==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 10-OCT-01 1K5C . COMPND 2 MOLECULE: ENDOPOLYGALACTURONASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CHONDROSTEREUM PURPUREUM; . AUTHOR T.SHIMIZU,T.NAKATSU,K.MIYAIRI,T.OKUNO,H.KATO . 333 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12527.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 264 79.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 166 49.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 42 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 0 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 . 1 4 11 6 3 1 1 1 1 1 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 1 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 3 A a 0 0 89 0, 0.0 18,-2.5 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 14.2 59.1 57.6 -8.5 2 4 A T E -a 19 0A 61 16,-0.2 2,-0.6 18,-0.1 18,-0.2 -0.956 360.0-146.9-113.0 126.1 56.5 60.3 -7.6 3 5 A V E +a 20 0A 0 16,-3.1 18,-2.4 -2,-0.5 3,-0.1 -0.825 30.0 159.5 -95.7 117.4 53.2 60.1 -9.4 4 6 A K + 0 0 129 -2,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.377 64.7 11.6-116.8 -1.1 51.7 63.6 -10.0 5 7 A S S > S- 0 0 36 18,-0.1 4,-0.9 1,-0.1 -1,-0.2 -0.944 85.0 -91.0-166.4 167.0 49.3 62.9 -12.9 6 8 A V T 4 S+ 0 0 19 -2,-0.3 3,-0.5 18,-0.2 4,-0.4 0.850 125.6 53.3 -61.5 -35.2 47.7 60.1 -14.9 7 9 A D T >4 S+ 0 0 103 1,-0.2 3,-1.1 2,-0.2 -1,-0.2 0.885 101.7 57.5 -72.3 -31.7 50.7 60.3 -17.3 8 10 A D G >4 S+ 0 0 55 1,-0.2 3,-2.1 2,-0.2 -1,-0.2 0.752 91.9 74.8 -62.2 -26.5 53.3 59.9 -14.5 9 11 A A G >< S+ 0 0 3 -4,-0.9 3,-0.7 -3,-0.5 25,-0.4 0.808 88.1 56.3 -63.1 -26.8 51.7 56.7 -13.5 10 12 A K G < S+ 0 0 140 -3,-1.1 3,-0.3 -4,-0.4 -1,-0.3 0.511 97.9 66.2 -78.4 -8.3 53.1 54.8 -16.5 11 13 A D G < + 0 0 103 -3,-2.1 -1,-0.2 1,-0.2 -2,-0.1 -0.073 67.3 98.6-106.2 30.7 56.6 55.7 -15.5 12 14 A I X + 0 0 5 -3,-0.7 3,-2.3 -11,-0.1 24,-0.4 0.412 43.5 126.5 -97.2 2.7 57.1 53.9 -12.2 13 15 A A T 3 S+ 0 0 87 -3,-0.3 3,-0.1 1,-0.3 -3,-0.0 -0.394 75.1 27.7 -64.6 131.5 59.0 50.8 -13.5 14 16 A G T 3 S+ 0 0 62 1,-0.3 2,-0.4 -2,-0.1 -1,-0.3 0.111 93.0 119.3 104.4 -19.4 62.1 50.4 -11.5 15 17 A a < + 0 0 10 -3,-2.3 21,-0.6 1,-0.1 -1,-0.3 -0.671 36.2 179.2 -83.0 130.2 60.8 52.0 -8.4 16 18 A S S S+ 0 0 92 -2,-0.4 24,-2.9 1,-0.2 2,-0.4 0.590 84.0 44.6 -95.3 -12.1 60.6 50.1 -5.1 17 19 A A E S- b 0 40A 63 22,-0.2 2,-0.4 2,-0.0 -1,-0.2 -0.949 74.2-178.3-132.2 108.8 59.2 53.2 -3.3 18 20 A V E - b 0 41A 2 22,-3.1 24,-2.8 -2,-0.4 2,-0.5 -0.912 13.9-153.6-107.6 134.0 56.5 55.0 -5.2 19 21 A T E -ab 2 42A 48 -18,-2.5 -16,-3.1 -2,-0.4 2,-0.8 -0.961 4.4-156.7-107.5 124.4 54.8 58.2 -3.9 20 22 A L E -ab 3 43A 0 22,-2.9 24,-3.2 -2,-0.5 25,-0.8 -0.883 16.7-160.1-100.9 103.0 51.3 58.8 -5.1 21 23 A N - 0 0 51 -18,-2.4 2,-0.3 -2,-0.8 24,-0.2 -0.260 26.1 -92.8 -75.0 167.4 50.7 62.6 -4.7 22 24 A G + 0 0 36 22,-0.2 2,-0.3 25,-0.1 25,-0.2 -0.603 62.5 132.3 -80.0 142.3 47.2 64.2 -4.6 23 25 A F E -c 47 0A 30 23,-1.0 25,-1.9 -2,-0.3 2,-0.5 -0.958 54.7 -89.9-171.3 171.9 45.8 65.4 -8.0 24 26 A T E -c 48 0A 80 -2,-0.3 -18,-0.2 23,-0.2 25,-0.2 -0.874 25.4-139.7 -96.8 133.9 42.6 65.3 -10.0 25 27 A V E -c 49 0A 2 23,-2.7 25,-2.1 -2,-0.5 3,-0.1 -0.849 35.8-131.3 -83.7 112.4 42.1 62.5 -12.6 26 28 A P > - 0 0 62 0, 0.0 3,-1.6 0, 0.0 26,-0.0 -0.212 29.4 -77.9 -68.3 161.2 40.5 64.5 -15.5 27 29 A A T 3 S+ 0 0 59 1,-0.3 25,-0.1 24,-0.1 24,-0.1 -0.217 119.3 24.0 -47.7 138.7 37.4 63.6 -17.3 28 30 A G T 3 S+ 0 0 44 1,-0.3 2,-0.3 22,-0.2 -1,-0.3 0.551 105.9 100.2 79.6 9.3 38.0 60.9 -19.9 29 31 A N < - 0 0 60 -3,-1.6 2,-0.3 -4,-0.1 -1,-0.3 -0.876 52.2-155.6-125.1 158.2 41.1 59.5 -18.1 30 32 A T - 0 0 54 -2,-0.3 2,-0.6 -3,-0.1 29,-0.2 -0.896 18.0-128.0-125.6 162.8 41.9 56.6 -15.8 31 33 A L E +d 59 0A 0 27,-2.7 29,-2.2 -2,-0.3 2,-0.5 -0.956 31.1 178.7-113.1 112.3 44.7 56.1 -13.2 32 34 A V E -d 60 0A 56 -2,-0.6 2,-0.5 -26,-0.3 29,-0.2 -0.971 7.4-172.8-122.5 124.2 46.5 52.8 -13.7 33 35 A L E +d 61 0A 0 27,-2.8 29,-2.0 -2,-0.5 -23,-0.1 -0.976 12.2 175.3-120.7 127.5 49.5 51.6 -11.6 34 36 A N - 0 0 103 -2,-0.5 29,-0.2 -25,-0.4 -22,-0.1 -0.762 24.4-170.5-123.3 75.4 51.6 48.5 -12.4 35 37 A P - 0 0 10 0, 0.0 29,-0.3 0, 0.0 3,-0.1 -0.281 28.2 -91.9 -73.0 159.6 54.3 48.7 -9.7 36 38 A D > - 0 0 53 -21,-0.6 3,-2.4 -24,-0.4 -23,-0.0 -0.218 60.4 -75.1 -57.2 154.4 57.4 46.5 -9.5 37 39 A K T 3 S+ 0 0 173 1,-0.3 28,-0.2 26,-0.1 -1,-0.2 -0.277 119.4 6.3 -49.9 129.4 57.2 43.3 -7.5 38 40 A G T 3 S+ 0 0 49 26,-2.9 -1,-0.3 1,-0.2 27,-0.1 0.512 92.2 156.4 75.6 6.3 57.3 44.1 -3.8 39 41 A A < - 0 0 0 -3,-2.4 28,-2.7 25,-0.3 2,-0.5 -0.322 39.9-133.5 -69.0 150.0 57.1 47.9 -4.3 40 42 A T E -be 17 67A 45 -24,-2.9 -22,-3.1 26,-0.2 2,-0.5 -0.895 18.7-166.0 -95.9 128.9 55.7 50.1 -1.5 41 43 A V E -be 18 68A 0 26,-2.4 28,-3.0 -2,-0.5 2,-0.5 -0.981 7.0-169.4-116.8 118.5 53.2 52.7 -2.8 42 44 A T E -be 19 69A 50 -24,-2.8 -22,-2.9 -2,-0.5 2,-0.4 -0.948 16.0-137.0-114.5 125.3 52.5 55.5 -0.4 43 45 A M E +b 20 0A 2 26,-2.6 -22,-0.2 -2,-0.5 30,-0.1 -0.665 22.9 174.3 -79.5 134.1 49.8 58.0 -0.8 44 46 A A + 0 0 54 -24,-3.2 2,-0.3 -2,-0.4 -22,-0.2 0.324 65.7 12.5-120.0 1.5 50.7 61.6 0.0 45 47 A G S S- 0 0 12 -25,-0.8 2,-0.3 -24,-0.2 -1,-0.1 -0.954 84.9 -82.8-163.7 174.3 47.5 63.4 -1.0 46 48 A D - 0 0 71 -2,-0.3 -23,-1.0 27,-0.1 2,-0.6 -0.663 33.1-142.8 -88.1 146.6 43.9 62.8 -2.0 47 49 A I E -cf 23 75A 0 27,-2.7 29,-2.8 -2,-0.3 2,-0.4 -0.945 15.0-165.0-114.5 119.1 42.9 61.8 -5.6 48 50 A T E -cf 24 76A 43 -25,-1.9 -23,-2.7 -2,-0.6 2,-0.7 -0.878 9.7-146.0-106.3 136.2 39.7 63.4 -6.9 49 51 A F E -c 25 0A 3 27,-2.7 3,-0.1 -2,-0.4 -25,-0.1 -0.878 15.8-137.5-108.6 110.9 38.0 62.0 -10.0 50 52 A A - 0 0 33 -25,-2.1 -22,-0.2 -2,-0.7 0, 0.0 -0.275 45.4 -75.8 -59.1 153.7 36.3 64.7 -12.2 51 53 A K - 0 0 117 -24,-0.1 2,-0.3 2,-0.1 -1,-0.2 -0.263 67.1-175.7 -56.1 132.1 32.8 63.7 -13.5 52 54 A T - 0 0 12 -25,-0.1 -25,-0.1 -3,-0.1 -1,-0.1 -0.893 40.8-146.7-135.6 157.8 33.5 61.3 -16.4 53 55 A T + 0 0 125 -2,-0.3 -1,-0.1 41,-0.1 -2,-0.1 0.453 67.3 112.3-100.2 -6.3 31.7 59.4 -19.1 54 56 A L S S- 0 0 54 -25,-0.1 2,-0.1 1,-0.1 -2,-0.1 -0.324 71.4-114.2 -65.4 151.9 34.1 56.4 -19.0 55 57 A D - 0 0 123 40,-0.1 -1,-0.1 1,-0.1 -2,-0.1 -0.463 54.3 -77.5 -69.0 151.1 33.3 53.0 -17.8 56 58 A G S S+ 0 0 18 40,-0.6 42,-0.2 38,-0.3 40,-0.1 -0.332 91.7 85.1 -76.0 172.4 35.1 51.9 -14.6 57 59 A P + 0 0 43 0, 0.0 41,-0.2 0, 0.0 42,-0.2 0.428 47.7 177.1 -74.3 147.0 37.3 51.0 -13.2 58 60 A L S S+ 0 0 3 40,-1.7 -27,-2.7 39,-0.5 2,-0.4 0.718 75.6 34.6 -88.6 -18.5 38.6 54.5 -12.9 59 61 A F E +dg 31 99A 3 39,-1.7 41,-2.2 -29,-0.2 2,-0.4 -0.997 69.7 177.9-134.1 128.0 41.6 53.4 -10.8 60 62 A T E -dg 32 100A 21 -29,-2.2 -27,-2.8 -2,-0.4 2,-0.4 -0.999 5.5-178.8-130.3 130.9 43.4 50.0 -11.3 61 63 A I E +dg 33 101A 1 39,-2.3 41,-2.5 -2,-0.4 2,-0.4 -0.994 7.7 173.2-127.8 132.1 46.4 48.8 -9.4 62 64 A D E + g 0 102A 60 -29,-2.0 2,-0.3 -2,-0.4 41,-0.2 -0.969 20.2 116.4-140.3 120.2 47.9 45.4 -10.3 63 65 A G E - g 0 103A 9 39,-1.5 41,-2.4 -2,-0.4 2,-0.5 -0.970 55.9 -96.6-171.3 177.2 51.1 43.9 -8.9 64 66 A T E S- 0 0 46 -29,-0.3 -26,-2.9 -2,-0.3 -25,-0.3 -0.911 98.1 -6.6-112.6 124.0 52.7 41.2 -6.8 65 67 A G E S+ 0 0 37 -2,-0.5 40,-0.3 -28,-0.2 -1,-0.2 0.824 85.2 177.2 64.9 31.7 53.5 41.6 -3.1 66 68 A I E - g 0 105A 1 38,-2.1 40,-2.8 -3,-0.2 2,-0.6 -0.455 23.8-152.8 -71.2 142.3 52.5 45.3 -3.2 67 69 A N E -eg 40 106A 49 -28,-2.7 -26,-2.4 38,-0.2 2,-0.6 -0.928 15.5-170.0-113.9 100.9 52.7 47.3 0.1 68 70 A F E -eg 41 107A 2 38,-3.0 40,-2.5 -2,-0.6 2,-0.7 -0.868 4.5-168.9-101.2 117.6 50.1 50.1 -0.3 69 71 A V E -eg 42 108A 45 -28,-3.0 -26,-2.6 -2,-0.6 40,-0.1 -0.901 5.1-176.6-111.4 104.3 50.3 52.7 2.5 70 72 A G > - 0 0 0 38,-2.4 3,-2.2 -2,-0.7 39,-0.2 0.740 17.0-153.8 -78.0 -27.7 47.3 55.0 2.3 71 73 A A T 3 - 0 0 54 1,-0.3 39,-0.2 37,-0.2 38,-0.1 0.815 69.9 -65.7 53.0 35.6 48.2 57.4 5.2 72 74 A D T 3 S+ 0 0 117 37,-2.6 -1,-0.3 1,-0.2 38,-0.2 0.607 95.0 151.5 63.7 20.4 44.4 58.0 5.6 73 75 A H < - 0 0 43 -3,-2.2 38,-2.6 36,-0.5 2,-0.4 -0.254 37.0-122.3 -79.8 169.3 44.1 59.6 2.1 74 76 A I E - h 0 111A 38 36,-0.2 -27,-2.7 38,-0.1 2,-0.6 -0.914 12.6-154.5-121.4 137.1 41.0 59.6 -0.0 75 77 A F E -fh 47 112A 1 36,-2.8 38,-2.9 -2,-0.4 2,-0.7 -0.968 28.6-157.4 -99.8 111.3 40.0 58.5 -3.5 76 78 A D E -fh 48 113A 34 -29,-2.8 -27,-2.7 -2,-0.6 38,-0.2 -0.866 16.5-176.7-101.3 111.8 37.0 60.9 -4.1 77 79 A G - 0 0 1 36,-2.8 37,-0.2 -2,-0.7 -1,-0.1 0.434 32.8-132.9 -87.9 -1.7 34.6 59.5 -6.8 78 80 A N > + 0 0 47 35,-0.4 3,-2.2 1,-0.1 4,-0.3 0.857 41.4 169.0 54.6 38.5 32.2 62.5 -6.8 79 81 A G G >> + 0 0 0 35,-2.1 3,-2.4 1,-0.3 4,-2.3 0.787 62.1 67.0 -60.1 -33.3 29.3 60.0 -6.6 80 82 A A G 34 S+ 0 0 69 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.728 90.7 65.8 -64.0 -16.3 26.6 62.6 -5.9 81 83 A L G <4 S+ 0 0 90 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.608 115.9 27.5 -74.9 -11.2 27.2 63.9 -9.4 82 84 A Y T <4 S+ 0 0 8 -3,-2.4 10,-0.2 -4,-0.3 -2,-0.2 0.667 89.1 112.8-113.8 -36.9 25.8 60.6 -10.7 83 85 A W < + 0 0 22 -4,-2.3 64,-0.2 1,-0.1 63,-0.1 -0.197 22.3 154.3 -56.4 136.4 23.5 59.2 -8.1 84 86 A D - 0 0 45 62,-0.6 63,-0.1 8,-0.1 -1,-0.1 0.159 67.7 -96.0-145.2 14.7 19.9 59.0 -9.3 85 87 A G S S+ 0 0 27 61,-2.3 62,-0.1 1,-0.1 -2,-0.1 0.306 112.2 80.2 85.1 -10.3 18.3 56.2 -7.2 86 88 A K >> - 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