==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-APR-06 2GPZ . COMPND 2 MOLECULE: TRANSTHYRETIN-LIKE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA ENTERICA SUBSP. ENTERICA . AUTHOR A.M.BUCKLE,R.H.LAW,J.C.WHISSTOCK . 220 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11205.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 159 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 68 30.9 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 . 2 0.9 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-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 . 33 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 5.5 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 4 0 0 0 0 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 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 4 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 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 5 A M 0 0 13 0, 0.0 51,-1.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 127.6 36.1 -23.2 -16.4 2 6 A I E -a 93 0A 31 90,-1.7 92,-3.5 49,-0.2 2,-0.5 -0.995 360.0-166.5-124.7 134.2 37.6 -26.1 -14.4 3 7 A L E +a 94 0A 1 46,-1.7 45,-2.9 -2,-0.4 2,-0.3 -0.984 12.1 172.8-122.8 121.1 36.2 -29.6 -14.2 4 8 A S E -a 95 0A 6 90,-3.1 92,-2.6 -2,-0.5 2,-0.3 -0.937 7.3-173.4-122.3 147.2 37.4 -32.1 -11.6 5 9 A V E -B 45 0B 2 40,-1.8 40,-2.8 -2,-0.3 2,-0.3 -0.967 3.2-178.7-131.3 153.6 36.2 -35.5 -10.7 6 10 A H E -B 44 0B 29 90,-0.5 92,-2.7 -2,-0.3 2,-0.5 -0.949 14.2-147.2-149.4 139.4 37.1 -38.0 -8.0 7 11 A I E -c 98 0C 1 36,-2.3 9,-2.1 9,-0.3 2,-0.5 -0.890 6.3-162.5-110.3 132.7 35.8 -41.5 -7.2 8 12 A L E -cD 99 15C 3 90,-3.0 92,-2.9 -2,-0.5 2,-0.6 -0.956 15.8-139.1-116.3 116.1 35.4 -42.9 -3.8 9 13 A D E >> -cD 100 14C 0 5,-1.9 4,-2.1 -2,-0.5 5,-0.5 -0.641 12.2-166.3 -75.0 118.6 35.1 -46.7 -3.4 10 14 A Q T 45S+ 0 0 67 90,-3.3 91,-0.2 -2,-0.6 -1,-0.2 0.652 83.9 61.0 -83.9 -18.9 32.4 -47.3 -0.7 11 15 A Q T 45S+ 0 0 79 89,-0.5 -1,-0.2 1,-0.1 90,-0.1 0.809 121.8 22.0 -71.5 -33.7 33.3 -51.0 -0.3 12 16 A T T 45S- 0 0 70 2,-0.3 -2,-0.2 -3,-0.1 -1,-0.1 0.657 94.2-129.8-108.5 -24.6 36.9 -50.1 0.8 13 17 A G T <5S+ 0 0 13 -4,-2.1 210,-0.3 1,-0.3 -3,-0.2 0.625 76.7 105.6 75.8 14.6 36.6 -46.5 2.0 14 18 A K E - 0 0 46 4,-2.1 3,-2.1 -23,-0.2 -21,-0.2 0.092 40.4 -69.2 -82.0-166.1 45.1 -41.4 -10.2 41 45 A Q T 3 S+ 0 0 154 1,-0.3 -2,-0.1 -24,-0.1 -1,-0.0 0.797 137.7 47.3 -55.8 -33.2 46.3 -43.0 -7.0 42 46 A D T 3 S- 0 0 100 2,-0.1 -1,-0.3 -26,-0.1 -26,-0.2 0.160 120.8-110.0 -97.0 16.0 44.0 -40.7 -5.0 43 47 A G S < S+ 0 0 0 -3,-2.1 -36,-2.3 -28,-0.2 2,-0.3 0.681 76.1 130.5 66.9 22.5 41.1 -41.4 -7.4 44 48 A R E -B 6 0B 100 -38,-0.2 -4,-2.1 -6,-0.1 2,-0.3 -0.764 48.6-170.0-113.1 149.3 41.2 -37.9 -8.9 45 49 A I E -B 5 0B 19 -40,-2.8 -40,-1.8 -2,-0.3 3,-0.2 -0.855 18.9-177.5-125.6 96.2 41.2 -36.2 -12.2 46 50 A K S S+ 0 0 149 -2,-0.3 2,-0.5 1,-0.2 -1,-0.1 0.854 73.7 29.7 -64.7 -41.0 42.0 -32.6 -11.2 47 51 A A + 0 0 51 1,-0.1 -1,-0.2 -45,-0.1 -43,-0.2 -0.906 63.3 156.1-126.9 102.8 41.8 -31.0 -14.6 48 52 A L S S+ 0 0 0 -45,-2.9 -25,-0.2 1,-1.4 -1,-0.1 0.872 96.7 15.0 -79.3 -43.6 39.4 -32.8 -16.9 49 53 A W S S- 0 0 42 -46,-0.1 -46,-1.7 -14,-0.1 -1,-1.4 -0.738 105.7-134.2 53.6 73.5 39.1 -30.1 -18.7 50 54 A P - 0 0 65 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 -0.356 49.0 -60.8 -73.6 165.5 42.0 -27.9 -17.5 51 55 A E S S+ 0 0 155 -2,-0.1 2,-0.3 -49,-0.1 -49,-0.2 -0.307 87.3 126.7 -56.9 99.6 41.4 -24.2 -16.7 52 56 A K - 0 0 90 -51,-1.7 -3,-0.1 -2,-0.6 2,-0.0 -0.975 65.1 -85.1-150.4 155.9 40.1 -22.7 -20.0 53 57 A A - 0 0 96 -2,-0.3 2,-0.3 1,-0.0 38,-0.1 -0.350 49.7-171.9 -61.7 142.4 37.1 -20.6 -21.1 54 58 A A - 0 0 16 36,-0.2 36,-0.1 -2,-0.0 -1,-0.0 -0.963 25.0-111.6-139.5 155.0 34.0 -22.7 -22.0 55 59 A A - 0 0 53 -2,-0.3 32,-0.1 1,-0.1 33,-0.0 -0.654 39.9-112.1 -82.6 139.6 30.6 -22.3 -23.5 56 60 A P + 0 0 84 0, 0.0 2,-0.3 0, 0.0 32,-0.2 -0.296 67.5 82.1 -65.9 157.6 27.6 -22.7 -21.3 57 61 A G E S- H 0 87D 18 30,-1.9 30,-2.3 -32,-0.0 2,-0.3 -0.911 78.0 -24.4 142.9-168.1 25.3 -25.7 -21.8 58 62 A D E + H 0 86D 64 -2,-0.3 -32,-2.6 28,-0.2 2,-0.3 -0.630 54.6 178.6 -84.5 133.0 24.8 -29.3 -21.0 59 63 A Y E -GH 25 85D 4 26,-3.6 26,-2.4 -2,-0.3 2,-0.3 -0.789 10.5-154.8-125.5 169.5 27.8 -31.5 -20.3 60 64 A R E -GH 24 84D 49 -36,-2.2 -36,-3.3 -2,-0.3 2,-0.4 -0.991 7.8-163.3-149.5 136.5 28.4 -35.2 -19.3 61 65 A V E -GH 23 83D 0 22,-2.1 22,-2.8 -2,-0.3 2,-0.6 -0.990 11.8-157.6-116.0 131.7 31.0 -37.3 -17.5 62 66 A I E -GH 22 82D 10 -40,-2.6 -40,-2.0 -2,-0.4 2,-0.8 -0.937 4.5-154.6-111.7 111.9 30.9 -41.0 -18.0 63 67 A F E -GH 21 81D 0 18,-3.5 18,-2.8 -2,-0.6 2,-2.6 -0.771 10.5-145.5 -84.8 111.1 32.6 -43.0 -15.2 64 68 A K > + 0 0 33 -44,-3.1 4,-0.7 -2,-0.8 -44,-0.4 -0.384 47.5 144.0 -75.4 65.3 33.8 -46.3 -16.7 65 69 A T H > + 0 0 0 -2,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.634 57.5 68.5 -84.1 -17.7 33.1 -48.2 -13.5 66 70 A G H > S+ 0 0 14 13,-0.7 4,-1.5 -3,-0.3 -1,-0.2 0.926 103.8 43.9 -63.8 -46.3 31.9 -51.4 -15.2 67 71 A Q H > S+ 0 0 76 12,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.783 109.8 59.6 -67.6 -29.5 35.5 -52.0 -16.4 68 72 A Y H X S+ 0 0 24 -4,-0.7 4,-0.6 2,-0.2 -2,-0.2 0.935 109.4 39.6 -64.2 -49.8 36.7 -51.1 -12.9 69 73 A F H <>S+ 0 0 0 -4,-2.0 5,-3.3 1,-0.2 -2,-0.2 0.766 109.6 61.9 -72.9 -27.4 34.8 -53.8 -11.1 70 74 A E H ><5S+ 0 0 126 -4,-1.5 3,-1.1 1,-0.2 -1,-0.2 0.884 102.0 50.9 -64.1 -40.2 35.5 -56.3 -13.9 71 75 A S H 3<5S+ 0 0 90 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.696 111.3 48.2 -71.8 -20.3 39.2 -56.1 -13.2 72 76 A K T 3<5S- 0 0 82 -4,-0.6 -1,-0.3 -3,-0.2 -2,-0.2 0.373 115.5-119.3 -93.6 1.5 38.6 -56.7 -9.5 73 77 A K T < 5 + 0 0 182 -3,-1.1 2,-0.4 1,-0.2 -3,-0.2 0.875 67.9 139.3 55.4 43.7 36.4 -59.7 -10.4 74 78 A L < - 0 0 60 -5,-3.3 -1,-0.2 -6,-0.1 -2,-0.2 -0.936 51.8-125.2-117.8 139.1 33.3 -58.0 -8.8 75 79 A D - 0 0 86 -2,-0.4 2,-0.3 -3,-0.1 27,-0.0 -0.461 31.7-178.6 -76.3 153.3 29.7 -57.9 -10.0 76 80 A T - 0 0 38 -2,-0.1 27,-0.2 1,-0.1 26,-0.1 -0.991 36.3-133.5-153.1 153.1 28.0 -54.5 -10.5 77 81 A F S S+ 0 0 147 25,-2.3 26,-0.1 -2,-0.3 -1,-0.1 0.772 89.7 67.6 -75.7 -26.4 24.6 -53.1 -11.5 78 82 A F - 0 0 33 24,-0.6 3,-0.1 1,-0.1 -1,-0.1 -0.840 55.7-165.0-109.4 125.8 26.1 -50.5 -13.8 79 83 A P S S- 0 0 108 0, 0.0 -13,-0.7 0, 0.0 -12,-0.3 0.780 89.1 -22.5 -70.5 -28.5 28.0 -51.1 -17.1 80 84 A E - 0 0 70 -15,-0.2 -16,-0.2 -14,-0.2 -18,-0.0 -0.921 68.0-118.3-167.5 166.8 29.2 -47.5 -16.6 81 85 A I E -H 63 0D 0 -18,-2.8 -18,-3.5 -2,-0.3 2,-0.3 -0.925 23.8-167.3-122.5 106.0 27.9 -44.4 -14.8 82 86 A P E -H 62 0D 63 0, 0.0 2,-0.4 0, 0.0 -20,-0.2 -0.725 1.2-165.3 -87.0 139.8 27.0 -41.3 -16.8 83 87 A V E -H 61 0D 16 -22,-2.8 -22,-2.1 -2,-0.3 2,-0.4 -0.949 4.1-159.6-127.7 111.5 26.4 -37.9 -15.0 84 88 A E E +H 60 0D 123 -2,-0.4 2,-0.3 -24,-0.2 -24,-0.2 -0.743 18.9 168.9 -87.8 133.4 24.7 -35.1 -16.9 85 89 A F E -H 59 0D 36 -26,-2.4 -26,-3.6 -2,-0.4 2,-0.4 -0.986 26.0-136.7-143.9 154.2 25.2 -31.6 -15.6 86 90 A H E -H 58 0D 113 -2,-0.3 2,-0.5 -28,-0.2 -28,-0.2 -0.936 11.5-160.3-114.5 133.8 24.5 -28.0 -16.8 87 91 A I E +H 57 0D 2 -30,-2.3 -30,-1.9 -2,-0.4 3,-0.1 -0.958 25.1 155.8-115.3 118.9 26.9 -25.1 -16.5 88 92 A S S S+ 0 0 89 -2,-0.5 2,-1.0 1,-0.2 -1,-0.1 0.697 73.8 58.6-106.0 -36.0 25.6 -21.5 -16.7 89 93 A K > + 0 0 97 1,-0.1 3,-0.9 2,-0.0 -1,-0.2 -0.830 65.9 179.3 -95.0 97.3 28.5 -19.9 -14.7 90 94 A T T 3 + 0 0 42 -2,-1.0 -36,-0.2 1,-0.2 -1,-0.1 0.472 68.9 72.1 -82.0 -3.4 31.4 -20.9 -16.9 91 95 A N T 3 S+ 0 0 122 -90,-0.1 -1,-0.2 -38,-0.1 2,-0.1 0.685 83.5 93.3 -79.7 -19.0 34.0 -19.0 -14.7 92 96 A E S < S- 0 0 43 -3,-0.9 -90,-1.7 -91,-0.1 2,-0.5 -0.271 76.6-117.2 -88.4 158.7 33.7 -21.5 -11.8 93 97 A H E -a 2 0A 71 -92,-0.2 2,-0.5 -2,-0.1 -90,-0.2 -0.833 34.1-157.7 -87.0 123.4 35.6 -24.7 -10.7 94 98 A Y E -a 3 0A 19 -92,-3.5 -90,-3.1 -2,-0.5 2,-0.5 -0.924 9.3-165.4-112.0 122.6 33.2 -27.6 -10.8 95 99 A H E -a 4 0A 58 -2,-0.5 15,-2.7 -92,-0.2 16,-0.3 -0.923 5.0-176.8-101.1 126.3 33.8 -30.8 -8.8 96 100 A V - 0 0 9 -92,-2.6 -90,-0.5 -2,-0.5 13,-0.2 -0.770 15.7-175.6-120.5 83.4 31.7 -33.9 -9.8 97 101 A P - 0 0 1 0, 0.0 11,-0.7 0, 0.0 2,-0.4 -0.388 14.1-146.0 -77.5 157.0 32.6 -36.6 -7.3 98 102 A L E -cE 7 107C 0 -92,-2.7 -90,-3.0 9,-0.2 2,-0.8 -0.989 4.3-157.2-126.8 122.2 31.3 -40.2 -7.4 99 103 A L E -cE 8 106C 1 7,-2.9 7,-1.5 -2,-0.4 2,-0.6 -0.881 29.7-154.7 -95.5 106.8 30.5 -42.2 -4.3 100 104 A L E +cE 9 105C 0 -92,-2.9 -90,-3.3 -2,-0.8 -89,-0.5 -0.761 27.8 159.2-104.2 119.3 30.8 -45.7 -5.8 101 105 A S E > - E 0 104C 33 3,-2.1 3,-0.6 -2,-0.6 -93,-0.0 -0.843 50.0-109.4-118.0 166.1 29.2 -49.0 -4.6 102 106 A Q T 3 S+ 0 0 45 -2,-0.3 -25,-2.3 1,-0.2 -24,-0.6 0.876 115.6 18.3 -61.3 -39.8 28.7 -52.1 -6.6 103 107 A Y T 3 S+ 0 0 146 -27,-0.2 2,-0.3 -26,-0.1 -1,-0.2 -0.028 129.8 31.0-126.4 28.9 24.9 -51.7 -6.8 104 108 A G E < -E 101 0C 26 -3,-0.6 -3,-2.1 -26,-0.0 2,-0.3 -0.938 57.5-178.8-174.9 157.1 24.4 -48.0 -5.9 105 109 A Y E -E 100 0C 92 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.991 14.9-143.7-159.1 165.5 26.0 -44.6 -6.1 106 110 A S E +E 99 0C 41 -7,-1.5 -7,-2.9 -2,-0.3 2,-0.3 -0.991 16.0 176.8-133.2 142.8 25.8 -40.9 -5.3 107 111 A T E +E 98 0C 47 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.975 10.9 147.5-142.9 158.1 26.9 -37.8 -7.2 108 112 A Y - 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