==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 09-MAR-03 1OQG . COMPND 2 MOLECULE: SEROTRANSFERRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.M.BAKER,Q.-Y.HE,S.K.BRIGG,A.B.MASON,E.N.BAKER . 329 1 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14273.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 216 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 10.9 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.5 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 2 0 1 2 1 1 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 0 0 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 PARALLEL BRIDGES PER LADDER . 0 2 2 3 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 0 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 3 A D 0 0 88 0, 0.0 33,-0.3 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 32.3 31.9 27.4 61.1 2 4 A K - 0 0 146 31,-0.1 32,-1.2 29,-0.1 2,-0.4 0.308 360.0 -68.8 48.2-178.8 29.4 30.0 59.8 3 5 A T E -a 34 0A 46 30,-0.2 2,-0.6 32,-0.0 32,-0.2 -0.871 31.5-144.0-111.8 139.3 29.8 32.4 56.9 4 6 A V E -a 35 0A 0 30,-2.5 32,-2.6 -2,-0.4 2,-1.1 -0.900 14.4-143.3-102.7 119.3 32.0 35.4 56.6 5 7 A R E -a 36 0A 58 -2,-0.6 51,-3.2 30,-0.2 52,-1.8 -0.708 21.4-160.1 -84.9 100.3 30.4 38.3 54.7 6 8 A W E -ab 37 57A 1 30,-2.8 32,-2.9 -2,-1.1 2,-0.7 -0.585 11.2-133.1 -83.3 141.2 33.3 39.8 52.8 7 9 A a E -a 38 0A 1 50,-2.5 2,-0.4 -2,-0.3 52,-0.3 -0.839 20.6-167.0 -99.9 113.9 33.1 43.3 51.4 8 10 A A E -a 39 0A 0 30,-2.5 32,-3.0 -2,-0.7 2,-0.8 -0.813 14.5-139.8 -99.4 135.3 34.1 43.7 47.8 9 11 A V E > -a 40 0A 16 -2,-0.4 4,-0.6 30,-0.2 170,-0.4 -0.845 64.0 -30.9-100.7 107.2 34.7 47.2 46.4 10 12 A S H > S- 0 0 10 30,-2.6 4,-1.8 -2,-0.8 30,-0.1 0.006 92.4 -55.5 76.6 178.4 33.4 47.4 42.8 11 13 A E H > S+ 0 0 90 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.819 125.8 54.4 -63.4 -40.4 33.1 44.8 40.1 12 14 A H H > S+ 0 0 72 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.950 115.4 41.6 -61.6 -46.9 36.6 43.5 39.7 13 15 A E H X S+ 0 0 28 -4,-0.6 4,-2.4 1,-0.2 -1,-0.2 0.857 111.7 56.8 -66.9 -34.9 36.8 42.7 43.4 14 16 A A H X S+ 0 0 17 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.911 107.3 48.5 -63.0 -41.5 33.2 41.3 43.3 15 17 A T H X S+ 0 0 45 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.921 112.6 47.3 -64.7 -43.5 34.2 38.9 40.6 16 18 A K H X S+ 0 0 1 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.853 110.2 54.3 -66.5 -33.6 37.3 37.7 42.6 17 19 A b H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 -1,-0.2 0.900 106.5 50.4 -67.1 -40.8 35.1 37.4 45.7 18 20 A Q H X S+ 0 0 92 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.903 111.4 48.6 -64.2 -39.7 32.6 35.1 43.9 19 21 A S H X S+ 0 0 32 -4,-1.9 4,-3.3 2,-0.2 5,-0.3 0.921 110.0 52.2 -63.7 -43.3 35.5 32.9 42.7 20 22 A F H X S+ 0 0 1 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.954 111.3 47.3 -55.4 -52.3 36.9 32.9 46.3 21 23 A R H X S+ 0 0 102 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.944 115.4 44.8 -54.9 -53.3 33.4 31.8 47.5 22 24 A D H X S+ 0 0 76 -4,-2.8 4,-1.4 1,-0.2 -2,-0.2 0.926 114.8 45.8 -59.6 -50.5 33.1 29.1 44.8 23 25 A H H X S+ 0 0 47 -4,-3.3 4,-1.0 1,-0.2 5,-0.2 0.868 111.0 53.1 -64.4 -36.8 36.6 27.6 45.1 24 26 A M H X S+ 0 0 1 -4,-2.5 4,-3.4 -5,-0.3 3,-0.5 0.886 107.7 52.1 -65.4 -37.1 36.5 27.6 48.9 25 27 A K H < S+ 0 0 151 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.828 106.5 53.8 -68.4 -31.0 33.2 25.6 48.8 26 28 A S H < S+ 0 0 84 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.703 123.1 26.5 -76.7 -20.0 34.8 23.0 46.4 27 29 A V H < S+ 0 0 56 -4,-1.0 -2,-0.2 -3,-0.5 -3,-0.2 0.750 110.5 69.8-110.1 -38.6 37.7 22.4 48.8 28 30 A I S < S- 0 0 9 -4,-3.4 -1,-0.1 -5,-0.2 239,-0.0 -0.698 85.5-118.7 -85.9 132.9 36.3 23.2 52.3 29 31 A P > - 0 0 85 0, 0.0 3,-2.4 0, 0.0 -2,-0.1 -0.209 31.8 -97.8 -67.1 159.9 33.7 20.8 53.6 30 32 A S T 3 S+ 0 0 140 1,-0.3 4,-0.1 -5,-0.0 -5,-0.0 0.412 126.2 58.5 -59.2 6.5 30.2 21.9 54.5 31 33 A D T 3 S+ 0 0 64 2,-0.1 -1,-0.3 -30,-0.1 3,-0.1 0.626 96.2 72.7-108.4 -23.0 31.5 22.1 58.0 32 34 A G S < S- 0 0 13 -3,-2.4 232,-0.1 1,-0.2 -4,-0.0 -0.076 95.9 -55.7 -85.3-173.0 34.3 24.6 57.4 33 35 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.302 50.4-168.7 -65.8 144.0 34.4 28.3 56.8 34 36 A S E -a 3 0A 40 -32,-1.2 -30,-2.5 -33,-0.3 2,-0.4 -0.893 11.5-135.2-130.4 160.8 32.5 29.8 53.8 35 37 A V E -a 4 0A 0 -2,-0.3 2,-0.3 -32,-0.2 -30,-0.2 -0.958 12.1-169.6-124.1 139.6 32.5 33.3 52.2 36 38 A A E -a 5 0A 21 -32,-2.6 -30,-2.8 -2,-0.4 2,-0.5 -0.879 21.3-130.1-119.0 153.4 29.6 35.5 51.1 37 39 A b E -a 6 0A 47 -2,-0.3 2,-0.5 -32,-0.2 -30,-0.2 -0.923 19.6-176.7-117.5 128.4 30.1 38.6 49.0 38 40 A V E -a 7 0A 34 -32,-2.9 -30,-2.5 -2,-0.5 2,-0.5 -0.970 19.4-148.8-118.3 116.0 28.8 42.1 49.6 39 41 A K E +a 8 0A 118 -2,-0.5 2,-0.3 -32,-0.2 -30,-0.2 -0.750 20.3 171.8 -95.2 129.1 29.6 44.6 46.9 40 42 A K E -a 9 0A 61 -32,-3.0 -30,-2.6 -2,-0.5 -26,-0.1 -0.858 38.4-127.7-127.6 161.4 30.1 48.4 47.6 41 43 A A S S+ 0 0 71 -2,-0.3 2,-0.3 -32,-0.2 136,-0.1 0.680 91.1 14.4 -82.8 -18.0 31.3 51.3 45.5 42 44 A S S >> S- 0 0 14 -34,-0.1 4,-1.2 1,-0.1 3,-0.9 -0.989 74.1-112.2-154.6 157.6 33.9 52.4 48.1 43 45 A Y H 3> S+ 0 0 41 134,-0.4 4,-2.2 -2,-0.3 5,-0.2 0.781 115.5 65.7 -62.2 -25.6 35.8 51.2 51.1 44 46 A L H 3> S+ 0 0 89 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.886 99.7 49.4 -63.8 -37.9 33.9 53.8 53.1 45 47 A D H <> S+ 0 0 43 -3,-0.9 4,-2.7 1,-0.2 -1,-0.2 0.821 108.6 54.7 -69.5 -31.2 30.6 51.9 52.4 46 48 A a H X S+ 0 0 0 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.889 106.4 49.5 -68.5 -41.5 32.4 48.7 53.6 47 49 A I H X S+ 0 0 8 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.945 113.5 47.7 -63.2 -44.7 33.3 50.3 56.9 48 50 A R H X S+ 0 0 138 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.950 111.6 49.4 -59.2 -52.1 29.7 51.5 57.3 49 51 A A H <>S+ 0 0 2 -4,-2.7 5,-3.3 1,-0.2 6,-0.9 0.880 111.4 48.7 -55.7 -43.5 28.2 48.1 56.4 50 52 A I H ><5S+ 0 0 0 -4,-2.3 3,-1.5 4,-0.2 -1,-0.2 0.921 112.3 47.5 -66.9 -42.3 30.5 46.2 58.8 51 53 A A H 3<5S+ 0 0 38 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.860 112.2 51.9 -66.0 -31.3 29.7 48.6 61.7 52 54 A A T 3<5S- 0 0 55 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.300 117.3-115.3 -86.7 9.0 26.0 48.2 60.8 53 55 A N T < 5S+ 0 0 94 -3,-1.5 -3,-0.2 2,-0.2 -2,-0.1 0.859 87.9 112.9 59.3 40.3 26.3 44.4 60.9 54 56 A E S > - 0 0 11 -2,-0.4 3,-1.6 186,-0.2 4,-0.8 -0.391 40.2-115.5 -57.8 138.6 45.0 50.0 53.6 62 64 A A H >> S+ 0 0 0 183,-0.3 3,-0.9 1,-0.3 4,-0.8 0.835 114.4 58.0 -50.6 -40.6 46.8 50.7 56.8 63 65 A G H 3> S+ 0 0 1 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.792 106.9 49.7 -62.3 -26.1 46.4 54.5 56.6 64 66 A L H <> S+ 0 0 9 -3,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.622 93.8 74.9 -86.8 -15.5 42.6 53.9 56.5 65 67 A V H X S+ 0 0 34 -4,-0.8 4,-1.0 1,-0.2 3,-0.7 0.927 109.7 47.3 -62.4 -45.8 43.1 54.5 61.9 67 69 A D H >< S+ 0 0 58 -4,-0.6 3,-0.7 1,-0.2 7,-0.2 0.910 107.4 56.4 -61.8 -44.0 40.1 56.3 60.5 68 70 A A H 3< S+ 0 0 1 -4,-2.1 7,-2.6 1,-0.2 -1,-0.2 0.681 100.2 61.4 -63.0 -18.7 38.0 53.1 60.7 69 71 A Y H << S+ 0 0 66 -4,-0.8 -1,-0.2 -3,-0.7 5,-0.2 0.873 84.6 94.5 -75.8 -38.3 38.8 53.0 64.4 70 72 A L S XX S- 0 0 83 -4,-1.0 4,-2.2 -3,-0.7 3,-1.2 -0.088 84.0 -62.5 -53.3 151.6 37.2 56.3 65.2 71 73 A A T 34 S+ 0 0 73 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 -0.363 114.0 33.0 -69.8 157.7 33.6 56.4 66.4 72 74 A P T 34 S+ 0 0 119 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.959 130.5 37.8 -87.8 12.6 30.9 55.6 65.4 73 75 A N T <4 + 0 0 53 -3,-1.2 -2,-0.2 -6,-0.2 -3,-0.1 0.926 67.0 176.1 -86.1 -49.6 32.6 52.7 63.5 74 76 A N < + 0 0 71 -4,-2.2 -5,-0.3 -7,-0.2 179,-0.2 0.818 16.9 174.3 44.6 44.3 35.3 51.6 65.9 75 77 A L - 0 0 2 -7,-2.6 234,-0.3 -5,-0.3 177,-0.2 -0.408 17.2-144.5 -75.6 155.8 36.4 48.7 63.7 76 78 A K E -D 251 0B 56 175,-3.1 175,-2.5 232,-0.1 2,-0.3 -0.931 15.5-111.6-125.8 148.8 39.5 46.7 64.7 77 79 A P E +D 250 0B 4 0, 0.0 173,-0.3 0, 0.0 3,-0.1 -0.607 39.8 163.6 -75.7 133.1 42.3 45.0 62.8 78 80 A V E + 0 0 15 171,-2.9 225,-2.4 1,-0.3 2,-0.4 0.661 61.6 27.6-121.9 -29.2 42.1 41.2 63.1 79 81 A V E -DE 249 302B 0 170,-1.3 170,-3.4 223,-0.2 -1,-0.3 -0.983 68.0-156.2-140.2 126.2 44.3 39.7 60.4 80 82 A A E -DE 248 301B 5 221,-2.9 221,-2.3 -2,-0.4 168,-0.2 -0.753 13.9-129.1-105.1 149.1 47.3 41.3 58.8 81 83 A E E - E 0 300B 1 166,-2.2 2,-0.3 -2,-0.3 219,-0.2 -0.552 23.7-159.8 -84.1 157.5 48.9 40.7 55.4 82 84 A F E - E 0 299B 14 217,-1.6 216,-2.9 -2,-0.2 217,-0.9 -0.967 6.2-162.2-137.0 152.7 52.7 40.0 55.4 83 85 A Y E +F 90 0C 3 7,-2.8 7,-2.1 -2,-0.3 2,-1.6 -0.476 52.9 52.1-122.3-169.5 55.0 40.3 52.5 84 86 A G E S-F 89 0C 38 212,-0.5 2,-0.3 5,-0.2 3,-0.1 -0.573 107.1 -35.4 82.9 -84.2 58.5 39.3 51.3 85 87 A S - 0 0 29 -2,-1.6 5,-0.1 3,-0.5 213,-0.1 -0.969 49.8-107.3-164.5 167.9 58.4 35.5 51.7 86 88 A K S S+ 0 0 103 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.814 118.3 57.1 -73.9 -29.1 57.0 32.8 54.0 87 89 A E S S+ 0 0 164 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.909 124.0 19.4 -67.1 -44.2 60.5 32.2 55.3 88 90 A D S S- 0 0 108 -5,-0.1 -3,-0.5 2,-0.0 -1,-0.3 -0.706 84.9-158.2-130.4 80.2 61.0 35.9 56.4 89 91 A P E -F 84 0C 55 0, 0.0 2,-0.5 0, 0.0 -5,-0.2 -0.359 3.7-152.9 -62.3 130.4 57.5 37.5 56.7 90 92 A Q E -F 83 0C 33 -7,-2.1 -7,-2.8 -5,-0.1 -2,-0.0 -0.927 13.4-169.3-109.1 122.6 57.5 41.3 56.5 91 93 A T S S+ 0 0 74 -2,-0.5 155,-1.6 -9,-0.2 2,-0.3 -0.019 74.5 49.0 -98.2 30.6 54.8 43.1 58.3 92 94 A F E -G 245 0D 52 153,-0.3 2,-0.3 2,-0.0 -9,-0.2 -0.946 63.2-162.9-154.7 167.9 55.8 46.4 56.6 93 95 A Y E -G 244 0D 1 151,-1.9 151,-2.3 -2,-0.3 2,-0.5 -0.916 28.5 -94.3-149.0 173.9 56.7 47.7 53.2 94 96 A Y E -G 243 0D 19 -2,-0.3 111,-1.7 149,-0.2 2,-0.5 -0.854 20.4-145.9-105.1 129.3 58.4 50.7 51.6 95 97 A A E +GH 242 204D 0 147,-2.8 146,-3.0 -2,-0.5 147,-1.0 -0.760 32.0 175.8 -86.2 125.7 56.7 53.9 50.4 96 98 A V E - H 0 203D 3 107,-3.0 107,-1.4 -2,-0.5 2,-0.6 -0.852 33.1-130.8-130.2 166.3 58.6 55.2 47.4 97 99 A A E - H 0 202D 0 127,-0.4 127,-1.9 -2,-0.3 2,-0.3 -0.907 26.4-160.4-120.6 99.9 58.3 58.0 44.8 98 100 A V E +IH 223 201D 2 103,-2.5 103,-2.4 -2,-0.6 2,-0.3 -0.630 17.3 166.6 -84.7 136.6 58.6 56.7 41.3 99 101 A V E -IH 222 200D 0 123,-2.8 123,-2.9 -2,-0.3 2,-0.3 -0.883 37.8 -93.6-139.8 169.9 59.6 59.0 38.4 100 102 A K E > -I 221 0D 68 99,-0.6 3,-1.5 -2,-0.3 121,-0.3 -0.667 46.9-100.2 -90.5 143.7 60.7 58.8 34.8 101 103 A K T 3 S+ 0 0 96 119,-2.3 -1,-0.1 -2,-0.3 119,-0.0 -0.280 104.9 16.3 -59.7 144.8 64.4 58.9 34.0 102 104 A D T 3 S+ 0 0 135 1,-0.1 -1,-0.2 -3,-0.0 119,-0.0 0.571 80.1 128.2 68.6 12.5 65.7 62.3 32.8 103 105 A S < - 0 0 47 -3,-1.5 -2,-0.1 2,-0.1 -1,-0.1 0.651 65.7-136.6 -73.2 -12.0 62.6 64.2 34.1 104 106 A G + 0 0 67 -4,-0.2 2,-0.3 1,-0.1 -3,-0.1 0.852 58.0 100.2 63.5 45.9 65.1 66.6 35.8 105 107 A F - 0 0 4 5,-0.0 2,-0.2 0, 0.0 -1,-0.1 -0.988 48.8-148.6-156.8 150.0 63.8 67.3 39.3 106 108 A Q > - 0 0 47 -2,-0.3 3,-2.3 118,-0.1 118,-0.1 -0.536 44.3 -86.0-110.0 178.5 64.3 66.1 42.9 107 109 A M G > S+ 0 0 17 118,-0.4 3,-1.1 1,-0.3 4,-0.1 0.838 128.0 54.3 -53.1 -38.7 62.0 65.8 45.9 108 110 A N G 3 S+ 0 0 90 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.281 105.2 55.4 -83.3 13.1 62.6 69.4 46.8 109 111 A Q G < S+ 0 0 97 -3,-2.3 -1,-0.3 1,-0.1 -2,-0.2 -0.033 70.3 110.8-129.9 26.2 61.5 70.5 43.3 110 112 A L X + 0 0 1 -3,-1.1 3,-2.3 2,-0.1 -2,-0.1 0.673 44.3 113.0 -76.1 -17.7 58.1 68.8 43.3 111 113 A R T 3 S+ 0 0 137 1,-0.3 41,-0.2 -4,-0.1 3,-0.1 -0.340 85.5 14.6 -58.4 129.8 56.3 72.1 43.4 112 114 A G T 3 S+ 0 0 38 39,-2.2 -1,-0.3 1,-0.3 40,-0.2 0.401 100.7 118.6 86.8 -4.2 54.4 72.6 40.2 113 115 A K < - 0 0 52 -3,-2.3 40,-2.4 38,-0.1 2,-0.5 -0.375 68.6-105.9 -88.7 172.8 54.7 68.9 39.1 114 116 A K - 0 0 66 38,-0.2 85,-2.8 39,-0.2 86,-1.4 -0.876 35.7-153.0-104.3 131.1 51.8 66.6 38.4 115 117 A S E -jk 155 200D 0 39,-1.8 41,-1.6 -2,-0.5 2,-0.5 -0.841 15.0-161.7-114.7 143.1 51.1 63.8 41.0 116 118 A c E -jk 156 201D 0 84,-2.2 86,-2.3 -2,-0.4 2,-0.3 -0.977 18.3-173.7-117.6 118.1 49.6 60.4 40.9 117 119 A H E - 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0 0 0 11,-2.2 3,-2.0 -2,-0.4 -39,-0.1 -0.787 29.6-142.8-123.2 83.6 43.9 61.6 44.4 158 160 A P T 3 S+ 0 0 0 0, 0.0 -38,-3.0 0, 0.0 18,-0.2 -0.124 83.2 23.6 -47.8 140.1 41.3 58.8 44.3 159 161 A f T 3 S+ 0 0 34 16,-2.7 2,-0.2 1,-0.3 18,-0.1 0.271 91.7 125.6 84.3 -8.4 38.5 59.2 46.8 160 162 A A S < S- 0 0 6 -3,-2.0 2,-0.8 8,-0.1 -1,-0.3 -0.525 74.2-100.8 -79.8 150.9 38.9 63.0 47.1 161 163 A D > - 0 0 79 -2,-0.2 4,-2.3 1,-0.2 7,-0.2 -0.617 30.6-164.2 -74.1 108.0 35.9 65.2 46.5 162 164 A G T 4 S+ 0 0 27 -2,-0.8 -1,-0.2 12,-0.3 7,-0.1 0.594 84.2 60.8 -70.4 -10.3 36.3 66.5 42.9 163 165 A T T 4 S+ 0 0 123 2,-0.2 -1,-0.2 11,-0.1 -2,-0.0 0.924 114.8 30.7 -80.8 -47.3 33.7 69.2 43.5 164 166 A D T 4 S+ 0 0 102 1,-0.2 -2,-0.2 -3,-0.1 -1,-0.1 0.797 135.3 29.2 -80.8 -29.6 35.6 70.9 46.3 165 167 A F >< + 0 0 31 -4,-2.3 3,-1.6 1,-0.1 4,-0.3 -0.524 68.9 165.9-131.6 66.8 39.1 70.0 45.1 166 168 A P G > S+ 0 0 82 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.803 72.5 59.9 -51.6 -40.1 38.9 69.7 41.2 167 169 A Q G > S+ 0 0 70 1,-0.3 -12,-2.4 2,-0.2 3,-1.1 0.767 92.3 69.5 -65.3 -20.9 42.7 69.8 40.5 168 170 A L G < S+ 0 0 0 -3,-1.6 -11,-2.2 1,-0.2 -1,-0.3 0.665 107.2 38.1 -69.3 -13.4 43.0 66.7 42.7 169 171 A g G X S+ 0 0 6 -3,-1.9 3,-0.7 -4,-0.3 6,-0.3 0.196 81.2 109.1-118.3 12.5 41.2 64.8 39.9 170 172 A Q T < S+ 0 0 90 -3,-1.1 -14,-0.2 -15,-0.3 -2,-0.1 0.868 87.6 41.6 -56.3 -37.8 42.7 66.6 36.9 171 173 A L T 3 S+ 0 0 17 -16,-2.5 -1,-0.3 -4,-0.3 -15,-0.2 0.580 132.9 22.6 -86.7 -11.9 44.7 63.4 36.1 172 174 A e S X S- 0 0 5 -3,-0.7 3,-2.7 -17,-0.6 -1,-0.2 -0.502 89.6-136.9-155.6 76.0 41.7 61.1 36.9 173 175 A P T 3 S+ 0 0 120 0, 0.0 3,-0.4 0, 0.0 -3,-0.1 -0.001 88.3 17.7 -38.6 125.8 38.4 63.0 36.5 174 176 A G T 3 S- 0 0 60 1,-0.2 -12,-0.3 -8,-0.1 -15,-0.1 0.103 97.4-120.8 95.6 -21.2 35.9 62.1 39.3 175 177 A g < - 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