==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 03-AUG-89 4APR . COMPND 2 MOLECULE: RHIZOPUSPEPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RHIZOPUS CHINENSIS; . AUTHOR K.SUGUNA,D.R.DAVIES . 330 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13185.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 245 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 109 33.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 12.7 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 . 20 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.8 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 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 2 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 . 3 5 3 5 2 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 . 0 0 2 0 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 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 E A 0 0 115 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 156.2 23.0 47.5 111.4 2 2 E G > - 0 0 49 1,-0.2 3,-1.5 2,-0.1 2,-0.3 0.069 360.0 -56.7 -62.5-179.8 24.3 44.2 110.1 3 3 E V T 3 S+ 0 0 113 1,-0.3 93,-0.2 93,-0.1 -1,-0.2 -0.435 125.2 5.7 -69.6 125.2 27.8 42.9 110.8 4 4 E G T 3 S+ 0 0 0 91,-3.3 167,-2.6 -2,-0.3 2,-0.5 0.596 94.4 141.1 78.6 12.0 30.6 45.3 109.7 5 5 E T E < -A 170 0A 20 -3,-1.5 -1,-0.3 90,-0.6 165,-0.2 -0.775 29.1-173.8 -91.5 126.6 28.0 48.0 108.8 6 6 E V E -A 169 0A 3 163,-3.4 163,-2.0 -2,-0.5 2,-0.2 -0.918 14.7-147.2-127.0 105.5 28.9 51.5 109.6 7 7 E P E -A 168 0A 78 0, 0.0 13,-0.4 0, 0.0 161,-0.3 -0.448 23.1-147.7 -68.2 130.7 26.4 54.3 109.0 8 8 E M - 0 0 11 159,-2.6 2,-0.4 -2,-0.2 159,-0.4 -0.622 5.7-135.9-102.2 160.9 28.1 57.5 108.0 9 9 E T E -F 18 0B 68 9,-1.9 9,-2.0 -2,-0.2 2,-0.6 -0.986 15.6-136.3-119.9 127.3 27.4 61.2 108.7 10 10 E D E -F 17 0B 21 -2,-0.4 2,-0.6 7,-0.2 7,-0.2 -0.754 18.9-147.8 -85.3 116.3 27.7 63.7 105.9 11 11 E Y E >> -F 16 0B 90 5,-3.3 4,-2.4 -2,-0.6 5,-0.9 -0.814 56.0 -42.1 -92.6 125.3 29.4 66.8 107.2 12 12 E G T 45S- 0 0 43 -2,-0.6 2,-1.6 1,-0.2 149,-0.1 -0.252 123.8 -11.7 58.5-144.3 28.2 70.1 105.6 13 13 E N T 45S- 0 0 71 1,-0.2 -1,-0.2 148,-0.1 -2,-0.1 -0.624 123.8 -59.5 -89.0 75.4 27.8 70.0 101.8 14 14 E D T 45S+ 0 0 12 -2,-1.6 -2,-0.2 2,-0.1 -1,-0.2 0.858 93.8 141.0 51.8 46.0 29.4 66.6 101.3 15 15 E I T <5S- 0 0 21 -4,-2.4 313,-0.4 1,-0.4 2,-0.3 0.784 71.9 -21.5 -83.0 -37.6 32.7 67.8 102.7 16 16 E E E < -F 11 0B 1 -5,-0.9 -5,-3.3 311,-0.1 2,-0.4 -0.970 54.6-133.8-167.7 162.9 33.4 64.6 104.5 17 17 E Y E -F 10 0B 4 -2,-0.3 17,-1.1 202,-0.3 2,-0.3 -0.994 24.3-177.6-130.6 131.3 31.9 61.5 105.9 18 18 E Y E -FG 9 33B 38 -9,-2.0 -9,-1.9 -2,-0.4 2,-0.3 -0.964 6.7-163.5-133.9 152.0 32.6 60.1 109.3 19 19 E G E - G 0 32B 2 13,-2.1 13,-2.9 -2,-0.3 2,-0.4 -0.828 27.9 -98.9-129.8 162.6 31.6 57.0 111.3 20 20 E Q E - G 0 31B 99 -13,-0.4 75,-0.4 -2,-0.3 2,-0.4 -0.715 34.1-178.2 -89.6 129.2 31.6 55.9 114.9 21 21 E V E - G 0 30B 0 9,-2.4 9,-3.3 -2,-0.4 2,-0.5 -0.980 18.9-141.0-129.7 135.4 34.4 53.5 116.1 22 22 E T E -HG 93 29B 31 71,-1.6 71,-2.8 -2,-0.4 2,-0.4 -0.905 21.8-173.0-101.8 122.1 34.6 52.1 119.6 23 23 E I E > +HG 92 28B 3 5,-2.6 5,-1.7 -2,-0.5 69,-0.2 -0.966 40.8 3.0-121.7 137.4 38.2 51.9 121.0 24 24 E G T 5S- 0 0 11 67,-2.4 39,-0.1 -2,-0.4 66,-0.1 -0.229 89.0 -40.5 91.4-179.5 39.3 50.3 124.3 25 25 E T T 5S+ 0 0 50 1,-0.2 39,-2.6 2,-0.1 40,-0.3 -0.992 134.7 6.9-130.5 121.1 37.8 48.4 127.1 26 26 E P T 5S- 0 0 126 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.977 119.5-145.9 -63.4 -22.4 35.1 49.2 128.2 27 27 E G T 5 - 0 0 32 35,-0.4 2,-0.3 -4,-0.1 -3,-0.2 0.208 17.3-131.7 104.6 139.3 35.3 51.5 125.2 28 28 E K E < -G 23 0B 71 -5,-1.7 -5,-2.6 -7,-0.0 2,-0.3 -0.945 25.8-114.8-126.3 148.4 34.4 54.9 123.9 29 29 E K E -G 22 0B 110 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.3 -0.678 32.3-170.1 -86.1 129.5 32.8 56.0 120.6 30 30 E F E -G 21 0B 0 -9,-3.3 -9,-2.4 -2,-0.3 2,-0.8 -0.929 21.2-134.6-121.7 145.9 35.0 58.1 118.3 31 31 E N E -G 20 0B 40 -2,-0.3 89,-3.4 -11,-0.2 90,-0.7 -0.897 34.0-179.9-101.3 106.4 34.0 59.9 115.1 32 32 E L E -Gi 19 121B 0 -13,-2.9 -13,-2.1 -2,-0.8 2,-0.5 -0.850 31.1-126.0-111.0 147.9 36.6 59.1 112.5 33 33 E D E -Gi 18 122B 0 88,-1.5 90,-2.4 -2,-0.4 2,-0.7 -0.755 28.7-134.0 -85.4 122.4 36.9 60.3 108.9 34 34 E F E - i 0 123B 1 -17,-1.1 2,-0.5 -2,-0.5 -17,-0.2 -0.741 29.9-170.7 -80.7 112.7 37.2 57.1 106.7 35 35 E D E > - i 0 124B 0 88,-3.1 90,-2.9 -2,-0.7 3,-1.1 -0.899 29.8-175.7-116.4 111.4 40.1 57.9 104.3 36 36 E T T 3 S+ 0 0 0 -2,-0.5 159,-0.4 1,-0.2 91,-0.2 0.546 86.5 66.5 -76.6 -1.2 41.2 55.7 101.3 37 37 E G T 3 S+ 0 0 0 89,-0.1 294,-1.0 157,-0.1 2,-0.3 0.362 104.8 37.4 -97.1 3.1 44.1 58.2 100.7 38 38 E S < - 0 0 0 -3,-1.1 88,-1.7 85,-0.1 87,-0.7 -0.939 57.7-152.7-152.0 160.7 46.0 57.3 104.0 39 39 E S + 0 0 3 91,-0.4 2,-0.4 -2,-0.3 92,-0.1 -0.002 60.5 101.2-130.7 28.7 46.8 54.3 106.1 40 40 E D - 0 0 1 91,-0.1 2,-0.7 98,-0.1 85,-0.1 -0.987 56.0-149.7-117.2 130.3 47.3 55.6 109.7 41 41 E L + 0 0 3 -2,-0.4 64,-2.3 62,-0.3 2,-0.3 -0.873 31.8 168.6 -96.0 107.2 44.5 55.3 112.4 42 42 E W E -jK 105 122B 0 80,-1.9 80,-1.4 -2,-0.7 2,-0.3 -0.933 13.3-173.7-127.9 153.1 45.0 58.3 114.7 43 43 E I E -jK 106 121B 0 62,-1.9 64,-2.8 -2,-0.3 78,-0.2 -0.967 34.5-100.2-145.9 149.6 42.9 59.8 117.4 44 44 E A E -j 107 0B 0 76,-2.3 14,-2.7 12,-0.3 2,-0.3 -0.397 49.9-172.1 -61.0 134.4 42.9 62.9 119.7 45 45 E S B > -n 58 0C 0 62,-0.8 3,-1.2 12,-0.3 14,-0.2 -0.811 40.2-102.5-132.1 175.0 44.2 61.7 123.2 46 46 E T T 3 S+ 0 0 75 12,-1.9 13,-0.1 -2,-0.3 62,-0.1 0.270 116.9 67.3 -82.2 11.3 44.5 63.2 126.6 47 47 E L T 3 S+ 0 0 77 60,-0.4 2,-0.3 11,-0.2 -1,-0.2 0.373 77.9 113.0-103.8 -7.8 48.2 63.8 126.0 48 48 E a < - 0 0 22 -3,-1.2 61,-0.2 59,-0.2 60,-0.1 -0.619 45.7-172.7 -75.3 128.6 47.3 66.4 123.4 49 49 E T S S+ 0 0 108 59,-2.3 60,-0.1 -2,-0.3 -1,-0.1 0.289 83.6 32.2-105.1 2.8 48.2 70.0 124.0 50 50 E N S S+ 0 0 61 58,-0.3 65,-0.2 2,-0.1 2,-0.1 -0.057 87.6 130.9-146.6 29.1 46.5 71.8 121.1 51 51 E a - 0 0 27 57,-0.1 2,-0.1 -6,-0.1 61,-0.1 -0.390 64.5 -94.3 -85.2 155.9 43.4 69.6 120.5 52 52 E G - 0 0 11 1,-0.2 3,-0.2 -2,-0.1 -1,-0.1 -0.521 19.7-141.2 -71.3 146.2 39.8 70.8 120.2 53 53 E S S S+ 0 0 122 1,-0.2 -1,-0.2 -2,-0.1 4,-0.1 0.585 105.3 60.1 -81.5 -15.3 37.8 70.8 123.5 54 54 E G S S+ 0 0 74 61,-0.3 -1,-0.2 2,-0.1 62,-0.1 0.749 88.1 95.5 -81.5 -24.2 34.9 69.6 121.3 55 55 E Q S S- 0 0 13 -3,-0.2 2,-0.4 60,-0.2 65,-0.1 -0.327 80.0-121.7 -68.9 151.0 36.9 66.4 120.3 56 56 E T - 0 0 55 -25,-0.1 2,-0.5 -2,-0.0 -12,-0.3 -0.770 33.9-145.9 -90.5 132.0 36.4 63.1 122.1 57 57 E K - 0 0 53 -2,-0.4 -12,-0.3 -4,-0.1 2,-0.2 -0.914 8.8-126.1-113.9 129.8 39.8 62.1 123.5 58 58 E Y B -n 45 0C 4 -14,-2.7 -12,-1.9 -2,-0.5 -11,-0.2 -0.412 24.4-159.6 -67.6 127.7 41.2 58.6 123.9 59 59 E D > - 0 0 32 -2,-0.2 3,-1.6 -14,-0.2 4,-0.1 -0.910 11.1-160.8-113.7 107.4 42.3 58.2 127.5 60 60 E P G > S+ 0 0 12 0, 0.0 3,-1.7 0, 0.0 6,-0.3 0.828 88.4 64.6 -50.9 -39.4 44.9 55.4 128.0 61 61 E N G 3 S+ 0 0 148 1,-0.3 -3,-0.0 -3,-0.1 -2,-0.0 0.665 101.1 49.0 -60.7 -20.6 44.0 55.2 131.8 62 62 E Q G < S+ 0 0 126 -3,-1.6 2,-0.6 3,-0.0 -35,-0.4 0.150 92.4 84.8-105.4 9.2 40.5 54.1 131.2 63 63 E S X - 0 0 14 -3,-1.7 3,-0.8 -39,-0.1 -39,-0.1 -0.982 56.8-165.6-116.8 118.7 41.2 51.3 128.8 64 64 E S T 3 S+ 0 0 98 -39,-2.6 -1,-0.1 -2,-0.6 -3,-0.0 0.613 91.1 56.0 -79.3 -10.5 42.0 48.1 130.6 65 65 E T T 3 S+ 0 0 52 -40,-0.3 -1,-0.2 26,-0.1 2,-0.2 0.196 77.0 125.5-104.2 12.0 43.4 46.8 127.2 66 66 E Y < - 0 0 70 -3,-0.8 2,-0.4 -6,-0.3 24,-0.2 -0.518 37.7-170.2 -75.0 138.4 45.9 49.7 126.5 67 67 E Q E -L 89 0B 118 22,-1.7 22,-1.7 -2,-0.2 2,-0.1 -0.997 20.8-128.7-132.1 120.7 49.5 48.5 125.8 68 68 E A E -L 88 0B 54 -2,-0.4 2,-0.4 20,-0.2 20,-0.2 -0.338 21.0-155.9 -67.2 150.1 52.2 51.3 125.7 69 69 E D E - 0 0 50 18,-0.8 18,-0.2 2,-0.1 20,-0.0 -0.995 18.7-141.7-138.1 144.2 54.6 51.6 122.8 70 70 E G E S+ 0 0 81 -2,-0.4 2,-0.2 16,-0.1 -1,-0.1 0.521 72.3 93.8 -76.3 -11.5 58.0 53.1 122.5 71 71 E R E - 0 0 103 1,-0.0 16,-3.1 62,-0.0 2,-0.3 -0.522 56.2-154.5 -92.7 152.4 57.5 54.5 119.0 72 72 E T E -L 86 0B 105 14,-0.3 2,-0.3 -2,-0.2 14,-0.3 -0.727 9.2-161.1-114.2 164.8 56.4 58.0 117.9 73 73 E W E -L 85 0B 10 12,-2.0 12,-2.5 -2,-0.3 2,-0.3 -0.972 8.7-171.8-148.0 159.6 54.8 59.0 114.6 74 74 E S E -L 84 0B 85 -2,-0.3 2,-0.3 10,-0.3 10,-0.2 -0.971 9.4-171.2-155.0 139.6 54.2 62.2 112.6 75 75 E I E -L 83 0B 7 8,-2.1 8,-1.3 -2,-0.3 2,-0.4 -0.985 11.1-166.9-140.6 150.6 52.0 62.8 109.5 76 76 E S E -L 82 0B 82 -2,-0.3 6,-0.2 6,-0.2 2,-0.2 -0.959 15.3-151.8-144.1 119.4 51.4 65.5 107.0 77 77 E Y > - 0 0 6 4,-2.1 3,-1.7 -2,-0.4 254,-0.3 -0.452 30.2-105.0 -88.5 162.3 48.5 65.5 104.5 78 78 E G T 3 S+ 0 0 35 252,-2.5 252,-0.2 1,-0.3 253,-0.2 0.704 118.3 57.8 -59.9 -30.8 48.1 67.0 101.1 79 79 E D T 3 S- 0 0 66 250,-2.1 -1,-0.3 251,-0.5 251,-0.1 0.340 122.9-103.7 -86.6 7.7 45.9 69.8 102.3 80 80 E G S < S+ 0 0 59 -3,-1.7 -2,-0.1 1,-0.3 250,-0.1 0.391 78.7 132.4 90.6 -1.6 48.7 70.8 104.7 81 81 E S + 0 0 4 248,-0.3 -4,-2.1 249,-0.1 -1,-0.3 -0.299 30.1 175.3 -77.9 169.6 47.2 69.5 107.9 82 82 E S E -L 76 0B 49 -6,-0.2 29,-2.0 2,-0.0 2,-0.3 -0.929 19.3-173.4-160.5 177.4 49.3 67.4 110.3 83 83 E A E -LM 75 110B 3 -8,-1.3 -8,-2.1 -2,-0.3 2,-0.3 -0.922 6.6-172.5-171.2 158.3 49.4 65.5 113.6 84 84 E S E +LM 74 109B 37 25,-1.9 24,-2.8 -2,-0.3 25,-1.5 -0.972 23.3 116.1-155.9 164.7 52.1 63.7 115.6 85 85 E G E -LM 73 107B 8 -12,-2.5 -12,-2.0 -2,-0.3 2,-0.3 -0.949 55.4 -48.9 170.9-148.0 52.3 61.6 118.8 86 86 E I E -LM 72 106B 31 20,-1.7 20,-2.2 -2,-0.3 -14,-0.3 -0.832 43.5-115.4-120.4 157.0 53.0 58.2 120.1 87 87 E L E + M 0 105B 0 -16,-3.1 -18,-0.8 -2,-0.3 2,-0.3 -0.459 37.3 163.1 -86.2 163.2 52.0 54.6 119.1 88 88 E A E -LM 68 104B 0 16,-1.6 16,-1.5 -20,-0.2 2,-0.4 -0.931 28.7-122.4-160.8-177.7 49.9 52.3 121.3 89 89 E K E +LM 67 103B 105 -22,-1.7 -22,-1.7 -2,-0.3 2,-0.3 -0.998 39.2 133.9-140.6 139.7 47.8 49.1 121.0 90 90 E D E - 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