==== 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 3KGS . 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) . 11117.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 180 78.3 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 . 1 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 . 34 14.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 5.7 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 2 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 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 79 0, 0.0 50,-0.1 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 89.0 16.2 30.7 25.5 2 11 A P + 0 0 6 0, 0.0 94,-3.0 0, 0.0 2,-0.4 0.573 360.0 48.4 -78.1 -12.3 13.9 30.3 28.6 3 12 A L E +a 96 0A 1 47,-0.2 46,-0.6 92,-0.2 2,-0.4 -0.980 59.7 165.0-135.9 121.4 16.7 30.2 31.2 4 13 A M E -a 97 0A 25 92,-2.5 94,-2.7 -2,-0.4 2,-0.4 -0.991 16.4-159.4-130.5 141.3 19.6 32.5 31.5 5 14 A V E -aB 98 46A 0 41,-1.7 41,-2.2 -2,-0.4 2,-0.4 -0.992 6.2-171.0-123.3 128.2 22.0 33.0 34.4 6 15 A K E -aB 99 45A 72 92,-3.2 94,-3.1 -2,-0.4 2,-0.4 -0.962 4.4-165.6-117.2 136.6 24.1 36.2 34.9 7 16 A V E -a 100 0A 0 37,-2.6 9,-2.7 -2,-0.4 2,-0.3 -0.987 3.3-170.4-128.8 129.2 26.9 36.4 37.5 8 17 A L E -aC 101 15A 74 92,-2.7 94,-2.9 -2,-0.4 2,-0.6 -0.900 20.3-134.6-120.0 147.6 28.6 39.6 38.8 9 18 A D E >> -aC 102 14A 2 5,-3.3 4,-1.6 -2,-0.3 5,-1.4 -0.896 12.6-167.7-102.3 112.9 31.6 40.2 41.0 10 19 A A T 45S+ 0 0 48 92,-2.9 93,-0.1 -2,-0.6 -1,-0.1 0.520 84.2 57.5 -81.5 -6.9 30.9 42.9 43.6 11 20 A V T 45S+ 0 0 87 91,-0.4 -1,-0.2 3,-0.1 92,-0.1 0.866 120.8 24.7 -85.2 -43.8 34.6 43.2 44.6 12 21 A R T 45S- 0 0 140 2,-0.2 -2,-0.2 3,-0.0 -1,-0.1 0.606 99.8-126.2 -97.4 -13.6 35.9 44.1 41.1 13 22 A G T <5S+ 0 0 72 -4,-1.6 -3,-0.2 1,-0.3 -5,-0.0 0.969 72.3 110.4 61.9 55.7 32.7 45.5 39.6 14 23 A S E - 0 0 0 -9,-2.7 3,-0.5 28,-0.2 2,-0.2 -0.882 39.3-157.0 -95.0 107.6 32.2 36.9 36.9 17 26 A I T 3 + 0 0 81 -2,-0.8 24,-0.2 1,-0.2 25,-0.1 -0.615 60.8 11.4 -93.6 147.7 33.8 35.0 34.1 18 27 A N T 3 S+ 0 0 89 22,-1.8 2,-0.6 -2,-0.2 -1,-0.2 0.796 78.4 160.4 59.8 32.2 34.2 31.2 33.7 19 28 A V < - 0 0 2 -3,-0.5 21,-1.9 22,-0.2 -1,-0.2 -0.765 31.7-140.3 -86.6 123.3 31.9 30.5 36.7 20 29 A A E +J 39 0B 33 -2,-0.6 45,-3.0 45,-0.4 2,-0.3 -0.513 24.7 175.1 -84.2 146.4 30.7 26.9 36.5 21 30 A M E -JK 38 64B 1 17,-2.4 17,-2.0 43,-0.2 2,-0.4 -0.991 18.2-151.3-150.4 153.3 27.2 25.9 37.4 22 31 A H E -JK 37 63B 95 41,-2.1 41,-3.1 -2,-0.3 2,-0.4 -0.978 8.8-152.4-127.1 135.2 25.0 22.8 37.4 23 32 A V E -JK 36 62B 1 13,-4.0 12,-3.1 -2,-0.4 13,-1.8 -0.910 14.2-175.2-109.6 135.3 21.2 22.7 37.0 24 33 A F E -JK 34 61B 38 37,-2.7 37,-2.6 -2,-0.4 2,-0.4 -0.899 13.0-149.2-125.5 153.9 19.1 19.9 38.4 25 34 A R E -JK 33 60B 69 8,-2.7 8,-2.5 -2,-0.3 2,-0.4 -0.992 26.1-114.9-124.6 135.7 15.4 19.1 38.2 26 35 A K E -J 32 0B 69 33,-2.9 33,-0.3 -2,-0.4 6,-0.2 -0.541 34.7-144.7 -71.7 123.8 13.4 17.3 40.9 27 36 A A > - 0 0 11 4,-3.1 3,-2.0 -2,-0.4 -1,-0.1 -0.312 28.6 -97.0 -82.1 169.9 12.2 13.9 39.8 28 37 A A T 3 S+ 0 0 106 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.863 125.8 55.7 -53.1 -39.9 8.9 12.2 40.6 29 38 A D T 3 S- 0 0 111 2,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.194 121.2-109.3 -81.4 15.6 10.7 10.2 43.4 30 39 A D S < S+ 0 0 122 -3,-2.0 2,-0.2 1,-0.2 -2,-0.1 0.579 77.5 126.7 68.7 14.4 11.9 13.5 44.9 31 40 A T - 0 0 72 -6,-0.0 -4,-3.1 1,-0.0 2,-0.7 -0.680 66.6-106.0 -96.8 158.2 15.6 13.2 44.0 32 41 A W E -J 26 0B 85 -2,-0.2 -6,-0.2 -6,-0.2 28,-0.1 -0.750 35.2-165.3 -85.4 111.9 17.7 15.8 42.1 33 42 A E E -J 25 0B 96 -8,-2.5 -8,-2.7 -2,-0.7 2,-0.2 -0.808 30.0-104.0 -98.4 133.8 18.3 14.7 38.5 34 43 A P E +J 24 0B 114 0, 0.0 -10,-0.3 0, 0.0 3,-0.1 -0.430 45.3 167.0 -57.9 123.6 21.1 16.4 36.4 35 44 A F E - 0 0 36 -12,-3.1 2,-0.3 1,-0.4 -11,-0.2 0.818 55.4 -27.2-108.3 -49.4 19.4 18.8 33.9 36 45 A A E -J 23 0B 20 -13,-1.8 -13,-4.0 2,-0.0 -1,-0.4 -0.976 50.7-167.9-164.1 163.4 22.1 21.1 32.4 37 46 A S E +J 22 0B 73 -2,-0.3 2,-0.3 -15,-0.3 -15,-0.2 -0.979 16.6 138.6-156.1 163.7 25.5 22.6 33.1 38 47 A G E -J 21 0B 25 -17,-2.0 -17,-2.4 -2,-0.3 2,-0.3 -0.979 39.2 -98.5 177.7-176.1 27.8 25.3 31.8 39 48 A K E -J 20 0B 112 -2,-0.3 -19,-0.2 -19,-0.2 2,-0.1 -0.966 38.3-104.8-127.2 144.9 30.2 28.2 32.5 40 49 A T - 0 0 4 -21,-1.9 -22,-1.8 -2,-0.3 6,-0.2 -0.377 36.3-131.4 -67.2 146.6 29.7 31.9 32.3 41 50 A S > - 0 0 52 4,-2.6 3,-2.1 -24,-0.2 -23,-0.2 -0.099 40.3 -78.1 -82.6-174.0 31.1 33.8 29.3 42 51 A E T 3 S+ 0 0 168 1,-0.3 -25,-0.1 -25,-0.1 -2,-0.1 0.710 135.0 55.5 -59.7 -21.3 33.3 37.0 29.3 43 52 A S T 3 S- 0 0 51 2,-0.2 -1,-0.3 -29,-0.1 -27,-0.1 0.437 118.9-113.7 -90.4 -1.2 30.0 38.9 29.8 44 53 A G S < S+ 0 0 0 -3,-2.1 -37,-2.6 1,-0.3 2,-0.3 0.596 78.2 125.0 77.6 14.7 29.3 36.8 33.0 45 54 A E E -B 6 0A 41 -39,-0.2 -4,-2.6 -6,-0.1 2,-0.5 -0.782 48.6-158.9-109.8 146.8 26.3 35.2 31.2 46 55 A L E +B 5 0A 20 -41,-2.2 -41,-1.7 -2,-0.3 2,-0.2 -0.961 21.8 171.3-125.2 111.3 25.3 31.6 30.5 47 56 A H + 0 0 101 -2,-0.5 -43,-0.1 -43,-0.2 -2,-0.0 -0.666 51.7 41.8-107.2 164.8 22.9 31.1 27.7 48 57 A G + 0 0 62 -45,-0.2 -1,-0.1 -2,-0.2 -44,-0.1 0.623 61.1 135.4 77.2 14.8 21.6 27.9 26.0 49 58 A L S S- 0 0 16 -46,-0.6 2,-0.2 -3,-0.2 -12,-0.1 0.845 76.7 -11.5 -61.9 -33.8 21.2 25.7 29.1 50 59 A T - 0 0 13 -47,-0.3 2,-0.3 -14,-0.1 -47,-0.2 -0.833 65.6-115.5-152.4-176.5 17.8 24.5 27.8 51 60 A T > - 0 0 68 -2,-0.2 4,-2.4 -50,-0.1 -2,-0.0 -0.882 33.9-106.3-127.2 163.1 15.0 24.9 25.3 52 61 A E T 4 S+ 0 0 115 -2,-0.3 -1,-0.1 1,-0.2 42,-0.1 0.883 120.5 48.3 -51.4 -43.5 11.3 25.8 25.6 53 62 A E T 4 S+ 0 0 155 1,-0.2 -1,-0.2 3,-0.0 3,-0.1 0.888 115.7 41.6 -67.4 -44.1 10.3 22.2 24.9 54 63 A E T 4 S+ 0 0 98 1,-0.2 2,-2.2 2,-0.1 -1,-0.2 0.814 96.5 79.4 -75.3 -32.2 12.7 20.6 27.4 55 64 A F < + 0 0 8 -4,-2.4 -1,-0.2 3,-0.0 3,-0.1 -0.458 68.8 165.8 -82.3 68.5 12.1 23.2 30.2 56 65 A V - 0 0 73 -2,-2.2 32,-0.1 1,-0.2 -2,-0.1 -0.190 47.9 -64.4 -76.3 172.7 8.9 21.7 31.4 57 66 A E S S+ 0 0 121 32,-0.2 2,-0.3 30,-0.1 -1,-0.2 -0.273 83.3 107.3 -50.7 141.6 7.1 22.5 34.7 58 67 A G E S- L 0 88B 15 30,-1.4 30,-3.2 -3,-0.1 2,-0.5 -0.944 72.3 -75.0 168.6 177.3 9.1 21.4 37.7 59 68 A I E - L 0 87B 39 -33,-0.3 -33,-2.9 -2,-0.3 2,-0.3 -0.911 51.2-168.1 -97.7 124.1 11.3 22.3 40.6 60 69 A Y E -KL 25 86B 0 26,-3.4 26,-2.6 -2,-0.5 2,-0.4 -0.857 12.3-160.3-116.6 148.9 14.7 23.4 39.4 61 70 A K E -KL 24 85B 21 -37,-2.6 -37,-2.7 -2,-0.3 2,-0.5 -0.997 1.2-165.6-129.1 129.3 18.0 24.0 41.3 62 71 A V E -KL 23 84B 0 22,-2.7 22,-1.0 -2,-0.4 2,-0.6 -0.975 5.8-166.2-110.8 120.9 20.9 25.9 40.0 63 72 A E E -KL 22 83B 48 -41,-3.1 -41,-2.1 -2,-0.5 2,-0.5 -0.941 7.4-160.5-108.9 111.7 24.1 25.4 42.0 64 73 A I E -KL 21 82B 0 18,-3.5 2,-2.3 -2,-0.6 18,-2.1 -0.818 17.7-132.9 -97.3 123.7 26.7 28.1 41.1 65 74 A D > + 0 0 54 -45,-3.0 4,-1.1 -2,-0.5 -45,-0.4 -0.429 45.7 152.5 -79.5 73.7 30.3 27.2 41.9 66 75 A T H > + 0 0 6 -2,-2.3 4,-2.3 1,-0.2 5,-0.2 0.809 63.4 65.5 -71.4 -30.4 31.2 30.5 43.6 67 76 A K H > S+ 0 0 49 13,-1.0 4,-2.8 -3,-0.3 5,-0.2 0.935 102.3 46.9 -60.6 -45.5 33.9 28.9 45.8 68 77 A S H > S+ 0 0 67 12,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.868 109.6 55.7 -63.2 -38.2 36.1 27.9 42.9 69 78 A Y H X S+ 0 0 21 -4,-1.1 4,-0.7 2,-0.2 -2,-0.2 0.957 113.4 39.2 -55.7 -54.3 35.7 31.4 41.4 70 79 A W H ><>S+ 0 0 5 -4,-2.3 5,-2.5 1,-0.2 3,-1.2 0.917 113.4 54.9 -66.4 -43.3 36.9 33.1 44.6 71 80 A K H ><5S+ 0 0 98 -4,-2.8 3,-1.8 1,-0.3 -1,-0.2 0.869 102.8 55.9 -57.9 -42.7 39.6 30.5 45.3 72 81 A A H 3<5S+ 0 0 90 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.729 107.3 51.4 -62.2 -21.7 41.1 31.1 41.8 73 82 A L T <<5S- 0 0 70 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.232 127.7-100.2 -97.0 9.6 41.4 34.8 42.8 74 83 A G T < 5S+ 0 0 72 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.388 83.6 126.4 90.2 0.4 43.2 33.9 46.0 75 84 A I < - 0 0 52 -5,-2.5 -1,-0.2 -6,-0.1 -2,-0.2 -0.751 53.0-150.1-102.8 133.6 40.1 34.3 48.3 76 85 A S - 0 0 84 -2,-0.4 -9,-0.1 -3,-0.1 2,-0.1 -0.885 32.8-161.9 -94.2 101.1 38.7 31.7 50.8 77 86 A P - 0 0 16 0, 0.0 28,-0.2 0, 0.0 -10,-0.0 -0.277 23.9-120.8 -84.2 172.0 35.0 32.6 50.6 78 87 A F S S+ 0 0 12 26,-3.0 125,-0.7 124,-0.1 27,-0.2 0.957 87.6 65.4 -73.8 -53.3 32.2 31.8 53.0 79 88 A H B -N 202 0C 5 25,-0.5 123,-0.3 123,-0.2 3,-0.1 -0.431 63.1-150.1 -82.7 145.6 29.8 29.9 50.8 80 89 A E S S- 0 0 36 121,-3.0 -13,-1.0 1,-0.3 2,-0.3 0.835 83.5 -27.1 -71.4 -35.7 30.4 26.6 49.1 81 90 A H - 0 0 26 120,-0.6 120,-0.5 -15,-0.2 2,-0.5 -0.950 64.1-104.3-163.2 172.8 28.1 27.7 46.3 82 91 A A E -L 64 0B 0 -18,-2.1 -18,-3.5 -2,-0.3 2,-0.2 -0.974 38.9-155.7-110.6 134.1 25.2 29.9 45.5 83 92 A E E -L 63 0B 0 -2,-0.5 2,-0.3 116,-0.3 -20,-0.2 -0.611 20.1-174.2-104.7 158.4 21.9 28.3 45.1 84 93 A V E +L 62 0B 0 -22,-1.0 -22,-2.7 -2,-0.2 2,-0.5 -0.793 10.6 178.1-147.6 112.8 18.7 29.0 43.3 85 94 A V E +L 61 0B 1 112,-0.5 111,-2.9 -2,-0.3 112,-0.6 -0.973 18.8 150.4-115.6 124.7 15.8 26.6 43.9 86 95 A F E -LM 60 195B 0 -26,-2.6 -26,-3.4 -2,-0.5 2,-0.5 -0.995 48.2-115.2-153.9 150.6 12.5 27.4 42.2 87 96 A T E -L 59 0B 42 107,-0.7 2,-0.4 -2,-0.3 -28,-0.2 -0.783 41.1-156.8 -83.2 128.8 9.3 26.1 40.7 88 97 A A E -L 58 0B 0 -30,-3.2 -30,-1.4 -2,-0.5 4,-0.1 -0.892 57.1 -1.1-114.2 143.9 9.2 26.9 37.0 89 98 A N > + 0 0 10 -2,-0.4 3,-1.7 -32,-0.2 -32,-0.2 0.653 69.8 145.9 63.0 25.0 6.4 27.3 34.4 90 99 A D T 3 S+ 0 0 108 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.654 80.6 36.2 -69.7 -15.9 3.6 26.5 36.9 91 100 A S T 3 S- 0 0 81 1,-0.7 -1,-0.3 0, 0.0 -2,-0.1 -0.043 136.2 -66.4-120.6 31.1 1.3 29.0 35.0 92 101 A G S < S- 0 0 31 -3,-1.7 -1,-0.7 -4,-0.1 -3,-0.1 -0.350 86.4 -29.0 103.7 169.8 2.6 28.3 31.5 93 102 A P + 0 0 96 0, 0.0 2,-0.3 0, 0.0 -37,-0.1 -0.312 63.4 175.8 -62.8 134.7 6.0 28.9 29.9 94 103 A R - 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