==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-FEB-98 1WQP . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.YAMAGATA,M.KUBOTA,Y.SUMIKAWA,J.FUNAHASHI,S.FUJII,K.YUTANI . 130 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7023.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 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 . 9 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 25.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 PARALLEL BRIDGES PER LADDER . 2 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 1 A K 0 0 78 0, 0.0 39,-2.6 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 139.2 1.6 20.4 22.0 2 2 A V B -A 39 0A 100 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.937 360.0-146.5-108.1 105.4 4.1 19.5 19.3 3 3 A F - 0 0 11 35,-2.6 2,-0.3 -2,-0.7 3,-0.0 -0.355 9.5-124.3 -69.2 151.8 7.0 22.0 19.5 4 4 A E > - 0 0 149 1,-0.1 4,-2.5 -2,-0.1 5,-0.2 -0.726 34.3-107.1 -92.0 150.4 8.9 23.2 16.5 5 5 A R H > S+ 0 0 90 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.903 114.3 35.3 -42.7 -67.7 12.7 22.8 16.8 6 6 A a H > S+ 0 0 27 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.838 112.8 59.6 -63.0 -32.9 13.8 26.3 17.4 7 7 A E H > S+ 0 0 68 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.954 110.3 44.1 -59.2 -46.2 10.7 27.3 19.4 8 8 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.911 109.8 55.3 -64.4 -44.0 11.7 24.6 21.9 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 -5,-0.2 -1,-0.2 0.913 109.9 45.9 -56.6 -45.2 15.4 25.5 21.9 10 10 A R H X S+ 0 0 114 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.902 112.4 51.3 -66.5 -37.9 14.6 29.1 22.8 11 11 A T H X S+ 0 0 25 -4,-1.9 4,-1.6 -5,-0.2 -2,-0.2 0.923 109.5 49.2 -64.9 -46.3 12.1 28.0 25.5 12 12 A L H <>S+ 0 0 0 -4,-2.8 5,-2.2 1,-0.2 6,-0.3 0.881 109.5 52.7 -62.2 -38.6 14.6 25.6 27.1 13 13 A K H ><5S+ 0 0 93 -4,-1.9 3,-1.5 -5,-0.2 -1,-0.2 0.919 108.2 50.1 -63.3 -41.7 17.3 28.3 27.2 14 14 A R H 3<5S+ 0 0 183 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.815 107.2 54.8 -67.0 -29.0 14.9 30.7 29.0 15 15 A L T 3<5S- 0 0 56 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.339 122.6-108.6 -85.6 4.0 14.1 28.0 31.5 16 16 A G T < 5S+ 0 0 37 -3,-1.5 -3,-0.2 -5,-0.1 -2,-0.1 0.811 76.2 133.5 75.1 37.5 17.8 27.7 32.2 17 17 A M > < + 0 0 0 -5,-2.2 3,-2.0 2,-0.1 2,-0.6 0.700 35.9 107.0 -89.7 -21.4 18.7 24.4 30.7 18 18 A D T 3 S- 0 0 82 -6,-0.3 6,-0.2 1,-0.3 4,-0.1 -0.442 102.7 -6.9 -65.4 107.8 21.8 25.5 28.8 19 19 A G T > S+ 0 0 42 4,-1.8 3,-2.0 -2,-0.6 2,-0.3 0.592 87.0 166.3 84.8 11.9 24.7 24.0 30.7 20 20 A Y B X S-B 23 0B 58 -3,-2.0 3,-1.9 3,-0.8 -1,-0.3 -0.469 79.2 -11.9 -65.2 119.8 22.5 22.7 33.6 21 21 A R T 3 S- 0 0 156 -2,-0.3 -1,-0.3 1,-0.3 85,-0.2 0.833 134.5 -53.8 56.5 33.9 24.7 20.2 35.5 22 22 A G T < S+ 0 0 75 -3,-2.0 2,-0.7 1,-0.2 -1,-0.3 0.487 106.8 132.4 82.0 5.1 27.2 20.4 32.6 23 23 A I B < -B 20 0B 12 -3,-1.9 -4,-1.8 -6,-0.1 -3,-0.8 -0.810 50.2-137.3 -97.4 115.7 24.6 19.5 30.0 24 24 A S >> - 0 0 47 -2,-0.7 4,-1.3 -5,-0.2 3,-1.1 -0.241 21.4-114.0 -66.6 153.5 24.5 21.7 26.9 25 25 A L H 3> S+ 0 0 5 1,-0.3 4,-2.3 2,-0.2 3,-0.5 0.899 115.4 59.9 -53.6 -44.5 21.2 22.8 25.3 26 26 A A H 3> S+ 0 0 11 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.805 102.4 53.2 -56.0 -32.0 21.9 20.8 22.2 27 27 A N H <> S+ 0 0 30 -3,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.866 108.6 48.7 -72.0 -37.3 22.0 17.6 24.3 28 28 A W H X S+ 0 0 0 -4,-1.3 4,-2.5 -3,-0.5 -2,-0.2 0.868 112.0 50.2 -68.1 -37.7 18.6 18.4 25.8 29 29 A M H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.923 110.0 49.4 -66.4 -43.2 17.3 19.0 22.3 30 30 A b H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.917 111.7 51.0 -62.3 -40.7 18.6 15.7 21.1 31 31 A L H X S+ 0 0 2 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.941 110.9 45.5 -62.2 -51.6 17.0 14.0 24.1 32 32 A A H X>S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 6,-1.4 0.866 110.9 56.3 -59.8 -38.2 13.5 15.6 23.5 33 33 A K H X5S+ 0 0 69 -4,-2.3 4,-0.6 4,-0.2 -1,-0.2 0.934 114.9 35.1 -59.8 -51.2 13.8 14.7 19.8 34 34 A W H <5S+ 0 0 94 -4,-2.1 -1,-0.2 2,-0.1 -2,-0.2 0.711 118.9 51.5 -79.0 -22.6 14.4 11.0 20.3 35 35 A E H <5S- 0 0 42 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.922 137.1 -12.0 -80.6 -47.1 12.1 10.7 23.4 36 36 A S H <5S- 0 0 23 -4,-2.3 3,-0.2 20,-0.4 -3,-0.2 0.457 83.7-110.5-134.2 -6.0 8.9 12.3 22.1 37 37 A G S < -A 2 0A 39 -7,-0.3 3,-0.8 -37,-0.2 -37,-0.2 -0.873 38.7-164.9-106.2 119.6 5.5 16.2 21.8 40 40 A T T 3 S+ 0 0 2 -39,-2.6 16,-0.2 -2,-0.6 -1,-0.1 0.672 86.5 53.8 -74.4 -21.2 4.3 17.1 25.4 41 41 A R T 3 S+ 0 0 186 -40,-0.3 -1,-0.2 14,-0.2 2,-0.2 0.361 77.2 128.7 -97.5 8.9 1.3 14.7 25.5 42 42 A A < + 0 0 21 -3,-0.8 13,-2.1 12,-0.1 2,-0.3 -0.406 32.7 178.9 -67.0 131.6 3.3 11.6 24.6 43 43 A T E -C 54 0C 74 11,-0.2 2,-0.4 -2,-0.2 11,-0.2 -0.985 11.5-167.7-134.6 144.6 2.9 8.6 26.9 44 44 A N E -C 53 0C 89 9,-2.0 9,-2.4 -2,-0.3 2,-0.4 -0.905 9.6-152.0-140.7 109.3 4.4 5.1 26.8 45 45 A F E -C 52 0C 114 -2,-0.4 2,-0.9 7,-0.2 7,-0.2 -0.655 8.5-150.0 -79.4 130.4 3.2 2.2 28.9 46 46 A N E >>> -C 51 0C 46 5,-3.0 4,-1.7 -2,-0.4 3,-1.1 -0.855 7.9-168.7-103.6 95.9 5.9 -0.3 29.6 47 47 A A T 345S+ 0 0 76 -2,-0.9 -1,-0.2 1,-0.2 5,-0.0 0.816 79.5 68.0 -53.5 -33.6 4.1 -3.6 29.9 48 48 A G T 345S+ 0 0 85 1,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 0.835 121.6 9.6 -58.1 -41.5 7.2 -5.3 31.3 49 49 A D T <45S- 0 0 67 -3,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.313 98.6-117.8-124.0 6.5 7.3 -3.4 34.6 50 50 A R T <5S+ 0 0 171 -4,-1.7 2,-0.2 1,-0.2 -3,-0.2 0.627 71.5 126.8 65.9 20.6 3.9 -1.6 34.6 51 51 A S E < -C 46 0C 0 -5,-0.7 -5,-3.0 19,-0.1 2,-0.4 -0.638 48.2-141.2-102.1 164.8 5.4 1.9 34.6 52 52 A T E -C 45 0C 8 -7,-0.2 9,-2.2 -2,-0.2 2,-0.5 -0.959 5.7-136.4-131.2 142.8 4.6 4.7 32.1 53 53 A D E -CD 44 60C 29 -9,-2.4 -9,-2.0 -2,-0.4 2,-0.4 -0.871 28.2-154.9 -96.3 130.4 6.8 7.3 30.5 54 54 A Y E > -CD 43 59C 23 5,-2.3 5,-2.1 -2,-0.5 3,-0.4 -0.911 31.3 -30.7-119.5 135.6 5.3 10.8 30.4 55 55 A G T > 5S- 0 0 0 -13,-2.1 3,-1.4 -2,-0.4 -15,-0.2 -0.036 98.1 -23.2 73.6-166.8 5.7 13.9 28.2 56 56 A I T 3 5S+ 0 0 2 28,-0.3 -20,-0.4 1,-0.3 -18,-0.3 0.778 140.7 35.6 -56.4 -32.5 8.4 15.6 26.2 57 57 A F T 3 5S- 0 0 2 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.395 105.0-126.4-103.7 2.8 11.2 14.0 28.2 58 58 A Q T < 5 - 0 0 12 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.946 35.4-166.5 49.6 57.1 9.4 10.7 28.7 59 59 A I E < -D 54 0C 3 -5,-2.1 -5,-2.3 25,-0.1 2,-0.3 -0.600 17.2-118.5 -79.0 129.7 9.9 10.8 32.4 60 60 A N E >>> -D 53 0C 27 -2,-0.3 4,-2.0 -7,-0.2 3,-0.8 -0.500 6.1-145.9 -77.6 134.3 9.2 7.4 34.2 61 61 A S T 345S+ 0 0 0 -9,-2.2 6,-0.3 -2,-0.3 7,-0.2 0.572 90.0 74.6 -71.2 -12.8 6.5 7.0 36.9 62 62 A R T 345S+ 0 0 44 11,-0.2 12,-2.9 -10,-0.2 -1,-0.2 0.856 120.2 3.0 -71.4 -30.4 8.5 4.5 38.9 63 63 A Y T <45S+ 0 0 125 -3,-0.8 13,-2.9 10,-0.2 -2,-0.2 0.740 131.9 39.8-123.3 -37.6 10.9 7.1 40.3 64 64 A W T <5S+ 0 0 34 -4,-2.0 13,-2.1 11,-0.3 15,-0.4 0.810 110.1 19.5 -93.9 -35.8 10.0 10.6 39.2 65 65 A c < - 0 0 0 -5,-0.7 2,-0.5 9,-0.2 15,-0.2 -0.907 69.9-116.5-134.7 162.8 6.2 11.3 39.2 66 66 A N B +e 80 0D 81 13,-2.5 15,-2.2 -2,-0.3 16,-0.4 -0.899 36.5 155.1-106.6 123.8 3.2 9.7 40.7 67 67 A D - 0 0 40 -2,-0.5 -1,-0.1 -6,-0.3 2,-0.1 0.307 50.0-131.3-119.7 2.0 0.4 8.2 38.7 68 68 A G S S+ 0 0 61 -7,-0.2 -2,-0.0 1,-0.1 5,-0.0 0.177 91.1 75.4 71.1 -19.1 -0.8 5.9 41.4 69 69 A K + 0 0 123 2,-0.1 -1,-0.1 -2,-0.1 -3,-0.0 0.499 67.1 100.9-102.1 -4.7 -0.9 2.6 39.4 70 70 A T S > S- 0 0 15 -9,-0.1 3,-1.1 1,-0.1 -19,-0.1 -0.692 76.4-121.0 -84.8 125.6 2.8 1.9 39.2 71 71 A P T 3 S- 0 0 64 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.399 86.3 -4.3 -66.3 137.1 3.9 -0.8 41.7 72 72 A G T 3 S+ 0 0 79 1,-0.2 2,-0.2 -2,-0.1 -2,-0.0 0.751 95.4 158.5 50.9 36.9 6.6 0.3 44.3 73 73 A A < - 0 0 33 -3,-1.1 2,-0.2 -5,-0.0 -10,-0.2 -0.501 29.1-155.3 -94.5 153.3 7.0 3.7 42.8 74 74 A V - 0 0 87 -12,-2.9 -9,-0.2 -2,-0.2 2,-0.2 -0.675 13.7-137.4-114.7 173.9 8.4 6.9 44.3 75 75 A N > + 0 0 44 -2,-0.2 3,-1.2 -11,-0.1 -11,-0.3 -0.608 29.8 164.6-135.2 71.6 7.7 10.5 43.3 76 76 A A T 3 S+ 0 0 21 -13,-2.9 -12,-0.2 1,-0.3 -11,-0.1 0.849 80.7 48.7 -60.6 -36.8 11.1 12.3 43.5 77 77 A d T 3 S- 0 0 20 -13,-2.1 -1,-0.3 -14,-0.1 -12,-0.1 0.583 104.8-134.2 -79.9 -7.5 9.9 15.3 41.5 78 78 A H < + 0 0 155 -3,-1.2 2,-0.3 -14,-0.3 -13,-0.1 0.949 62.1 123.5 51.6 56.2 6.9 15.4 43.8 79 79 A L - 0 0 39 -15,-0.4 -13,-2.5 16,-0.0 2,-0.3 -0.950 69.5-111.1-141.3 155.0 4.5 15.9 41.0 80 80 A S B > -e 66 0D 71 -2,-0.3 3,-1.6 -15,-0.2 4,-0.4 -0.691 34.4-123.3 -81.0 143.1 1.4 14.1 39.6 81 81 A c G > S+ 0 0 1 -15,-2.2 3,-1.3 -2,-0.3 -14,-0.1 0.771 110.3 72.8 -62.0 -20.6 2.4 12.6 36.2 82 82 A S G > S+ 0 0 82 -16,-0.4 3,-2.0 1,-0.3 -1,-0.3 0.846 84.8 66.6 -59.4 -33.1 -0.4 14.6 34.8 83 83 A A G X S+ 0 0 17 -3,-1.6 3,-1.0 1,-0.3 9,-0.3 0.804 93.9 58.8 -59.4 -29.1 1.8 17.7 35.3 84 84 A L G < S+ 0 0 3 -3,-1.3 -28,-0.3 -4,-0.4 -1,-0.3 0.266 96.4 62.3 -86.5 11.3 4.2 16.3 32.6 85 85 A L G < S+ 0 0 59 -3,-2.0 -1,-0.2 -30,-0.1 -2,-0.2 0.225 78.9 113.9-117.0 10.5 1.4 16.3 30.0 86 86 A Q S < S- 0 0 83 -3,-1.0 6,-0.1 2,-0.2 -3,-0.0 -0.350 72.3-127.0 -80.1 162.4 0.8 20.0 29.9 87 87 A D S S+ 0 0 99 -2,-0.1 2,-0.7 -46,-0.1 -1,-0.1 0.818 99.7 74.6 -75.1 -34.7 1.5 22.3 27.0 88 88 A N S S- 0 0 108 1,-0.1 3,-0.5 -48,-0.0 4,-0.3 -0.746 72.3-162.1 -79.8 116.9 3.5 24.5 29.4 89 89 A I > + 0 0 6 -2,-0.7 4,-2.3 1,-0.2 5,-0.2 0.290 58.4 108.3 -87.3 13.5 6.8 22.6 29.9 90 90 A A H > S+ 0 0 40 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.911 83.5 42.8 -55.2 -48.6 7.8 24.4 33.1 91 91 A D H > S+ 0 0 62 -3,-0.5 4,-1.9 -8,-0.2 -1,-0.2 0.879 112.8 53.3 -67.5 -37.0 7.1 21.5 35.4 92 92 A A H > S+ 0 0 7 -9,-0.3 4,-2.1 -4,-0.3 -1,-0.2 0.855 109.9 48.3 -65.1 -37.4 8.6 19.0 33.0 93 93 A V H X S+ 0 0 4 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.894 109.4 52.3 -70.3 -39.8 11.9 21.0 32.9 94 94 A A H X S+ 0 0 54 -4,-2.0 4,-1.4 -5,-0.2 -2,-0.2 0.874 112.8 45.4 -63.4 -37.2 11.9 21.3 36.7 95 95 A d H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.881 109.6 54.3 -73.9 -37.5 11.6 17.5 36.9 96 96 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.895 106.3 53.3 -62.0 -38.6 14.2 16.9 34.2 97 97 A K H < S+ 0 0 44 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.898 108.1 50.6 -62.4 -40.1 16.6 19.1 36.3 98 98 A R H >< S+ 0 0 70 -4,-1.4 3,-1.2 1,-0.2 4,-0.4 0.929 106.8 55.2 -62.6 -46.3 15.9 16.8 39.3 99 99 A V H >< S+ 0 0 3 -4,-2.5 3,-1.4 1,-0.3 6,-0.3 0.922 108.7 45.7 -53.7 -51.5 16.6 13.7 37.2 100 100 A V T 3< S+ 0 0 2 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.503 94.0 77.5 -74.6 -4.0 20.1 14.8 36.1 101 101 A R T < S+ 0 0 115 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.657 81.4 87.7 -76.8 -14.6 21.0 15.9 39.7 102 102 A D S X S- 0 0 64 -3,-1.4 3,-1.7 -4,-0.4 6,-0.1 -0.448 102.1 -97.7 -77.7 159.0 21.5 12.2 40.3 103 103 A P T 3 S+ 0 0 136 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.784 119.8 59.6 -48.2 -37.9 24.9 10.6 39.6 104 104 A Q T > S- 0 0 113 1,-0.2 3,-1.6 -5,-0.1 -4,-0.1 0.793 82.2-178.9 -63.4 -31.9 24.0 9.3 36.2 105 105 A G G X - 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