==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-JUN-03 1UH9 . COMPND 2 MOLECULE: HIZOPUSPEPSIN I; . SOURCE 2 ORGANISM_SCIENTIFIC: RHIZOPUS MICROSPORUS VAR. CHINENSIS; . AUTHOR B.V.L.S.PRASAD,K.SUGUNA . 325 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13470.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 240 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 108 33.2 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 . 45 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 6.2 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 . 2 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 A A 0 0 113 0, 0.0 3,-0.1 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 160.3 23.0 47.7 111.6 2 2 A G > - 0 0 47 1,-0.2 3,-2.0 2,-0.1 2,-0.1 0.000 360.0 -67.3 -61.2 170.6 24.4 44.5 110.1 3 3 A V T 3 S+ 0 0 118 1,-0.3 93,-0.2 93,-0.1 -1,-0.2 -0.384 123.4 7.8 -62.3 130.8 27.8 43.0 110.9 4 4 A G T 3 S+ 0 0 0 91,-2.7 167,-2.6 1,-0.2 2,-0.5 0.518 97.7 135.2 75.4 4.2 30.6 45.2 109.7 5 5 A T E < -A 170 0A 19 -3,-2.0 -1,-0.2 90,-0.6 165,-0.2 -0.763 32.1-175.5 -92.2 125.4 28.1 47.9 108.8 6 6 A V E -A 169 0A 4 163,-3.1 163,-2.2 -2,-0.5 2,-0.1 -0.923 16.6-143.9-125.0 107.4 29.0 51.5 109.8 7 7 A P E -A 168 0A 75 0, 0.0 13,-0.5 0, 0.0 2,-0.3 -0.399 21.7-144.8 -65.4 143.2 26.5 54.3 109.2 8 8 A M E -F 19 0B 10 159,-2.9 2,-0.5 11,-0.1 159,-0.5 -0.760 4.4-137.1-111.7 158.4 28.2 57.5 108.2 9 9 A T E -F 18 0B 69 9,-2.5 9,-1.7 -2,-0.3 2,-0.6 -0.960 16.7-137.3-114.3 129.4 27.4 61.1 108.9 10 10 A D E -F 17 0B 23 -2,-0.5 2,-0.6 7,-0.2 7,-0.2 -0.783 19.0-147.3 -88.5 118.1 27.7 63.7 106.1 11 11 A Y E >> -F 16 0B 96 5,-2.8 4,-2.2 -2,-0.6 5,-0.9 -0.775 53.6 -40.8 -92.7 122.8 29.3 66.8 107.4 12 12 A G T 45S- 0 0 38 -2,-0.6 2,-1.7 1,-0.2 149,-0.0 -0.279 121.4 -14.4 63.4-148.8 28.2 70.1 105.9 13 13 A N T 45S- 0 0 92 1,-0.2 -1,-0.2 147,-0.1 -2,-0.1 -0.484 123.8 -57.9 -86.8 66.5 27.7 70.2 102.1 14 14 A D T 45S+ 0 0 15 -2,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.870 94.9 142.1 63.9 38.0 29.4 66.9 101.4 15 15 A I T <5S- 0 0 51 -4,-2.2 2,-0.3 1,-0.3 286,-0.2 0.943 71.4 -28.4 -73.2 -51.0 32.7 68.2 103.0 16 16 A E E < -F 11 0B 33 -5,-0.9 -5,-2.8 285,-0.1 2,-0.4 -0.973 56.0-129.3-160.0 165.0 33.6 64.9 104.6 17 17 A Y E -F 10 0B 5 202,-0.3 17,-1.2 -2,-0.3 2,-0.3 -0.988 23.2-177.3-128.3 129.0 32.0 61.7 106.0 18 18 A Y E -FG 9 33B 37 -9,-1.7 -9,-2.5 -2,-0.4 2,-0.3 -0.906 6.3-161.9-126.3 153.5 32.7 60.2 109.4 19 19 A G E -FG 8 32B 2 13,-2.3 13,-2.5 -2,-0.3 2,-0.3 -0.925 28.6 -99.1-131.3 157.3 31.6 57.1 111.3 20 20 A Q E - G 0 31B 106 -13,-0.5 75,-0.4 -2,-0.3 2,-0.4 -0.585 36.2-179.6 -79.9 133.8 31.6 55.9 114.9 21 21 A V E - G 0 30B 0 9,-2.5 9,-3.1 -2,-0.3 2,-0.5 -0.997 19.9-139.5-131.9 132.8 34.3 53.6 116.0 22 22 A T E -HG 93 29B 36 71,-1.8 71,-3.5 -2,-0.4 2,-0.4 -0.842 22.6-174.1 -98.3 127.7 34.6 52.1 119.5 23 23 A I E > +HG 92 28B 2 5,-2.5 5,-2.1 -2,-0.5 69,-0.2 -0.967 40.3 2.3-125.0 135.8 38.1 52.0 121.0 24 24 A G T 5S- 0 0 9 67,-2.7 39,-0.1 -2,-0.4 66,-0.1 -0.239 89.6 -36.3 91.5-179.8 39.3 50.5 124.3 25 25 A T T 5S- 0 0 47 1,-0.2 39,-2.2 2,-0.1 40,-0.3 -0.988 135.9 -0.5-134.0 122.9 37.7 48.5 127.2 26 26 A P T 5S- 0 0 124 0, 0.0 -1,-0.2 0, 0.0 37,-0.1 -0.975 120.9-151.5 -62.2 -20.3 35.0 49.2 128.1 27 27 A G T 5 - 0 0 29 35,-0.4 2,-0.3 -5,-0.0 -3,-0.2 0.126 15.5-120.6 101.9 146.3 35.6 51.6 125.3 28 28 A K E < -G 23 0B 67 -5,-2.1 -5,-2.5 -7,-0.0 2,-0.5 -0.883 27.2-117.6-119.0 151.8 34.7 55.1 124.1 29 29 A K E -G 22 0B 124 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.2 -0.781 32.1-171.3 -93.7 131.2 33.0 56.0 120.8 30 30 A F E -G 21 0B 0 -9,-3.1 -9,-2.5 -2,-0.5 2,-0.8 -0.928 22.8-131.8-122.7 147.4 35.0 58.2 118.4 31 31 A N E -G 20 0B 42 -2,-0.3 89,-3.6 -11,-0.2 90,-0.7 -0.873 34.8-176.4 -98.7 110.7 34.0 59.9 115.2 32 32 A L E -Gi 19 121B 0 -13,-2.5 -13,-2.3 -2,-0.8 2,-0.5 -0.864 29.0-124.1-114.4 146.0 36.6 59.1 112.6 33 33 A D E -Gi 18 122B 13 88,-2.2 90,-2.7 -2,-0.4 2,-0.8 -0.734 27.2-135.5 -82.4 121.5 37.1 60.3 109.0 34 34 A F E - i 0 123B 1 -17,-1.2 2,-0.6 -2,-0.5 -17,-0.2 -0.744 30.1-174.5 -84.1 111.3 37.3 57.2 106.8 35 35 A D E > - i 0 124B 10 88,-2.7 90,-3.2 -2,-0.8 3,-1.2 -0.895 29.1-178.7-118.3 107.1 40.2 58.0 104.5 36 36 A T T 3 S+ 0 0 0 -2,-0.6 159,-0.4 1,-0.2 91,-0.2 0.473 84.3 70.8 -77.9 1.1 41.3 55.8 101.6 37 37 A G T 3 S+ 0 0 15 89,-0.1 2,-0.3 157,-0.1 -1,-0.2 0.459 103.4 31.9 -95.6 -2.4 44.0 58.4 101.0 38 38 A S < - 0 0 8 -3,-1.2 88,-2.7 85,-0.1 87,-0.4 -0.911 61.0-145.5-144.8 172.2 46.1 57.5 104.0 39 39 A S + 0 0 3 91,-0.4 2,-0.4 -2,-0.3 92,-0.1 0.145 61.4 100.4-132.9 23.5 46.9 54.5 106.2 40 40 A D - 0 0 2 91,-0.1 2,-0.8 90,-0.1 84,-0.3 -0.904 54.7-149.4-112.4 138.9 47.3 55.6 109.8 41 41 A L + 0 0 3 -2,-0.4 64,-2.5 62,-0.3 2,-0.3 -0.884 34.4 160.3-106.0 101.6 44.7 55.3 112.5 42 42 A W E -jK 105 122B 0 80,-1.3 80,-1.9 -2,-0.8 2,-0.3 -0.924 15.4-176.6-124.4 152.0 45.2 58.2 114.8 43 43 A I E -jK 106 121B 0 62,-2.2 64,-2.4 -2,-0.3 78,-0.2 -0.979 35.6 -94.8-143.6 153.9 42.9 59.9 117.4 44 44 A A E -j 107 0B 0 76,-2.6 14,-2.7 -2,-0.3 2,-0.3 -0.361 49.1-171.8 -63.5 148.4 43.0 62.9 119.7 45 45 A S B > -n 58 0C 0 62,-0.6 3,-1.9 12,-0.3 14,-0.2 -0.909 41.2-102.1-140.5 168.7 44.1 61.8 123.2 46 46 A T T 3 S+ 0 0 75 12,-2.2 13,-0.1 -2,-0.3 62,-0.1 0.474 117.6 67.4 -71.9 1.1 44.3 63.3 126.7 47 47 A L T 3 S+ 0 0 75 60,-0.3 -1,-0.3 11,-0.3 2,-0.2 0.512 78.6 107.8 -93.7 -9.2 48.1 63.6 126.1 48 48 A a < - 0 0 19 -3,-1.9 61,-0.2 59,-0.2 60,-0.1 -0.511 49.0-170.5 -75.4 135.1 47.3 66.3 123.4 49 49 A T S S+ 0 0 106 59,-2.3 60,-0.1 -2,-0.2 -1,-0.1 0.427 83.3 31.1-105.6 -1.3 48.2 69.9 124.3 50 50 A N S S+ 0 0 57 58,-0.3 65,-0.1 2,-0.1 -1,-0.1 0.044 86.6 125.2-144.5 29.6 46.5 71.8 121.4 51 51 A a - 0 0 23 -6,-0.1 2,-0.2 57,-0.1 64,-0.1 -0.427 66.9 -87.3 -87.3 165.2 43.5 69.7 120.5 52 52 A G > - 0 0 11 1,-0.1 3,-1.0 -2,-0.1 -1,-0.1 -0.478 19.6-137.8 -76.9 142.8 39.9 70.9 120.4 53 53 A S T 3 S+ 0 0 127 1,-0.2 -1,-0.1 -2,-0.2 4,-0.1 0.647 105.6 60.3 -70.7 -13.5 37.7 70.9 123.5 54 54 A R T 3 S+ 0 0 73 61,-0.4 -1,-0.2 63,-0.1 2,-0.1 0.680 86.6 92.9 -86.8 -19.0 35.0 69.6 121.2 55 55 A Q S < S- 0 0 12 -3,-1.0 2,-0.5 60,-0.2 65,-0.1 -0.457 80.6-120.5 -76.5 146.6 36.8 66.4 120.2 56 56 A T - 0 0 54 -2,-0.1 2,-0.4 -25,-0.1 -12,-0.3 -0.763 34.8-147.9 -84.4 127.6 36.4 63.2 122.2 57 57 A K - 0 0 56 -2,-0.5 -12,-0.3 -4,-0.1 2,-0.2 -0.857 9.8-123.9-108.1 133.6 39.8 62.2 123.5 58 58 A Y B -n 45 0C 3 -14,-2.7 -12,-2.2 -2,-0.4 -11,-0.3 -0.518 24.0-158.6 -69.7 131.1 41.2 58.7 124.0 59 59 A D > - 0 0 31 -2,-0.2 3,-1.6 -14,-0.2 4,-0.2 -0.936 9.3-160.3-117.2 107.0 42.3 58.3 127.7 60 60 A P G > S+ 0 0 12 0, 0.0 3,-1.7 0, 0.0 6,-0.3 0.877 91.8 59.9 -51.5 -41.3 44.8 55.4 128.2 61 61 A N G 3 S+ 0 0 153 1,-0.3 5,-0.0 3,-0.0 -2,-0.0 0.733 100.2 56.6 -62.7 -22.0 44.0 55.3 131.9 62 62 A Q G < S+ 0 0 116 -3,-1.6 2,-0.5 1,-0.1 -35,-0.4 0.343 94.7 75.7 -93.9 7.9 40.3 54.5 131.1 63 63 A S X - 0 0 12 -3,-1.7 3,-1.4 -4,-0.2 -1,-0.1 -0.968 59.2-161.9-123.8 119.4 41.1 51.4 129.0 64 64 A S T 3 S+ 0 0 101 -39,-2.2 -1,-0.1 -2,-0.5 -3,-0.0 0.607 94.0 54.9 -72.0 -10.9 42.0 48.1 130.7 65 65 A T T 3 S+ 0 0 49 -40,-0.3 -1,-0.3 26,-0.1 2,-0.2 0.201 77.1 126.4-107.2 15.4 43.4 46.9 127.3 66 66 A Y < - 0 0 67 -3,-1.4 2,-0.4 -6,-0.3 24,-0.2 -0.519 37.9-170.6 -73.5 138.6 45.8 49.8 126.7 67 67 A Q E -L 89 0B 112 22,-1.7 22,-1.5 -2,-0.2 -2,-0.0 -0.977 19.4-126.1-135.8 120.6 49.4 48.8 126.0 68 68 A A E -L 88 0B 57 -2,-0.4 2,-0.4 20,-0.2 20,-0.2 -0.217 20.4-163.6 -63.5 152.8 52.2 51.3 125.9 69 69 A D E - 0 0 44 18,-0.7 18,-0.2 2,-0.1 -1,-0.0 -0.997 18.3-143.1-139.9 132.6 54.5 51.5 122.8 70 70 A G E + 0 0 85 -2,-0.4 2,-0.2 16,-0.1 18,-0.1 0.401 69.6 99.5 -80.1 5.6 57.9 53.3 122.8 71 71 A R E - 0 0 103 62,-0.0 16,-2.8 16,-0.0 2,-0.3 -0.624 57.1-149.7 -96.1 152.6 57.5 54.6 119.3 72 72 A T E -L 86 0B 105 14,-0.3 2,-0.3 -2,-0.2 14,-0.3 -0.752 8.9-157.0-113.7 162.1 56.5 58.1 118.1 73 73 A W E -L 85 0B 10 12,-2.3 12,-2.4 -2,-0.3 2,-0.3 -0.958 10.3-175.9-139.4 157.7 54.7 59.2 114.9 74 74 A S E -L 84 0B 87 -2,-0.3 2,-0.4 10,-0.2 10,-0.2 -0.962 8.5-174.3-153.1 132.6 54.3 62.3 112.8 75 75 A I E -L 83 0B 17 8,-3.0 8,-1.9 -2,-0.3 2,-0.4 -0.985 11.2-169.0-136.3 146.3 52.2 62.8 109.7 76 76 A S E -L 82 0B 94 -2,-0.4 6,-0.2 6,-0.2 2,-0.1 -0.974 16.2-153.8-134.4 117.2 51.7 65.6 107.2 77 77 A Y > - 0 0 34 4,-2.3 3,-1.6 -2,-0.4 -39,-0.0 -0.381 29.8-104.6 -87.9 168.1 48.8 65.5 104.8 78 78 A G T 3 S+ 0 0 74 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 0.879 116.4 61.3 -58.0 -42.5 48.5 67.1 101.3 79 79 A D T 3 S- 0 0 131 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.324 121.9-104.2 -70.6 11.7 46.2 69.9 102.5 80 80 A G S < S+ 0 0 57 -3,-1.6 -2,-0.1 1,-0.3 -1,-0.1 0.202 80.2 131.3 87.9 -17.6 49.0 71.0 104.8 81 81 A S + 0 0 6 -5,-0.1 -4,-2.3 30,-0.1 2,-0.3 -0.200 32.0 177.7 -65.9 161.4 47.4 69.7 108.0 82 82 A S E -L 76 0B 51 -6,-0.2 29,-2.4 -3,-0.1 2,-0.3 -0.970 17.7-176.2-158.2 171.6 49.5 67.6 110.4 83 83 A A E -LM 75 110B 3 -8,-1.9 -8,-3.0 -2,-0.3 2,-0.3 -0.965 5.2-174.4-167.4 158.7 49.6 65.7 113.7 84 84 A S E +LM 74 109B 38 25,-2.4 24,-3.4 -2,-0.3 25,-1.8 -0.984 20.7 115.6-157.6 162.0 52.1 63.8 115.8 85 85 A G E -LM 73 107B 7 -12,-2.4 -12,-2.3 -2,-0.3 2,-0.3 -0.912 54.8 -47.4 173.4-144.0 52.3 61.7 119.0 86 86 A I E -LM 72 106B 38 20,-1.8 20,-2.4 -2,-0.3 -14,-0.3 -0.868 45.0-115.6-123.9 156.8 53.0 58.3 120.3 87 87 A L E + M 0 105B 0 -16,-2.8 -18,-0.7 -2,-0.3 2,-0.3 -0.439 35.2 168.1 -86.2 164.9 51.9 54.8 119.3 88 88 A A E -LM 68 104B 0 16,-1.8 16,-2.2 -20,-0.2 2,-0.4 -0.930 26.4-124.1-161.3 177.0 49.9 52.5 121.4 89 89 A K E +LM 67 103B 103 -22,-1.5 -22,-1.7 -2,-0.3 2,-0.3 -0.999 40.1 131.2-138.2 136.0 47.9 49.3 121.2 90 90 A D E - 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