==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 26-DEC-12 4IKJ . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.M.T.R.LIMA . 231 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10805.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 194 84.0 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 . 94 40.7 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 . 43 18.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 5.6 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 1 1 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 10 A C 0 0 47 0, 0.0 50,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 81.1 -26.4 -11.8 -38.2 2 11 A P + 0 0 9 0, 0.0 94,-3.3 0, 0.0 2,-0.4 0.525 360.0 49.4 -79.0 -12.0 -28.9 -12.1 -35.3 3 12 A L E +a 96 0A 0 47,-0.2 46,-0.7 92,-0.2 2,-0.3 -0.917 63.6 165.8-137.2 111.2 -26.2 -12.5 -32.6 4 13 A M E -a 97 0A 24 92,-3.0 94,-2.9 -2,-0.4 2,-0.4 -0.912 18.6-155.5-119.4 147.2 -23.3 -10.1 -32.4 5 14 A V E -aB 98 46A 0 41,-1.8 41,-2.5 -2,-0.3 2,-0.4 -0.988 9.6-173.2-122.7 131.6 -20.9 -9.7 -29.5 6 15 A K E -aB 99 45A 64 92,-3.3 94,-3.3 -2,-0.4 2,-0.5 -0.998 2.4-169.1-126.8 131.8 -19.0 -6.5 -29.0 7 16 A V E -a 100 0A 0 37,-3.1 9,-3.0 -2,-0.4 2,-0.4 -0.976 1.0-168.8-128.1 127.3 -16.3 -6.1 -26.4 8 17 A L E -aC 101 15A 71 92,-3.2 94,-3.5 -2,-0.5 2,-0.6 -0.888 19.8-134.7-113.7 145.0 -14.6 -2.9 -25.2 9 18 A D E >> -aC 102 14A 2 5,-3.3 5,-1.5 -2,-0.4 4,-1.4 -0.894 13.3-167.1 -98.1 115.7 -11.6 -2.6 -23.1 10 19 A A T 45S+ 0 0 45 92,-3.2 93,-0.2 -2,-0.6 -1,-0.1 0.597 85.1 55.7 -81.5 -15.0 -12.3 0.1 -20.4 11 20 A V T 45S+ 0 0 85 91,-0.6 -1,-0.2 1,-0.1 92,-0.1 0.881 119.8 28.0 -80.6 -44.0 -8.6 0.4 -19.4 12 21 A R T 45S- 0 0 130 2,-0.2 -2,-0.2 3,-0.0 -1,-0.1 0.618 97.7-127.7 -96.6 -12.9 -7.3 1.2 -22.9 13 22 A G T <5S+ 0 0 73 -4,-1.4 -3,-0.2 1,-0.3 3,-0.0 0.961 74.4 108.4 62.1 50.7 -10.3 2.9 -24.4 14 23 A S E - 0 0 0 -9,-3.0 3,-0.5 28,-0.2 -9,-0.3 -0.845 42.1-157.0 -90.7 104.9 -11.1 -5.7 -26.9 17 26 A I T 3 + 0 0 65 -2,-0.9 24,-0.2 1,-0.2 25,-0.1 -0.536 60.8 9.9 -91.7 148.9 -9.4 -7.6 -29.8 18 27 A N T 3 S+ 0 0 113 22,-1.8 2,-0.6 1,-0.2 -1,-0.2 0.797 79.8 162.6 51.6 35.9 -9.0 -11.4 -30.2 19 28 A V < - 0 0 1 -3,-0.5 21,-1.6 22,-0.2 2,-0.2 -0.747 39.2-127.0 -85.6 120.3 -11.3 -12.1 -27.3 20 29 A A E -J 39 0B 16 -2,-0.6 45,-3.8 45,-0.4 2,-0.4 -0.501 28.3-170.5 -70.7 133.0 -12.5 -15.7 -27.4 21 30 A V E -JK 38 64B 0 17,-3.5 17,-2.9 43,-0.2 2,-0.4 -0.997 5.1-169.4-129.3 126.8 -16.3 -15.9 -27.3 22 31 A H E -JK 37 63B 82 41,-2.4 41,-3.5 -2,-0.4 2,-0.4 -0.971 5.9-158.0-119.7 130.1 -18.2 -19.2 -26.8 23 32 A V E -JK 36 62B 1 13,-4.3 12,-3.1 -2,-0.4 13,-1.7 -0.909 11.3-177.9-111.1 135.1 -21.9 -19.5 -27.3 24 33 A F E -JK 34 61B 39 37,-2.7 37,-3.0 -2,-0.4 2,-0.4 -0.928 14.3-151.0-128.1 151.2 -24.0 -22.3 -25.7 25 34 A R E -JK 33 60B 75 8,-2.6 8,-3.1 -2,-0.3 35,-0.2 -0.986 27.5-115.8-121.8 134.3 -27.7 -23.1 -25.9 26 35 A K E -J 32 0B 62 33,-3.3 33,-0.3 -2,-0.4 6,-0.2 -0.531 36.9-139.9 -68.1 130.1 -29.5 -24.9 -23.1 27 36 A A > - 0 0 13 4,-3.4 3,-2.2 -2,-0.2 -1,-0.1 -0.343 27.7 -95.4 -86.2 172.3 -30.7 -28.3 -24.4 28 37 A A T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.812 128.3 52.3 -52.5 -32.6 -34.0 -30.1 -23.8 29 38 A D T 3 S- 0 0 105 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.288 120.2-109.3 -92.0 8.0 -32.1 -31.9 -21.0 30 39 A D S < S+ 0 0 112 -3,-2.2 2,-0.2 1,-0.3 -2,-0.1 0.515 78.2 122.5 80.3 5.0 -30.8 -28.7 -19.3 31 40 A T S S- 0 0 73 -6,-0.0 -4,-3.4 1,-0.0 2,-0.8 -0.591 70.0-103.7 -90.1 163.4 -27.1 -29.1 -20.3 32 41 A W E -J 26 0B 68 -6,-0.2 -6,-0.2 -2,-0.2 28,-0.1 -0.776 33.7-159.0 -88.7 108.6 -25.3 -26.4 -22.3 33 42 A E E -J 25 0B 106 -8,-3.1 -8,-2.6 -2,-0.8 2,-0.3 -0.732 28.5-106.8 -88.2 138.3 -24.8 -27.5 -25.8 34 43 A P E +J 24 0B 113 0, 0.0 -10,-0.3 0, 0.0 3,-0.1 -0.491 44.7 170.2 -63.2 121.2 -22.0 -25.7 -27.8 35 44 A F E - 0 0 30 -12,-3.1 2,-0.3 1,-0.4 -11,-0.2 0.858 54.6 -32.9-102.4 -51.9 -23.7 -23.4 -30.2 36 45 A A E -J 23 0B 20 -13,-1.7 -13,-4.3 14,-0.0 -1,-0.4 -0.973 52.3-166.8-163.5 162.4 -21.0 -21.2 -31.8 37 46 A S E +J 22 0B 73 -2,-0.3 2,-0.3 -15,-0.3 -15,-0.3 -0.980 14.6 147.1-153.2 165.2 -17.8 -19.6 -30.9 38 47 A G E -J 21 0B 22 -17,-2.9 -17,-3.5 -2,-0.3 2,-0.4 -0.981 39.4 -96.7-176.9-178.4 -15.4 -17.0 -32.3 39 48 A K E -J 20 0B 132 -2,-0.3 -19,-0.2 -19,-0.2 2,-0.1 -0.943 40.0-111.6-117.6 141.4 -12.8 -14.3 -31.6 40 49 A T - 0 0 1 -21,-1.6 -22,-1.8 -2,-0.4 6,-0.3 -0.463 37.6-130.1 -70.1 145.2 -13.6 -10.6 -31.6 41 50 A S > - 0 0 51 4,-3.7 3,-1.9 -24,-0.2 -22,-0.2 -0.044 38.1 -75.5 -82.4-168.7 -12.1 -8.8 -34.5 42 51 A E T 3 S+ 0 0 164 1,-0.3 -25,-0.1 2,-0.2 -2,-0.1 0.779 135.1 55.1 -58.6 -31.1 -10.0 -5.6 -34.6 43 52 A S T 3 S- 0 0 53 2,-0.2 -1,-0.3 -29,-0.1 -27,-0.2 0.476 120.4-112.3 -84.0 -2.3 -13.2 -3.6 -34.0 44 53 A G S < S+ 0 0 0 -3,-1.9 -37,-3.1 1,-0.3 2,-0.3 0.659 79.5 127.0 77.3 17.3 -13.8 -5.8 -30.8 45 54 A E E -B 6 0A 39 -39,-0.2 -4,-3.7 -6,-0.1 2,-0.5 -0.790 49.6-157.1-111.0 152.2 -16.8 -7.2 -32.6 46 55 A L E +B 5 0A 13 -41,-2.5 -41,-1.8 -2,-0.3 2,-0.2 -0.965 22.5 170.4-129.0 109.7 -17.7 -10.8 -33.3 47 56 A H + 0 0 100 -2,-0.5 -43,-0.1 -43,-0.2 -2,-0.0 -0.693 52.4 41.2-110.9 163.4 -20.0 -11.2 -36.3 48 57 A G + 0 0 64 -2,-0.2 -1,-0.1 2,-0.2 -44,-0.1 0.699 63.2 135.7 78.6 20.1 -21.2 -14.4 -38.0 49 58 A L S S- 0 0 14 -46,-0.7 2,-0.3 -3,-0.2 -12,-0.2 0.848 75.6 -18.0 -67.1 -34.9 -21.7 -16.5 -35.0 50 59 A T - 0 0 10 -47,-0.3 2,-0.3 -14,-0.1 -47,-0.2 -0.867 64.7-113.3-156.8-174.0 -25.0 -17.8 -36.2 51 60 A T > - 0 0 61 -2,-0.3 4,-2.9 -50,-0.1 -2,-0.0 -0.815 33.1-105.1-130.5 167.7 -27.9 -17.4 -38.6 52 61 A E T 4 S+ 0 0 115 -2,-0.3 -1,-0.1 1,-0.2 42,-0.1 0.915 122.3 48.4 -56.8 -46.1 -31.6 -16.5 -38.4 53 62 A E T 4 S+ 0 0 147 1,-0.2 -1,-0.2 3,-0.0 3,-0.0 0.903 117.8 39.3 -60.1 -45.4 -32.4 -20.2 -39.2 54 63 A E T 4 S+ 0 0 92 1,-0.2 2,-2.4 2,-0.1 -2,-0.2 0.855 97.8 78.4 -78.0 -37.1 -30.0 -21.6 -36.6 55 64 A F < + 0 0 7 -4,-2.9 -1,-0.2 3,-0.0 3,-0.1 -0.433 69.1 165.0 -77.0 71.7 -30.7 -19.0 -33.9 56 65 A V - 0 0 70 -2,-2.4 32,-0.1 1,-0.2 -2,-0.1 -0.295 48.1 -66.4 -82.6 169.9 -33.9 -20.6 -32.7 57 66 A E S S+ 0 0 111 32,-0.2 2,-0.3 30,-0.1 -1,-0.2 -0.162 83.1 103.6 -47.5 151.2 -35.7 -19.8 -29.5 58 67 A G E S- L 0 88B 14 30,-1.6 30,-3.3 -3,-0.1 2,-0.6 -0.924 73.7 -71.5 157.9 178.8 -33.8 -20.9 -26.4 59 68 A I E - L 0 87B 43 -33,-0.3 -33,-3.3 -2,-0.3 2,-0.3 -0.930 51.7-168.8-103.0 122.9 -31.7 -20.0 -23.5 60 69 A Y E -KL 25 86B 0 26,-3.3 26,-2.4 -2,-0.6 2,-0.5 -0.859 14.3-155.1-113.6 151.5 -28.2 -19.0 -24.7 61 70 A K E -KL 24 85B 23 -37,-3.0 -37,-2.7 -2,-0.3 2,-0.6 -0.993 2.8-164.1-125.5 126.7 -25.0 -18.4 -22.8 62 71 A V E -KL 23 84B 0 22,-2.6 22,-2.3 -2,-0.5 2,-0.7 -0.949 8.6-165.2-108.8 110.0 -22.3 -16.2 -24.2 63 72 A E E -KL 22 83B 51 -41,-3.5 -41,-2.4 -2,-0.6 2,-0.6 -0.887 3.2-159.9-100.6 113.4 -19.0 -16.8 -22.4 64 73 A I E -KL 21 82B 0 18,-3.7 2,-2.9 -2,-0.7 18,-1.9 -0.797 17.8-134.9 -96.7 118.2 -16.5 -14.1 -23.1 65 74 A D > + 0 0 45 -45,-3.8 4,-1.4 -2,-0.6 -45,-0.4 -0.390 45.4 153.7 -75.5 72.8 -13.0 -15.2 -22.3 66 75 A T H > + 0 0 3 -2,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.796 63.6 63.2 -69.8 -29.1 -12.1 -12.0 -20.5 67 76 A K H > S+ 0 0 55 13,-1.0 4,-2.8 -3,-0.3 5,-0.2 0.976 104.2 43.7 -65.1 -53.1 -9.4 -13.8 -18.4 68 77 A S H > S+ 0 0 64 12,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.893 111.4 58.7 -56.7 -39.4 -7.2 -14.8 -21.4 69 78 A Y H < S+ 0 0 17 -4,-1.4 4,-0.3 1,-0.2 -1,-0.2 0.945 112.8 35.9 -51.4 -55.9 -7.7 -11.2 -22.7 70 79 A W H ><>S+ 0 0 4 -4,-2.3 5,-2.7 1,-0.2 3,-1.1 0.862 113.8 58.7 -68.3 -37.4 -6.3 -9.6 -19.6 71 80 A K H ><5S+ 0 0 98 -4,-2.8 3,-2.7 1,-0.3 -2,-0.2 0.926 101.3 53.7 -58.4 -48.2 -3.7 -12.2 -19.0 72 81 A A T 3<5S+ 0 0 94 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.577 107.1 54.0 -67.2 -10.2 -2.1 -11.6 -22.4 73 82 A L T < 5S- 0 0 61 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.221 124.1-106.3-101.2 8.6 -1.9 -8.0 -21.4 74 83 A G T < 5S+ 0 0 69 -3,-2.7 2,-0.5 1,-0.3 -3,-0.2 0.557 82.1 127.6 81.0 10.2 0.0 -9.0 -18.2 75 84 A I < - 0 0 52 -5,-2.7 -1,-0.3 -6,-0.1 -2,-0.2 -0.844 54.8-147.0-105.6 129.6 -3.1 -8.3 -16.0 76 85 A S - 0 0 76 -2,-0.5 -9,-0.1 -3,-0.1 -5,-0.0 -0.821 30.2-155.8 -92.2 98.7 -4.4 -10.9 -13.6 77 86 A P - 0 0 15 0, 0.0 28,-0.2 0, 0.0 -10,-0.0 -0.241 18.7-126.0 -80.1 166.5 -8.1 -10.1 -13.8 78 87 A F S S+ 0 0 10 26,-3.3 126,-0.8 125,-0.1 2,-0.2 0.953 86.5 60.8 -69.3 -52.1 -10.8 -10.8 -11.2 79 88 A H E - M 0 203B 4 25,-0.5 124,-0.3 124,-0.2 3,-0.1 -0.518 67.1-144.5 -85.5 146.8 -13.3 -12.8 -13.3 80 89 A E E S- 0 0 36 122,-2.7 -13,-1.0 1,-0.2 -12,-0.3 0.830 83.4 -29.8 -68.5 -34.9 -12.7 -16.1 -15.1 81 90 A H E - M 0 202B 21 121,-0.6 2,-0.5 -15,-0.2 121,-0.5 -0.938 60.2-107.6-164.9 171.9 -15.0 -14.9 -17.9 82 91 A A E -LM 64 201B 0 -18,-1.9 -18,-3.7 -2,-0.3 2,-0.5 -0.996 38.7-171.6-110.1 118.6 -18.0 -12.7 -18.5 83 92 A E E -LM 63 200B 2 117,-0.6 117,-0.6 -2,-0.5 2,-0.5 -0.973 10.4-166.2-117.1 134.1 -21.0 -14.8 -19.2 84 93 A V E -LM 62 199B 0 -22,-2.3 -22,-2.6 -2,-0.5 2,-0.5 -0.968 7.2-169.3-113.7 120.9 -24.3 -13.5 -20.4 85 94 A V E +LM 61 198B 1 113,-0.5 112,-3.7 -2,-0.5 113,-0.6 -0.957 18.7 154.3-118.4 128.0 -27.3 -15.9 -20.2 86 95 A F E -LM 60 196B 0 -26,-2.4 -26,-3.3 -2,-0.5 2,-0.5 -0.990 47.3-112.6-151.9 152.1 -30.5 -15.0 -21.9 87 96 A T E -L 59 0B 33 108,-0.8 2,-0.3 -2,-0.3 -28,-0.3 -0.791 42.0-157.1 -81.9 125.9 -33.7 -16.3 -23.4 88 97 A A E +L 58 0B 0 -30,-3.3 -30,-1.6 -2,-0.5 4,-0.1 -0.838 60.6 1.6-107.9 145.7 -33.5 -15.5 -27.1 89 98 A N S > S+ 0 0 8 -2,-0.3 3,-1.4 -32,-0.2 -32,-0.2 0.652 73.0 144.8 61.8 27.4 -36.4 -15.1 -29.6 90 99 A D T 3 S+ 0 0 109 1,-0.3 -1,-0.1 -3,-0.2 -2,-0.1 0.825 80.6 34.4 -63.1 -39.1 -39.2 -15.7 -27.0 91 100 A S T 3 S- 0 0 103 1,-0.5 -1,-0.3 0, 0.0 -2,-0.1 -0.011 138.7 -64.3-102.0 25.1 -41.5 -13.2 -28.8 92 101 A G S < S- 0 0 28 -3,-1.4 -1,-0.5 -4,-0.1 -3,-0.1 -0.385 86.8 -30.5 107.6 168.6 -40.2 -14.0 -32.3 93 102 A P + 0 0 94 0, 0.0 2,-0.3 0, 0.0 -37,-0.1 -0.261 63.4 177.2 -63.7 138.5 -36.7 -13.6 -33.9 94 103 A R - 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