==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 15-SEP-05 2B14 . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.MORAIS-DE-SA,R.M.NETO-SILVA,P.J.PEREIRA,M.J.SARAIVA,A.M.DA . 229 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10420.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 174 76.0 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 . 87 38.0 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 . 31 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 6.6 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 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 . 0 2 0 0 3 0 5 1 1 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 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 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 88 0, 0.0 50,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 113.8 26.6 53.9 25.5 2 11 A P + 0 0 9 0, 0.0 94,-2.8 0, 0.0 2,-0.4 0.605 360.0 47.2 -82.2 -11.3 29.3 54.3 28.2 3 12 A L E +a 96 0A 1 47,-0.2 46,-0.4 92,-0.2 47,-0.3 -0.942 66.7 165.1-136.5 117.3 26.6 54.6 30.9 4 13 A M E -a 97 0A 71 92,-2.9 94,-2.6 -2,-0.4 2,-0.4 -0.923 16.7-159.2-127.6 150.0 23.7 52.3 31.2 5 14 A V E -a 98 0A 0 41,-0.4 2,-0.4 -2,-0.3 94,-0.2 -0.983 3.3-168.1-131.0 138.8 21.3 51.7 34.0 6 15 A K E -a 99 0A 72 92,-2.7 94,-2.2 -2,-0.4 2,-0.5 -0.992 4.8-165.0-131.4 127.8 19.1 48.6 34.6 7 16 A V E -a 100 0A 0 37,-2.8 9,-3.6 -2,-0.4 2,-0.3 -0.958 4.0-170.4-122.6 129.0 16.3 48.5 37.1 8 17 A L E -aB 101 15A 65 92,-2.8 94,-2.8 -2,-0.5 2,-0.6 -0.870 18.9-137.7-119.9 143.2 14.6 45.3 38.3 9 18 A D E >> -aB 102 14A 2 5,-3.7 4,-1.4 -2,-0.3 5,-1.4 -0.899 11.5-168.6-101.6 115.2 11.5 44.9 40.5 10 19 A A T 45S+ 0 0 47 92,-3.0 93,-0.1 -2,-0.6 -1,-0.1 0.519 86.1 54.2 -83.8 -4.7 12.1 42.2 43.1 11 20 A V T 45S+ 0 0 86 91,-0.4 -1,-0.2 3,-0.1 92,-0.1 0.880 120.3 29.2 -87.6 -49.6 8.4 42.1 44.0 12 21 A R T 45S- 0 0 118 2,-0.2 -2,-0.2 3,-0.0 -1,-0.0 0.574 99.5-128.6 -86.3 -16.5 7.1 41.5 40.5 13 22 A G T <5S+ 0 0 71 -4,-1.4 -3,-0.2 1,-0.3 -5,-0.0 0.962 73.7 99.1 64.8 49.6 10.1 39.6 39.1 14 23 A S E - 0 0 12 4,-4.3 3,-2.0 -2,-0.3 -1,-0.1 -0.320 24.2-102.3 -79.5 166.9 30.6 70.6 39.5 28 37 A A T 3 S+ 0 0 114 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 0.890 125.4 55.1 -52.6 -43.8 33.8 72.5 40.2 29 38 A D T 3 S- 0 0 110 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.237 124.8-110.2 -79.4 15.2 32.1 74.5 42.9 30 39 A D S < S+ 0 0 83 -3,-2.0 2,-0.2 1,-0.2 -2,-0.2 0.559 76.9 127.9 70.9 14.0 31.2 71.1 44.4 31 40 A T - 0 0 68 -6,-0.0 -4,-4.3 -5,-0.0 2,-0.6 -0.570 67.5-102.6 -91.8 163.1 27.5 71.1 43.6 32 41 A W E -H 26 0B 83 -6,-0.2 -6,-0.2 -2,-0.2 28,-0.1 -0.785 38.5-162.3 -86.6 120.1 25.6 68.4 41.8 33 42 A E E -H 25 0B 93 -8,-2.7 -8,-2.4 -2,-0.6 -3,-0.0 -0.904 27.3-104.7-103.5 132.1 24.9 69.5 38.2 34 43 A P E +H 24 0B 112 0, 0.0 -10,-0.3 0, 0.0 3,-0.1 -0.234 46.2 163.7 -46.8 136.7 22.3 67.8 36.0 35 44 A F E - 0 0 37 -12,-2.9 2,-0.3 1,-0.5 -11,-0.2 0.614 57.4 -18.3-126.0 -45.5 24.1 65.6 33.5 36 45 A A E -H 23 0B 18 -13,-2.2 -13,-3.9 14,-0.0 -1,-0.5 -0.988 51.4-174.3-162.3 165.9 21.4 63.3 32.1 37 46 A S E +H 22 0B 80 -2,-0.3 2,-0.3 -15,-0.3 -15,-0.2 -0.985 13.5 145.9-165.7 149.3 18.0 61.8 32.6 38 47 A G E -H 21 0B 27 -17,-2.2 -17,-3.1 -2,-0.3 2,-0.3 -0.943 37.5-106.9-164.8-170.6 15.7 59.3 31.2 39 48 A K E -H 20 0B 86 -2,-0.3 8,-0.3 -19,-0.2 -19,-0.2 -0.986 37.0-104.9-138.7 144.2 13.0 56.7 32.0 40 49 A T - 0 0 1 -21,-1.9 -22,-1.9 -2,-0.3 -21,-0.1 -0.419 32.3-147.5 -73.2 145.9 13.3 53.0 31.9 41 50 A S > - 0 0 36 4,-2.1 3,-2.4 -24,-0.2 -22,-0.2 -0.147 45.7 -70.4 -91.8-165.1 11.7 51.2 29.1 42 51 A E T 3 S+ 0 0 95 1,-0.3 -25,-0.1 2,-0.1 -2,-0.1 0.765 134.3 58.3 -61.5 -23.4 10.2 47.7 29.1 43 52 A S T 3 S- 0 0 42 2,-0.3 -1,-0.3 -29,-0.1 -27,-0.2 0.506 120.3-110.7 -82.6 -2.3 13.7 46.2 29.5 44 53 A G S < S+ 0 0 0 -3,-2.4 -37,-2.8 1,-0.2 -28,-0.2 0.630 84.2 103.8 83.0 16.0 14.1 48.2 32.7 45 54 A E - 0 0 44 -39,-0.2 -4,-2.1 -6,-0.1 -2,-0.3 -0.976 65.9-131.5-131.6 144.9 16.7 50.6 31.2 46 55 A P - 0 0 9 0, 0.0 -41,-0.4 0, 0.0 2,-0.3 -0.423 34.8-127.2 -80.7 165.5 16.7 54.1 30.0 47 56 A H S S+ 0 0 125 -8,-0.3 -8,-0.1 1,-0.2 -43,-0.0 -0.883 70.6 2.5-123.0 149.6 18.3 54.6 26.6 48 57 A G + 0 0 59 -2,-0.3 -1,-0.2 1,-0.1 -44,-0.1 0.839 66.3 164.2 49.3 44.2 21.0 56.8 25.2 49 58 A L - 0 0 15 -46,-0.4 2,-0.2 -3,-0.2 -12,-0.2 0.897 63.8 -17.8 -52.7 -47.2 21.7 58.5 28.6 50 59 A T - 0 0 9 -47,-0.3 2,-0.3 -14,-0.1 -47,-0.2 -0.868 62.9-116.2-151.6-179.0 25.1 59.9 27.4 51 60 A T > - 0 0 78 -2,-0.2 4,-1.9 -50,-0.1 3,-0.0 -0.845 32.2-109.6-124.5 163.1 27.8 59.7 24.8 52 61 A E T 4 S+ 0 0 101 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 0.878 118.4 52.9 -58.3 -36.4 31.5 58.8 25.0 53 62 A E T 4 S+ 0 0 89 1,-0.2 -1,-0.2 3,-0.0 3,-0.1 0.902 114.0 39.9 -68.2 -40.6 32.4 62.5 24.3 54 63 A E T 4 S+ 0 0 91 1,-0.2 2,-2.0 2,-0.1 -1,-0.2 0.766 97.4 79.9 -77.7 -26.1 30.2 63.9 27.1 55 64 A F < + 0 0 8 -4,-1.9 -1,-0.2 3,-0.0 3,-0.1 -0.527 66.5 158.0 -91.6 74.9 30.9 61.3 29.7 56 65 A V - 0 0 71 -2,-2.0 32,-0.1 1,-0.2 34,-0.1 -0.259 51.4 -59.7 -89.9-179.8 34.3 62.6 30.9 57 66 A E S S+ 0 0 118 32,-0.2 2,-0.3 -2,-0.1 -1,-0.2 -0.259 82.3 106.2 -55.5 144.3 36.1 62.0 34.1 58 67 A G E S- J 0 88B 15 30,-1.3 30,-2.4 -3,-0.1 2,-0.5 -0.968 72.8 -76.2 167.5-176.9 34.1 63.1 37.2 59 68 A I E - J 0 87B 39 -33,-0.3 -33,-2.7 -2,-0.3 2,-0.3 -0.951 52.1-167.2-108.4 126.1 32.1 62.1 40.2 60 69 A Y E -IJ 25 86B 0 26,-3.3 26,-2.0 -2,-0.5 2,-0.4 -0.799 15.6-157.1-114.8 158.0 28.6 61.0 39.1 61 70 A K E -IJ 24 85B 21 -37,-2.4 -37,-2.6 -2,-0.3 2,-0.6 -0.992 3.8-161.7-135.0 124.7 25.4 60.3 40.9 62 71 A V E -IJ 23 84B 0 22,-3.5 22,-2.0 -2,-0.4 2,-0.6 -0.936 10.3-168.0-105.9 117.2 22.7 58.2 39.5 63 72 A E E -IJ 22 83B 41 -41,-3.7 -41,-3.2 -2,-0.6 2,-0.6 -0.948 3.2-163.4-114.6 118.8 19.4 58.8 41.2 64 73 A I E -IJ 21 82B 0 18,-2.4 2,-2.5 -2,-0.6 18,-2.0 -0.889 21.6-131.2-104.7 121.7 16.7 56.3 40.5 65 74 A D > + 0 0 26 -45,-2.8 4,-1.3 -2,-0.6 -45,-0.4 -0.385 43.3 157.5 -78.2 76.0 13.2 57.5 41.4 66 75 A T H > + 0 0 4 -2,-2.5 4,-2.6 1,-0.2 5,-0.2 0.795 64.7 61.5 -71.7 -29.3 12.1 54.4 43.3 67 76 A K H > S+ 0 0 65 13,-1.2 4,-2.2 -3,-0.2 -1,-0.2 0.928 104.7 45.2 -66.0 -45.7 9.5 56.2 45.4 68 77 A S H > S+ 0 0 84 12,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.857 113.7 54.0 -66.5 -33.5 7.3 57.4 42.5 69 78 A Y H X S+ 0 0 25 -4,-1.3 4,-1.4 2,-0.2 -2,-0.2 0.969 110.4 42.2 -62.1 -56.1 7.7 53.9 41.1 70 79 A W H <>S+ 0 0 4 -4,-2.6 5,-3.2 1,-0.2 -2,-0.2 0.860 113.5 55.3 -61.3 -35.1 6.5 52.0 44.2 71 80 A K H ><5S+ 0 0 82 -4,-2.2 3,-1.1 3,-0.2 -1,-0.2 0.851 103.4 52.6 -67.3 -42.6 3.7 54.6 44.6 72 81 A A H 3<5S+ 0 0 95 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.803 109.7 50.9 -59.6 -31.4 2.3 54.1 41.0 73 82 A L T 3<5S- 0 0 58 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.438 123.6-110.0 -82.7 -1.8 2.2 50.4 41.9 74 83 A G T < 5S+ 0 0 67 -3,-1.1 2,-0.3 1,-0.3 -3,-0.2 0.641 76.7 127.8 83.7 15.6 0.3 51.3 45.1 75 84 A I < - 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