==== 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 03-AUG-89 6APR . 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) . 13135.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 248 75.2 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 . 110 33.3 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 . 1 0.3 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 . 44 13.3 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 2 6 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 0 119 0, 0.0 3,-0.1 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 131.2 22.9 47.6 111.6 2 2 E G > - 0 0 46 1,-0.2 3,-1.7 2,-0.1 2,-0.1 0.163 360.0 -63.8 -56.0 171.8 24.3 44.4 110.0 3 3 E V T 3 S+ 0 0 119 1,-0.3 93,-0.2 93,-0.1 -1,-0.2 -0.491 124.4 4.7 -67.5 134.7 27.6 42.9 110.9 4 4 E G T 3 S+ 0 0 0 91,-2.9 167,-3.2 1,-0.2 2,-0.5 0.631 96.4 140.0 64.8 19.8 30.5 45.2 110.0 5 5 E T E < -A 170 0A 18 -3,-1.7 165,-0.3 90,-0.6 -1,-0.2 -0.861 31.5-171.1 -95.9 122.8 28.0 47.9 108.9 6 6 E V E -A 169 0A 4 163,-4.4 163,-2.4 -2,-0.5 2,-0.2 -0.944 13.8-145.7-122.0 107.0 29.0 51.4 109.8 7 7 E P E -A 168 0A 77 0, 0.0 13,-0.5 0, 0.0 161,-0.3 -0.512 23.2-142.5 -68.6 130.8 26.4 54.2 109.3 8 8 E M E -F 19 0B 11 159,-3.4 2,-0.5 -2,-0.2 159,-0.5 -0.651 5.9-137.8-101.3 158.5 28.2 57.5 108.3 9 9 E T E -F 18 0B 68 9,-2.5 9,-1.8 -2,-0.2 2,-0.5 -0.971 16.9-140.4-113.7 121.0 27.5 61.1 109.1 10 10 E D E -F 17 0B 23 -2,-0.5 2,-0.6 7,-0.2 7,-0.2 -0.713 18.1-148.0 -82.1 124.1 27.7 63.6 106.2 11 11 E Y E >> -F 16 0B 90 5,-3.7 4,-2.3 -2,-0.5 5,-0.9 -0.875 53.3 -39.3-101.8 119.3 29.4 66.8 107.5 12 12 E G T 45S- 0 0 43 -2,-0.6 2,-1.9 2,-0.2 149,-0.0 -0.309 122.6 -14.9 66.5-154.0 28.4 70.1 105.9 13 13 E N T 45S- 0 0 89 1,-0.2 -1,-0.2 148,-0.1 -2,-0.0 -0.539 125.3 -56.5 -83.1 66.4 27.7 70.1 102.2 14 14 E D T 45S+ 0 0 14 -2,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.863 94.5 143.0 63.2 39.2 29.5 66.8 101.6 15 15 E I T <5S- 0 0 39 -4,-2.3 2,-0.3 1,-0.4 286,-0.2 0.922 70.9 -31.0 -72.0 -48.0 32.7 68.0 103.2 16 16 E E E < -F 11 0B 6 -5,-0.9 -5,-3.7 285,-0.1 -1,-0.4 -0.931 54.1-130.0-165.9 166.5 33.5 64.7 104.8 17 17 E Y E +F 10 0B 5 -2,-0.3 17,-1.2 -7,-0.2 2,-0.3 -0.995 22.6 179.5-132.4 128.8 31.9 61.6 106.3 18 18 E Y E -FG 9 33B 37 -9,-1.8 -9,-2.5 -2,-0.4 2,-0.3 -0.890 6.1-165.5-131.5 160.2 32.7 60.0 109.6 19 19 E G E -FG 8 32B 2 13,-2.3 13,-2.4 -2,-0.3 2,-0.4 -0.895 30.7 -90.4-139.2 167.2 31.4 57.0 111.6 20 20 E Q E - G 0 31B 91 -13,-0.5 75,-0.4 -2,-0.3 2,-0.4 -0.642 35.0-178.7 -89.2 139.8 31.7 55.7 115.1 21 21 E V E - G 0 30B 0 9,-2.3 9,-3.0 -2,-0.4 2,-0.5 -0.970 19.6-140.8-131.1 139.0 34.4 53.4 116.3 22 22 E T E -HG 93 29B 29 71,-1.7 71,-3.6 -2,-0.4 2,-0.4 -0.953 22.8-175.3-106.2 121.0 34.7 51.9 119.8 23 23 E I E > +HG 92 28B 2 5,-2.2 5,-1.6 -2,-0.5 69,-0.2 -0.960 41.6 6.8-122.0 137.5 38.2 51.8 121.2 24 24 E G T 5S- 0 0 11 67,-2.5 39,-0.1 -2,-0.4 66,-0.1 -0.153 89.6 -40.7 90.0 178.5 39.4 50.3 124.5 25 25 E T T 5S+ 0 0 48 1,-0.3 39,-2.6 2,-0.1 40,-0.3 -0.979 135.5 3.0-133.6 119.4 37.9 48.3 127.3 26 26 E P T 5S- 0 0 122 0, 0.0 -1,-0.3 0, 0.0 37,-0.1 -0.978 119.8-149.1 -64.8 -14.8 35.2 48.9 128.3 27 27 E G T 5 - 0 0 35 35,-0.4 2,-0.3 -5,-0.0 -3,-0.2 0.114 15.2-127.6 98.0 151.4 35.6 51.4 125.4 28 28 E K E < -G 23 0B 72 -5,-1.6 -5,-2.2 -7,-0.0 2,-0.4 -0.924 27.7-111.6-129.3 147.4 34.5 54.8 124.2 29 29 E K E -G 22 0B 108 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.2 -0.691 31.8-170.1 -87.6 135.9 33.0 55.9 120.9 30 30 E F E -G 21 0B 0 -9,-3.0 -9,-2.3 -2,-0.4 2,-0.7 -0.942 21.1-136.5-126.3 142.6 35.1 58.0 118.5 31 31 E N E -G 20 0B 40 -2,-0.4 89,-3.9 -11,-0.2 90,-0.6 -0.957 35.0-178.8-101.1 110.7 33.9 59.8 115.4 32 32 E L E -Gi 19 121B 0 -13,-2.4 -13,-2.3 -2,-0.7 2,-0.5 -0.895 30.0-122.7-115.3 147.8 36.6 59.0 112.9 33 33 E D E -Gi 18 122B 0 88,-1.7 90,-2.4 -2,-0.3 2,-0.9 -0.756 27.9-131.7 -86.8 124.7 36.9 60.2 109.2 34 34 E F E - i 0 123B 1 -17,-1.2 2,-0.6 -2,-0.5 90,-0.2 -0.733 31.7-170.8 -85.0 106.3 37.2 57.1 107.0 35 35 E D E > + i 0 124B 0 88,-2.9 90,-2.9 -2,-0.9 3,-1.1 -0.874 30.8 179.9-113.9 112.5 40.1 57.8 104.7 36 36 E T T 3 S+ 0 0 0 -2,-0.6 159,-0.5 1,-0.2 91,-0.2 0.418 85.0 65.5 -80.1 2.9 41.2 55.8 101.6 37 37 E G T 3 S+ 0 0 0 89,-0.1 293,-1.9 157,-0.1 2,-0.3 0.409 105.8 39.4-103.0 0.9 44.1 58.3 101.1 38 38 E S < - 0 0 0 -3,-1.1 88,-1.5 291,-0.2 87,-0.5 -0.932 58.5-153.2-144.9 164.0 45.9 57.4 104.2 39 39 E S + 0 0 3 91,-0.5 2,-0.4 -2,-0.3 -3,-0.1 0.053 59.5 103.6-128.3 22.6 46.7 54.3 106.3 40 40 E D - 0 0 1 91,-0.1 2,-0.8 98,-0.1 64,-0.1 -0.918 54.3-150.8-111.6 137.2 47.2 55.6 109.9 41 41 E L + 0 0 4 -2,-0.4 64,-2.6 62,-0.3 2,-0.3 -0.882 33.6 163.4-101.4 101.7 44.6 55.1 112.6 42 42 E W E -jK 105 122B 0 80,-1.2 80,-1.6 -2,-0.8 2,-0.3 -0.897 15.3-174.3-123.3 153.9 45.0 58.1 115.0 43 43 E I E -jK 106 121B 0 62,-2.1 64,-2.7 -2,-0.3 78,-0.2 -0.987 34.9 -97.1-146.1 151.5 42.9 59.7 117.7 44 44 E A E -j 107 0B 0 76,-2.7 14,-2.5 12,-0.3 2,-0.3 -0.381 50.1-169.8 -60.0 139.2 42.9 62.7 120.0 45 45 E S B > -n 58 0C 0 62,-0.7 3,-1.2 12,-0.3 14,-0.2 -0.803 40.1-106.1-132.4 175.2 44.2 61.6 123.4 46 46 E T T 3 S+ 0 0 74 12,-1.9 13,-0.1 -2,-0.3 62,-0.1 0.330 118.0 67.3 -83.2 10.1 44.5 63.0 127.0 47 47 E L T 3 S+ 0 0 76 60,-0.4 -1,-0.3 11,-0.2 2,-0.2 0.459 79.9 111.7 -99.2 -13.8 48.2 63.4 126.2 48 48 E a < - 0 0 21 -3,-1.2 61,-0.2 59,-0.2 3,-0.2 -0.473 45.0-175.2 -68.3 128.3 47.2 66.1 123.6 49 49 E T S S+ 0 0 108 59,-2.7 60,-0.2 -2,-0.2 -1,-0.1 0.436 83.0 32.6-106.9 -1.8 48.2 69.7 124.3 50 50 E N S S+ 0 0 56 58,-0.4 2,-0.2 2,-0.1 65,-0.2 -0.124 88.0 134.3-141.7 33.9 46.5 71.6 121.4 51 51 E a - 0 0 25 -3,-0.2 61,-0.1 57,-0.1 64,-0.1 -0.480 63.0 -93.5 -89.6 155.8 43.4 69.4 120.9 52 52 E G - 0 0 9 -2,-0.2 3,-0.1 1,-0.2 -1,-0.1 -0.358 21.3-138.6 -63.5 145.1 39.8 70.6 120.5 53 53 E S S S+ 0 0 130 1,-0.2 -1,-0.2 62,-0.1 63,-0.1 0.651 106.5 57.0 -79.3 -15.7 37.8 70.8 123.7 54 54 E G S S+ 0 0 71 61,-0.4 -1,-0.2 63,-0.1 62,-0.1 0.805 86.8 99.1 -82.9 -28.4 34.9 69.3 121.6 55 55 E Q S S- 0 0 15 60,-0.3 2,-0.4 -3,-0.1 65,-0.1 -0.242 77.9-121.6 -63.2 145.9 36.9 66.2 120.6 56 56 E T - 0 0 56 -25,-0.1 2,-0.5 -28,-0.0 -12,-0.3 -0.756 34.8-147.3 -86.2 134.4 36.4 62.9 122.4 57 57 E K - 0 0 48 -2,-0.4 2,-0.3 -14,-0.1 -12,-0.3 -0.949 8.5-126.8-115.8 132.2 39.8 61.9 123.8 58 58 E Y B -n 45 0C 5 -14,-2.5 -12,-1.9 -2,-0.5 -11,-0.2 -0.505 23.1-158.2 -72.4 128.6 41.2 58.5 124.3 59 59 E D > - 0 0 33 -2,-0.3 3,-1.9 -14,-0.2 4,-0.2 -0.910 11.1-161.2-116.1 102.4 42.4 57.9 127.8 60 60 E P G > S+ 0 0 13 0, 0.0 3,-2.2 0, 0.0 6,-0.3 0.902 91.5 60.2 -44.4 -50.7 45.0 55.2 128.4 61 61 E N G 3 S+ 0 0 153 1,-0.3 5,-0.0 3,-0.1 -2,-0.0 0.713 103.3 51.5 -53.7 -27.2 44.2 55.1 132.1 62 62 E Q G < S+ 0 0 124 -3,-1.9 2,-0.5 1,-0.0 -35,-0.4 0.252 95.1 75.9 -98.5 9.1 40.5 54.2 131.4 63 63 E S X - 0 0 12 -3,-2.2 3,-1.2 -4,-0.2 -39,-0.1 -0.987 60.2-161.8-120.0 117.6 41.1 51.2 129.1 64 64 E S T 3 S+ 0 0 102 -39,-2.6 -1,-0.1 -2,-0.5 -3,-0.1 0.526 92.1 56.2 -75.2 -3.4 42.2 48.0 130.8 65 65 E T T 3 S+ 0 0 50 -40,-0.3 -1,-0.2 -5,-0.1 2,-0.2 0.151 76.7 122.6-111.3 15.5 43.4 46.7 127.4 66 66 E Y < - 0 0 68 -3,-1.2 2,-0.4 -6,-0.3 24,-0.2 -0.579 41.3-168.6 -76.1 143.4 45.8 49.6 126.6 67 67 E Q E -L 89 0B 116 22,-1.7 22,-1.7 -2,-0.2 -2,-0.0 -0.995 20.0-122.6-137.4 125.7 49.4 48.5 126.0 68 68 E A E -L 88 0B 58 -2,-0.4 2,-0.3 20,-0.2 20,-0.2 -0.278 23.1-165.3 -63.6 154.7 52.3 51.0 125.9 69 69 E D E - 0 0 46 18,-0.7 18,-0.2 2,-0.1 -1,-0.0 -0.996 19.9-142.9-144.8 133.3 54.5 51.3 122.9 70 70 E G E + 0 0 83 -2,-0.3 2,-0.3 16,-0.1 18,-0.1 0.432 68.7 102.5 -78.5 3.5 57.9 53.1 122.7 71 71 E R E - 0 0 98 62,-0.0 16,-2.7 16,-0.0 2,-0.3 -0.604 54.3-153.6 -96.6 155.5 57.4 54.4 119.1 72 72 E T E -L 86 0B 105 14,-0.3 2,-0.3 -2,-0.3 14,-0.3 -0.768 10.0-163.6-114.8 164.4 56.4 57.8 118.0 73 73 E W E -L 85 0B 10 12,-1.9 12,-2.4 -2,-0.3 2,-0.3 -0.977 10.9-177.0-149.2 159.7 54.6 59.0 114.8 74 74 E S E -L 84 0B 84 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.973 7.5-172.4-159.1 137.7 54.0 62.0 112.7 75 75 E I E -L 83 0B 9 8,-2.4 8,-1.4 -2,-0.3 2,-0.4 -0.948 11.8-160.0-135.8 157.1 51.9 62.6 109.6 76 76 E S E -L 82 0B 65 -2,-0.3 6,-0.2 6,-0.2 255,-0.1 -0.962 15.6-153.9-137.5 114.4 51.4 65.4 107.1 77 77 E Y > - 0 0 3 4,-2.2 3,-1.1 -2,-0.4 253,-0.3 -0.281 30.5-104.8 -83.9 173.2 48.2 65.4 104.9 78 78 E G T 3 S+ 0 0 30 251,-3.2 251,-0.2 250,-0.7 252,-0.1 0.603 115.9 60.9 -74.4 -14.6 47.9 67.0 101.5 79 79 E D T 3 S- 0 0 58 249,-1.2 -1,-0.2 250,-0.3 250,-0.1 0.178 123.0-100.9 -96.5 13.2 45.8 70.0 102.7 80 80 E G S < S+ 0 0 61 -3,-1.1 -2,-0.1 1,-0.3 2,-0.1 0.402 82.2 129.9 85.2 -1.1 48.6 71.0 105.0 81 81 E S + 0 0 3 247,-0.2 -4,-2.2 248,-0.1 2,-0.3 -0.344 31.2 174.2 -81.0 168.9 47.1 69.5 108.2 82 82 E S E -L 76 0B 46 -6,-0.2 29,-2.4 -3,-0.1 2,-0.3 -0.943 18.3-167.3-160.2 177.9 49.2 67.2 110.5 83 83 E A E -LM 75 110B 4 -8,-1.4 -8,-2.4 -2,-0.3 2,-0.3 -0.940 6.9-176.2-168.4 158.7 49.3 65.3 113.8 84 84 E S E +LM 74 109B 39 25,-2.2 24,-3.1 -2,-0.3 25,-1.6 -0.970 22.3 111.2-159.1 163.1 51.9 63.6 115.9 85 85 E G E -LM 73 107B 6 -12,-2.4 -12,-1.9 -2,-0.3 2,-0.3 -0.951 56.9 -45.0 168.9-144.9 52.2 61.5 119.0 86 86 E I E -LM 72 106B 33 20,-2.2 20,-3.1 -2,-0.3 -14,-0.3 -0.898 42.6-117.8-126.7 153.9 52.9 58.1 120.3 87 87 E L E + M 0 105B 0 -16,-2.7 -18,-0.7 -2,-0.3 2,-0.3 -0.320 35.6 164.2 -83.1 161.9 51.8 54.5 119.3 88 88 E A E -LM 68 104B 0 16,-1.7 16,-1.7 -20,-0.2 2,-0.4 -0.952 28.7-121.8-162.4 178.7 49.9 52.2 121.6 89 89 E K E +LM 67 103B 105 -22,-1.7 -22,-1.7 -2,-0.3 2,-0.3 -1.000 41.7 130.1-137.9 140.2 47.9 49.0 121.3 90 90 E D E - 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