==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE/HORMONE INHIBITOR 08-JUN-12 4FI6 . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.CONNELLY,N.GRIMSTER,I.A.WILSON,J.W.KELLY . 229 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11407.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 79.0 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 . 94 41.0 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 . 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 . 30 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 6.1 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 . 0 4 0 0 3 0 5 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 0 0 0 1 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 11 A P 0 0 51 0, 0.0 94,-2.9 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -23.5 8.1 -12.4 3.8 2 12 A L E +a 95 0A 8 47,-0.2 46,-0.6 92,-0.2 2,-0.3 -0.969 360.0 167.4-141.4 120.7 5.4 -12.6 1.1 3 13 A M E -a 96 0A 34 92,-2.4 94,-2.8 -2,-0.4 2,-0.4 -0.966 17.3-155.4-133.1 147.5 2.4 -10.3 0.8 4 14 A V E -aB 97 45A 0 41,-2.1 41,-2.3 -2,-0.3 2,-0.4 -0.990 8.2-172.9-125.1 135.1 -0.0 -9.7 -2.1 5 15 A K E -aB 98 44A 74 92,-2.5 94,-2.1 -2,-0.4 2,-0.4 -0.992 4.3-170.5-129.6 132.2 -2.0 -6.6 -2.6 6 16 A V E -a 99 0A 0 37,-2.4 9,-2.7 -2,-0.4 2,-0.3 -0.994 1.2-169.7-132.4 132.4 -4.7 -6.2 -5.2 7 17 A L E -aC 100 14A 82 92,-2.6 94,-2.8 -2,-0.4 2,-0.6 -0.879 19.7-132.0-119.2 150.2 -6.6 -3.1 -6.4 8 18 A D E >> -aC 101 13A 3 5,-3.3 4,-1.5 -2,-0.3 5,-1.3 -0.911 11.3-167.4-106.0 116.3 -9.6 -2.7 -8.6 9 19 A A T 45S+ 0 0 50 92,-2.7 93,-0.1 -2,-0.6 -1,-0.1 0.502 86.7 53.5 -80.0 -12.5 -9.2 -0.0 -11.3 10 20 A V T 45S+ 0 0 95 91,-0.4 -1,-0.2 3,-0.1 92,-0.1 0.845 120.1 29.4 -85.2 -45.3 -12.9 0.0 -12.2 11 21 A R T 45S- 0 0 158 2,-0.2 -2,-0.2 3,-0.0 -1,-0.0 0.592 98.6-126.5 -89.2 -24.3 -14.2 0.7 -8.7 12 22 A G T <5S+ 0 0 73 -4,-1.5 -3,-0.2 1,-0.3 3,-0.0 0.942 74.0 104.4 66.6 52.0 -11.3 2.6 -7.2 13 23 A S E - 0 0 0 -9,-2.7 3,-0.5 28,-0.1 2,-0.2 -0.873 40.4-159.6 -92.2 107.5 -10.0 -5.9 -4.7 16 26 A I T 3 + 0 0 65 -2,-0.8 24,-0.2 1,-0.2 25,-0.2 -0.614 60.6 15.7 -97.7 148.9 -11.6 -8.0 -1.9 17 27 A N T 3 S+ 0 0 99 22,-1.9 2,-0.5 -2,-0.2 -1,-0.2 0.813 77.4 159.2 63.3 35.1 -12.0 -11.7 -1.7 18 28 A V < - 0 0 0 -3,-0.5 21,-2.1 22,-0.2 2,-0.3 -0.773 38.0-131.3 -88.8 125.0 -9.5 -12.4 -4.6 19 29 A A E -J 38 0B 34 -2,-0.5 45,-3.0 45,-0.4 2,-0.4 -0.590 24.7-170.0 -76.3 140.3 -8.2 -16.0 -4.4 20 30 A V E -JK 37 63B 0 17,-2.7 17,-2.2 -2,-0.3 2,-0.4 -1.000 6.9-168.5-135.1 128.7 -4.4 -16.3 -4.7 21 31 A H E -JK 36 62B 69 41,-2.5 41,-3.3 -2,-0.4 2,-0.4 -0.985 6.6-158.6-118.8 133.5 -2.5 -19.5 -5.2 22 32 A V E -JK 35 61B 1 13,-3.7 12,-3.0 -2,-0.4 13,-1.6 -0.900 10.4-175.1-114.2 135.9 1.3 -19.7 -4.8 23 33 A F E -JK 33 60B 35 37,-2.6 37,-2.6 -2,-0.4 2,-0.4 -0.903 12.3-151.9-124.1 155.9 3.4 -22.5 -6.3 24 34 A R E -JK 32 59B 79 8,-2.4 8,-2.6 -2,-0.3 2,-0.2 -0.997 26.4-115.5-130.2 134.6 7.1 -23.3 -6.1 25 35 A K E -J 31 0B 71 33,-2.9 33,-0.3 -2,-0.4 6,-0.2 -0.467 33.6-144.6 -71.7 126.7 9.0 -25.1 -8.9 26 36 A A > - 0 0 26 4,-3.4 3,-2.1 -2,-0.2 -1,-0.1 -0.389 29.8 -96.8 -86.6 172.5 10.3 -28.5 -7.7 27 37 A A T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.769 125.6 55.0 -61.7 -28.1 13.5 -30.2 -8.6 28 38 A D T 3 S- 0 0 111 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.215 120.9-107.1 -90.0 11.9 11.6 -32.2 -11.3 29 39 A D S < S+ 0 0 116 -3,-2.1 2,-0.2 1,-0.3 -2,-0.1 0.420 77.8 127.8 79.7 2.4 10.3 -29.0 -12.9 30 40 A T - 0 0 69 1,-0.1 -4,-3.4 -5,-0.1 2,-0.8 -0.489 65.3-111.5 -86.8 160.8 6.7 -29.3 -11.7 31 41 A W E -J 25 0B 73 -6,-0.2 -6,-0.2 -2,-0.2 -1,-0.1 -0.828 33.1-159.6 -93.6 104.9 4.8 -26.6 -9.9 32 42 A E E -J 24 0B 114 -8,-2.6 -8,-2.4 -2,-0.8 2,-0.1 -0.678 26.3-107.7 -86.7 135.4 4.2 -27.7 -6.4 33 43 A P E +J 23 0B 96 0, 0.0 -10,-0.3 0, 0.0 3,-0.1 -0.391 43.2 170.5 -59.5 132.1 1.4 -26.0 -4.4 34 44 A F E - 0 0 53 -12,-3.0 2,-0.3 1,-0.4 -11,-0.2 0.742 54.3 -31.1-114.7 -44.9 3.1 -23.7 -1.8 35 45 A A E -J 22 0B 22 -13,-1.6 -13,-3.7 14,-0.0 -1,-0.4 -0.974 52.0-168.6-168.6 166.4 0.4 -21.6 -0.2 36 46 A S E +J 21 0B 74 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.985 16.4 138.8-156.5 164.3 -2.9 -20.0 -0.9 37 47 A G E -J 20 0B 29 -17,-2.2 -17,-2.7 -2,-0.3 2,-0.3 -0.959 38.8-100.1-178.5-168.6 -5.4 -17.5 0.6 38 48 A K E -J 19 0B 127 -2,-0.3 -19,-0.2 -19,-0.2 6,-0.1 -0.987 36.2 -97.9-139.3 152.8 -7.7 -14.7 -0.3 39 49 A T - 0 0 2 -21,-2.1 -22,-1.9 -2,-0.3 6,-0.2 -0.354 37.4-131.9 -69.4 146.6 -7.4 -10.9 -0.1 40 50 A S > - 0 0 49 4,-2.5 3,-2.2 -24,-0.2 -23,-0.2 -0.079 40.7 -78.0 -80.3-175.5 -9.0 -9.1 2.8 41 51 A E T 3 S+ 0 0 171 1,-0.3 -25,-0.1 -25,-0.2 -2,-0.1 0.719 134.8 53.3 -58.3 -22.8 -11.3 -6.1 2.9 42 52 A S T 3 S- 0 0 60 2,-0.2 -1,-0.3 -29,-0.1 -27,-0.1 0.344 120.1-110.6 -94.3 8.2 -8.2 -4.0 2.4 43 53 A G S < S+ 0 0 0 -3,-2.2 -37,-2.4 1,-0.3 2,-0.3 0.607 78.4 124.9 71.8 18.4 -7.2 -6.0 -0.7 44 54 A E E -B 5 0A 43 -39,-0.2 -4,-2.5 -6,-0.1 2,-0.4 -0.797 45.3-162.5-116.1 148.8 -4.2 -7.6 1.1 45 55 A L E +B 4 0A 14 -41,-2.3 -41,-2.1 -2,-0.3 2,-0.2 -0.972 20.3 164.0-133.2 116.3 -3.1 -11.1 1.8 46 56 A H + 0 0 116 -2,-0.4 -43,-0.1 -43,-0.2 -2,-0.0 -0.609 49.9 52.3-116.2 172.9 -0.6 -11.8 4.5 47 57 A G + 0 0 76 -2,-0.2 -1,-0.1 -45,-0.1 -44,-0.1 0.730 60.6 131.0 72.7 18.8 0.4 -15.0 6.3 48 58 A L S S- 0 0 19 -46,-0.6 2,-0.3 -3,-0.2 -12,-0.2 0.878 75.4 -10.0 -69.4 -39.9 1.1 -17.1 3.2 49 59 A T - 0 0 19 -47,-0.3 2,-0.3 -14,-0.1 -47,-0.2 -0.850 62.4-117.0-148.8-177.4 4.4 -18.3 4.5 50 60 A T > - 0 0 69 -2,-0.3 4,-2.1 -49,-0.1 0, 0.0 -0.827 35.3-107.8-123.3 161.7 7.2 -18.0 7.1 51 61 A E T 4 S+ 0 0 133 -2,-0.3 -1,-0.1 1,-0.2 42,-0.1 0.886 119.9 52.1 -53.8 -41.1 10.8 -17.0 6.7 52 62 A E T 4 S+ 0 0 176 1,-0.2 -1,-0.2 3,-0.0 3,-0.0 0.914 114.1 40.2 -65.0 -43.1 11.8 -20.7 7.3 53 63 A E T 4 S+ 0 0 129 1,-0.2 2,-2.0 2,-0.1 -1,-0.2 0.771 96.7 81.1 -80.0 -23.3 9.5 -22.1 4.7 54 64 A F < + 0 0 9 -4,-2.1 -1,-0.2 3,-0.0 3,-0.1 -0.512 67.4 162.6 -86.6 72.4 10.2 -19.4 2.1 55 65 A V - 0 0 72 -2,-2.0 32,-0.1 1,-0.2 34,-0.1 -0.160 48.0 -63.8 -82.3 175.0 13.4 -20.8 0.8 56 66 A E S S+ 0 0 121 32,-0.2 2,-0.3 30,-0.1 32,-0.2 -0.342 81.9 105.0 -50.3 144.4 15.2 -20.0 -2.5 57 67 A G E S- L 0 87B 15 30,-1.5 30,-2.8 -3,-0.1 2,-0.6 -0.946 73.2 -72.9 165.1-179.4 13.3 -21.1 -5.5 58 68 A I E - L 0 86B 40 -33,-0.3 -33,-2.9 -2,-0.3 2,-0.3 -0.928 51.5-166.5-100.2 120.4 11.2 -20.1 -8.5 59 69 A Y E -KL 24 85B 0 26,-3.0 26,-2.4 -2,-0.6 2,-0.5 -0.835 14.2-156.4-113.1 149.3 7.7 -19.0 -7.3 60 70 A K E -KL 23 84B 22 -37,-2.6 -37,-2.6 -2,-0.3 2,-0.6 -0.994 3.3-163.3-126.1 119.7 4.5 -18.5 -9.2 61 71 A V E -KL 22 83B 0 22,-3.0 22,-2.3 -2,-0.5 2,-0.6 -0.936 9.6-165.2-103.0 109.0 1.8 -16.2 -7.7 62 72 A E E -KL 21 82B 31 -41,-3.3 -41,-2.5 -2,-0.6 2,-0.6 -0.905 2.3-162.1-102.1 117.2 -1.5 -16.9 -9.4 63 73 A I E -KL 20 81B 0 18,-3.1 2,-2.3 -2,-0.6 18,-2.2 -0.896 18.4-135.9-102.6 119.6 -4.1 -14.2 -8.8 64 74 A D > + 0 0 20 -45,-3.0 4,-1.8 -2,-0.6 -45,-0.4 -0.425 41.9 156.9 -84.6 71.4 -7.6 -15.6 -9.7 65 75 A T H > + 0 0 5 -2,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.848 68.3 55.3 -66.0 -39.8 -8.8 -12.5 -11.5 66 76 A K H > S+ 0 0 50 13,-1.2 4,-3.0 -3,-0.2 5,-0.2 0.942 108.3 48.7 -60.8 -45.9 -11.4 -14.3 -13.6 67 77 A S H > S+ 0 0 79 12,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.888 112.3 51.5 -60.6 -37.9 -13.1 -15.8 -10.5 68 78 A Y H X S+ 0 0 14 -4,-1.8 4,-0.9 2,-0.2 -2,-0.2 0.959 113.6 41.0 -63.8 -50.6 -13.0 -12.2 -9.0 69 79 A W H ><>S+ 0 0 8 -4,-2.7 5,-2.5 1,-0.2 3,-0.7 0.906 115.1 51.6 -68.8 -38.5 -14.6 -10.6 -12.0 70 80 A K H ><5S+ 0 0 130 -4,-3.0 3,-1.7 1,-0.2 -1,-0.2 0.827 103.7 57.5 -65.6 -34.7 -17.2 -13.4 -12.5 71 81 A A H 3<5S+ 0 0 90 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.771 107.2 50.4 -68.2 -19.9 -18.2 -13.2 -8.8 72 82 A L T <<5S- 0 0 62 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.242 124.5-108.9 -94.4 3.4 -19.0 -9.6 -9.6 73 83 A G T < 5S+ 0 0 67 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.690 77.9 129.7 78.5 19.4 -21.1 -10.7 -12.6 74 84 A I < - 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