==== 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 11-MAR-92 1ENT . COMPND 2 MOLECULE: ENDOTHIAPEPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CRYPHONECTRIA PARASITICA; . AUTHOR T.L.BLUNDELL,C.G.DEALWIS . 331 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13177.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 236 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 5.1 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 . 48 14.5 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 3 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 3 5 3 3 2 1 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 61 0, 0.0 152,-1.9 0, 0.0 153,-0.3 0.000 360.0 360.0 360.0 170.3 28.0 32.8 -2.8 2 -1 E T - 0 0 56 150,-0.2 2,-0.3 96,-0.1 170,-0.2 -0.897 360.0-152.1-145.6 173.6 26.0 30.3 -0.8 3 0 E G E -A 171 0A 2 168,-1.8 168,-3.0 -2,-0.3 2,-0.3 -0.974 4.9-170.6-150.5 148.0 25.3 29.2 2.8 4 1 E S E +A 170 0A 65 93,-1.7 2,-0.4 -2,-0.3 166,-0.2 -0.955 11.7 173.8-146.5 120.9 24.3 25.9 4.5 5 2 E A E -A 169 0A 7 164,-2.2 164,-2.3 -2,-0.3 2,-0.4 -0.982 29.1-123.0-134.7 143.1 23.3 25.6 8.1 6 3 E T E -A 168 0A 82 -2,-0.4 2,-0.4 162,-0.2 162,-0.3 -0.653 24.0-158.8 -83.9 133.2 21.9 22.7 10.2 7 4 E T E -A 167 0A 0 160,-2.0 160,-3.2 -2,-0.4 155,-0.3 -0.953 7.9-165.4-116.2 135.4 18.7 23.4 12.0 8 5 E T E -F 18 0B 56 10,-2.1 10,-2.9 -2,-0.4 2,-0.1 -0.917 25.0-108.5-122.3 146.3 17.6 21.3 15.1 9 6 E P E -F 17 0B 28 0, 0.0 8,-0.3 0, 0.0 3,-0.0 -0.382 22.5-137.7 -67.4 145.2 14.3 20.9 16.9 10 7 E I S S+ 0 0 27 6,-2.6 2,-0.3 -2,-0.1 7,-0.1 0.685 79.8 7.7 -79.0 -18.0 14.2 22.6 20.3 11 8 E D S > S- 0 0 58 5,-0.4 3,-1.3 0, 0.0 5,-0.1 -0.899 88.0 -86.5-151.7 178.3 12.5 19.6 22.0 12 9 E S T 3 S+ 0 0 101 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 0.585 120.9 56.9 -68.3 -11.1 11.3 16.1 21.5 13 10 E L T 3 S- 0 0 49 3,-0.0 -1,-0.2 268,-0.0 151,-0.0 0.470 105.7-121.0 -99.5 -3.5 8.0 17.3 20.0 14 11 E D < + 0 0 0 -3,-1.3 -2,-0.1 2,-0.1 3,-0.1 0.871 55.5 156.7 66.1 36.6 9.5 19.4 17.2 15 12 E D - 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0 0 61 61,-2.3 3,-2.2 1,-0.2 -1,-0.1 -0.283 38.0-131.6 -51.5 119.3 15.6 44.1 31.0 50 47 E A G > S+ 0 0 86 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.820 102.2 55.9 -43.8 -46.7 17.6 41.8 33.2 51 48 E S G 3 S+ 0 0 106 1,-0.3 -1,-0.3 0, 0.0 -2,-0.1 0.626 102.8 57.7 -69.1 -10.8 14.7 40.2 34.9 52 49 E E G < S+ 0 0 55 -3,-2.2 2,-0.5 2,-0.0 -1,-0.3 0.213 88.3 93.7-101.4 10.6 13.2 39.1 31.5 53 50 E V < + 0 0 43 -3,-1.5 64,-0.1 -4,-0.1 65,-0.1 -0.955 47.9 175.8-112.6 122.5 16.3 37.1 30.5 54 51 E D - 0 0 85 -2,-0.5 -1,-0.1 63,-0.3 64,-0.1 0.594 66.9 -49.8 -87.3-128.2 16.5 33.3 31.3 55 52 E G S S+ 0 0 61 62,-0.3 65,-0.0 2,-0.1 -2,-0.0 0.063 93.2 133.6-105.1 23.6 19.5 31.3 30.1 56 53 E Q - 0 0 13 61,-0.2 2,-0.4 66,-0.1 65,-0.1 -0.336 63.0-112.0 -69.9 159.9 19.3 32.6 26.5 57 54 E T - 0 0 70 63,-0.2 -13,-0.3 -26,-0.1 2,-0.3 -0.772 37.0-145.9 -91.3 134.2 22.6 33.8 25.0 58 55 E I - 0 0 61 -2,-0.4 2,-0.5 -15,-0.1 -13,-0.3 -0.744 8.3-126.9-108.1 156.0 22.6 37.6 24.4 59 56 E Y B -o 45 0D 0 -15,-2.1 -13,-2.0 -2,-0.3 -12,-0.4 -0.841 17.8-159.8 -96.0 129.4 24.2 39.9 21.8 60 57 E T > - 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