==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE 11-AUG-09 3IMS . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.CONNELLY,I.A.WILSON . 229 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11122.0 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 . 92 40.2 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 . 25 10.9 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 6 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 11 A P 0 0 35 0, 0.0 94,-2.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -4.8 8.2 -12.3 3.8 2 12 A L E +a 95 0A 2 92,-0.2 46,-0.6 47,-0.2 2,-0.3 -0.870 360.0 163.4-150.1 107.7 5.6 -12.6 1.0 3 13 A M E -a 96 0A 47 92,-2.6 94,-2.7 -2,-0.3 2,-0.4 -0.910 20.5-150.8-127.5 154.0 2.5 -10.4 0.8 4 14 A V E -aB 97 45A 2 41,-2.0 41,-2.5 -2,-0.3 2,-0.4 -0.962 7.6-172.1-127.5 140.4 0.0 -9.6 -1.9 5 15 A K E -aB 98 44A 81 92,-2.5 94,-2.3 -2,-0.4 2,-0.4 -0.996 6.3-170.8-132.6 129.9 -2.0 -6.5 -2.5 6 16 A V E -a 99 0A 0 37,-2.5 9,-2.6 -2,-0.4 2,-0.3 -0.980 0.8-171.0-129.0 130.9 -4.7 -6.2 -5.1 7 17 A L E -aC 100 14A 73 92,-2.5 94,-2.7 -2,-0.4 2,-0.6 -0.882 20.4-130.1-119.7 154.3 -6.6 -3.1 -6.3 8 18 A D E >> -aC 101 13A 2 5,-3.3 4,-1.3 -2,-0.3 5,-1.3 -0.920 10.7-166.5-110.9 116.0 -9.7 -2.6 -8.5 9 19 A A T 45S+ 0 0 48 92,-2.8 93,-0.2 -2,-0.6 -1,-0.1 0.519 87.8 52.1 -79.5 -9.2 -9.2 -0.0 -11.3 10 20 A V T 45S+ 0 0 90 91,-0.5 -1,-0.2 3,-0.1 92,-0.1 0.884 120.1 30.1 -88.6 -47.4 -13.0 0.1 -12.1 11 21 A R T 45S- 0 0 158 2,-0.1 -2,-0.2 3,-0.0 -1,-0.0 0.610 98.3-128.0 -84.8 -25.1 -14.3 0.7 -8.5 12 22 A G T <5S+ 0 0 71 -4,-1.3 -3,-0.2 1,-0.3 3,-0.0 0.956 73.6 102.2 67.2 51.1 -11.3 2.6 -7.2 13 23 A S E - 0 0 0 -9,-2.6 3,-0.5 27,-0.1 -9,-0.2 -0.876 41.2-160.0 -96.3 102.5 -10.0 -5.9 -4.6 16 26 A I T 3 + 0 0 49 -2,-0.8 24,-0.2 1,-0.2 25,-0.1 -0.603 61.1 14.7 -92.8 143.5 -11.6 -7.9 -1.8 17 27 A N T 3 S+ 0 0 106 22,-1.8 2,-0.5 -2,-0.2 -1,-0.2 0.803 77.8 159.7 66.1 33.4 -12.0 -11.7 -1.6 18 28 A V < - 0 0 1 -3,-0.5 21,-2.1 22,-0.2 2,-0.2 -0.767 37.4-131.5 -89.6 123.2 -9.5 -12.4 -4.4 19 29 A A E -J 38 0B 20 -2,-0.5 45,-3.0 45,-0.4 2,-0.4 -0.560 24.8-170.3 -74.4 139.1 -8.2 -16.0 -4.3 20 30 A V E -JK 37 63B 0 17,-2.8 17,-2.3 -2,-0.2 2,-0.4 -0.997 6.9-169.1-134.3 130.0 -4.4 -16.3 -4.6 21 31 A H E -JK 36 62B 69 41,-2.6 41,-3.2 -2,-0.4 2,-0.4 -0.973 5.8-159.4-119.8 132.4 -2.4 -19.5 -5.1 22 32 A V E -JK 35 61B 1 13,-3.9 12,-2.5 -2,-0.4 13,-1.8 -0.928 10.8-176.8-111.2 133.9 1.4 -19.6 -4.8 23 33 A F E -JK 33 60B 40 37,-2.5 37,-2.5 -2,-0.4 2,-0.4 -0.882 13.3-149.8-121.7 159.4 3.4 -22.5 -6.3 24 34 A R E -JK 32 59B 66 8,-2.5 8,-2.4 -2,-0.3 35,-0.2 -0.997 26.6-113.9-128.6 136.2 7.2 -23.3 -6.2 25 35 A K E -J 31 0B 61 33,-2.9 33,-0.3 -2,-0.4 6,-0.2 -0.447 35.6-145.5 -72.2 129.8 9.0 -25.0 -9.0 26 36 A A > - 0 0 20 4,-3.1 3,-2.1 -2,-0.2 -1,-0.1 -0.383 29.6 -95.5 -89.4 173.1 10.3 -28.5 -7.9 27 37 A A T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.761 126.9 54.8 -60.4 -28.5 13.4 -30.3 -8.8 28 38 A D T 3 S- 0 0 116 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.292 120.7-110.8 -86.8 8.4 11.5 -32.2 -11.5 29 39 A D S < S+ 0 0 108 -3,-2.1 -2,-0.1 1,-0.3 2,-0.1 0.422 76.2 130.0 75.3 7.2 10.4 -28.8 -12.9 30 40 A T - 0 0 76 -5,-0.1 -4,-3.1 1,-0.1 2,-0.9 -0.432 66.9-106.2 -82.3 163.6 6.7 -29.2 -11.9 31 41 A W E -J 25 0B 78 -6,-0.2 -6,-0.2 -2,-0.1 -1,-0.1 -0.790 37.1-161.3 -92.7 103.5 4.8 -26.5 -10.0 32 42 A E E -J 24 0B 102 -8,-2.4 -8,-2.5 -2,-0.9 -3,-0.0 -0.624 26.2-105.7 -83.1 138.0 4.4 -27.7 -6.4 33 43 A P E +J 23 0B 107 0, 0.0 -10,-0.2 0, 0.0 -1,-0.1 -0.299 44.4 166.9 -61.4 139.9 1.7 -26.0 -4.2 34 44 A F E - 0 0 49 -12,-2.5 2,-0.3 1,-0.4 -11,-0.2 0.673 54.0 -28.2-122.1 -48.6 3.2 -23.7 -1.7 35 45 A A E -J 22 0B 19 -13,-1.8 -13,-3.9 14,-0.0 -1,-0.4 -0.972 51.4-170.8-166.3 156.8 0.6 -21.5 -0.1 36 46 A S E +J 21 0B 76 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.986 14.6 142.9-151.7 163.8 -2.8 -19.9 -0.8 37 47 A G E -J 20 0B 25 -17,-2.3 -17,-2.8 -2,-0.3 2,-0.3 -0.964 38.1 -99.6-175.2-171.6 -5.2 -17.4 0.7 38 48 A K E -J 19 0B 132 -2,-0.3 -19,-0.2 -19,-0.2 6,-0.1 -0.989 36.0-105.6-130.9 145.1 -7.7 -14.7 -0.1 39 49 A T - 0 0 3 -21,-2.1 -22,-1.8 -2,-0.3 6,-0.2 -0.364 36.3-131.7 -70.4 147.3 -7.4 -10.9 0.0 40 50 A S > - 0 0 51 4,-2.6 3,-2.2 -24,-0.2 -22,-0.2 -0.119 38.9 -78.4 -80.7-172.1 -9.0 -9.1 2.9 41 51 A E T 3 S+ 0 0 139 1,-0.3 -25,-0.1 -25,-0.1 -2,-0.1 0.739 133.9 53.9 -62.6 -21.3 -11.3 -6.0 3.0 42 52 A S T 3 S- 0 0 55 2,-0.2 -1,-0.3 -29,-0.1 -27,-0.1 0.359 119.5-110.9 -91.1 0.2 -8.1 -3.9 2.5 43 53 A G S < S+ 0 0 0 -3,-2.2 -37,-2.5 1,-0.3 2,-0.3 0.570 78.8 126.9 80.9 9.8 -7.1 -5.9 -0.6 44 54 A E E -B 5 0A 61 -39,-0.2 -4,-2.6 -6,-0.1 2,-0.4 -0.701 45.0-162.8-106.6 150.0 -4.2 -7.4 1.3 45 55 A L E +B 4 0A 14 -41,-2.5 -41,-2.0 -2,-0.3 2,-0.2 -0.959 20.4 166.8-134.3 111.8 -3.1 -11.0 1.9 46 56 A H + 0 0 103 -2,-0.4 -43,-0.1 -43,-0.2 -2,-0.0 -0.722 50.2 45.1-114.4 167.1 -0.7 -11.7 4.7 47 57 A G + 0 0 74 -2,-0.2 -1,-0.1 2,-0.1 -44,-0.1 0.685 60.8 134.5 75.6 17.5 0.5 -14.8 6.4 48 58 A L S S- 0 0 23 -46,-0.6 2,-0.2 -3,-0.2 -12,-0.2 0.902 75.3 -12.4 -61.4 -44.4 1.0 -17.0 3.3 49 59 A T - 0 0 17 -47,-0.3 2,-0.3 -14,-0.1 -47,-0.2 -0.761 64.4-113.1-147.4-172.9 4.3 -18.3 4.5 50 60 A T > - 0 0 70 -2,-0.2 4,-2.2 1,-0.1 -2,-0.0 -0.884 33.0-110.1-129.3 158.2 7.1 -18.0 7.0 51 61 A E T 4 S+ 0 0 109 -2,-0.3 -1,-0.1 1,-0.2 42,-0.1 0.921 119.2 53.8 -58.7 -37.8 10.8 -17.0 6.6 52 62 A E T 4 S+ 0 0 179 1,-0.2 -1,-0.2 -3,-0.0 3,-0.0 0.926 114.6 37.9 -58.4 -49.0 11.7 -20.7 7.3 53 63 A E T 4 S+ 0 0 129 1,-0.2 2,-1.9 2,-0.1 -1,-0.2 0.764 97.9 81.5 -76.0 -25.0 9.5 -22.1 4.7 54 64 A F < + 0 0 8 -4,-2.2 -1,-0.2 3,-0.0 3,-0.1 -0.516 66.5 162.3 -86.8 75.5 10.1 -19.4 2.1 55 65 A V - 0 0 72 -2,-1.9 32,-0.1 1,-0.2 34,-0.1 -0.161 48.0 -63.2 -83.4 175.6 13.4 -20.8 0.8 56 66 A E S S+ 0 0 98 32,-0.2 2,-0.3 30,-0.1 -1,-0.2 -0.317 81.2 103.9 -51.3 145.7 15.2 -20.0 -2.5 57 67 A G E S- L 0 87B 15 30,-1.5 30,-2.9 -3,-0.1 2,-0.6 -0.922 73.0 -70.5 163.8-178.4 13.3 -21.0 -5.6 58 68 A I E - L 0 86B 37 -33,-0.3 -33,-2.9 -2,-0.3 2,-0.3 -0.920 52.2-166.2-101.3 119.3 11.2 -20.0 -8.6 59 69 A Y E -KL 24 85B 0 26,-3.0 26,-2.3 -2,-0.6 2,-0.5 -0.850 15.0-157.7-111.7 147.2 7.7 -19.0 -7.4 60 70 A K E -KL 23 84B 16 -37,-2.5 -37,-2.5 -2,-0.3 2,-0.7 -0.990 4.3-163.2-123.5 117.1 4.5 -18.4 -9.2 61 71 A V E -KL 22 83B 0 22,-3.0 22,-2.0 -2,-0.5 2,-0.6 -0.933 10.6-164.6-101.9 111.9 1.8 -16.2 -7.6 62 72 A E E -KL 21 82B 29 -41,-3.2 -41,-2.6 -2,-0.7 2,-0.6 -0.919 2.8-161.6-105.1 116.6 -1.5 -16.8 -9.4 63 73 A I E -KL 20 81B 0 18,-3.1 18,-2.3 -2,-0.6 2,-2.2 -0.889 17.5-136.4-102.3 118.1 -4.1 -14.2 -8.8 64 74 A D > + 0 0 26 -45,-3.0 4,-1.6 -2,-0.6 -45,-0.4 -0.432 41.6 156.2 -82.4 73.9 -7.6 -15.5 -9.6 65 75 A T H > + 0 0 6 -2,-2.2 4,-2.5 1,-0.2 5,-0.3 0.850 67.0 57.0 -70.8 -35.5 -8.9 -12.5 -11.4 66 76 A K H > S+ 0 0 55 13,-1.4 4,-2.9 -3,-0.3 -1,-0.2 0.943 107.2 49.0 -64.1 -43.7 -11.5 -14.2 -13.5 67 77 A S H > S+ 0 0 83 12,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.887 111.4 51.9 -60.9 -37.4 -13.2 -15.6 -10.3 68 78 A Y H X S+ 0 0 18 -4,-1.6 4,-0.9 2,-0.2 -2,-0.2 0.955 113.0 42.2 -61.9 -52.2 -13.1 -12.1 -8.8 69 79 A W H ><>S+ 0 0 4 -4,-2.5 5,-2.7 1,-0.2 3,-0.7 0.918 113.0 52.6 -66.7 -39.9 -14.7 -10.4 -11.8 70 80 A K H ><5S+ 0 0 108 -4,-2.9 3,-1.6 -5,-0.3 -1,-0.2 0.875 104.1 56.9 -63.6 -38.1 -17.3 -13.2 -12.2 71 81 A A H 3<5S+ 0 0 90 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.758 107.4 50.2 -63.7 -22.9 -18.3 -12.8 -8.5 72 82 A L T <<5S- 0 0 64 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.280 125.1-107.4 -92.0 1.0 -19.0 -9.2 -9.4 73 83 A G T < 5S+ 0 0 71 -3,-1.6 2,-0.4 1,-0.3 -3,-0.2 0.686 79.2 127.0 83.0 23.8 -21.1 -10.3 -12.4 74 84 A I < - 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