==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 27-NOV-01 1KGI . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR A.WOJTCZAK,P.NEUMANN,T.MUZIOL,V.CODY,J.R.LUFT,W.PANGBORN . 481 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21165.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 6.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 182 37.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 0.2 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 . 57 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 3 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 4 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 . 1 11 0 0 6 0 8 0 4 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 4 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 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 8 A S 0 0 168 0, 0.0 48,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 149.3 30.0 53.7 43.5 2 9 A K + 0 0 62 1,-0.1 4,-0.1 2,-0.0 51,-0.1 -0.114 360.0 156.6 -74.2 178.3 32.5 56.1 45.0 3 10 A C + 0 0 59 49,-0.2 95,-0.2 2,-0.2 3,-0.1 0.155 64.1 47.1-166.2 -57.9 32.4 57.4 48.6 4 11 A P S S+ 0 0 2 0, 0.0 94,-3.3 0, 0.0 2,-0.4 0.933 117.5 19.4 -68.0 -52.1 35.7 58.6 50.2 5 12 A L E +a 98 0A 1 92,-0.2 46,-0.6 47,-0.2 2,-0.3 -0.976 63.7 172.5-131.6 124.8 37.1 60.8 47.4 6 13 A M E -a 99 0A 16 92,-2.6 94,-3.3 -2,-0.4 2,-0.4 -0.954 13.3-158.5-129.9 145.4 35.3 62.5 44.5 7 14 A V E -aB 100 48A 0 41,-1.4 41,-2.4 -2,-0.3 2,-0.4 -0.978 8.9-177.0-124.5 135.9 36.5 65.0 41.9 8 15 A K E -aB 101 47A 54 92,-2.6 94,-2.3 -2,-0.4 2,-0.4 -0.998 3.1-172.2-136.1 127.6 34.3 67.3 39.9 9 16 A V E -a 102 0A 0 37,-2.3 9,-2.2 -2,-0.4 2,-0.3 -0.980 0.9-168.7-126.9 135.5 35.5 69.7 37.2 10 17 A L E -aC 103 17A 25 92,-2.6 94,-2.9 -2,-0.4 2,-0.6 -0.887 19.6-131.6-120.8 154.6 33.5 72.3 35.2 11 18 A D E >> -aC 104 16A 1 5,-3.2 4,-1.3 -2,-0.3 5,-1.2 -0.930 12.8-169.0-107.4 115.2 34.3 74.4 32.2 12 19 A A T 45S+ 0 0 0 92,-2.9 459,-2.6 -2,-0.6 460,-0.3 0.584 85.7 54.2 -79.3 -14.4 33.6 78.2 32.6 13 20 A V T 45S+ 0 0 38 91,-0.5 -1,-0.2 457,-0.2 92,-0.1 0.855 120.9 27.4 -84.9 -40.1 34.1 79.0 28.9 14 21 A R T 45S- 0 0 121 2,-0.2 344,-0.2 456,-0.1 -2,-0.2 0.544 98.7-127.3-100.7 -8.4 31.6 76.4 27.6 15 22 A G T <5S+ 0 0 0 -4,-1.3 343,-2.4 1,-0.2 -3,-0.2 0.953 74.1 97.3 60.7 51.0 29.3 76.2 30.6 16 23 A S E - 0 0 0 -9,-2.2 3,-0.6 28,-0.1 2,-0.2 -0.869 39.5-159.0 -94.0 103.2 35.1 69.3 31.8 19 26 A V T 3 + 0 0 40 -2,-0.9 24,-0.2 1,-0.2 25,-0.1 -0.574 61.7 12.7 -87.8 147.2 35.2 65.8 30.3 20 27 A D T 3 S+ 0 0 106 22,-2.1 2,-0.4 1,-0.2 -1,-0.2 0.704 76.5 160.3 65.4 21.4 38.3 63.6 30.0 21 28 A V < - 0 0 1 -3,-0.6 21,-1.9 22,-0.2 2,-0.4 -0.636 41.8-123.9 -73.9 127.1 40.4 65.7 32.4 22 29 A A E -J 41 0B 18 45,-0.4 45,-2.6 -2,-0.4 2,-0.4 -0.621 28.7-166.3 -76.5 129.5 43.3 63.5 33.6 23 30 A V E -JK 40 66B 2 17,-3.3 17,-2.2 -2,-0.4 2,-0.4 -0.973 8.3-174.8-121.6 131.5 43.4 63.3 37.4 24 31 A K E -JK 39 65B 107 41,-2.2 41,-3.2 -2,-0.4 2,-0.4 -0.990 6.7-161.6-126.4 131.2 46.3 61.9 39.4 25 32 A V E -JK 38 64B 1 13,-3.3 12,-2.8 -2,-0.4 13,-1.6 -0.953 8.3-175.4-116.3 134.0 46.3 61.5 43.2 26 33 A F E -JK 36 63B 40 37,-2.7 37,-2.7 -2,-0.4 2,-0.4 -0.894 12.2-148.9-125.4 154.0 49.4 61.1 45.3 27 34 A K E -JK 35 62B 47 8,-2.6 8,-2.4 -2,-0.3 35,-0.2 -0.989 21.3-120.8-127.2 133.6 49.8 60.4 49.0 28 35 A K E -J 34 0B 90 33,-2.7 6,-0.2 -2,-0.4 33,-0.2 -0.372 27.2-143.9 -72.3 148.1 52.7 61.7 51.2 29 36 A T > - 0 0 53 4,-1.8 3,-0.7 -2,-0.1 -1,-0.1 -0.282 32.9 -85.9 -99.9-170.1 55.0 59.2 53.0 30 37 A A T 3 S+ 0 0 112 1,-0.2 -2,-0.0 2,-0.1 -1,-0.0 0.891 128.4 42.7 -65.4 -43.2 56.8 59.2 56.4 31 38 A D T 3 S- 0 0 130 2,-0.1 -1,-0.2 1,-0.0 -3,-0.0 0.378 127.0 -96.4 -86.3 3.3 59.8 61.1 55.0 32 39 A G S < S+ 0 0 31 -3,-0.7 2,-0.3 1,-0.3 -2,-0.1 0.666 77.8 139.3 92.2 18.2 57.7 63.5 53.1 33 40 A S - 0 0 48 -6,-0.0 -4,-1.8 1,-0.0 2,-0.4 -0.750 49.7-124.0 -98.5 144.0 57.8 61.9 49.7 34 41 A W E -J 28 0B 60 -2,-0.3 -6,-0.2 -6,-0.2 28,-0.1 -0.681 27.3-172.4 -87.7 134.6 54.7 61.6 47.4 35 42 A E E -J 27 0B 96 -8,-2.4 -8,-2.6 -2,-0.4 0, 0.0 -0.935 35.0 -89.7-126.4 149.2 53.6 58.2 46.1 36 43 A P E +J 26 0B 105 0, 0.0 -10,-0.2 0, 0.0 3,-0.1 -0.310 47.0 164.0 -55.2 133.2 51.0 57.2 43.5 37 44 A F E - 0 0 31 -12,-2.8 2,-0.3 1,-0.5 -11,-0.2 0.710 57.7 -30.3-117.9 -50.0 47.6 56.7 45.1 38 45 A A E -J 25 0B 19 -13,-1.6 -13,-3.3 14,-0.0 -1,-0.5 -0.969 53.0-172.5-164.5 166.3 45.0 56.7 42.4 39 46 A S E +J 24 0B 87 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.981 16.3 132.6-164.2 159.1 44.2 58.1 39.0 40 47 A G E -J 23 0B 25 -17,-2.2 -17,-3.3 -2,-0.3 2,-0.3 -0.969 43.1 -92.3 176.4-170.1 41.5 58.4 36.3 41 48 A K E -J 22 0B 113 -2,-0.3 -19,-0.2 -19,-0.2 6,-0.1 -0.978 39.3-102.4-132.6 143.9 39.7 60.8 34.0 42 49 A T - 0 0 4 -21,-1.9 -22,-2.1 -2,-0.3 6,-0.2 -0.347 37.6-136.9 -64.5 144.2 36.5 62.7 34.4 43 50 A A > - 0 0 52 4,-2.5 3,-2.3 -24,-0.2 -22,-0.2 -0.143 41.2 -74.2 -88.1-171.4 33.4 61.3 32.7 44 51 A E T 3 S+ 0 0 136 1,-0.3 -25,-0.1 2,-0.1 -2,-0.1 0.751 133.9 58.0 -57.5 -27.7 30.7 63.1 30.7 45 52 A S T 3 S- 0 0 48 2,-0.2 -1,-0.3 -29,-0.1 -27,-0.1 0.563 116.6-117.0 -78.3 -10.9 29.3 64.4 34.0 46 53 A G S < S+ 0 0 0 -3,-2.3 -37,-2.3 1,-0.3 2,-0.3 0.471 79.0 119.4 84.6 5.5 32.7 66.0 34.7 47 54 A E E -B 8 0A 51 -39,-0.2 -4,-2.5 -6,-0.1 2,-0.5 -0.715 53.5-152.5-106.8 153.6 33.0 63.7 37.7 48 55 A L E +B 7 0A 17 -41,-2.4 -41,-1.4 -2,-0.3 2,-0.2 -0.989 22.5 175.1-126.2 116.2 35.5 61.0 38.6 49 56 A H + 0 0 77 -2,-0.5 -43,-0.1 -43,-0.2 0, 0.0 -0.660 53.1 40.8-113.2 171.6 34.3 58.3 41.0 50 57 A G + 0 0 57 -2,-0.2 -1,-0.1 2,-0.1 -44,-0.1 0.736 62.3 137.7 62.8 26.9 35.8 55.1 42.3 51 58 A L S S- 0 0 9 -46,-0.6 2,-0.3 -3,-0.2 -12,-0.1 0.836 75.2 -21.4 -70.1 -31.7 39.3 56.5 42.9 52 59 A T - 0 0 12 -47,-0.3 2,-0.3 -14,-0.1 -49,-0.2 -0.891 61.0-114.4-160.3-175.4 39.5 54.7 46.2 53 60 A T > - 0 0 80 -2,-0.3 4,-2.9 -50,-0.1 -51,-0.0 -0.798 35.3-105.5-127.5 169.2 37.7 53.0 49.1 54 61 A D T 4 S+ 0 0 61 -2,-0.3 -1,-0.1 2,-0.2 42,-0.0 0.868 121.1 49.8 -65.9 -36.3 37.3 53.8 52.8 55 62 A E T 4 S+ 0 0 182 1,-0.2 -1,-0.2 3,-0.1 3,-0.1 0.849 118.2 39.8 -69.6 -35.2 39.8 51.1 53.9 56 63 A K T 4 S+ 0 0 89 1,-0.2 2,-1.9 2,-0.1 -2,-0.2 0.828 102.5 72.4 -81.7 -36.9 42.3 52.3 51.3 57 64 A F S < S+ 0 0 0 -4,-2.9 -1,-0.2 38,-0.0 3,-0.1 -0.532 73.3 161.2 -83.4 75.2 41.7 56.0 51.9 58 65 A T - 0 0 46 -2,-1.9 32,-0.1 1,-0.2 34,-0.1 -0.196 47.1 -56.9 -87.3-177.6 43.4 56.3 55.3 59 66 A E S S+ 0 0 108 32,-0.3 2,-0.3 33,-0.1 32,-0.2 -0.264 84.4 88.8 -60.5 141.2 44.7 59.3 57.3 60 67 A G E S- L 0 90B 20 30,-2.0 30,-3.9 -3,-0.1 2,-0.5 -0.942 75.0 -62.3 157.2 179.8 47.3 61.4 55.5 61 68 A V E - L 0 89B 29 -2,-0.3 -33,-2.7 28,-0.3 2,-0.3 -0.894 50.0-166.9-100.9 122.3 48.2 64.3 53.2 62 69 A Y E -KL 27 88B 0 26,-3.5 26,-2.3 -2,-0.5 2,-0.4 -0.801 14.6-153.5-112.4 157.5 47.0 63.9 49.7 63 70 A R E -KL 26 87B 41 -37,-2.7 -37,-2.7 -2,-0.3 2,-0.5 -0.995 7.7-168.6-130.8 118.5 47.8 65.7 46.4 64 71 A V E -KL 25 86B 0 22,-2.7 22,-2.6 -2,-0.4 2,-0.5 -0.968 8.4-168.6-112.1 119.8 45.2 65.8 43.6 65 72 A E E -KL 24 85B 36 -41,-3.2 -41,-2.2 -2,-0.5 2,-0.5 -0.950 7.1-162.2-115.9 122.0 46.5 67.0 40.3 66 73 A L E -KL 23 84B 1 18,-2.9 18,-2.2 -2,-0.5 2,-2.1 -0.896 19.3-137.1-103.2 122.7 44.3 68.0 37.4 67 74 A D > + 0 0 48 -45,-2.6 4,-1.1 -2,-0.5 -45,-0.4 -0.549 40.6 158.6 -79.7 77.9 46.0 68.1 33.9 68 75 A T H > + 0 0 5 -2,-2.1 4,-2.1 2,-0.2 5,-0.2 0.791 63.7 63.5 -72.4 -29.8 44.3 71.4 32.9 69 76 A K H > S+ 0 0 54 13,-0.7 4,-3.0 -3,-0.2 5,-0.3 0.970 103.6 45.7 -61.5 -52.1 46.9 72.2 30.3 70 77 A S H > S+ 0 0 68 12,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.874 111.0 55.7 -58.3 -38.0 46.2 69.1 28.1 71 78 A Y H X S+ 0 0 20 -4,-1.1 4,-0.5 2,-0.2 -1,-0.2 0.909 114.2 37.5 -60.5 -49.4 42.4 69.8 28.4 72 79 A W H ><>S+ 0 0 6 -4,-2.1 5,-1.9 2,-0.2 3,-1.0 0.909 114.4 54.1 -70.5 -44.7 42.7 73.4 27.1 73 80 A K H ><5S+ 0 0 123 -4,-3.0 3,-1.9 1,-0.3 -2,-0.2 0.888 101.6 59.4 -59.3 -37.2 45.3 72.7 24.5 74 81 A A H 3<5S+ 0 0 86 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.785 105.4 50.5 -61.7 -27.8 43.2 69.9 23.0 75 82 A L T <<5S- 0 0 72 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.465 124.4-105.7 -87.9 -4.2 40.5 72.5 22.3 76 83 A G T < 5S+ 0 0 66 -3,-1.9 -3,-0.2 1,-0.3 2,-0.2 0.352 79.5 132.4 94.8 -4.8 43.1 74.8 20.7 77 84 A I < - 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