==== 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/HYDROLASE INHIBITOR 27-JUL-94 1EPO . COMPND 2 MOLECULE: ENDOTHIAPEPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CRYPHONECTRIA PARASITICA; . AUTHOR B.VEERAPANDIAN,J.B.COOPER,T.L.BLUNDELL . 331 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13178.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 231 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 105 31.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 45 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 1 2 0 0 1 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 1 2 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 PARALLEL BRIDGES PER LADDER . 2 5 4 3 4 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 0 1 0 1 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 -2 E S 0 0 60 0, 0.0 152,-1.7 0, 0.0 153,-0.3 0.000 360.0 360.0 360.0 156.6 29.5 8.7 25.2 2 -1 E T - 0 0 60 150,-0.2 2,-0.3 96,-0.1 170,-0.2 -0.871 360.0-159.6-135.9 167.5 28.3 8.4 21.6 3 0 E G E -A 171 0A 3 168,-1.5 168,-3.2 -2,-0.3 2,-0.3 -0.943 2.6-168.9-147.6 153.2 29.6 8.9 18.0 4 1 E S E +A 170 0A 63 93,-1.1 2,-0.3 -2,-0.3 166,-0.3 -0.976 12.3 175.8-144.7 109.5 27.6 9.3 14.7 5 2 E A E -A 169 0A 9 164,-3.5 164,-3.4 -2,-0.3 2,-0.4 -0.984 27.2-125.9-128.3 144.9 29.4 9.2 11.3 6 3 E T E -A 168 0A 77 -2,-0.3 2,-0.3 162,-0.3 162,-0.3 -0.776 19.7-160.6 -80.2 124.5 28.2 9.4 7.6 7 4 E T E -A 167 0A 0 160,-2.0 160,-3.1 -2,-0.4 12,-0.2 -0.886 9.4-164.2-107.1 151.2 29.3 6.5 5.3 8 5 E T E -F 18 0B 60 10,-1.7 10,-2.3 -2,-0.3 153,-0.0 -0.983 26.7-102.8-132.4 130.5 29.0 7.3 1.5 9 6 E P E -F 17 0B 22 0, 0.0 8,-0.3 0, 0.0 154,-0.0 -0.310 22.2-137.5 -56.4 143.3 29.2 4.7 -1.4 10 7 E I S S+ 0 0 31 6,-3.4 2,-0.3 2,-0.0 7,-0.1 0.543 81.2 2.4 -66.3 -13.6 32.5 4.7 -3.2 11 8 E D S > S- 0 0 61 5,-0.4 3,-1.4 1,-0.0 5,-0.1 -0.940 90.8 -82.6-167.5-173.9 30.9 4.5 -6.7 12 9 E S T 3 S+ 0 0 99 1,-0.3 -1,-0.0 -2,-0.3 152,-0.0 0.545 122.4 55.9 -96.8 2.4 27.5 4.4 -8.3 13 10 E L T 3 S- 0 0 60 3,-0.1 -1,-0.3 150,-0.0 151,-0.0 0.437 106.8-121.0 -98.9 1.0 26.9 0.7 -7.7 14 11 E D < + 0 0 0 -3,-1.4 3,-0.1 2,-0.1 -2,-0.1 0.879 53.0 161.2 60.9 44.0 27.4 1.0 -3.9 15 12 E D - 0 0 26 1,-0.2 2,-0.3 292,-0.0 292,-0.1 0.793 69.4 -13.0 -62.1 -25.6 30.3 -1.6 -4.3 16 13 E A - 0 0 2 -5,-0.1 -6,-3.4 316,-0.1 -5,-0.4 -0.963 65.0-122.0-177.4 158.2 31.5 -0.2 -0.8 17 14 E Y E -F 9 0B 3 -8,-0.3 17,-0.4 -2,-0.3 2,-0.3 -0.952 16.7-157.8-116.7 119.9 31.0 2.5 1.8 18 15 E I E -F 8 0B 26 -10,-2.3 -10,-1.7 -2,-0.4 15,-0.2 -0.792 7.1-168.7-105.6 151.3 33.8 4.9 3.1 19 16 E T E -G 32 0C 0 13,-1.5 13,-2.2 -2,-0.3 2,-0.2 -0.990 26.9-114.7-139.1 125.8 33.4 6.7 6.5 20 17 E P E -G 31 0C 50 0, 0.0 2,-0.4 0, 0.0 77,-0.3 -0.409 35.5-176.1 -63.5 132.8 35.8 9.5 7.6 21 18 E V E -G 30 0C 0 9,-2.3 9,-2.8 -2,-0.2 2,-0.6 -0.999 20.2-137.2-132.9 139.0 38.0 8.7 10.6 22 19 E Q E -GH 29 95C 57 73,-2.2 73,-3.1 -2,-0.4 2,-0.5 -0.797 23.9-178.2 -94.9 123.4 40.4 11.0 12.5 23 20 E I E > -GH 28 94C 0 5,-3.2 5,-2.1 -2,-0.6 71,-0.2 -0.968 43.4 -4.3-121.4 116.7 43.7 9.3 13.5 24 21 E G T 5S- 0 0 10 69,-2.2 40,-0.1 -2,-0.5 3,-0.1 -0.440 88.9 -38.2 113.7-174.7 46.4 11.1 15.4 25 22 E T T 5S+ 0 0 55 1,-0.3 40,-2.1 2,-0.1 41,-0.3 -0.973 131.6 21.1-135.7 121.9 47.2 14.5 16.9 26 23 E P T 5S- 0 0 103 0, 0.0 -1,-0.3 0, 0.0 40,-0.1 0.789 124.3 -91.4 -64.4 166.9 46.5 16.7 15.3 27 24 E A T 5 - 0 0 60 -2,-0.2 2,-0.5 -5,-0.1 -3,-0.2 -0.157 31.5-161.7 -43.4 123.9 43.8 14.7 13.4 28 25 E Q E < -G 23 0C 34 -5,-2.1 -5,-3.2 -4,-0.0 2,-0.6 -0.965 17.2-147.6 -92.2 128.3 44.7 13.0 10.2 29 26 E T E +G 22 0C 69 -2,-0.5 2,-0.4 -7,-0.2 -7,-0.2 -0.835 25.0 166.4 -97.1 116.3 41.4 12.2 8.3 30 27 E L E -G 21 0C 1 -9,-2.8 -9,-2.3 -2,-0.6 2,-0.7 -0.967 35.6-123.2-120.5 161.2 41.4 9.0 6.3 31 28 E N E -G 20 0C 58 -2,-0.4 92,-2.5 -11,-0.2 93,-0.5 -0.796 33.5-168.0-107.9 121.3 38.3 7.3 4.8 32 29 E L E -Gi 19 124C 0 -13,-2.2 -13,-1.5 -2,-0.7 2,-0.8 -0.763 24.6-123.2-109.6 143.2 38.0 3.8 6.0 33 30 E D E - i 0 125C 12 91,-2.1 93,-1.6 -2,-0.3 2,-0.5 -0.854 30.9-133.5 -81.2 110.9 35.8 0.9 4.9 34 31 E F E - i 0 126C 1 -2,-0.8 2,-0.7 -17,-0.4 93,-0.2 -0.530 27.4-166.1 -64.9 108.8 33.9 -0.3 8.0 35 32 E D E > - i 0 127C 7 91,-2.3 93,-3.2 -2,-0.5 3,-1.0 -0.829 25.2-177.9-124.8 99.9 34.2 -4.0 8.0 36 33 E T T 3 S+ 0 0 1 -2,-0.7 159,-0.5 1,-0.2 94,-0.1 0.446 84.7 56.5 -84.5 1.3 32.2 -6.4 10.1 37 34 E G T 3 S+ 0 0 17 157,-0.1 2,-0.3 92,-0.1 -1,-0.2 0.029 105.6 53.6-110.6 19.0 33.9 -9.6 8.9 38 35 E S < - 0 0 6 -3,-1.0 91,-2.6 88,-0.1 90,-0.5 -0.960 62.7-151.7-145.2 164.6 37.4 -8.6 9.8 39 36 E S + 0 0 2 94,-0.3 2,-0.5 -2,-0.3 102,-0.1 0.172 59.5 103.8-132.3 20.4 39.1 -7.3 13.1 40 37 E D - 0 0 0 94,-0.1 2,-0.8 -5,-0.1 87,-0.3 -0.926 51.1-158.1-103.4 119.9 41.9 -5.2 11.9 41 38 E L + 0 0 7 -2,-0.5 66,-2.9 64,-0.3 2,-0.3 -0.793 35.2 160.7 -82.7 105.3 42.2 -1.4 11.8 42 39 E W E -jK 107 125C 0 83,-1.8 83,-1.0 -2,-0.8 2,-0.3 -0.935 16.6-168.4-129.2 155.6 44.9 -0.9 9.2 43 40 E V E -jK 108 124C 0 64,-2.1 66,-2.4 -2,-0.3 81,-0.3 -0.975 33.0 -98.7-140.0 144.4 45.7 2.2 7.1 44 41 E F - 0 0 1 79,-2.6 15,-3.7 -2,-0.3 2,-0.3 -0.424 60.2-178.3 -44.0 134.2 47.7 3.4 4.1 45 42 E S B > -o 59 0D 2 64,-0.4 3,-1.4 13,-0.3 15,-0.2 -0.864 47.3 -96.1-140.0 168.8 50.9 4.9 5.6 46 43 E S T 3 S+ 0 0 57 13,-2.8 14,-0.1 -2,-0.3 4,-0.1 0.727 122.5 53.0 -35.4 -26.0 54.2 6.7 5.4 47 44 E E T 3 S+ 0 0 60 12,-0.3 -1,-0.2 62,-0.2 3,-0.1 0.579 81.0 118.7-104.2 -9.3 55.8 3.3 5.5 48 45 E T S < S- 0 0 10 -3,-1.4 62,-0.2 1,-0.1 63,-0.2 -0.320 83.1 -93.9 -55.0 130.1 53.7 1.8 2.6 49 46 E T > - 0 0 52 61,-2.5 3,-2.3 1,-0.2 4,-0.4 -0.276 37.0-132.6 -54.2 126.4 55.8 0.7 -0.3 50 47 E A G > S+ 0 0 84 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.752 101.1 56.4 -64.3 -29.5 55.7 3.7 -2.6 51 48 E S G 3 S+ 0 0 104 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.552 103.5 57.5 -83.2 -2.9 54.9 1.8 -5.8 52 49 E E G < S+ 0 0 48 -3,-2.3 2,-0.4 -4,-0.0 -1,-0.3 0.407 89.5 84.4-102.9 -4.6 51.8 0.4 -4.1 53 50 E V < + 0 0 46 -3,-1.0 64,-0.1 -4,-0.4 65,-0.1 -0.878 48.5 169.6-103.7 138.8 50.2 3.7 -3.2 54 51 E D S S- 0 0 108 -2,-0.4 66,-0.1 63,-0.2 3,-0.1 -0.432 72.7 -36.0-148.8 70.4 48.1 5.5 -5.9 55 52 E G S S+ 0 0 65 1,-0.3 -2,-0.1 64,-0.0 62,-0.0 0.280 95.7 133.0 98.6 -5.5 46.0 8.5 -4.8 56 53 E Q - 0 0 13 61,-0.1 2,-0.5 1,-0.1 -1,-0.3 -0.281 62.8-112.3 -70.8 157.9 45.1 7.1 -1.4 57 54 E T - 0 0 71 63,-0.2 2,-0.3 -26,-0.1 -13,-0.3 -0.855 36.7-146.5 -94.5 132.4 45.5 9.3 1.7 58 55 E I - 0 0 59 -2,-0.5 2,-0.4 -15,-0.1 -13,-0.3 -0.784 9.1-129.0-104.8 141.4 48.3 8.0 3.9 59 56 E Y B -o 45 0D 0 -15,-3.7 -13,-2.8 -2,-0.3 -12,-0.3 -0.770 19.1-162.0 -83.1 130.6 48.7 8.1 7.7 60 57 E T > - 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