==== 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 3IMU . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.CONNELLY,I.A.WILSON . 228 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11167.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 76.8 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 . 93 40.8 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 1.8 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 . 27 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 5.3 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 1.8 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 5 1 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 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 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 54 0, 0.0 94,-2.8 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -13.4 8.0 -12.2 3.7 2 12 A L E +a 95 0A 8 47,-0.2 46,-0.6 92,-0.2 2,-0.3 -0.969 360.0 165.6-138.7 116.5 5.4 -12.6 1.0 3 13 A M E -a 96 0A 17 92,-2.4 94,-2.7 -2,-0.4 2,-0.4 -0.961 19.1-154.7-131.9 149.3 2.4 -10.3 0.6 4 14 A V E -aB 97 45A 0 41,-2.2 41,-2.3 -2,-0.3 2,-0.4 -0.987 8.3-172.4-126.7 133.6 0.0 -9.8 -2.2 5 15 A K E -aB 98 44A 61 92,-2.3 94,-2.3 -2,-0.4 2,-0.4 -0.999 4.4-172.2-129.3 129.1 -2.0 -6.5 -2.8 6 16 A V E -a 99 0A 0 37,-2.4 9,-2.7 -2,-0.4 2,-0.3 -0.987 1.4-171.2-131.5 133.3 -4.7 -6.2 -5.4 7 17 A L E -aC 100 14A 94 92,-2.5 94,-2.8 -2,-0.4 2,-0.6 -0.880 20.5-130.9-120.5 153.0 -6.6 -3.1 -6.5 8 18 A D E >> -aC 101 13A 2 5,-3.2 4,-1.4 -2,-0.3 5,-1.3 -0.920 11.1-166.6-109.5 114.7 -9.6 -2.7 -8.8 9 19 A A T 45S+ 0 0 48 92,-2.7 93,-0.1 -2,-0.6 -1,-0.1 0.506 86.2 54.1 -78.0 -11.1 -9.2 -0.0 -11.5 10 20 A V T 45S+ 0 0 87 91,-0.5 -1,-0.2 3,-0.1 92,-0.1 0.867 120.3 27.8 -88.5 -43.9 -12.9 0.1 -12.3 11 21 A R T 45S- 0 0 155 2,-0.1 -2,-0.2 3,-0.0 -1,-0.1 0.609 98.4-126.3 -93.6 -19.9 -14.2 0.7 -8.9 12 22 A G T <5S+ 0 0 72 -4,-1.4 -3,-0.2 1,-0.3 3,-0.0 0.951 73.6 104.2 65.6 54.1 -11.2 2.6 -7.4 13 23 A S E - 0 0 25 4,-3.5 3,-2.1 -2,-0.2 -1,-0.1 -0.344 28.4 -96.5 -88.9 173.3 10.2 -28.5 -7.7 27 37 A A T 3 S+ 0 0 114 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.779 126.1 51.7 -55.9 -32.0 13.4 -30.5 -8.5 28 38 A D T 3 S- 0 0 109 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.169 121.2-107.2 -99.5 10.9 11.5 -32.3 -11.2 29 39 A D S < S+ 0 0 111 -3,-2.1 2,-0.2 1,-0.3 -2,-0.1 0.566 77.7 129.2 73.4 12.3 10.3 -29.1 -12.7 30 40 A T - 0 0 72 -6,-0.0 -4,-3.5 1,-0.0 2,-0.8 -0.582 65.1-111.0 -87.8 159.2 6.7 -29.5 -11.6 31 41 A W E -J 25 0B 77 -6,-0.2 -6,-0.2 -2,-0.2 28,-0.0 -0.832 33.8-160.1 -93.1 107.2 4.8 -26.7 -9.8 32 42 A E E -J 24 0B 103 -8,-2.4 -8,-2.5 -2,-0.8 2,-0.0 -0.664 26.0-107.3 -87.8 135.1 4.2 -27.7 -6.3 33 43 A P E +J 23 0B 100 0, 0.0 -10,-0.3 0, 0.0 3,-0.1 -0.361 43.0 169.3 -59.5 134.6 1.5 -26.0 -4.3 34 44 A F E - 0 0 33 -12,-2.9 2,-0.3 1,-0.4 -11,-0.2 0.691 54.7 -29.4-116.2 -47.9 3.1 -23.7 -1.7 35 45 A A E -J 22 0B 20 -13,-1.7 -13,-3.5 14,-0.0 -1,-0.4 -0.976 51.4-168.2-167.6 164.6 0.4 -21.6 -0.2 36 46 A S E +J 21 0B 77 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.984 15.3 140.8-156.6 162.6 -2.9 -20.0 -0.8 37 47 A G E -J 20 0B 25 -17,-2.2 -17,-2.8 -2,-0.3 2,-0.3 -0.967 38.8 -97.2-176.7-170.2 -5.4 -17.5 0.5 38 48 A K E -J 19 0B 136 -2,-0.3 -19,-0.2 -19,-0.2 6,-0.1 -0.983 37.3-105.1-130.7 144.1 -7.8 -14.7 -0.3 39 49 A T 0 0 2 -21,-2.0 -22,-1.8 -2,-0.3 6,-0.2 -0.361 360.0 360.0 -68.8 147.5 -7.4 -10.9 -0.2 40 50 A S 0 0 66 4,-2.4 3,-2.1 -24,-0.2 -23,-0.2 -0.065 360.0 360.0 -80.5 360.0 -9.0 -9.1 2.7 41 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 42 52 A S 0 0 84 0, 0.0 -27,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 5.2 -8.1 -4.0 2.2 43 53 A G + 0 0 1 -3,-2.1 -37,-2.4 1,-0.3 2,-0.3 0.627 360.0 123.8 74.7 15.4 -7.1 -6.0 -0.8 44 54 A E E -B 5 0A 58 -39,-0.2 -4,-2.4 -6,-0.1 2,-0.4 -0.813 45.6-162.6-116.2 150.1 -4.2 -7.6 1.0 45 55 A L E +B 4 0A 14 -41,-2.3 -41,-2.2 -2,-0.3 2,-0.2 -0.976 20.3 162.1-136.5 114.0 -3.1 -11.1 1.7 46 56 A H + 0 0 110 -2,-0.4 -43,-0.1 -43,-0.2 -2,-0.0 -0.674 49.8 54.4-114.5 173.4 -0.6 -11.7 4.4 47 57 A G + 0 0 74 -2,-0.2 -1,-0.1 -45,-0.2 -44,-0.1 0.670 60.4 130.9 74.1 17.4 0.3 -14.8 6.2 48 58 A L S S- 0 0 16 -46,-0.6 2,-0.3 -3,-0.1 -12,-0.2 0.889 75.1 -12.1 -66.3 -41.4 1.0 -16.9 3.2 49 59 A T - 0 0 19 -47,-0.3 2,-0.3 -14,-0.1 -47,-0.2 -0.866 60.9-115.3-151.9-179.9 4.4 -18.2 4.5 50 60 A T > - 0 0 78 -2,-0.3 4,-2.0 -49,-0.1 -2,-0.0 -0.809 34.6-110.5-120.2 160.5 7.2 -17.9 7.0 51 61 A E T 4 S+ 0 0 131 -2,-0.3 -1,-0.1 1,-0.2 42,-0.0 0.862 120.0 53.5 -61.5 -31.3 10.8 -17.0 6.6 52 62 A E T 4 S+ 0 0 184 1,-0.2 -1,-0.2 3,-0.0 3,-0.1 0.937 114.2 39.1 -65.9 -44.0 11.7 -20.6 7.4 53 63 A E T 4 S+ 0 0 95 1,-0.2 2,-1.9 2,-0.1 -2,-0.2 0.763 98.7 80.1 -75.2 -30.3 9.4 -22.0 4.8 54 64 A F < + 0 0 8 -4,-2.0 -1,-0.2 3,-0.0 3,-0.1 -0.515 66.9 162.6 -87.0 70.9 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 47.8 -62.8 -80.0 175.5 13.3 -20.8 0.8 56 66 A E S S+ 0 0 118 32,-0.2 2,-0.3 30,-0.1 32,-0.2 -0.337 81.5 103.7 -52.1 144.7 15.2 -20.0 -2.4 57 67 A G E S- L 0 87B 15 30,-1.6 30,-2.8 -3,-0.1 2,-0.6 -0.950 73.0 -72.0 163.8-179.6 13.3 -21.0 -5.5 58 68 A I E - L 0 86B 44 -33,-0.3 -33,-2.9 -2,-0.3 2,-0.3 -0.919 52.2-166.1-101.1 118.6 11.2 -20.0 -8.5 59 69 A Y E -KL 24 85B 0 26,-3.1 26,-2.3 -2,-0.6 2,-0.5 -0.834 14.5-156.0-111.6 147.5 7.7 -19.0 -7.3 60 70 A K E -KL 23 84B 27 -37,-2.6 -37,-2.6 -2,-0.3 2,-0.7 -0.990 3.2-164.2-124.1 120.0 4.5 -18.5 -9.2 61 71 A V E -KL 22 83B 0 22,-3.0 22,-2.5 -2,-0.5 2,-0.6 -0.935 9.9-165.1-104.6 108.1 1.7 -16.3 -7.7 62 72 A E E -KL 21 82B 28 -41,-3.4 -41,-2.5 -2,-0.7 2,-0.6 -0.898 2.0-161.8-100.5 116.9 -1.5 -17.0 -9.5 63 73 A I E -KL 20 81B 0 18,-3.0 18,-2.3 -2,-0.6 2,-2.3 -0.887 17.7-136.8-103.0 119.3 -4.2 -14.3 -8.9 64 74 A D > + 0 0 25 -45,-2.9 4,-1.4 -2,-0.6 -45,-0.4 -0.427 41.7 156.4 -83.1 69.5 -7.6 -15.6 -9.8 65 75 A T H > + 0 0 5 -2,-2.3 4,-2.5 1,-0.2 5,-0.2 0.856 68.2 56.6 -65.7 -36.0 -8.8 -12.5 -11.6 66 76 A K H > S+ 0 0 54 13,-1.0 4,-3.0 -3,-0.2 5,-0.2 0.943 107.5 48.4 -64.0 -44.6 -11.5 -14.3 -13.7 67 77 A S H > S+ 0 0 81 12,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.835 112.0 51.8 -62.0 -35.6 -13.2 -15.7 -10.6 68 78 A Y H X S+ 0 0 15 -4,-1.4 4,-0.8 2,-0.2 -2,-0.2 0.966 113.2 41.9 -63.5 -50.8 -13.1 -12.1 -9.1 69 79 A W H ><>S+ 0 0 5 -4,-2.5 5,-2.4 1,-0.2 3,-0.9 0.926 115.2 50.3 -67.6 -43.5 -14.7 -10.5 -12.1 70 80 A K H ><5S+ 0 0 130 -4,-3.0 3,-1.6 1,-0.3 -1,-0.2 0.830 104.2 58.3 -64.5 -33.6 -17.3 -13.3 -12.5 71 81 A A H 3<5S+ 0 0 90 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.742 107.1 49.4 -69.6 -17.9 -18.2 -13.0 -8.8 72 82 A L T <<5S- 0 0 60 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.240 125.3-109.5 -98.6 5.3 -19.0 -9.4 -9.6 73 83 A G T < 5S+ 0 0 71 -3,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.754 77.8 127.8 71.7 27.5 -21.0 -10.6 -12.6 74 84 A I < - 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