==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 03-MAR-03 1OO2 . COMPND 2 MOLECULE: TRANSTHYRETIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SPARUS AURATA; . AUTHOR N.PASQUATO,I.RAMAZZINA,C.FOLLI,R.BATTISTUTTA,R.BERNI, . 464 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19441.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 333 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 171 36.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 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 0.9 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 . 0 0.0 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 . 40 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 6.0 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 0 1 3 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 . 0 7 1 0 6 0 8 2 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 2 1 0 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 9 A R 0 0 154 0, 0.0 52,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 52.0 50.8 22.4 15.3 2 10 A C - 0 0 28 1,-0.2 95,-0.2 50,-0.1 3,-0.1 -0.719 360.0-154.3 -87.9 119.9 50.2 18.9 16.6 3 11 A P S S+ 0 0 7 0, 0.0 94,-2.7 0, 0.0 2,-0.4 0.769 84.1 36.4 -58.7 -30.0 50.0 16.4 13.9 4 12 A L E S+a 97 0A 0 47,-0.4 46,-0.4 92,-0.2 2,-0.3 -0.962 70.2 167.3-136.3 118.4 47.8 14.1 16.0 5 13 A M E -a 98 0A 69 92,-3.1 94,-2.7 -2,-0.4 2,-0.3 -0.905 16.2-154.3-126.3 156.6 45.2 15.2 18.5 6 14 A V E -a 99 0A 2 -2,-0.3 41,-0.3 92,-0.2 2,-0.3 -0.919 6.3-169.7-124.5 155.4 42.4 13.6 20.5 7 15 A K E -a 100 0A 62 92,-2.2 94,-2.5 -2,-0.3 2,-0.5 -0.869 13.0-173.7-142.1 108.1 39.2 14.9 22.0 8 16 A I E -a 101 0A 0 37,-2.2 9,-2.4 -2,-0.3 2,-0.3 -0.906 1.9-170.8-108.8 129.7 37.4 12.4 24.3 9 17 A L E -aB 102 16A 26 92,-2.7 94,-3.0 -2,-0.5 2,-0.6 -0.906 20.0-135.1-119.8 148.6 33.9 13.2 25.7 10 18 A D E >> -aB 103 15A 1 5,-3.0 4,-1.7 -2,-0.3 5,-0.9 -0.910 11.3-166.0-103.4 115.5 31.8 11.4 28.4 11 19 A A T 45S+ 0 0 0 92,-3.0 446,-2.8 -2,-0.6 447,-0.3 0.451 85.4 54.9 -84.3 -2.1 28.2 11.0 27.3 12 20 A V T 45S+ 0 0 18 91,-0.4 -1,-0.2 444,-0.2 92,-0.1 0.854 120.5 26.0 -91.0 -43.4 27.0 10.1 30.8 13 21 A K T 45S- 0 0 101 2,-0.2 -2,-0.2 443,-0.1 335,-0.2 0.626 97.9-127.5 -93.4 -21.8 28.3 13.2 32.6 14 22 A G T <5S+ 0 0 1 -4,-1.7 334,-3.0 1,-0.3 -3,-0.2 0.923 73.1 105.6 69.1 43.8 28.4 15.6 29.7 15 23 A T E - 0 0 0 -9,-2.4 3,-0.5 27,-0.2 -9,-0.2 -0.799 41.5-168.8 -94.4 101.1 36.7 12.5 29.6 18 26 A G T 3 + 0 0 20 -2,-0.9 24,-0.2 1,-0.2 25,-0.2 -0.541 60.8 28.4 -86.9 159.9 39.8 13.2 31.7 19 27 A S T 3 S+ 0 0 100 22,-2.4 2,-0.6 1,-0.2 -1,-0.2 0.677 74.7 150.2 69.2 19.3 42.4 10.6 32.9 20 28 A V < - 0 0 1 -3,-0.5 21,-2.4 22,-0.2 -1,-0.2 -0.736 38.6-141.3 -82.8 121.4 41.9 8.3 29.9 21 29 A A E +H 40 0B 32 -2,-0.6 45,-3.0 45,-0.4 2,-0.3 -0.555 25.2 178.3 -81.3 144.2 45.1 6.5 29.2 22 30 A L E -HI 39 65B 1 17,-2.7 17,-2.2 43,-0.2 2,-0.4 -0.981 20.5-148.6-145.7 160.1 46.1 5.9 25.6 23 31 A K E -HI 38 64B 76 41,-2.0 41,-2.7 -2,-0.3 2,-0.5 -0.992 7.4-154.0-128.9 132.0 48.9 4.3 23.4 24 32 A V E +HI 37 63B 0 13,-3.1 12,-3.0 -2,-0.4 13,-1.8 -0.960 20.6 178.0-106.6 124.2 50.0 5.4 19.9 25 33 A S E -HI 35 62B 18 37,-2.9 37,-2.5 -2,-0.5 2,-0.4 -0.931 19.3-145.5-127.5 152.3 51.6 2.8 17.8 26 34 A Q E -HI 34 61B 45 8,-2.8 8,-2.7 -2,-0.3 35,-0.2 -0.930 27.8-112.8-116.1 136.6 52.9 2.7 14.2 27 35 A K E -H 33 0B 98 33,-2.9 6,-0.2 -2,-0.4 33,-0.2 -0.452 36.1-147.4 -69.0 136.4 52.7 -0.4 11.9 28 36 A T > - 0 0 45 4,-3.1 3,-1.7 -2,-0.1 -1,-0.1 -0.477 25.7 -99.2-103.5 174.3 56.2 -1.9 11.2 29 37 A A T 3 S+ 0 0 113 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.888 120.8 54.2 -60.5 -40.3 57.6 -3.6 8.1 30 38 A D T 3 S- 0 0 141 1,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.422 124.3-102.1 -78.0 6.5 57.1 -7.1 9.5 31 39 A G S < S+ 0 0 38 -3,-1.7 -2,-0.1 1,-0.3 -1,-0.1 0.274 87.4 119.1 93.0 -9.9 53.4 -6.3 10.1 32 40 A G - 0 0 25 -5,-0.1 -4,-3.1 1,-0.1 2,-0.4 0.029 62.7-108.7 -75.4-173.8 54.0 -5.8 13.8 33 41 A W E -H 27 0B 96 -6,-0.2 2,-0.5 -3,-0.1 -6,-0.2 -0.959 17.8-161.0-124.4 137.5 53.4 -2.6 15.9 34 42 A T E -H 26 0B 63 -8,-2.7 -8,-2.8 -2,-0.4 2,-0.4 -0.971 23.0-129.6-115.8 126.8 55.9 -0.3 17.5 35 43 A Q E +H 25 0B 113 -2,-0.5 -10,-0.3 -10,-0.2 3,-0.1 -0.541 30.3 171.8 -71.6 127.0 54.7 2.0 20.3 36 44 A I E + 0 0 38 -12,-3.0 2,-0.3 -2,-0.4 -11,-0.2 0.661 60.4 6.1-111.3 -14.7 55.7 5.6 19.6 37 45 A A E -H 24 0B 13 -13,-1.8 -13,-3.1 14,-0.1 -1,-0.3 -0.990 52.1-167.1-161.5 154.0 53.8 7.5 22.3 38 46 A T E +H 23 0B 83 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.955 18.9 156.7-138.0 159.7 51.7 7.1 25.4 39 47 A G E -H 22 0B 15 -17,-2.2 -17,-2.7 -2,-0.3 2,-0.4 -0.980 34.2-126.6-168.4 176.3 49.6 9.6 27.4 40 48 A V E -H 21 0B 83 -2,-0.3 -19,-0.2 -19,-0.2 6,-0.1 -0.997 38.5-112.1-135.6 126.4 46.7 10.3 29.7 41 49 A T - 0 0 5 -21,-2.4 -22,-2.4 -2,-0.4 6,-0.2 -0.270 27.0-132.9 -62.3 148.4 44.0 12.9 28.8 42 50 A D > - 0 0 53 4,-2.6 3,-2.4 -24,-0.2 -22,-0.2 -0.169 43.3 -79.0 -82.7-174.6 43.8 16.1 30.8 43 51 A A T 3 S+ 0 0 90 1,-0.3 -25,-0.2 -25,-0.2 -2,-0.1 0.624 131.8 59.4 -70.6 -7.5 40.5 17.6 32.1 44 52 A T T 3 S- 0 0 60 2,-0.2 -1,-0.3 -27,-0.1 -27,-0.2 0.381 117.4-112.5 -94.9 4.6 39.7 18.9 28.6 45 53 A G S < S+ 0 0 0 -3,-2.4 -37,-2.2 1,-0.3 2,-0.3 0.776 82.8 106.7 72.3 24.9 39.8 15.3 27.2 46 54 A E - 0 0 57 -39,-0.2 -4,-2.6 -6,-0.1 2,-0.4 -0.861 59.9-144.9-126.6 163.8 42.9 16.1 25.2 47 55 A I > - 0 0 39 -41,-0.3 3,-0.7 -2,-0.3 -41,-0.2 -0.907 21.1-148.2-130.4 111.8 46.6 15.3 25.2 48 56 A H T 3 S+ 0 0 99 -2,-0.4 -43,-0.1 1,-0.2 -2,-0.0 -0.456 78.6 12.1 -75.1 146.9 48.9 18.2 24.0 49 57 A N T 3 S+ 0 0 131 -2,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.878 73.7 161.4 59.5 40.2 52.1 17.3 22.2 50 58 A L < - 0 0 13 -3,-0.7 2,-0.3 -46,-0.4 -12,-0.2 0.941 69.2 -11.9 -56.6 -52.3 51.2 13.7 21.8 51 59 A I S S- 0 0 4 -47,-0.3 -47,-0.4 -14,-0.1 -1,-0.2 -0.946 74.5-114.5-143.2 162.2 53.8 13.2 19.1 52 60 A T > - 0 0 60 -2,-0.3 3,-0.7 -3,-0.1 4,-0.2 -0.513 30.1-105.7 -97.0 165.2 56.0 15.4 16.9 53 61 A E G > S+ 0 0 100 1,-0.2 3,-1.3 2,-0.2 -1,-0.1 0.867 119.5 53.9 -47.5 -45.5 56.1 16.1 13.2 54 62 A Q G 3 S+ 0 0 159 1,-0.3 -1,-0.2 2,-0.1 0, 0.0 0.740 105.8 50.9 -74.2 -23.9 59.2 14.0 12.9 55 63 A Q G < S+ 0 0 70 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.316 99.3 73.0 -95.3 13.9 57.7 10.9 14.5 56 64 A F < + 0 0 24 -3,-1.3 -1,-0.2 -4,-0.2 3,-0.1 -0.429 59.8 154.3-122.8 60.8 54.6 11.0 12.3 57 65 A P - 0 0 69 0, 0.0 32,-0.2 0, 0.0 -3,-0.0 -0.222 58.3 -70.0 -73.7 172.9 55.6 9.9 8.8 58 66 A A S S+ 0 0 73 32,-0.1 2,-0.3 30,-0.1 32,-0.2 -0.330 87.8 88.8 -58.9 145.9 53.1 8.3 6.3 59 67 A G E S- J 0 89B 22 30,-1.6 30,-2.8 -3,-0.1 2,-0.3 -0.877 78.7 -51.0 148.6 179.5 52.0 4.9 7.4 60 68 A V E - J 0 88B 21 -2,-0.3 -33,-2.9 28,-0.2 2,-0.3 -0.678 51.0-171.9 -91.4 136.4 49.4 3.0 9.4 61 69 A Y E -IJ 26 87B 0 26,-2.8 26,-2.4 -2,-0.3 2,-0.4 -0.916 12.5-157.1-129.3 152.9 48.8 4.0 13.0 62 70 A R E -IJ 25 86B 38 -37,-2.5 -37,-2.9 -2,-0.3 2,-0.5 -0.998 1.9-166.3-130.2 130.6 46.8 2.6 15.9 63 71 A V E -IJ 24 85B 0 22,-2.7 22,-2.5 -2,-0.4 2,-0.6 -0.984 9.8-162.1-117.4 119.4 45.6 4.5 18.9 64 72 A E E -IJ 23 84B 56 -41,-2.7 -41,-2.0 -2,-0.5 2,-0.5 -0.920 1.3-160.8-105.2 123.0 44.4 2.4 21.7 65 73 A F E -IJ 22 83B 1 18,-3.1 18,-2.3 -2,-0.6 2,-1.8 -0.880 16.1-138.8-105.3 127.4 42.2 4.0 24.4 66 74 A D > + 0 0 52 -45,-3.0 4,-1.2 -2,-0.5 -45,-0.4 -0.546 41.2 155.0 -88.9 75.5 41.8 2.3 27.8 67 75 A T H > + 0 0 4 -2,-1.8 4,-2.4 1,-0.2 5,-0.2 0.754 60.5 67.5 -74.9 -25.0 38.1 2.9 28.2 68 76 A K H > S+ 0 0 78 13,-0.7 4,-2.7 -3,-0.2 5,-0.2 0.938 103.7 44.1 -61.5 -45.3 37.5 -0.0 30.6 69 77 A A H > S+ 0 0 33 12,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.880 109.5 58.4 -67.4 -39.0 39.6 1.6 33.3 70 78 A Y H X S+ 0 0 16 -4,-1.2 4,-1.0 1,-0.2 -1,-0.2 0.956 113.1 37.9 -54.4 -49.3 37.9 4.9 32.7 71 79 A W H ><>S+ 0 0 5 -4,-2.4 5,-2.8 2,-0.2 3,-0.9 0.951 114.1 52.9 -72.5 -42.5 34.5 3.5 33.3 72 80 A T H ><5S+ 0 0 72 -4,-2.7 3,-1.3 1,-0.3 -1,-0.2 0.899 109.6 50.8 -62.7 -35.9 35.4 1.2 36.2 73 81 A N H 3<5S+ 0 0 136 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.732 106.5 53.5 -73.8 -19.9 37.0 4.1 38.0 74 82 A Q T <<5S- 0 0 88 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.371 126.1-106.9 -85.8 1.0 33.8 6.1 37.5 75 83 A G T < 5S+ 0 0 69 -3,-1.3 2,-0.3 -4,-0.3 -3,-0.2 0.655 82.0 122.6 80.8 19.4 32.1 3.2 39.1 76 84 A S < - 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