==== 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 TRANSPORT (THYROXINE,RETINOL) IN SERUM 16-SEP-77 2PAB . COMPND 2 MOLECULE: TRANSTHYRETIN PRECURSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.J.OATLEY,C.C.F.BLAKE . 228 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11200.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 177 77.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 87 38.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 34 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 PARALLEL BRIDGES PER LADDER . 1 5 0 0 3 0 5 1 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 1 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 10 A C 0 0 63 0, 0.0 50,-0.1 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 150.3 -5.5 11.5 22.5 2 11 A P + 0 0 24 0, 0.0 94,-3.4 0, 0.0 2,-0.4 0.698 360.0 36.3 -75.3 -24.5 -8.0 12.5 19.8 3 12 A L E +a 96 0A 0 47,-0.2 2,-0.3 44,-0.2 47,-0.3 -0.997 68.6 170.0-135.7 122.9 -5.4 12.6 17.1 4 13 A M E -a 97 0A 42 92,-2.9 94,-3.1 -2,-0.4 2,-0.4 -0.976 13.7-160.2-134.2 150.0 -2.5 10.2 16.8 5 14 A V E -aB 98 46A 0 41,-1.4 41,-1.9 -2,-0.3 2,-0.4 -0.967 5.3-173.6-129.9 146.3 0.0 9.5 14.0 6 15 A K E -aB 99 45A 78 92,-2.4 94,-2.7 -2,-0.4 2,-0.4 -0.994 4.6-170.0-138.7 136.1 2.1 6.5 13.4 7 16 A V E -a 100 0A 0 37,-2.3 9,-2.7 -2,-0.4 2,-0.3 -0.997 1.9-173.2-136.9 133.6 4.8 6.2 10.8 8 17 A L E -aC 101 15A 70 92,-2.4 94,-2.7 -2,-0.4 2,-0.6 -0.841 21.2-131.2-121.1 155.4 6.7 3.1 9.6 9 18 A D E >> -aC 102 14A 2 5,-3.1 4,-1.7 -2,-0.3 5,-1.5 -0.963 11.8-169.5-114.1 115.1 9.7 2.6 7.2 10 19 A A T 45S+ 0 0 49 92,-2.7 93,-0.2 -2,-0.6 -1,-0.1 0.605 85.5 59.4 -75.4 -20.1 9.1 -0.1 4.7 11 20 A V T 45S+ 0 0 79 91,-0.5 -1,-0.2 1,-0.1 92,-0.1 0.885 121.4 21.8 -77.6 -41.6 12.8 0.0 3.6 12 21 A R T 45S- 0 0 141 2,-0.2 -2,-0.2 3,-0.0 -1,-0.1 0.583 99.1-125.0-101.7 -16.8 14.2 -0.8 7.0 13 22 A G T <5S+ 0 0 69 -4,-1.7 -3,-0.2 1,-0.3 -5,-0.0 0.936 72.7 104.2 70.5 46.9 11.2 -2.5 8.6 14 23 A S E - 0 0 12 4,-2.9 3,-1.1 -2,-0.5 -1,-0.1 0.121 26.1 -84.1 -68.5 178.2 -9.3 28.5 8.9 28 37 A A T 3 S+ 0 0 100 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 0.863 116.8 53.9 -55.9 -29.2 -12.3 30.8 8.6 29 38 A D T 3 S- 0 0 144 2,-0.1 -1,-0.2 1,-0.1 3,-0.1 0.175 119.9 -83.9 -97.6 26.4 -11.1 32.1 5.3 30 39 A D S < S+ 0 0 136 -3,-1.1 2,-0.2 1,-0.3 -2,-0.1 0.319 101.2 105.5 100.2 -18.3 -10.3 29.5 2.5 31 40 A T S S- 0 0 91 -6,-0.1 -4,-2.9 -4,-0.0 2,-0.6 -0.538 71.4-107.8-100.3 156.7 -6.8 29.1 4.2 32 41 A W E -J 26 0B 83 -6,-0.3 -6,-0.2 -2,-0.2 28,-0.1 -0.750 25.6-164.7 -92.7 114.6 -4.6 26.9 6.5 33 42 A E E -J 25 0B 103 -8,-2.7 -8,-3.2 -2,-0.6 2,-0.3 -0.696 28.6-111.0 -96.9 150.2 -3.7 27.7 10.1 34 43 A P E +J 24 0B 115 0, 0.0 -10,-0.2 0, 0.0 3,-0.1 -0.495 44.7 162.1 -63.6 128.1 -1.0 26.0 12.1 35 44 A F E - 0 0 40 -12,-3.6 2,-0.3 1,-0.5 -11,-0.2 0.749 56.5 -5.6-119.0 -34.2 -2.6 23.9 14.8 36 45 A A E -J 23 0B 19 -13,-1.7 -13,-3.7 2,-0.0 -1,-0.5 -0.978 53.5-171.1-160.8 156.1 -0.1 21.4 16.2 37 46 A S E +J 22 0B 78 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.974 18.0 135.7-149.9 153.5 3.4 20.2 15.6 38 47 A G E -J 21 0B 23 -17,-1.9 -17,-2.7 -2,-0.3 2,-0.4 -0.975 39.5-108.2-178.9 179.5 5.6 17.4 16.9 39 48 A K E -J 20 0B 122 -2,-0.3 -19,-0.2 -19,-0.2 6,-0.1 -0.979 38.9-100.4-129.4 148.1 8.1 14.7 16.0 40 49 A T - 0 0 4 -21,-1.7 -22,-2.2 -2,-0.4 6,-0.2 -0.352 39.1-126.1 -66.8 144.0 7.6 10.9 16.0 41 50 A S > - 0 0 50 4,-2.9 3,-3.9 -24,-0.2 -22,-0.1 -0.154 38.9 -80.7 -81.0 172.8 9.0 9.0 19.0 42 51 A E T 3 S+ 0 0 151 1,-0.3 -25,-0.1 2,-0.1 -1,-0.1 0.755 135.2 51.4 -48.7 -22.3 11.3 6.0 19.1 43 52 A S T 3 S- 0 0 60 2,-0.2 -1,-0.3 -29,-0.1 -27,-0.1 0.325 123.1-104.6-101.8 11.8 8.2 4.0 18.3 44 53 A G S < S+ 0 0 0 -3,-3.9 -37,-2.3 1,-0.3 2,-0.3 0.646 80.1 131.2 80.4 16.1 7.2 6.0 15.3 45 54 A E E -B 6 0A 39 -39,-0.2 -4,-2.9 -6,-0.1 2,-0.4 -0.785 43.8-166.7-110.9 148.3 4.4 7.7 17.3 46 55 A L E +B 5 0A 12 -41,-1.9 -41,-1.4 -2,-0.3 -6,-0.1 -0.938 24.5 150.4-132.8 105.5 3.2 11.2 17.9 47 56 A H + 0 0 78 -2,-0.4 3,-0.3 -43,-0.2 -44,-0.2 0.607 49.2 86.2-105.7 -24.9 0.7 11.6 20.7 48 57 A G + 0 0 75 1,-0.2 -1,-0.1 -47,-0.1 -44,-0.1 0.547 65.2 110.8 -58.1 -10.8 1.2 15.1 22.1 49 58 A L S S- 0 0 21 -46,-0.3 2,-0.2 -3,-0.1 -1,-0.2 0.784 71.7 -27.0 -31.8 -87.2 -1.1 16.8 19.7 50 59 A T - 0 0 17 -47,-0.3 2,-0.2 -3,-0.3 -47,-0.2 -0.711 51.4-133.5-135.2-176.7 -4.4 18.2 20.7 51 60 A T >> - 0 0 78 -2,-0.2 4,-1.5 -50,-0.1 3,-0.7 -0.661 42.6 -57.9-130.9-175.4 -7.1 17.8 23.3 52 61 A E T 34 S+ 0 0 146 -2,-0.2 -2,-0.0 1,-0.2 0, 0.0 0.635 117.9 0.1 -29.9 -63.7 -10.9 17.5 23.8 53 62 A E T 34 S+ 0 0 101 3,-0.0 -1,-0.2 40,-0.0 3,-0.2 -0.284 117.6 74.6-162.4 60.7 -12.6 20.6 22.4 54 63 A Q T <4 S+ 0 0 118 -3,-0.7 2,-0.6 2,-0.1 -2,-0.2 0.114 90.1 69.0-125.7 -54.3 -9.7 22.4 21.2 55 64 A F S < S+ 0 0 10 -4,-1.5 2,-0.2 3,-0.0 3,-0.0 -0.746 82.5 166.9 -71.9 119.7 -10.0 19.7 18.6 56 65 A V - 0 0 56 -2,-0.6 2,-0.2 -3,-0.2 32,-0.1 -0.673 42.9 -67.6-130.3-179.1 -13.2 21.0 17.1 57 66 A E S S+ 0 0 111 -2,-0.2 2,-0.3 30,-0.1 32,-0.2 -0.496 80.7 93.9 -74.6 146.4 -15.1 20.2 13.9 58 67 A G E S- L 0 88B 10 30,-1.9 30,-3.5 31,-0.2 2,-0.6 -0.982 74.8 -64.0 163.7-175.9 -13.3 21.2 10.7 59 68 A I E - L 0 87B 40 -33,-0.4 -33,-3.8 -2,-0.3 2,-0.3 -0.925 51.5-174.3-102.8 121.1 -11.0 20.3 7.9 60 69 A Y E -KL 25 86B 0 26,-3.0 26,-2.5 -2,-0.6 2,-0.4 -0.815 15.3-150.2-115.9 159.0 -7.5 19.5 9.0 61 70 A K E -KL 24 85B 29 -37,-2.7 -37,-3.6 -2,-0.3 2,-0.6 -0.998 2.0-160.6-128.9 129.9 -4.3 18.7 7.2 62 71 A V E -KL 23 84B 0 22,-2.6 22,-2.2 -2,-0.4 2,-0.5 -0.968 11.8-167.9-112.8 116.6 -1.5 16.4 8.5 63 72 A E E -KL 22 83B 45 -41,-2.7 -41,-2.7 -2,-0.6 2,-0.6 -0.957 2.8-161.7-112.1 116.8 1.8 17.1 6.7 64 73 A I E -KL 21 82B 0 18,-3.1 2,-2.6 -2,-0.5 18,-2.2 -0.896 18.2-135.6-105.7 118.4 4.5 14.5 7.3 65 74 A D > + 0 0 47 -45,-3.1 4,-1.0 -2,-0.6 -45,-0.4 -0.410 43.1 154.7 -75.9 75.0 8.0 15.7 6.4 66 75 A T H > + 0 0 6 -2,-2.6 4,-2.1 1,-0.2 5,-0.2 0.825 61.8 68.2 -66.8 -32.9 9.1 12.5 4.6 67 76 A K H > S+ 0 0 52 13,-0.8 4,-2.5 -3,-0.3 -1,-0.2 0.928 101.3 44.8 -55.1 -50.5 11.7 14.4 2.5 68 77 A S H > S+ 0 0 59 12,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.800 109.9 56.2 -63.6 -33.7 14.0 15.1 5.4 69 78 A Y H X S+ 0 0 33 -4,-1.0 4,-0.9 2,-0.2 -1,-0.2 0.937 111.5 41.7 -61.4 -54.7 13.7 11.6 6.8 70 79 A W H >X>S+ 0 0 4 -4,-2.1 5,-2.2 2,-0.2 4,-1.3 0.935 114.3 52.8 -62.9 -47.0 14.9 9.9 3.6 71 80 A K H ><5S+ 0 0 121 -4,-2.5 3,-1.1 1,-0.3 -2,-0.2 0.946 103.1 55.5 -54.2 -53.7 17.6 12.6 3.1 72 81 A A H 3<5S+ 0 0 96 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.791 108.9 53.0 -48.4 -26.3 19.0 12.1 6.5 73 82 A L H <<5S- 0 0 73 -3,-0.9 -1,-0.3 -4,-0.9 -2,-0.2 0.790 121.6-105.5 -78.8 -34.9 19.3 8.4 5.5 74 83 A G T <<5S+ 0 0 71 -4,-1.3 2,-0.3 -3,-1.1 -3,-0.2 0.319 81.2 126.6 119.3 6.3 21.2 9.0 2.2 75 84 A I < - 0 0 60 -5,-2.2 -1,-0.4 -6,-0.1 -2,-0.2 -0.693 56.0-141.8 -99.3 142.9 18.1 8.4 0.1 76 85 A S - 0 0 81 -2,-0.3 -9,-0.1 -3,-0.1 -5,-0.0 -0.866 28.5-158.9-108.4 94.2 16.8 10.8 -2.5 77 86 A P - 0 0 25 0, 0.0 28,-0.2 0, 0.0 -10,-0.0 0.049 20.4-141.7 -72.3 171.6 13.0 10.6 -2.3 78 87 A F S S+ 0 0 12 26,-1.9 124,-1.0 123,-0.1 2,-0.2 0.840 78.5 72.2-100.0 -40.1 10.4 11.6 -4.8 79 88 A H E -N 201 0C 7 25,-0.6 122,-0.2 122,-0.2 3,-0.1 -0.495 65.1-149.3 -80.1 144.7 7.7 13.2 -2.6 80 89 A E E S- 0 0 30 120,-3.2 -13,-0.8 1,-0.3 2,-0.3 0.872 79.6 -34.0 -74.4 -35.7 8.2 16.6 -1.0 81 90 A H E -N 200 0C 36 119,-0.5 2,-0.5 -15,-0.2 119,-0.5 -0.919 63.9 -99.5-168.7 175.1 6.1 15.5 1.9 82 91 A A E -L 64 0B 2 -18,-2.2 -18,-3.1 -2,-0.3 2,-0.4 -0.974 36.9-163.3-117.6 114.4 3.1 13.3 2.7 83 92 A E E -L 63 0B 8 -2,-0.5 2,-0.4 115,-0.4 115,-0.4 -0.801 10.4-172.2-103.5 139.1 -0.2 15.2 3.1 84 93 A V E -L 62 0B 2 -22,-2.2 -22,-2.6 -2,-0.4 2,-0.5 -0.952 7.9-173.7-131.9 109.7 -3.4 13.9 4.7 85 94 A V E +L 61 0B 4 111,-0.5 110,-2.2 -2,-0.4 111,-0.4 -0.907 15.6 153.3-112.2 130.1 -6.5 16.0 4.4 86 95 A F E -LM 60 194B 0 -26,-2.5 -26,-3.0 -2,-0.5 2,-0.5 -0.994 44.6-117.1-153.6 157.9 -9.7 15.2 6.2 87 96 A T E -L 59 0B 37 106,-0.7 2,-0.3 -2,-0.3 -28,-0.2 -0.806 38.8-162.9 -92.0 130.2 -13.0 16.4 7.7 88 97 A A E +L 58 0B 0 -30,-3.5 -30,-1.9 -2,-0.5 4,-0.1 -0.889 48.6 15.2-120.5 157.0 -13.0 15.7 11.5 89 98 A N + 0 0 30 -2,-0.3 -31,-0.2 -32,-0.2 -33,-0.1 0.316 65.4 124.1 59.8 158.3 -15.9 15.7 14.0 90 99 A D S S+ 0 0 125 2,-1.1 -33,-0.1 -33,-0.1 -2,-0.0 -0.367 83.7 25.0 161.7 -76.6 -19.5 15.5 12.6 91 100 A S S S- 0 0 125 1,-0.2 -2,-0.1 -2,-0.0 0, 0.0 -0.483 138.2 -12.9-117.3 55.1 -21.4 12.6 13.9 92 101 A G S S- 0 0 32 2,-0.1 -2,-1.1 -4,-0.1 2,-0.7 -0.482 77.3 -90.9 129.0 152.4 -19.3 12.5 17.0 93 102 A P - 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