -0.225 360.0-175.7 -69.0 144.7 31.1 -3.7 49.7 3 27 A E - 0 0 42 30,-0.1 197,-0.0 199,-0.1 -1,-0.0 -0.899 37.4 -86.0-130.6 157.9 30.6 -0.6 47.5 4 28 A P - 0 0 4 0, 0.0 3,-0.1 0, 0.0 31,-0.0 -0.292 26.5-130.5 -66.1 154.8 32.8 0.7 44.7 5 29 A A S S+ 0 0 85 1,-0.2 30,-3.0 29,-0.2 2,-0.3 0.785 89.3 20.4 -68.3 -26.9 35.8 2.9 45.5 6 30 A Q E -a 35 0A 66 28,-0.3 2,-0.4 2,-0.0 30,-0.2 -0.993 52.8-164.6-147.8 145.7 34.6 5.4 42.8 7 31 A L E -a 36 0A 0 28,-3.1 30,-3.1 -2,-0.3 2,-0.8 -0.935 7.0-171.1-126.5 107.3 31.6 6.5 40.8 8 32 A R E -a 37 0A 84 -2,-0.4 49,-2.8 28,-0.2 50,-1.1 -0.915 20.4-175.6 -93.0 106.5 32.4 8.6 37.8 9 33 A I E -ab 38 58A 0 28,-2.4 30,-2.7 -2,-0.8 2,-0.3 -0.931 16.2-142.2-114.0 125.0 28.8 9.7 36.9 10 34 A G E +ab 39 59A 0 48,-3.4 50,-1.2 -2,-0.5 2,-0.3 -0.617 26.0 170.5 -83.7 146.9 28.1 11.8 33.8 11 35 A Y E -a 40 0A 14 28,-2.3 30,-2.3 -2,-0.3 2,-0.5 -0.980 30.5-130.1-151.7 162.7 25.4 14.4 33.9 12 36 A Q > - 0 0 17 -2,-0.3 3,-2.1 28,-0.2 7,-0.2 -0.962 19.1-136.1-113.7 131.4 24.1 17.2 31.8 13 37 A K T 3 S+ 0 0 85 -2,-0.5 6,-0.2 28,-0.4 -1,-0.1 0.736 100.8 74.3 -57.4 -26.4 23.6 20.6 33.5 14 38 A A T 3 S+ 0 0 28 1,-0.1 2,-1.2 28,-0.1 -1,-0.3 0.714 78.9 82.5 -60.4 -20.9 20.2 20.9 31.8 15 39 A V X> - 0 0 41 -3,-2.1 4,-1.9 1,-0.2 3,-0.9 -0.752 67.5-169.0 -90.6 94.6 19.0 18.3 34.3 16 40 A S H 3> S+ 0 0 13 -2,-1.2 4,-2.2 1,-0.2 -1,-0.2 0.847 81.6 57.9 -53.5 -41.6 18.3 20.6 37.2 17 41 A S H 3> S+ 0 0 10 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.837 107.7 47.4 -61.6 -33.6 17.9 17.7 39.7 18 42 A L H <> S+ 0 0 4 -3,-0.9 4,-2.9 2,-0.2 -1,-0.2 0.884 108.8 53.2 -73.3 -43.5 21.4 16.4 38.9 19 43 A V H X S+ 0 0 8 -4,-1.9 4,-2.9 -7,-0.2 -2,-0.2 0.899 115.1 42.9 -50.7 -48.0 22.9 19.8 39.3 20 44 A L H X S+ 0 0 0 -4,-2.2 4,-3.6 2,-0.2 -2,-0.2 0.903 110.7 53.6 -67.1 -44.8 21.2 19.9 42.7 21 45 A A H <>S+ 0 0 0 -4,-2.6 5,-2.2 2,-0.2 6,-0.4 0.918 114.7 44.4 -55.0 -42.2 22.2 16.3 43.6 22 46 A K H ><5S+ 0 0 69 -4,-2.9 3,-1.3 3,-0.2 -2,-0.2 0.971 115.7 45.0 -63.9 -56.1 25.7 17.4 42.8 23 47 A Q H 3<5S+ 0 0 85 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.849 117.0 44.6 -57.6 -42.6 25.5 20.7 44.7 24 48 A H T 3<5S- 0 0 60 -4,-3.6 -1,-0.3 -5,-0.1 -2,-0.2 0.449 104.8-132.4 -82.7 -4.8 23.8 19.2 47.7 25 49 A R T <>5 + 0 0 146 -3,-1.3 4,-2.3 -4,-0.3 -3,-0.2 0.871 46.2 160.8 53.7 46.5 26.3 16.2 47.6 26 50 A L H > S+ 0 0 0 -6,-0.4 4,-3.1 2,-0.2 -1,-0.2 0.892 110.7 52.7 -76.0 -37.7 25.5 10.8 46.7 28 52 A E H 4 S+ 0 0 31 2,-0.2 -2,-0.2 1,-0.2 6,-0.2 0.930 109.6 50.0 -59.8 -43.9 28.4 11.7 48.9 29 53 A Q H < S+ 0 0 138 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.913 116.6 40.5 -61.6 -42.6 26.1 11.7 51.9 30 54 A R H < S+ 0 0 107 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.841 124.0 38.1 -76.1 -34.0 24.6 8.3 51.0 31 55 A F >< + 0 0 0 -4,-3.1 3,-1.9 1,-0.1 -1,-0.2 -0.604 61.7 165.0-120.4 73.5 27.9 6.7 49.9 32 56 A P T 3 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.689 78.4 52.9 -68.8 -14.0 30.7 7.9 52.3 33 57 A R T 3 S+ 0 0 165 2,-0.1 2,-0.5 -29,-0.0 -30,-0.1 0.324 97.3 80.4 -97.8 5.9 33.1 5.2 51.1 34 58 A T S < S- 0 0 9 -3,-1.9 2,-0.6 -6,-0.2 -28,-0.3 -0.955 77.8-130.8-118.1 128.0 32.7 6.0 47.4 35 59 A K E -a 6 0A 135 -30,-3.0 -28,-3.1 -2,-0.5 2,-0.6 -0.660 26.6-153.3 -70.3 116.9 34.5 8.8 45.6 36 60 A I E -a 7 0A 21 -2,-0.6 2,-0.5 -30,-0.2 -28,-0.2 -0.865 15.0-177.7 -99.5 123.0 31.8 10.6 43.7 37 61 A T E -a 8 0A 32 -30,-3.1 -28,-2.4 -2,-0.6 2,-0.4 -0.932 11.0-158.1-126.6 107.8 33.0 12.3 40.6 38 62 A W E -a 9 0A 28 -2,-0.5 2,-0.5 -30,-0.2 -28,-0.2 -0.703 8.7-167.1 -85.8 131.3 30.4 14.2 38.6 39 63 A V E -a 10 0A 31 -30,-2.7 -28,-2.3 -2,-0.4 2,-0.3 -0.987 12.8-139.6-124.2 120.2 31.5 14.7 35.0 40 64 A E E -a 11 0A 99 -2,-0.5 -28,-0.2 -30,-0.2 -30,-0.1 -0.613 16.8-170.6 -83.7 140.4 29.5 17.3 32.9 41 65 A F - 0 0 25 -30,-2.3 -28,-0.4 -2,-0.3 3,-0.1 -0.955 28.2-130.8-128.1 145.7 28.7 16.6 29.3 42 66 A P S S- 0 0 74 0, 0.0 2,-0.3 0, 0.0 -28,-0.1 0.851 86.0 -21.8 -64.9 -34.9 27.2 19.1 26.8 43 67 A A S > S- 0 0 0 99,-0.1 4,-1.4 -32,-0.1 5,-0.1 -0.870 80.1 -77.6-159.1-172.6 24.5 16.6 25.8 44 68 A G H > S+ 0 0 2 -2,-0.3 4,-3.0 2,-0.2 5,-0.2 0.879 117.2 53.2 -67.2 -51.2 23.6 12.9 25.7 45 69 A P H > S+ 0 0 19 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.890 110.3 50.6 -57.4 -37.0 25.6 11.5 22.8 46 70 A Q H > S+ 0 0 46 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.903 111.5 47.4 -62.5 -47.5 28.8 13.0 24.3 47 71 A L H X S+ 0 0 0 -4,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.931 112.5 50.0 -61.4 -47.3 28.1 11.4 27.7 48 72 A L H X S+ 0 0 5 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.878 107.3 53.4 -57.3 -45.1 27.4 8.1 25.9 49 73 A E H X S+ 0 0 122 -4,-2.6 4,-1.4 2,-0.2 -1,-0.2 0.881 111.0 47.9 -55.3 -40.3 30.7 8.3 24.0 50 74 A A H <>S+ 0 0 7 -4,-1.7 5,-2.1 2,-0.2 6,-0.7 0.879 109.0 52.6 -68.3 -39.9 32.4 8.8 27.3 51 75 A L H ><5S+ 0 0 10 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.914 107.2 53.9 -64.0 -39.8 30.5 5.9 28.8 52 76 A N H 3<5S+ 0 0 92 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.868 111.1 43.0 -67.9 -33.7 31.6 3.7 26.0 53 77 A V T 3<5S- 0 0 109 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.399 119.5-109.0 -89.9 3.6 35.4 4.5 26.4 54 78 A G T < 5S+ 0 0 57 -3,-1.1 -3,-0.2 -4,-0.5 -2,-0.1 0.586 79.8 130.3 84.2 12.2 35.0 4.1 30.3 55 79 A S S S+ 0 0 5 124,-0.9 4,-0.7 1,-0.2 125,-0.1 0.838 117.2 54.6 -73.6 -29.2 16.1 8.2 25.0 64 88 A I H >> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 3,-0.6 0.885 91.4 65.1 -81.4 -41.6 17.9 8.6 21.7 65 89 A P H 3> S+ 0 0 2 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.890 102.1 49.7 -52.4 -43.8 21.6 8.7 22.7 66 90 A P H 3> S+ 0 0 0 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.833 108.3 55.2 -65.6 -27.9 21.7 5.1 24.0 67 91 A L H S+ 0 0 11 -4,-2.7 5,-2.9 -5,-0.2 4,-0.2 0.928 113.3 47.6 -61.6 -45.7 25.4 4.2 21.1 70 94 A Q H ><5S+ 0 0 31 -4,-3.1 3,-1.8 1,-0.2 -2,-0.2 0.918 109.4 52.9 -59.1 -45.8 23.9 0.7 20.9 71 95 A A H 3<5S+ 0 0 9 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.851 107.1 53.0 -57.3 -33.9 23.7 1.0 17.1 72 96 A A T 3<5S- 0 0 85 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.470 131.6 -93.4 -84.8 0.1 27.5 1.8 17.2 73 97 A G T < 5 + 0 0 61 -3,-1.8 2,-0.2 1,-0.3 -3,-0.2 0.564 68.3 158.8 98.5 11.9 28.2 -1.3 19.2 74 98 A A < - 0 0 15 -5,-2.9 2,-0.8 -6,-0.1 -1,-0.3 -0.503 34.1-149.9 -67.5 129.3 28.0 0.1 22.8 75 99 A D + 0 0 100 -2,-0.2 119,-0.6 -23,-0.1 -1,-0.1 -0.373 44.2 150.6 -96.0 54.5 27.4 -2.7 25.3 76 100 A L E -D 193 0A 5 -2,-0.8 2,-0.4 -10,-0.1 117,-0.2 -0.312 39.1-133.3 -85.3 166.8 25.6 -0.4 27.7 77 101 A L E -D 192 0A 5 115,-2.8 115,-2.8 -2,-0.1 2,-0.7 -0.972 9.0-135.5-117.0 139.9 22.8 -1.1 30.2 78 102 A Y E +De 191 286A 0 207,-3.2 209,-3.0 -2,-0.4 113,-0.2 -0.837 34.1 164.1 -85.4 117.1 19.6 0.8 30.8 79 103 A V E + 0 0 5 111,-2.5 2,-0.3 -2,-0.7 210,-0.2 0.493 58.2 19.0-115.0 -10.5 19.4 1.0 34.6 80 104 A G E -D 190 0A 0 110,-1.2 110,-2.4 174,-0.1 2,-0.4 -0.980 61.3-140.8-160.3 150.7 16.9 3.7 35.1 81 105 A W E -DF 189 253A 41 172,-3.4 172,-2.4 -2,-0.3 108,-0.3 -0.949 8.3-157.9-118.8 139.2 14.1 5.5 33.3 82 106 A V E -D 188 0A 32 106,-2.6 106,-3.0 -2,-0.4 170,-0.1 -0.974 27.1-119.1-113.8 121.9 13.3 9.2 33.6 83 107 A P - 0 0 21 0, 0.0 104,-0.2 0, 0.0 103,-0.1 -0.268 38.7 -96.8 -58.2 152.1 9.8 10.3 32.6 84 108 A P - 0 0 38 0, 0.0 3,-0.1 0, 0.0 104,-0.0 -0.189 20.7-158.0 -70.1 156.8 9.5 12.7 29.7 85 109 A T > + 0 0 11 162,-0.1 3,-1.6 1,-0.1 95,-0.1 -0.732 18.6 175.2-132.8 77.6 9.1 16.4 30.0 86 110 A P G > S+ 0 0 32 0, 0.0 94,-2.8 0, 0.0 3,-1.1 0.712 73.8 61.7 -66.1 -26.2 7.6 17.1 26.6 87 111 A K G 3 S+ 0 0 92 159,-0.5 160,-0.1 1,-0.2 159,-0.1 0.724 103.8 52.5 -68.1 -21.4 7.0 20.8 27.3 88 112 A A G < S+ 0 0 5 -3,-1.6 74,-1.1 158,-0.4 2,-0.6 0.333 92.1 80.9 -99.0 2.2 10.8 21.1 27.6 89 113 A E E < S+G 161 0B 29 -3,-1.1 91,-1.0 72,-0.2 2,-0.3 -0.959 70.5 163.3-108.9 115.7 11.5 19.4 24.3 90 114 A T E -GH 160 179B 0 70,-2.6 70,-2.5 -2,-0.6 2,-0.5 -0.906 46.6-138.8-140.4 152.4 11.1 22.1 21.7 91 115 A I E -GH 159 178B 0 87,-3.4 86,-3.3 -2,-0.3 87,-1.5 -0.983 34.2-169.1-106.5 121.4 11.7 23.3 18.2 92 116 A L E -GH 158 176B 0 66,-3.1 66,-2.8 -2,-0.5 84,-0.2 -0.807 9.5-165.5-106.3 151.2 12.6 27.0 18.3 93 117 A V E - H 0 175B 0 82,-2.4 82,-2.6 -2,-0.3 64,-0.2 -0.952 41.8 -86.7-127.9 153.1 12.8 29.5 15.4 94 118 A P E > - H 0 174B 19 0, 0.0 3,-1.8 0, 0.0 80,-0.3 -0.346 40.0-125.3 -53.5 138.5 14.4 32.9 15.5 95 119 A S T 3 S+ 0 0 48 78,-2.3 79,-0.2 1,-0.3 78,-0.1 0.823 110.2 58.5 -59.5 -28.8 11.7 35.2 16.7 96 120 A K T 3 S+ 0 0 191 77,-0.3 -1,-0.3 2,-0.0 78,-0.1 0.608 87.5 112.9 -72.1 -11.9 12.2 37.4 13.6 97 121 A S < - 0 0 19 -3,-1.8 -4,-0.1 1,-0.1 59,-0.0 -0.197 67.1-143.5 -65.4 150.5 11.4 34.4 11.4 98 122 A A + 0 0 80 6,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.504 68.3 116.9 -88.0 -4.2 8.4 34.0 9.2 99 123 A L + 0 0 15 1,-0.2 3,-0.1 -5,-0.2 -2,-0.1 -0.501 27.7 153.6 -60.8 122.1 8.4 30.3 10.1 100 124 A R + 0 0 145 -2,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.560 54.5 39.3-127.9 -16.7 5.1 29.7 11.9 101 125 A T S > S- 0 0 68 1,-0.1 3,-0.6 77,-0.0 4,-0.3 -0.866 80.2-112.2-128.9 165.3 4.2 26.1 11.4 102 126 A V G > S+ 0 0 20 -2,-0.3 3,-2.5 1,-0.2 4,-0.3 0.909 117.3 63.2 -58.8 -42.9 6.0 22.7 11.2 103 127 A A G > S+ 0 0 54 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.836 93.0 63.6 -48.5 -38.3 5.2 22.6 7.5 104 128 A D G < S+ 0 0 61 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.661 85.1 75.7 -65.4 -15.1 7.3 25.8 7.1 105 129 A L G X + 0 0 0 -3,-2.5 3,-2.4 -4,-0.3 -1,-0.2 0.680 66.3 120.0 -69.3 -16.8 10.4 23.7 8.2 106 130 A K T < S+ 0 0 137 -3,-1.5 30,-0.2 -4,-0.3 3,-0.1 -0.270 87.0 3.3 -51.8 125.7 10.5 22.0 4.8 107 131 A G T 3 S+ 0 0 50 28,-3.7 -1,-0.3 1,-0.2 2,-0.2 0.630 104.7 131.5 74.3 15.5 13.9 22.8 3.2 108 132 A K < - 0 0 72 -3,-2.4 29,-3.1 27,-0.2 2,-0.7 -0.602 63.9-110.6-101.5 160.9 15.1 24.7 6.3 109 133 A R E -i 137 0B 139 -2,-0.2 47,-3.0 27,-0.2 48,-1.6 -0.821 37.6-173.2 -90.8 114.9 18.4 24.5 8.2 110 134 A I E -ij 138 157B 0 27,-2.6 29,-2.7 -2,-0.7 48,-0.2 -0.955 12.1-148.8-119.8 115.4 17.6 23.0 11.6 111 135 A A E +ij 139 158B 0 46,-2.3 48,-2.5 -2,-0.6 2,-0.3 -0.545 33.7 140.5 -75.6 139.1 20.3 22.8 14.3 112 136 A F E -i 140 0B 0 27,-2.5 29,-1.9 -2,-0.2 2,-0.6 -0.921 57.1 -93.5-170.9 158.8 20.2 19.9 16.8 113 137 A Q > - 0 0 24 46,-0.5 3,-1.7 -2,-0.3 6,-0.4 -0.677 49.6-119.5 -78.3 122.6 22.4 17.5 18.6 114 138 A K T 3 S+ 0 0 96 -2,-0.6 3,-0.1 1,-0.3 -1,-0.1 -0.386 95.3 12.0 -61.0 136.9 22.6 14.4 16.4 115 139 A G T 3 S+ 0 0 0 1,-0.2 -47,-0.3 -2,-0.1 -1,-0.3 0.664 101.9 119.9 69.3 15.3 21.3 11.3 18.3 116 140 A S S X> S- 0 0 1 -3,-1.7 4,-1.1 -52,-0.2 3,-1.0 -0.485 85.5 -94.2 -98.4 176.6 19.7 13.4 21.1 117 141 A S H 3> S+ 0 0 18 1,-0.2 4,-3.0 2,-0.2 5,-0.1 0.828 125.8 64.3 -55.2 -35.0 16.0 13.6 22.2 118 142 A A H 3> S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.827 95.3 57.5 -58.7 -34.0 15.8 16.6 19.9 119 143 A H H <> S+ 0 0 3 -3,-1.0 4,-2.5 -6,-0.4 -1,-0.2 0.946 111.6 41.4 -63.4 -48.8 16.6 14.3 16.9 120 144 A N H X S+ 0 0 3 -4,-1.1 4,-3.0 2,-0.2 5,-0.2 0.906 112.6 54.7 -62.1 -45.1 13.6 12.2 17.8 121 145 A L H X S+ 0 0 1 -4,-3.0 4,-2.8 2,-0.2 5,-0.3 0.936 111.5 44.9 -52.8 -49.3 11.4 15.3 18.6 122 146 A L H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.940 113.0 50.0 -63.4 -48.4 12.2 16.7 15.1 123 147 A L H X S+ 0 0 5 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.926 114.7 44.3 -54.9 -49.9 11.6 13.4 13.4 124 148 A R H X S+ 0 0 61 -4,-3.0 4,-1.2 2,-0.2 -1,-0.2 0.886 117.4 43.1 -65.2 -45.0 8.2 12.9 15.2 125 149 A V H X S+ 0 0 16 -4,-2.8 4,-0.7 -5,-0.2 3,-0.5 0.934 114.2 50.2 -71.6 -43.3 7.0 16.5 14.7 126 150 A L H ><>S+ 0 0 0 -4,-3.0 5,-2.3 -5,-0.3 3,-1.8 0.927 105.3 59.5 -55.5 -43.3 8.1 16.6 11.0 127 151 A A H ><5S+ 0 0 57 -4,-2.2 3,-1.6 -5,-0.3 -1,-0.2 0.823 96.4 60.1 -59.3 -35.8 6.4 13.3 10.4 128 152 A K H 3<5S+ 0 0 142 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.738 108.8 44.4 -63.6 -26.6 3.0 14.8 11.4 129 153 A S T <<5S- 0 0 57 -3,-1.8 -1,-0.3 -4,-0.7 -2,-0.2 0.217 124.6-101.9-101.5 13.4 3.4 17.3 8.6 130 154 A G T < 5S+ 0 0 65 -3,-1.6 2,-0.4 1,-0.3 -3,-0.2 0.815 82.1 130.6 72.5 28.7 4.5 14.8 6.1 131 155 A L < - 0 0 15 -5,-2.3 -1,-0.3 -6,-0.1 2,-0.2 -0.938 37.5-165.9-113.6 136.4 8.1 15.8 6.4 132 156 A S > - 0 0 13 -2,-0.4 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