==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 24-JUN-08 3DJT . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.CENDRON,G.ZANOTTI,C.FOLLI,R.BERNI . 231 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11130.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 173 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 90 39.0 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 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 5.6 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 1 1 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 . 1 5 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 64 0, 0.0 3,-0.1 0, 0.0 50,-0.1 0.000 360.0 360.0 360.0 109.7 16.3 31.7 25.8 2 11 A P + 0 0 14 0, 0.0 94,-2.2 0, 0.0 2,-0.2 0.419 360.0 32.2 -79.7 -1.6 13.7 30.7 28.4 3 12 A L E +a 96 0A 2 92,-0.2 46,-0.6 47,-0.2 2,-0.3 -0.795 67.3 164.8-161.4 115.2 16.4 30.7 31.2 4 13 A M E -a 97 0A 39 92,-3.2 94,-4.3 -2,-0.2 2,-0.4 -0.948 18.5-152.3-138.0 150.5 19.5 32.7 31.6 5 14 A V E -aB 98 46A 0 41,-1.6 41,-2.3 -2,-0.3 2,-0.4 -0.968 7.4-170.6-123.6 138.6 22.0 33.4 34.4 6 15 A K E -aB 99 45A 65 92,-3.1 94,-3.3 -2,-0.4 2,-0.4 -0.988 6.0-167.3-129.6 131.8 24.2 36.6 34.9 7 16 A V E -a 100 0A 0 37,-2.8 9,-1.9 -2,-0.4 2,-0.3 -0.952 2.7-171.6-124.2 140.3 26.9 36.9 37.4 8 17 A L E -aC 101 15A 70 92,-2.2 94,-2.1 -2,-0.4 2,-0.6 -0.946 22.9-130.2-126.6 148.7 28.8 39.9 38.6 9 18 A D E >> -aC 102 14A 3 5,-3.7 5,-1.5 -2,-0.3 4,-1.2 -0.894 14.6-170.2 -96.0 115.9 31.9 40.5 40.8 10 19 A A T 45S+ 0 0 48 92,-2.1 93,-0.1 -2,-0.6 -1,-0.1 0.484 86.9 53.4 -81.2 -16.1 31.1 43.1 43.5 11 20 A V T 45S+ 0 0 83 91,-0.4 -1,-0.2 3,-0.1 92,-0.1 0.692 121.6 27.0 -88.6 -39.0 34.8 43.2 44.5 12 21 A R T 45S- 0 0 166 2,-0.2 -2,-0.2 0, 0.0 -1,-0.0 0.496 99.6-128.9 -98.8 -14.7 36.2 43.9 41.0 13 22 A G T <5S+ 0 0 72 -4,-1.2 -3,-0.2 1,-0.2 -5,-0.0 0.977 73.1 102.0 59.2 58.9 33.1 45.7 39.6 14 23 A S E - 0 0 0 -9,-1.9 3,-0.5 28,-0.2 2,-0.2 -0.812 39.3-155.7 -93.2 107.4 32.3 37.1 36.9 17 26 A I T 3 + 0 0 60 -2,-0.9 24,-0.2 1,-0.2 25,-0.1 -0.572 62.2 13.2 -91.2 145.2 34.0 35.1 34.2 18 27 A N T 3 S+ 0 0 114 22,-1.7 2,-0.6 1,-0.2 -1,-0.2 0.772 77.9 161.8 64.4 23.0 34.4 31.3 33.9 19 28 A V < - 0 0 1 -3,-0.5 21,-2.5 22,-0.2 2,-0.3 -0.736 30.9-141.2 -77.4 123.3 31.8 30.6 36.7 20 29 A A E -J 39 0B 28 -2,-0.6 45,-2.6 45,-0.4 2,-0.3 -0.600 22.3-177.3 -90.5 137.4 30.6 27.0 36.5 21 30 A M E -JK 38 64B 1 17,-3.9 17,-3.1 -2,-0.3 2,-0.4 -0.991 15.5-156.8-138.9 148.9 27.0 26.2 37.2 22 31 A H E -JK 37 63B 72 41,-2.2 41,-3.0 -2,-0.3 2,-0.4 -0.983 8.7-154.8-127.5 129.0 24.8 23.1 37.4 23 32 A V E -JK 36 62B 3 13,-4.3 12,-2.7 -2,-0.4 13,-1.8 -0.907 14.2-173.2-105.2 135.2 21.1 23.1 36.9 24 33 A F E -JK 34 61B 39 37,-2.9 37,-2.5 -2,-0.4 2,-0.3 -0.861 12.5-148.4-125.0 155.5 18.9 20.3 38.5 25 34 A R E -JK 33 60B 78 8,-3.8 8,-3.0 -2,-0.3 2,-0.9 -0.917 26.3-114.0-121.2 148.2 15.2 19.3 38.3 26 35 A K E -J 32 0B 66 33,-2.4 33,-0.3 -2,-0.3 6,-0.2 -0.744 34.3-144.0 -86.0 107.8 13.1 17.8 41.0 27 36 A A > - 0 0 12 4,-3.6 3,-2.8 -2,-0.9 4,-0.1 -0.179 29.5 -99.4 -62.2 161.9 12.1 14.2 40.0 28 37 A A T 3 S+ 0 0 114 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.758 126.9 55.2 -53.4 -26.2 8.6 12.6 40.9 29 38 A D T 3 S- 0 0 102 2,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.236 123.4-105.3 -90.9 8.8 10.4 10.9 43.7 30 39 A D S < S+ 0 0 118 -3,-2.8 2,-0.3 1,-0.3 -2,-0.1 0.713 79.2 126.4 70.3 22.9 11.7 14.2 45.2 31 40 A T - 0 0 73 -4,-0.1 -4,-3.6 0, 0.0 2,-1.1 -0.807 67.8-103.9-102.9 162.9 15.3 13.8 44.1 32 41 A W E -J 26 0B 72 -2,-0.3 -6,-0.2 -6,-0.2 28,-0.1 -0.691 33.7-162.8 -88.5 97.4 17.4 16.2 42.0 33 42 A E E -J 25 0B 114 -8,-3.0 -8,-3.8 -2,-1.1 -3,-0.0 -0.683 28.3-108.6 -73.0 131.0 17.7 15.0 38.5 34 43 A P E +J 24 0B 99 0, 0.0 -10,-0.2 0, 0.0 3,-0.1 -0.233 42.8 168.1 -53.9 143.0 20.5 16.7 36.5 35 44 A F E - 0 0 39 -12,-2.7 2,-0.3 1,-0.4 -11,-0.2 0.646 55.5 -28.9-132.9 -38.0 19.1 19.1 33.8 36 45 A A E -J 23 0B 25 -13,-1.8 -13,-4.3 2,-0.0 -1,-0.4 -0.926 48.0-161.1 179.2 160.4 22.0 21.2 32.5 37 46 A S E +J 22 0B 74 -15,-0.3 2,-0.3 -2,-0.3 -15,-0.2 -0.965 19.7 139.9-150.6 154.0 25.4 22.7 33.3 38 47 A G E -J 21 0B 26 -17,-3.1 -17,-3.9 -2,-0.3 2,-0.3 -0.969 38.7-102.2-176.8-174.1 27.7 25.4 32.0 39 48 A K E -J 20 0B 125 -2,-0.3 -19,-0.2 -19,-0.3 6,-0.1 -0.959 36.6-110.8-128.3 132.6 30.2 28.2 32.6 40 49 A T - 0 0 2 -21,-2.5 -22,-1.7 -2,-0.3 6,-0.2 -0.316 36.5-129.8 -62.1 145.5 29.6 32.0 32.3 41 50 A S > - 0 0 53 4,-2.6 3,-2.5 -24,-0.2 -22,-0.2 -0.068 39.2 -72.7 -76.5-169.3 31.3 33.8 29.5 42 51 A E T 3 S+ 0 0 167 1,-0.3 -25,-0.1 -25,-0.1 -2,-0.1 0.739 136.6 51.5 -55.9 -28.2 33.5 37.0 29.2 43 52 A S T 3 S- 0 0 54 2,-0.2 -1,-0.3 -29,-0.1 -27,-0.1 0.322 119.1-114.2 -93.2 3.1 30.3 39.0 29.9 44 53 A G S < S+ 0 0 0 -3,-2.5 -37,-2.8 1,-0.2 2,-0.3 0.588 77.1 124.1 72.4 19.0 29.5 36.8 33.0 45 54 A E E -B 6 0A 49 -39,-0.2 -4,-2.6 -6,-0.1 2,-0.4 -0.750 48.7-155.3-115.9 148.4 26.4 35.4 31.3 46 55 A L E +B 5 0A 18 -41,-2.3 -41,-1.6 -2,-0.3 2,-0.2 -0.977 21.2 174.0-126.5 122.0 25.3 31.9 30.5 47 56 A H + 0 0 92 -2,-0.4 -43,-0.1 -43,-0.2 -2,-0.0 -0.731 50.2 32.8-119.3 166.9 22.9 31.2 27.7 48 57 A G + 0 0 61 -2,-0.2 -1,-0.2 -45,-0.1 -44,-0.1 0.846 60.4 144.0 61.6 39.6 21.3 28.2 25.8 49 58 A L S S- 0 0 16 -46,-0.6 2,-0.2 -3,-0.2 -12,-0.1 0.798 74.3 -20.4 -71.9 -32.3 21.1 25.9 28.9 50 59 A T - 0 0 12 -47,-0.2 2,-0.3 -14,-0.1 -47,-0.2 -0.757 68.0-108.2-157.9-164.0 17.8 24.5 27.6 51 60 A T > - 0 0 72 -2,-0.2 4,-2.3 -50,-0.1 0, 0.0 -0.888 32.5-103.1-143.0 162.6 14.8 25.1 25.3 52 61 A E T 4 S+ 0 0 119 -2,-0.3 -1,-0.1 1,-0.2 42,-0.1 0.901 121.6 46.6 -53.4 -49.3 11.1 25.9 25.5 53 62 A E T 4 S+ 0 0 185 1,-0.2 -1,-0.2 3,-0.1 3,-0.0 0.860 118.4 40.4 -58.8 -44.3 10.2 22.2 24.8 54 63 A E T 4 S+ 0 0 95 1,-0.2 2,-1.5 2,-0.1 -2,-0.2 0.771 100.9 76.0 -81.9 -24.4 12.6 20.7 27.3 55 64 A F < + 0 0 7 -4,-2.3 -1,-0.2 3,-0.0 2,-0.1 -0.646 69.8 159.8 -92.7 79.2 12.0 23.4 30.0 56 65 A V - 0 0 73 -2,-1.5 32,-0.2 1,-0.2 34,-0.1 -0.399 48.8 -57.8 -93.1 178.4 8.6 22.1 31.2 57 66 A E S S+ 0 0 112 32,-0.3 2,-0.3 -2,-0.1 32,-0.2 -0.185 83.7 100.4 -48.4 139.8 6.7 22.8 34.5 58 67 A G E S- L 0 88B 15 30,-1.6 30,-2.3 -3,-0.1 2,-0.5 -0.955 74.5 -76.9 164.7 178.4 8.6 21.7 37.6 59 68 A I E - L 0 87B 41 -2,-0.3 -33,-2.4 -33,-0.3 2,-0.3 -0.981 51.7-173.6-106.5 119.2 10.8 22.8 40.6 60 69 A Y E -KL 25 86B 1 26,-2.6 26,-2.3 -2,-0.5 2,-0.4 -0.790 14.7-154.0-114.8 158.1 14.4 23.6 39.4 61 70 A K E -KL 24 85B 18 -37,-2.5 -37,-2.9 -2,-0.3 2,-0.5 -0.980 0.2-160.5-134.7 125.9 17.5 24.4 41.2 62 71 A V E -KL 23 84B 0 22,-2.4 22,-2.9 -2,-0.4 2,-0.6 -0.922 9.9-163.3-105.3 125.3 20.6 26.4 39.8 63 72 A E E -KL 22 83B 33 -41,-3.0 -41,-2.2 -2,-0.5 2,-0.6 -0.933 2.6-159.3-113.7 115.5 23.8 25.8 41.7 64 73 A I E -KL 21 82B 0 18,-3.6 18,-2.4 -2,-0.6 2,-2.0 -0.802 14.7-139.4-101.8 119.4 26.5 28.4 41.1 65 74 A D > + 0 0 23 -45,-2.6 4,-0.7 -2,-0.6 -45,-0.4 -0.483 40.7 154.6 -84.1 76.9 29.9 27.3 42.0 66 75 A T H > + 0 0 5 -2,-2.0 4,-2.1 1,-0.2 3,-0.4 0.846 62.0 64.8 -75.0 -38.3 31.2 30.5 43.6 67 76 A K H > S+ 0 0 51 13,-0.9 4,-2.0 -3,-0.2 -1,-0.2 0.943 102.3 49.0 -47.1 -50.0 33.8 28.9 45.9 68 77 A S H > S+ 0 0 80 12,-0.3 4,-1.2 1,-0.2 -1,-0.2 0.797 108.6 55.7 -69.2 -27.2 35.9 27.7 42.9 69 78 A Y H < S+ 0 0 25 -4,-0.7 4,-0.4 -3,-0.4 -1,-0.2 0.936 109.8 44.3 -63.0 -49.5 35.7 31.2 41.4 70 79 A W H ><>S+ 0 0 3 -4,-2.1 5,-3.2 1,-0.2 3,-0.8 0.787 106.1 60.5 -67.8 -37.6 37.1 32.9 44.5 71 80 A K H ><5S+ 0 0 104 -4,-2.0 3,-2.5 3,-0.2 -1,-0.2 0.949 98.6 58.1 -54.0 -50.6 40.0 30.3 45.0 72 81 A A T 3<5S+ 0 0 84 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.651 107.8 47.7 -56.7 -17.4 41.4 31.1 41.5 73 82 A L T < 5S- 0 0 56 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.163 126.6 -98.6-112.7 16.9 41.8 34.8 42.6 74 83 A G T < 5S+ 0 0 71 -3,-2.5 2,-0.4 1,-0.2 -3,-0.2 0.597 81.1 130.1 76.7 14.8 43.4 33.9 46.0 75 84 A I < - 0 0 55 -5,-3.2 -1,-0.2 -6,-0.1 -2,-0.2 -0.846 51.9-148.5-112.5 138.4 40.3 34.2 48.1 76 85 A S - 0 0 81 -2,-0.4 2,-0.1 -5,-0.1 -9,-0.1 -0.912 29.9-160.9 -95.7 101.5 38.7 31.9 50.7 77 86 A P - 0 0 14 0, 0.0 28,-0.2 0, 0.0 -10,-0.0 -0.363 19.4-130.5 -78.0 164.2 35.0 32.6 50.4 78 87 A F S S+ 0 0 10 26,-2.5 126,-0.8 -2,-0.1 2,-0.2 0.892 83.9 64.9 -80.9 -48.2 32.4 31.8 53.0 79 88 A H E -N 203 0C 4 25,-0.5 124,-0.3 124,-0.2 3,-0.1 -0.540 67.1-146.2 -85.9 142.2 29.7 30.0 50.9 80 89 A E E S- 0 0 34 122,-3.7 -13,-0.9 1,-0.3 -12,-0.3 0.861 80.0 -37.2 -71.1 -38.5 30.3 26.6 49.2 81 90 A H E -N 202 0C 30 121,-0.7 121,-0.6 -15,-0.2 2,-0.5 -0.951 62.0 -96.9-165.2-180.0 28.1 27.8 46.4 82 91 A A E -L 64 0B 1 -18,-2.4 -18,-3.6 -2,-0.3 2,-0.4 -0.972 34.5-161.2-114.3 133.2 25.0 29.7 45.6 83 92 A E E -L 63 0B 7 117,-0.5 2,-0.4 -2,-0.5 117,-0.4 -0.903 7.0-169.0-116.7 133.0 21.7 27.8 45.2 84 93 A V E -L 62 0B 2 -22,-2.9 -22,-2.4 -2,-0.4 2,-0.4 -0.904 8.4-178.6-124.3 114.7 18.5 29.1 43.5 85 94 A V E +L 61 0B 3 113,-0.6 112,-2.3 -2,-0.4 113,-0.4 -0.881 14.8 145.1-112.7 133.2 15.3 27.0 43.8 86 95 A F E -LM 60 196B 1 -26,-2.3 -26,-2.6 -2,-0.4 2,-0.4 -0.990 48.3-111.3-160.3 151.1 12.0 27.9 42.2 87 96 A T E -L 59 0B 38 108,-0.6 2,-0.4 -2,-0.3 -28,-0.2 -0.758 41.8-166.8 -77.9 132.0 8.9 26.6 40.5 88 97 A A E +L 58 0B 0 -30,-2.3 -30,-1.6 -2,-0.4 4,-0.1 -0.941 55.5 4.6-123.0 144.3 8.9 27.4 36.8 89 98 A N S > S+ 0 0 13 -2,-0.4 3,-1.1 -32,-0.2 -32,-0.3 0.595 73.2 136.9 67.6 20.5 6.2 27.3 34.1 90 99 A D T 3 S+ 0 0 102 1,-0.3 -1,-0.1 -32,-0.1 -2,-0.0 0.532 80.1 34.9 -77.9 -2.1 3.3 26.4 36.4 91 100 A S T 3 S- 0 0 82 1,-0.7 -1,-0.3 0, 0.0 -2,-0.1 -0.157 136.0 -56.6-137.9 39.9 1.0 28.9 34.8 92 101 A G S < S- 0 0 33 -3,-1.1 -1,-0.7 -4,-0.1 2,-0.2 -0.228 87.5 -38.4 107.2 167.5 2.2 28.6 31.1 93 102 A P + 0 0 73 0, 0.0 2,-0.3 0, 0.0 -37,-0.1 -0.406 61.5 177.0 -69.0 134.7 5.7 29.2 29.7 94 103 A R - 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