==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 25-MAR-09 3GRG . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.C.PALMIERI,J.B.B.FREIRE,D.FOGUEL,L.M.T.R.LIMA . 461 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19374.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 342 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 172 37.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 0.4 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 . 60 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.7 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 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 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 4 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 8 0 0 6 0 4 4 4 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 4 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 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 65 0, 0.0 95,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 136.1 35.9 11.9 8.3 2 11 A P + 0 0 19 0, 0.0 94,-2.2 0, 0.0 2,-0.4 0.755 360.0 27.9 -64.3 -23.5 37.1 9.2 5.9 3 12 A L E +a 96 0A 0 47,-0.2 46,-0.7 92,-0.2 2,-0.3 -0.985 66.4 169.8-147.5 124.4 36.1 6.8 8.7 4 13 A M E -a 97 0A 28 92,-2.1 94,-2.4 -2,-0.4 2,-0.4 -0.959 15.3-155.9-134.4 151.8 33.6 7.0 11.5 5 14 A V E -aB 98 46A 0 41,-1.1 41,-2.1 -2,-0.3 2,-0.4 -0.998 7.7-171.4-134.6 128.1 32.4 4.3 13.9 6 15 A K E -aB 99 45A 48 92,-2.8 94,-2.9 -2,-0.4 2,-0.5 -0.995 3.7-168.5-126.1 129.3 29.0 4.4 15.6 7 16 A V E -a 100 0A 0 37,-2.6 9,-2.3 -2,-0.4 2,-0.4 -0.960 1.2-167.8-126.8 128.0 28.2 1.9 18.4 8 17 A L E -aC 101 15A 14 92,-3.0 94,-2.5 -2,-0.5 2,-0.8 -0.927 23.4-131.0-113.2 142.3 24.7 1.3 19.9 9 18 A D E >> -aC 102 14A 1 5,-3.2 5,-1.6 -2,-0.4 4,-1.4 -0.838 21.4-172.0 -90.3 103.8 23.9 -0.6 23.0 10 19 A A T 45S+ 0 0 1 92,-2.6 328,-2.5 -2,-0.8 329,-0.2 0.624 81.0 57.6 -74.4 -15.1 21.0 -2.9 21.8 11 20 A V T 45S+ 0 0 0 91,-0.6 -1,-0.2 326,-0.2 92,-0.1 0.922 120.1 24.4 -80.1 -47.7 20.3 -4.2 25.3 12 21 A R T 45S- 0 0 74 2,-0.1 -2,-0.2 325,-0.1 450,-0.2 0.531 102.2-121.0 -96.5 -6.8 19.6 -0.7 26.9 13 22 A G T <5S+ 0 0 0 -4,-1.4 449,-3.0 1,-0.2 -3,-0.2 0.959 73.3 113.9 62.6 52.5 18.5 1.2 23.8 14 23 A S E - 0 0 21 4,-3.8 3,-2.7 -2,-0.3 4,-0.1 -0.372 25.2 -97.7 -88.3 166.7 50.2 -5.0 6.8 28 37 A A T 3 S+ 0 0 117 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.842 124.8 51.7 -44.0 -41.8 52.4 -6.3 4.0 29 38 A D T 3 S- 0 0 105 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.082 122.7-103.4 -93.5 22.6 53.5 -9.2 6.2 30 39 A D S < S+ 0 0 123 -3,-2.7 2,-0.3 1,-0.2 -2,-0.1 0.801 81.6 124.2 68.6 31.5 49.8 -10.2 7.0 31 40 A T - 0 0 68 -4,-0.1 -4,-3.8 -6,-0.1 2,-0.8 -0.883 68.0-109.2-114.6 158.1 49.8 -8.8 10.5 32 41 A W E -J 26 0B 51 -2,-0.3 -6,-0.2 -6,-0.2 28,-0.1 -0.765 34.3-161.1 -84.3 113.5 47.3 -6.2 11.9 33 42 A E E -J 25 0B 78 -8,-2.6 -8,-2.2 -2,-0.8 -2,-0.0 -0.830 27.1-105.2 -99.7 130.6 49.1 -3.0 12.4 34 43 A P E +J 24 0B 107 0, 0.0 -10,-0.3 0, 0.0 3,-0.1 -0.184 43.1 169.6 -51.3 140.5 47.5 -0.4 14.8 35 44 A F E - 0 0 49 -12,-2.8 2,-0.3 1,-0.5 -11,-0.2 0.669 56.7 -24.9-126.3 -47.4 45.9 2.4 12.8 36 45 A A E -J 23 0B 20 -13,-1.5 -13,-3.3 14,-0.0 -1,-0.5 -0.970 55.4-175.6-167.5 159.3 43.9 4.5 15.1 37 46 A S E +J 22 0B 79 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.955 15.7 131.5-155.1 173.9 42.0 4.3 18.5 38 47 A G E -J 21 0B 26 -17,-1.6 -17,-2.9 -2,-0.3 2,-0.4 -0.971 46.8 -84.4 166.3-170.6 39.8 6.2 20.8 39 48 A K E -J 20 0B 134 -2,-0.3 -19,-0.2 -19,-0.3 -21,-0.1 -0.985 44.7 -99.8-128.0 146.0 36.6 6.0 22.9 40 49 A T - 0 0 2 -21,-2.2 -22,-2.0 -2,-0.4 6,-0.2 -0.199 34.9-129.4 -65.9 150.1 33.1 6.7 21.8 41 50 A S > - 0 0 46 4,-2.8 3,-1.9 -24,-0.2 -23,-0.3 -0.089 41.7 -77.9 -84.0-170.8 31.4 10.0 22.5 42 51 A E T 3 S+ 0 0 163 1,-0.3 -25,-0.1 -25,-0.1 -1,-0.1 0.732 133.3 52.1 -65.7 -19.6 28.0 10.6 24.1 43 52 A S T 3 S- 0 0 45 2,-0.2 -1,-0.3 -29,-0.1 -27,-0.1 0.293 121.2-106.8 -97.8 8.6 26.3 9.8 20.8 44 53 A G S < S+ 0 0 0 -3,-1.9 -37,-2.6 1,-0.3 2,-0.3 0.641 80.3 130.9 79.9 15.3 28.2 6.5 20.5 45 54 A E E -B 6 0A 43 -39,-0.2 -4,-2.8 -6,-0.1 2,-0.5 -0.745 48.1-158.5-111.6 149.4 30.4 8.0 17.8 46 55 A L E +B 5 0A 15 -41,-2.1 -41,-1.1 -2,-0.3 3,-0.2 -0.951 24.5 175.8-126.4 104.9 34.1 8.1 17.3 47 56 A H + 0 0 96 -2,-0.5 -43,-0.1 1,-0.2 -2,-0.0 -0.595 53.7 38.7-105.4 164.8 35.1 10.9 14.9 48 57 A G + 0 0 63 -2,-0.2 -1,-0.2 -45,-0.1 -44,-0.1 0.852 65.8 142.5 64.9 37.5 38.6 12.2 13.8 49 58 A L - 0 0 18 -46,-0.7 2,-0.3 -3,-0.2 -12,-0.1 0.878 69.3 -15.1 -74.2 -39.3 40.1 8.7 13.5 50 59 A T - 0 0 16 -47,-0.3 2,-0.3 -14,-0.1 -47,-0.2 -0.870 66.2-111.1-149.6-179.5 42.2 9.4 10.4 51 60 A T > - 0 0 66 -2,-0.3 4,-2.2 -50,-0.1 0, 0.0 -0.800 37.1-100.0-117.0 163.0 42.7 11.8 7.6 52 61 A E T 4 S+ 0 0 148 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 0.861 123.8 45.5 -35.0 -51.4 42.2 11.7 3.7 53 62 A E T 4 S+ 0 0 150 1,-0.2 -1,-0.2 3,-0.0 3,-0.0 0.907 113.0 45.8 -72.0 -46.9 45.9 11.0 3.3 54 63 A E T 4 S+ 0 0 118 1,-0.2 2,-2.1 2,-0.1 -1,-0.2 0.738 93.1 81.8 -73.7 -24.7 46.4 8.3 6.0 55 64 A F < + 0 0 10 -4,-2.2 -1,-0.2 -52,-0.0 3,-0.1 -0.430 67.9 168.8 -83.6 66.7 43.2 6.3 5.0 56 65 A V - 0 0 68 -2,-2.1 32,-0.1 1,-0.2 -2,-0.1 -0.176 45.5 -78.4 -70.8 168.2 45.0 4.5 2.2 57 66 A E S S+ 0 0 120 32,-0.1 2,-0.3 30,-0.1 32,-0.2 -0.373 81.0 99.9 -66.8 151.9 43.4 1.5 0.4 58 67 A G E S- L 0 88B 21 30,-1.5 30,-3.5 -3,-0.1 2,-0.5 -0.951 74.7 -61.9 157.4-177.7 43.6 -1.7 2.4 59 68 A I E - L 0 87B 45 -33,-0.3 -33,-3.2 -2,-0.3 2,-0.3 -0.926 51.4-168.5-105.1 127.5 41.9 -4.2 4.7 60 69 A Y E -KL 25 86B 0 26,-2.8 26,-2.6 -2,-0.5 2,-0.5 -0.859 12.3-155.0-118.7 147.1 40.8 -2.7 8.0 61 70 A K E -KL 24 85B 15 -37,-2.2 -37,-2.5 -2,-0.3 2,-0.5 -0.989 4.3-158.0-123.2 131.3 39.6 -4.2 11.2 62 71 A V E -KL 23 84B 0 22,-3.7 22,-2.6 -2,-0.5 2,-0.5 -0.941 10.0-168.1-105.8 120.6 37.5 -2.3 13.7 63 72 A E E -KL 22 83B 20 -41,-3.1 -41,-2.4 -2,-0.5 2,-0.6 -0.957 3.6-165.1-106.8 124.7 37.5 -3.8 17.4 64 73 A I E -KL 21 82B 0 18,-3.2 18,-2.5 -2,-0.5 2,-0.5 -0.887 22.7-128.7-107.6 126.1 35.1 -2.5 19.8 65 74 A D E + L 0 81B 44 -45,-3.3 16,-0.2 -2,-0.6 -45,-0.2 -0.588 43.8 153.3 -82.8 119.0 36.0 -3.4 23.3 66 75 A T >> + 0 0 8 14,-2.1 3,-0.9 -2,-0.5 4,-0.8 0.459 30.1 114.0-121.7 -3.5 33.0 -5.0 25.0 67 76 A K T 34 S+ 0 0 138 13,-1.4 3,-0.4 1,-0.3 14,-0.1 0.860 96.4 11.7 -46.4 -58.2 34.5 -7.2 27.6 68 77 A S T >4 S+ 0 0 87 1,-0.2 3,-1.2 12,-0.1 4,-0.4 0.340 100.1 97.2-106.3 7.4 33.2 -5.4 30.7 69 78 A Y T <4 S+ 0 0 58 -3,-0.9 3,-0.3 1,-0.3 -1,-0.2 0.810 92.1 45.3 -58.5 -27.3 30.7 -3.2 29.0 70 79 A W T >X>S+ 0 0 0 -4,-0.8 3,-2.7 -3,-0.4 5,-1.1 0.457 83.8 104.6 -93.5 -8.1 28.1 -5.8 29.9 71 80 A K G X45S+ 0 0 160 -3,-1.2 3,-1.9 1,-0.3 -1,-0.2 0.806 74.3 56.2 -49.9 -46.2 29.4 -6.2 33.5 72 81 A A G 345S+ 0 0 94 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.664 104.2 56.5 -65.2 -16.7 26.6 -4.3 35.2 73 82 A L G <45S- 0 0 27 -3,-2.7 -1,-0.3 2,-0.2 -2,-0.2 0.583 112.3-118.0 -87.9 -17.8 24.1 -6.6 33.5 74 83 A G T <<5S+ 0 0 70 -3,-1.9 2,-0.4 -4,-0.6 -3,-0.2 0.699 73.8 125.6 85.8 18.9 25.7 -9.7 35.0 75 84 A I < - 0 0 28 -5,-1.1 -1,-0.3 -7,-0.1 -2,-0.2 -0.944 52.0-152.7-122.4 134.5 26.6 -11.0 31.6 76 85 A S - 0 0 83 -2,-0.4 -8,-0.1 -3,-0.1 -9,-0.1 -0.915 34.3-130.4 -95.9 120.9 29.9 -12.1 30.2 77 86 A P - 0 0 20 0, 0.0 28,-0.2 0, 0.0 127,-0.1 -0.106 20.5 -99.5 -80.6 178.6 29.7 -11.6 26.4 78 87 A M S S- 0 0 15 26,-2.9 126,-3.0 1,-0.1 2,-0.3 0.745 103.3 -2.5 -65.5 -27.2 30.5 -14.0 23.5 79 88 A H S S- 0 0 3 25,-0.3 -1,-0.1 124,-0.3 124,-0.1 -0.966 72.5-110.2-161.7 155.4 34.0 -12.3 23.0 80 89 A E S S+ 0 0 51 -2,-0.3 -14,-2.1 -14,-0.1 -13,-1.4 0.537 102.2 34.8 -75.0 -6.7 35.9 -9.4 24.5 81 90 A H E -L 65 0B 48 -16,-0.2 2,-0.5 -15,-0.2 -16,-0.2 -0.953 69.7-136.6-131.8 157.7 35.6 -7.4 21.3 82 91 A A E -L 64 0B 7 -18,-2.5 -18,-3.2 -2,-0.3 2,-0.4 -0.992 38.1-163.7-103.1 128.2 33.0 -6.9 18.7 83 92 A E E -L 63 0B 20 -2,-0.5 2,-0.4 -20,-0.2 -20,-0.2 -0.904 18.3-177.1-119.3 137.0 35.1 -7.0 15.5 84 93 A V E -L 62 0B 1 -22,-2.6 -22,-3.7 -2,-0.4 2,-0.4 -0.993 7.8-162.5-131.3 133.4 34.3 -5.9 11.9 85 94 A V E +L 61 0B 13 -2,-0.4 2,-0.3 -24,-0.3 -24,-0.2 -0.897 14.8 173.5-109.6 135.0 36.6 -6.3 9.0 86 95 A F E -L 60 0B 0 -26,-2.6 -26,-2.8 -2,-0.4 2,-0.6 -0.989 31.5-125.4-138.8 155.6 36.1 -4.3 5.7 87 96 A T E -L 59 0B 24 108,-3.1 2,-0.3 -2,-0.3 -28,-0.2 -0.873 39.2-142.3-100.9 125.1 38.0 -3.8 2.5 88 97 A A E -L 58 0B 0 -30,-3.5 -30,-1.5 -2,-0.6 8,-0.0 -0.754 44.7 -16.8-106.4 140.1 38.6 -0.1 1.8 89 98 A N + 0 0 12 -2,-0.3 -1,-0.2 -32,-0.2 -32,-0.1 0.812 52.1 168.6 63.1 67.6 38.7 2.5 -1.0 90 99 A D S S+ 0 0 102 -3,-0.2 -1,-0.1 -33,-0.1 -2,-0.0 0.107 72.8 10.6 -98.8 23.2 39.0 0.6 -4.3 91 100 A S S S- 0 0 103 1,-0.7 3,-0.1 3,-0.0 0, 0.0 0.076 123.1 -16.0-151.5 -81.8 38.3 3.4 -6.8 92 101 A G S S- 0 0 29 1,-0.2 -1,-0.7 0, 0.0 -3,-0.0 -0.552 97.7 -50.3-116.8-169.5 38.1 7.1 -5.7 93 102 A P - 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