==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 29-OCT-09 3KGU . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.B.TRIVELLA,I.POLIKARPOV . 230 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11210.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 174 75.7 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 . 88 38.3 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 1.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 28 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 1 1 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 . 2 4 0 0 3 0 4 0 2 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 86 0, 0.0 50,-0.1 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 155.3 5.7 -11.6 6.5 2 11 A P + 0 0 4 0, 0.0 94,-3.1 0, 0.0 2,-0.4 0.687 360.0 35.3 -66.1 -23.3 8.0 -12.6 3.5 3 12 A L E +a 96 0A 1 47,-0.2 46,-0.6 92,-0.2 2,-0.3 -0.984 62.7 169.1-141.9 124.4 5.2 -12.6 0.9 4 13 A M E -a 97 0A 23 92,-2.3 94,-2.9 -2,-0.4 2,-0.4 -0.990 16.4-154.5-135.4 141.9 2.1 -10.3 0.6 5 14 A V E -aB 98 46A 0 41,-1.7 41,-2.4 -2,-0.3 2,-0.4 -0.976 9.3-173.7-120.4 131.2 -0.3 -9.8 -2.3 6 15 A K E -aB 99 45A 67 92,-2.6 94,-2.4 -2,-0.4 2,-0.4 -0.992 3.9-168.8-126.4 130.1 -2.3 -6.6 -2.9 7 16 A V E -a 100 0A 0 37,-2.4 9,-2.5 -2,-0.4 2,-0.3 -0.978 1.3-169.0-126.2 130.5 -5.1 -6.3 -5.5 8 17 A L E -aC 101 15A 72 92,-2.8 94,-2.7 -2,-0.4 2,-0.6 -0.892 19.2-134.6-120.4 149.5 -6.8 -3.2 -6.8 9 18 A D E >> -aC 102 14A 3 5,-3.1 5,-1.3 -2,-0.3 4,-1.3 -0.916 12.1-168.6-104.9 114.8 -9.9 -2.6 -9.0 10 19 A A T 45S+ 0 0 48 92,-2.6 93,-0.1 -2,-0.6 -1,-0.1 0.488 84.6 54.5 -82.4 -8.1 -9.2 0.1 -11.6 11 20 A V T 45S+ 0 0 84 91,-0.4 -1,-0.2 3,-0.1 92,-0.1 0.848 120.2 27.3 -90.1 -45.9 -12.9 0.4 -12.6 12 21 A R T 45S- 0 0 147 2,-0.1 -2,-0.2 3,-0.0 -1,-0.0 0.619 99.7-127.2 -90.9 -16.0 -14.4 1.1 -9.1 13 22 A G T <5S+ 0 0 71 -4,-1.3 -3,-0.2 1,-0.3 -5,-0.0 0.944 72.2 108.1 62.5 51.4 -11.2 2.7 -7.7 14 23 A S E - 0 0 0 -9,-2.5 3,-0.5 28,-0.1 -9,-0.2 -0.872 40.4-158.9 -96.2 106.4 -10.4 -5.8 -4.9 17 26 A I T 3 + 0 0 71 -2,-0.8 24,-0.2 1,-0.2 25,-0.1 -0.558 60.2 14.1 -94.8 147.4 -12.0 -7.8 -2.0 18 27 A N T 3 S+ 0 0 116 22,-1.7 2,-0.4 23,-0.2 -1,-0.2 0.772 79.7 160.7 66.3 26.8 -12.5 -11.5 -1.7 19 28 A V < - 0 0 2 -3,-0.5 21,-1.8 22,-0.2 2,-0.3 -0.718 38.8-126.0 -85.9 128.8 -10.1 -12.4 -4.5 20 29 A A E -J 39 0B 15 -2,-0.4 45,-3.0 45,-0.4 2,-0.4 -0.543 27.3-172.1 -74.6 134.4 -8.8 -16.0 -4.6 21 30 A V E -JK 38 64B 0 17,-2.6 17,-2.0 -2,-0.3 2,-0.4 -0.997 4.7-170.6-132.3 124.8 -5.0 -16.3 -4.7 22 31 A H E -JK 37 63B 78 41,-2.4 41,-3.1 -2,-0.4 2,-0.4 -0.970 6.0-159.1-119.9 131.1 -3.0 -19.6 -5.2 23 32 A V E -JK 36 62B 3 13,-3.6 12,-3.1 -2,-0.4 13,-1.6 -0.921 10.4-176.6-113.9 134.2 0.7 -19.9 -4.8 24 33 A F E -JK 34 61B 41 37,-2.6 37,-2.7 -2,-0.4 2,-0.4 -0.903 12.0-151.2-127.0 154.7 2.8 -22.7 -6.3 25 34 A R E -JK 33 60B 75 8,-2.8 8,-2.9 -2,-0.3 2,-0.4 -0.987 24.7-114.6-129.4 137.0 6.5 -23.6 -6.1 26 35 A K E -J 32 0B 72 33,-2.7 33,-0.3 -2,-0.4 6,-0.2 -0.554 32.5-147.8 -74.1 124.6 8.6 -25.4 -8.8 27 36 A A > - 0 0 15 4,-3.0 3,-1.6 -2,-0.4 -1,-0.1 -0.265 30.3 -98.3 -82.7 174.3 9.8 -28.9 -7.7 28 37 A A T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.824 124.6 57.0 -62.6 -32.6 13.0 -30.7 -8.6 29 38 A D T 3 S- 0 0 110 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.233 120.5-109.9 -83.5 12.1 11.1 -32.7 -11.3 30 39 A D S < S+ 0 0 121 -3,-1.6 2,-0.2 1,-0.2 -2,-0.1 0.581 77.7 125.5 70.3 15.1 9.9 -29.4 -12.9 31 40 A T - 0 0 68 -6,-0.0 -4,-3.0 1,-0.0 2,-0.6 -0.669 66.1-108.3 -95.6 157.9 6.3 -29.7 -11.8 32 41 A W E -J 26 0B 80 -2,-0.2 -6,-0.2 -6,-0.2 28,-0.1 -0.777 33.6-162.4 -85.4 121.9 4.3 -27.0 -9.9 33 42 A E E -J 25 0B 104 -8,-2.9 -8,-2.8 -2,-0.6 2,-0.1 -0.884 28.4-103.1-104.6 138.1 3.6 -28.0 -6.3 34 43 A P E +J 24 0B 115 0, 0.0 -10,-0.2 0, 0.0 3,-0.1 -0.362 44.6 167.3 -56.1 130.1 0.9 -26.2 -4.2 35 44 A F E - 0 0 38 -12,-3.1 2,-0.3 1,-0.4 -11,-0.2 0.775 54.9 -28.1-114.6 -53.6 2.6 -23.9 -1.7 36 45 A A E -J 23 0B 20 -13,-1.6 -13,-3.6 2,-0.0 -1,-0.4 -0.982 51.4-169.3-161.5 161.3 -0.1 -21.6 -0.2 37 46 A S E +J 22 0B 78 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.985 14.7 140.9-153.7 162.9 -3.5 -20.0 -0.8 38 47 A G E -J 21 0B 26 -17,-2.0 -17,-2.6 -2,-0.3 2,-0.3 -0.964 39.9 -93.9-176.7-173.6 -6.0 -17.4 0.5 39 48 A K E -J 20 0B 127 -2,-0.3 -19,-0.2 -19,-0.2 2,-0.1 -0.960 39.5-107.9-122.6 142.3 -8.5 -14.6 -0.2 40 49 A T - 0 0 3 -21,-1.8 -22,-1.7 -2,-0.3 6,-0.2 -0.394 37.3-131.2 -68.0 147.9 -7.9 -10.8 -0.2 41 50 A S > - 0 0 51 4,-2.6 3,-1.7 -24,-0.2 -23,-0.2 -0.046 38.0 -76.6 -84.7-170.2 -9.3 -8.8 2.7 42 51 A E T 3 S+ 0 0 166 1,-0.3 -25,-0.1 -25,-0.1 -2,-0.1 0.732 134.6 51.9 -58.1 -28.1 -11.4 -5.7 2.9 43 52 A S T 3 S- 0 0 53 2,-0.2 -1,-0.3 -29,-0.1 -27,-0.1 0.372 119.9-111.0 -90.3 2.0 -8.2 -3.7 2.2 44 53 A G S < S+ 0 0 0 -3,-1.7 -37,-2.4 1,-0.3 2,-0.3 0.571 79.2 127.1 76.4 12.7 -7.5 -5.9 -0.9 45 54 A E E -B 6 0A 43 -39,-0.2 -4,-2.6 -6,-0.1 2,-0.5 -0.736 48.0-157.9-106.0 147.4 -4.5 -7.4 0.9 46 55 A L E +B 5 0A 15 -41,-2.4 -41,-1.7 -2,-0.3 2,-0.2 -0.951 21.7 173.2-125.3 109.7 -3.5 -11.0 1.6 47 56 A H + 0 0 102 -2,-0.5 -43,-0.1 -43,-0.2 -2,-0.0 -0.706 51.8 38.6-109.6 160.8 -1.1 -11.5 4.5 48 57 A G + 0 0 58 -2,-0.2 -1,-0.2 -45,-0.2 -44,-0.1 0.694 61.4 137.7 76.6 21.1 0.2 -14.6 6.3 49 58 A L S S- 0 0 16 -46,-0.6 2,-0.2 -3,-0.2 -12,-0.2 0.880 74.6 -13.4 -62.5 -38.4 0.6 -16.8 3.2 50 59 A T - 0 0 11 -47,-0.3 2,-0.3 -14,-0.1 -47,-0.2 -0.810 64.1-115.5-150.9-175.9 4.0 -18.2 4.4 51 60 A T > - 0 0 67 -2,-0.2 4,-2.5 -50,-0.1 3,-0.1 -0.873 33.3-106.4-129.4 164.9 6.9 -17.8 6.9 52 61 A E T 4 S+ 0 0 122 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 0.833 120.4 51.4 -57.6 -35.7 10.6 -17.0 6.8 53 62 A E T 4 S+ 0 0 156 1,-0.2 -1,-0.2 3,-0.0 3,-0.1 0.886 116.4 38.6 -67.7 -41.1 11.4 -20.7 7.5 54 63 A E T 4 S+ 0 0 94 1,-0.2 2,-2.1 -3,-0.1 -2,-0.2 0.813 97.4 78.9 -82.3 -34.0 9.1 -22.1 4.8 55 64 A F < + 0 0 8 -4,-2.5 -1,-0.2 3,-0.0 3,-0.1 -0.447 66.8 161.9 -82.8 70.0 9.8 -19.5 2.0 56 65 A V - 0 0 74 -2,-2.1 32,-0.1 1,-0.2 34,-0.1 -0.139 48.6 -62.7 -78.4 177.8 13.1 -20.9 0.8 57 66 A E S S+ 0 0 121 32,-0.2 2,-0.3 30,-0.1 -1,-0.2 -0.319 83.0 99.0 -55.2 145.0 14.9 -20.2 -2.6 58 67 A G E S- L 0 88B 17 30,-1.3 30,-2.7 -3,-0.1 2,-0.5 -0.932 74.3 -67.3 162.6-176.1 13.0 -21.3 -5.7 59 68 A I E - L 0 87B 39 -33,-0.3 -33,-2.7 -2,-0.3 2,-0.3 -0.907 51.5-167.0-102.5 125.9 10.7 -20.3 -8.6 60 69 A Y E -KL 25 86B 0 26,-3.0 26,-2.1 -2,-0.5 2,-0.4 -0.828 14.1-154.3-115.9 151.5 7.3 -19.3 -7.4 61 70 A K E -KL 24 85B 27 -37,-2.7 -37,-2.6 -2,-0.3 2,-0.6 -0.993 3.2-166.1-125.8 123.3 4.0 -18.8 -9.2 62 71 A V E -KL 23 84B 0 22,-2.9 22,-2.5 -2,-0.4 2,-0.6 -0.951 9.7-168.8-106.7 115.9 1.2 -16.5 -7.8 63 72 A E E -KL 22 83B 48 -41,-3.1 -41,-2.4 -2,-0.6 2,-0.5 -0.921 3.2-161.9-111.8 115.7 -2.1 -17.0 -9.6 64 73 A I E -KL 21 82B 0 18,-3.4 18,-2.2 -2,-0.6 2,-2.2 -0.861 19.2-133.4-102.6 123.0 -4.8 -14.4 -9.0 65 74 A D > + 0 0 44 -45,-3.0 4,-1.2 -2,-0.5 -45,-0.4 -0.457 43.2 155.6 -79.8 75.5 -8.4 -15.5 -9.8 66 75 A T H > + 0 0 6 -2,-2.2 4,-2.3 1,-0.2 5,-0.2 0.810 64.8 63.4 -70.1 -31.6 -9.4 -12.3 -11.7 67 76 A K H > S+ 0 0 60 13,-0.8 4,-2.4 -3,-0.2 -1,-0.2 0.946 103.1 46.3 -60.4 -51.5 -12.1 -14.1 -13.7 68 77 A S H > S+ 0 0 70 12,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.867 111.5 54.9 -59.1 -38.8 -14.3 -15.0 -10.7 69 78 A Y H X S+ 0 0 22 -4,-1.2 4,-0.6 2,-0.2 -1,-0.2 0.949 111.7 41.0 -57.1 -54.4 -13.9 -11.5 -9.4 70 79 A W H ><>S+ 0 0 4 -4,-2.3 5,-2.6 1,-0.2 3,-0.8 0.878 112.6 55.8 -65.1 -37.4 -15.2 -9.8 -12.6 71 80 A K H ><5S+ 0 0 115 -4,-2.4 3,-1.3 1,-0.3 -1,-0.2 0.840 102.0 55.2 -65.5 -37.4 -18.0 -12.4 -13.1 72 81 A A H 3<5S+ 0 0 90 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.667 107.8 51.4 -69.7 -18.7 -19.4 -11.8 -9.6 73 82 A L T <<5S- 0 0 66 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.339 125.3-104.7 -95.8 2.4 -19.6 -8.1 -10.6 74 83 A G T < 5S+ 0 0 69 -3,-1.3 2,-0.4 1,-0.3 -3,-0.2 0.596 80.6 126.1 89.0 13.3 -21.5 -9.0 -13.8 75 84 A I < - 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