==== 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 20-OCT-90 2ER9 . COMPND 2 MOLECULE: ENDOTHIAPEPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CRYPHONECTRIA PARASITICA; . AUTHOR J.B.COOPER,S.I.FOUNDLING,J.BOGER,T.L.BLUNDELL . 336 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13120.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 241 71.7 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 . 108 32.1 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 . 3 0.9 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 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 10.4 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 2 0 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 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 6 3 2 4 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,-1.4 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 118.0 29.9 8.8 25.0 2 -1 E T - 0 0 58 150,-0.2 2,-0.3 151,-0.1 170,-0.2 -0.733 360.0-158.1-130.5 179.5 28.3 8.2 21.6 3 0 E G E -A 171 0A 2 168,-1.1 168,-2.8 -2,-0.2 2,-0.4 -0.901 6.0-173.8-163.3 132.8 29.6 8.8 17.9 4 1 E S E +A 170 0A 60 93,-1.0 2,-0.4 -2,-0.3 166,-0.2 -0.991 9.7 174.8-132.8 125.3 27.8 9.2 14.6 5 2 E A E -A 169 0A 9 164,-2.5 164,-2.1 -2,-0.4 2,-0.4 -0.996 30.8-117.5-131.5 138.7 29.6 9.4 11.2 6 3 E T E -A 168 0A 80 -2,-0.4 2,-0.4 162,-0.2 162,-0.3 -0.606 23.7-155.6 -70.6 126.2 28.2 9.5 7.7 7 4 E T E -A 167 0A 0 160,-2.1 160,-2.6 -2,-0.4 12,-0.2 -0.868 11.2-166.3-101.0 138.5 29.1 6.6 5.4 8 5 E T E -F 18 0B 55 10,-2.7 10,-2.0 -2,-0.4 153,-0.0 -0.969 24.1-111.6-131.0 131.3 29.1 7.2 1.7 9 6 E P E -F 17 0B 23 0, 0.0 8,-0.2 0, 0.0 3,-0.1 -0.298 17.7-145.7 -59.0 147.5 29.1 4.8 -1.3 10 7 E I S S+ 0 0 30 6,-1.9 2,-0.3 1,-0.0 7,-0.1 0.596 79.4 17.5 -90.3 -12.2 32.4 4.9 -3.3 11 8 E D S > S- 0 0 53 5,-0.4 3,-1.1 0, 0.0 5,-0.1 -0.903 84.3-101.7-148.9 171.8 30.6 4.3 -6.6 12 9 E S T 3 S+ 0 0 96 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 0.538 120.8 59.2 -79.3 -5.4 27.2 4.3 -8.2 13 10 E L T 3 S- 0 0 46 267,-0.1 -1,-0.2 3,-0.0 268,-0.0 0.499 106.1-128.9 -91.2 -13.0 27.0 0.5 -7.8 14 11 E D < + 0 0 1 -3,-1.1 -2,-0.1 2,-0.1 3,-0.1 0.942 49.0 160.5 59.7 49.2 27.5 0.8 -4.0 15 12 E D - 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0 0 66 61,-2.0 3,-2.3 1,-0.2 4,-0.2 -0.346 30.3-134.8 -56.2 123.2 55.5 0.8 -0.7 50 47 E A T 3 S+ 0 0 90 1,-0.3 3,-0.3 2,-0.2 -1,-0.2 0.548 104.2 61.5 -61.3 -12.1 55.3 3.8 -3.0 51 48 E S T 3 S+ 0 0 105 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.277 105.0 51.0 -96.2 9.6 54.6 1.5 -6.0 52 49 E E S < S+ 0 0 34 -3,-2.3 2,-0.5 1,-0.1 -2,-0.2 0.243 90.5 82.5-130.1 4.2 51.5 0.4 -4.2 53 50 E V + 0 0 44 -3,-0.3 64,-0.1 -4,-0.2 -1,-0.1 -0.986 48.1 175.3-119.2 127.0 49.8 3.8 -3.3 54 51 E D S S- 0 0 101 -2,-0.5 -3,-0.0 63,-0.3 66,-0.0 -0.512 73.6 -40.3-128.5 55.1 47.8 5.4 -6.1 55 52 E G S S+ 0 0 71 1,-0.3 2,-0.1 66,-0.0 -2,-0.0 0.509 95.9 135.7 100.0 2.0 46.0 8.6 -4.9 56 53 E Q - 0 0 12 61,-0.1 2,-0.5 1,-0.1 -1,-0.3 -0.474 61.5-110.6 -77.7 153.4 45.0 7.2 -1.5 57 54 E T - 0 0 72 63,-0.2 -13,-0.3 -2,-0.1 2,-0.3 -0.773 36.4-148.0 -87.9 128.3 45.5 9.4 1.6 58 55 E I - 0 0 63 -2,-0.5 2,-0.5 -15,-0.1 -13,-0.3 -0.687 10.4-127.3-101.7 149.2 48.2 8.1 3.9 59 56 E Y B -o 45 0D 0 -15,-2.4 -13,-1.7 -2,-0.3 -12,-0.3 -0.829 19.1-156.1 -88.2 123.6 48.6 8.2 7.6 60 57 E T > - 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