==== 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 3DJZ . 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) . 11234.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 169 73.2 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 . 83 35.9 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 . 28 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 6.5 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 2 0 0 3 0 3 1 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 1 0 0 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 71 0, 0.0 50,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 97.0 16.6 30.5 27.7 2 11 A P + 0 0 12 0, 0.0 94,-2.9 0, 0.0 2,-0.4 0.657 360.0 44.7 -74.4 -14.4 13.7 29.9 30.1 3 12 A L E S+a 96 0A 1 92,-0.2 46,-0.4 47,-0.2 2,-0.4 -0.929 71.3 171.1-131.1 109.5 16.2 29.5 33.1 4 13 A M E -a 97 0A 57 92,-2.8 94,-3.0 -2,-0.4 2,-0.4 -0.902 14.1-161.8-121.9 144.1 19.0 32.0 33.3 5 14 A V E -a 98 0A 1 -2,-0.4 2,-0.5 41,-0.3 94,-0.2 -0.991 3.5-170.6-125.8 132.9 21.5 32.4 36.1 6 15 A K E -a 99 0A 70 92,-2.9 94,-2.7 -2,-0.4 2,-0.5 -0.981 5.1-167.6-126.6 123.1 23.6 35.5 36.7 7 16 A V E -a 100 0A 0 37,-2.5 9,-2.9 -2,-0.5 2,-0.3 -0.938 4.1-171.4-118.1 129.2 26.4 35.4 39.3 8 17 A L E -aB 101 15A 64 92,-2.8 94,-3.0 -2,-0.5 2,-0.7 -0.907 20.7-134.4-120.4 147.8 28.2 38.6 40.6 9 18 A D E >> -aB 102 14A 3 5,-3.3 4,-1.4 -2,-0.3 5,-1.3 -0.894 12.1-168.2-104.0 112.2 31.3 39.0 42.8 10 19 A A T 45S+ 0 0 48 92,-2.7 93,-0.1 -2,-0.7 -1,-0.1 0.499 85.6 55.1 -74.6 -13.6 30.6 41.8 45.4 11 20 A V T 45S+ 0 0 85 91,-0.5 -1,-0.2 3,-0.1 92,-0.1 0.839 120.3 27.6 -86.9 -43.4 34.4 41.9 46.4 12 21 A R T 45S- 0 0 129 2,-0.2 -2,-0.2 3,-0.0 -1,-0.1 0.592 99.3-127.5 -95.5 -9.7 35.8 42.6 42.9 13 22 A G T <5S+ 0 0 71 -4,-1.4 -3,-0.2 1,-0.2 3,-0.0 0.939 72.5 105.7 60.9 47.4 32.7 44.4 41.4 14 23 A S E - 0 0 16 4,-3.5 3,-2.0 -2,-0.5 4,-0.1 -0.425 27.6 -97.6 -88.8 165.7 11.9 13.3 40.9 28 37 A A T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.863 123.0 56.8 -45.2 -43.2 8.8 11.2 41.5 29 38 A D T 3 S- 0 0 110 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.130 120.1-104.2 -82.6 23.2 10.7 9.3 44.2 30 39 A D S < S+ 0 0 130 -3,-2.0 2,-0.3 1,-0.2 -2,-0.1 0.674 84.5 119.1 64.4 18.5 11.6 12.4 46.3 31 40 A T S S- 0 0 73 -4,-0.1 -4,-3.5 -6,-0.0 2,-0.5 -0.791 70.5-106.7-107.6 159.8 15.2 12.4 45.1 32 41 A W E -H 26 0B 77 -2,-0.3 -6,-0.2 -6,-0.2 28,-0.1 -0.743 32.8-157.6 -85.1 124.7 17.0 15.2 43.2 33 42 A E E -H 25 0B 113 -8,-3.7 -8,-2.7 -2,-0.5 2,-0.0 -0.899 24.7-109.1-104.4 130.1 17.6 14.3 39.6 34 43 A P E +H 24 0B 105 0, 0.0 -10,-0.2 0, 0.0 3,-0.1 -0.326 44.7 164.3 -54.8 129.0 20.4 16.0 37.5 35 44 A F E - 0 0 35 -12,-2.8 2,-0.3 1,-0.4 -11,-0.2 0.672 56.7 -23.5-122.1 -40.5 18.7 18.3 35.0 36 45 A A E -H 23 0B 19 -13,-1.8 -13,-3.9 14,-0.1 -1,-0.4 -0.977 51.5-173.7-170.3 159.7 21.4 20.6 33.7 37 46 A S E +H 22 0B 77 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.983 11.8 151.6-158.9 162.6 24.8 22.2 34.5 38 47 A G E -H 21 0B 28 -17,-2.1 -17,-3.3 -2,-0.3 2,-0.4 -0.958 36.7-104.9-173.4-179.6 27.2 24.8 33.1 39 48 A K E -H 20 0B 136 -2,-0.3 8,-0.4 -19,-0.2 -19,-0.2 -0.977 40.0-104.0-125.3 140.7 29.9 27.3 34.0 40 49 A T - 0 0 2 -21,-2.3 -22,-2.5 -2,-0.4 -21,-0.1 -0.412 34.7-144.2 -66.5 137.8 29.5 31.1 34.0 41 50 A S > - 0 0 34 4,-2.5 3,-2.5 -24,-0.2 -22,-0.2 -0.079 44.3 -73.0 -83.6-170.7 31.0 32.9 31.1 42 51 A E T 3 S+ 0 0 167 1,-0.3 -25,-0.1 2,-0.1 -2,-0.1 0.699 134.6 58.6 -61.6 -20.9 32.7 36.3 31.1 43 52 A S T 3 S- 0 0 38 2,-0.3 -1,-0.3 -29,-0.1 -27,-0.1 0.435 119.6-110.1 -86.0 -1.1 29.2 37.8 31.6 44 53 A G S < S+ 0 0 0 -3,-2.5 -37,-2.5 1,-0.3 -28,-0.1 0.596 86.3 108.0 80.3 14.0 28.6 35.8 34.8 45 54 A E - 0 0 39 -39,-0.2 -4,-2.5 -6,-0.1 2,-0.5 -0.958 67.9-133.5-124.9 141.5 26.0 33.6 33.1 46 55 A P - 0 0 8 0, 0.0 3,-0.5 0, 0.0 2,-0.4 -0.783 35.1-131.6 -86.2 128.6 26.2 30.0 31.9 47 56 A H S S+ 0 0 134 -2,-0.5 -8,-0.1 -8,-0.4 -43,-0.0 -0.671 73.4 5.6 -92.0 138.6 24.8 30.0 28.4 48 57 A G + 0 0 55 -2,-0.4 -1,-0.2 -10,-0.1 -44,-0.1 0.902 64.9 162.1 67.0 53.1 22.1 27.5 27.3 49 58 A L - 0 0 13 -3,-0.5 2,-0.2 -46,-0.4 -12,-0.2 0.909 64.7 -17.1 -66.1 -44.6 21.2 25.6 30.6 50 59 A T - 0 0 12 -47,-0.3 2,-0.3 -14,-0.1 -47,-0.2 -0.840 63.4-112.9-148.3-175.9 17.9 24.2 29.4 51 60 A T > - 0 0 79 -2,-0.2 4,-2.0 -50,-0.1 -2,-0.0 -0.855 28.6-113.8-125.1 167.9 15.1 24.5 26.8 52 61 A E T 4 S+ 0 0 130 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 0.856 117.5 51.5 -66.9 -32.5 11.4 25.5 26.9 53 62 A E T 4 S+ 0 0 184 1,-0.2 -1,-0.2 3,-0.0 3,-0.1 0.915 115.9 39.6 -69.8 -43.2 10.5 21.9 26.0 54 63 A E T 4 S+ 0 0 93 1,-0.2 2,-2.0 2,-0.1 -2,-0.2 0.759 96.9 81.1 -77.1 -29.4 12.6 20.3 28.7 55 64 A F < + 0 0 8 -4,-2.0 -1,-0.2 3,-0.0 3,-0.1 -0.513 66.1 161.4 -87.3 77.0 11.8 22.9 31.4 56 65 A V - 0 0 70 -2,-2.0 32,-0.1 1,-0.2 34,-0.1 -0.222 49.8 -62.9 -86.6 177.8 8.5 21.5 32.5 57 66 A E S S+ 0 0 121 32,-0.2 2,-0.3 30,-0.1 -1,-0.2 -0.286 83.5 104.6 -57.5 148.6 6.5 22.2 35.8 58 67 A G E S- J 0 88B 16 30,-1.4 30,-3.3 -3,-0.1 2,-0.5 -0.944 73.7 -72.4 162.6 177.6 8.4 20.9 38.8 59 68 A I E - J 0 87B 47 -33,-0.3 -33,-2.4 -2,-0.3 2,-0.3 -0.931 51.7-165.5-101.0 121.3 10.5 21.7 41.9 60 69 A Y E -IJ 25 86B 0 26,-3.0 26,-2.3 -2,-0.5 2,-0.4 -0.817 14.5-156.4-113.6 149.4 14.0 22.8 40.8 61 70 A K E -IJ 24 85B 30 -37,-2.7 -37,-2.6 -2,-0.3 2,-0.6 -0.991 4.4-166.0-124.3 123.0 17.2 23.2 42.7 62 71 A V E -IJ 23 84B 0 22,-3.2 22,-2.2 -2,-0.4 2,-0.5 -0.945 9.2-168.9-108.9 116.7 20.0 25.5 41.4 63 72 A E E -IJ 22 83B 43 -41,-3.2 -41,-2.6 -2,-0.6 2,-0.5 -0.914 4.4-161.5-106.7 132.4 23.3 24.9 43.2 64 73 A I E -IJ 21 82B 0 18,-3.4 18,-2.3 -2,-0.5 2,-2.0 -0.976 19.0-134.8-116.3 123.2 26.1 27.4 42.7 65 74 A D > + 0 0 42 -45,-2.5 4,-0.9 -2,-0.5 -45,-0.4 -0.559 43.4 154.8 -78.3 79.9 29.6 26.2 43.6 66 75 A T H > + 0 0 5 -2,-2.0 4,-2.4 2,-0.2 5,-0.3 0.814 64.3 64.2 -78.4 -30.5 30.7 29.3 45.5 67 76 A K H > S+ 0 0 60 13,-0.7 4,-2.5 -3,-0.3 5,-0.2 0.953 104.0 45.0 -60.7 -48.4 33.2 27.5 47.6 68 77 A S H > S+ 0 0 65 12,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.845 111.1 55.9 -63.7 -34.0 35.4 26.5 44.6 69 78 A Y H X S+ 0 0 18 -4,-0.9 4,-0.5 2,-0.2 -2,-0.2 0.965 111.4 40.6 -59.6 -53.6 35.1 30.1 43.2 70 79 A W H ><>S+ 0 0 5 -4,-2.4 5,-2.5 1,-0.2 3,-1.2 0.893 114.2 54.1 -69.1 -36.9 36.4 31.8 46.4 71 80 A K H ><5S+ 0 0 124 -4,-2.5 3,-1.5 -5,-0.3 -1,-0.2 0.902 102.8 55.5 -65.0 -36.9 39.1 29.1 46.9 72 81 A A H 3<5S+ 0 0 90 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.626 110.0 48.7 -68.3 -12.5 40.4 29.6 43.3 73 82 A L T <<5S- 0 0 70 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.344 124.5-103.4-103.4 0.6 40.8 33.3 44.3 74 83 A G T < 5S+ 0 0 69 -3,-1.5 2,-0.4 1,-0.3 -3,-0.2 0.664 81.7 121.5 89.9 19.4 42.6 32.5 47.6 75 84 A I < - 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