==== 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 28-APR-93 1HPG . COMPND 2 MOLECULE: GLUTAMIC ACID SPECIFIC PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES GRISEUS; . AUTHOR V.L.NIENABER,J.J.BIRKTOFT . 191 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7271.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 127 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 79 41.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 7 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 0 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 . 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 0 0 PARALLEL BRIDGES PER LADDER . 2 3 3 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 0 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 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 16 A V 0 0 43 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 150.2 12.7 -3.8 14.4 2 17 A L > - 0 0 49 1,-0.1 3,-2.3 74,-0.1 14,-0.4 -0.645 360.0 -78.9 -94.6 163.3 15.7 -5.9 15.3 3 18 A G B 3 S+a 78 0A 0 74,-2.7 76,-3.0 1,-0.3 14,-0.2 -0.371 123.3 25.4 -58.3 139.6 19.2 -4.8 14.7 4 19 A G T 3 S+ 0 0 0 12,-3.1 -1,-0.3 1,-0.3 104,-0.1 0.288 98.3 131.1 85.1 -8.6 20.1 -5.4 11.0 5 29 A G < - 0 0 6 -3,-2.3 11,-2.3 1,-0.1 -1,-0.3 -0.369 63.9 -95.2 -79.9 154.4 16.4 -5.1 10.1 6 30 A A E -C 15 0B 23 9,-0.2 2,-0.3 98,-0.1 9,-0.3 -0.380 37.5-176.6 -68.0 141.3 14.9 -3.0 7.4 7 31 A I E -C 14 0B 0 7,-2.5 7,-3.2 -2,-0.1 2,-0.4 -0.971 9.9-152.4-133.8 151.9 13.5 0.5 8.1 8 32 A Y E +CD 13 42B 60 34,-2.4 34,-2.4 -2,-0.3 2,-0.3 -0.981 25.3 145.6-131.6 133.3 11.8 2.8 5.6 9 33 A G E > +C 12 0B 5 3,-2.1 3,-2.3 -2,-0.4 32,-0.1 -0.944 67.3 17.0-162.3 147.3 11.5 6.6 5.4 10 34 A G T 3 S- 0 0 53 30,-0.3 3,-0.1 -2,-0.3 31,-0.1 0.670 129.4 -64.5 60.3 20.4 11.4 9.1 2.6 11 39 A G T 3 S+ 0 0 81 1,-0.3 2,-0.3 34,-0.2 -1,-0.3 0.683 114.9 110.7 74.1 17.3 10.5 6.3 0.2 12 40 A S E < -C 9 0B 50 -3,-2.3 -3,-2.1 22,-0.1 2,-0.5 -0.872 63.6-129.0-120.4 155.8 14.0 4.7 0.9 13 41 A R E +C 8 0B 91 -2,-0.3 -5,-0.2 -5,-0.2 2,-0.2 -0.882 33.5 157.5-102.5 129.3 15.1 1.5 2.7 14 42 A a E -C 7 0B 7 -7,-3.2 -7,-2.5 -2,-0.5 2,-0.3 -0.665 33.5-116.1-125.7-165.0 17.8 1.6 5.3 15 43 A S E -C 6 0B 0 128,-2.7 16,-0.5 -9,-0.3 2,-0.3 -0.928 18.6-122.1-134.3 150.5 18.6 -0.8 8.2 16 44 A A - 0 0 1 -11,-2.3 -12,-3.1 -14,-0.4 130,-0.5 -0.690 15.3-159.3 -86.7 152.4 18.6 -0.3 12.0 17 45 A A - 0 0 0 12,-2.8 2,-0.3 1,-0.3 129,-0.3 0.884 61.8 -17.3 -93.9 -67.4 21.8 -1.0 14.0 18 46 A F E -E 29 0B 5 11,-0.7 11,-2.2 -15,-0.2 2,-0.4 -0.993 56.2-117.3-146.7 144.9 20.8 -1.6 17.6 19 47 A N E -E 28 0B 4 -2,-0.3 168,-0.7 9,-0.2 9,-0.3 -0.678 43.4-178.3 -76.0 134.3 17.9 -1.1 20.0 20 48 A V E -EF 27 186B 0 7,-2.9 7,-2.7 -2,-0.4 2,-0.3 -0.815 10.4-151.3-134.5 168.8 19.1 1.3 22.8 21 48AA T E +EF 26 185B 19 164,-2.2 164,-2.2 -2,-0.3 2,-0.3 -0.971 18.7 165.0-148.4 149.7 17.5 2.8 25.9 22 48BA K E > S+E 25 0B 71 3,-1.4 3,-2.9 -2,-0.3 162,-0.1 -0.904 76.4 9.3-155.7 146.8 17.5 5.8 28.3 23 48CA G T 3 S- 0 0 91 1,-0.3 3,-0.1 -2,-0.3 161,-0.0 0.762 127.9 -63.6 56.8 27.1 15.0 6.8 30.9 24 48DA G T 3 S+ 0 0 74 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.532 111.7 118.5 74.5 5.7 13.1 3.5 30.5 25 49 A A E < -E 22 0B 38 -3,-2.9 -3,-1.4 48,-0.0 2,-0.4 -0.710 59.9-126.5-103.7 158.9 12.3 4.4 26.9 26 50 A R E +E 21 0B 75 -2,-0.2 42,-1.8 -5,-0.2 2,-0.3 -0.816 32.2 161.5-110.2 140.1 13.3 2.5 23.7 27 51 A Y E -EG 20 67B 23 -7,-2.7 -7,-2.9 -2,-0.4 2,-0.4 -0.904 25.9-139.2-141.5 165.9 15.1 3.9 20.7 28 52 A F E -EG 19 66B 0 38,-2.4 38,-2.8 -2,-0.3 2,-0.3 -0.989 13.1-143.0-129.4 144.5 17.1 2.5 17.8 29 53 A V E +EG 18 65B 0 -11,-2.2 -12,-2.8 -2,-0.4 -11,-0.7 -0.803 29.4 156.3 -98.6 153.4 20.3 4.0 16.3 30 54 A T E - G 0 64B 0 34,-2.2 34,-1.6 -2,-0.3 2,-0.2 -0.818 48.4 -47.4-156.4-173.1 21.0 3.9 12.5 31 55 A A >> - 0 0 0 -16,-0.5 4,-2.2 -2,-0.2 3,-1.2 -0.537 39.2-136.1 -74.9 140.4 23.1 5.9 10.0 32 56 A G H 3> S+ 0 0 0 25,-0.4 4,-2.5 1,-0.3 26,-0.2 0.848 106.1 59.7 -62.0 -34.7 22.9 9.7 9.9 33 57 A H H 34 S+ 0 0 24 24,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.737 108.9 47.5 -71.3 -18.4 22.7 9.8 6.1 34 58 A a H X> S+ 0 0 0 -3,-1.2 3,-2.1 2,-0.1 4,-0.6 0.923 112.7 44.7 -81.2 -53.2 19.5 7.7 6.6 35 59 A T H >< S+ 0 0 0 -4,-2.2 3,-0.5 1,-0.3 -2,-0.2 0.817 102.2 68.7 -66.6 -23.8 17.9 9.9 9.4 36 62 A N T 3< S+ 0 0 68 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.1 0.797 96.7 55.6 -55.7 -26.6 18.8 13.0 7.4 37 63 A I T <4 S+ 0 0 87 -3,-2.1 2,-0.3 1,-0.2 -1,-0.2 0.816 116.1 10.2 -80.6 -30.7 16.1 12.0 4.8 38 64 A S << - 0 0 16 -4,-0.6 -1,-0.2 -3,-0.5 15,-0.1 -0.997 41.6-150.8-155.8 148.4 13.0 11.6 7.1 39 65 A A S S+ 0 0 41 -2,-0.3 14,-2.5 13,-0.1 2,-0.4 0.779 88.6 59.2 -83.8 -27.6 11.5 12.2 10.4 40 65AA N E - H 0 52B 81 12,-0.2 2,-0.4 26,-0.0 -30,-0.3 -0.847 65.4-169.9-112.1 137.1 9.0 9.3 10.3 41 66 A W E - H 0 51B 0 10,-2.3 9,-2.4 -2,-0.4 10,-1.6 -0.985 2.5-173.2-131.9 140.4 10.2 5.6 9.9 42 67 A S E -DH 8 49B 12 -34,-2.4 -34,-2.4 -2,-0.4 7,-0.2 -0.750 31.6-126.1-125.7 161.6 8.2 2.4 9.2 43 68 A A S S+ 0 0 56 5,-0.6 2,-0.3 -2,-0.2 -37,-0.1 0.439 96.9 32.6 -95.2 4.6 9.1 -1.3 9.1 44 78 A S S > S- 0 0 61 4,-0.2 3,-1.8 -36,-0.1 -36,-0.2 -0.953 98.9 -95.1-145.2 161.1 7.7 -1.8 5.5 45 79 A S T 3 S+ 0 0 106 -2,-0.3 -34,-0.2 1,-0.3 -3,-0.1 0.819 121.8 14.0 -46.4 -45.9 7.5 0.6 2.5 46 80 A G T 3 S+ 0 0 76 -3,-0.0 -1,-0.3 -35,-0.0 3,-0.1 -0.135 103.0 127.7-122.1 34.5 3.9 1.9 3.1 47 81 A G < - 0 0 27 -3,-1.8 2,-0.1 1,-0.2 3,-0.1 -0.203 68.0 -77.9 -85.1 178.2 3.6 0.6 6.7 48 82 A S - 0 0 104 1,-0.1 -5,-0.6 -6,-0.0 2,-0.3 -0.394 57.5 -91.6 -75.8 155.6 2.5 2.5 9.8 49 84 A V E +H 42 0B 60 -7,-0.2 -7,-0.3 1,-0.2 -1,-0.1 -0.515 38.7 179.7 -70.4 127.0 5.1 4.7 11.6 50 85 A V E - 0 0 16 -9,-2.4 19,-2.7 -2,-0.3 20,-1.2 0.662 66.2 -0.8 -95.1 -25.4 7.1 2.8 14.3 51 86 A G E -HI 41 68B 0 -10,-1.6 -10,-2.3 17,-0.3 2,-0.3 -0.994 58.0-132.4-160.5 165.0 9.3 5.8 15.3 52 87 A V E -HI 40 67B 43 15,-1.9 15,-2.9 -2,-0.3 -12,-0.2 -0.925 37.7 -99.0-124.7 144.2 10.3 9.4 14.8 53 88 A R E + I 0 66B 92 -14,-2.5 13,-0.3 -2,-0.3 3,-0.1 -0.408 33.5 175.5 -60.1 134.6 13.7 10.9 14.4 54 89 A E E - 0 0 83 11,-2.6 2,-0.3 1,-0.4 12,-0.2 0.474 67.6 -4.7-114.5 -14.4 15.3 12.5 17.5 55 90 A G E - I 0 65B 17 10,-1.4 10,-2.0 2,-0.0 -1,-0.4 -0.948 55.7-175.7-171.9 157.7 18.7 13.3 16.2 56 91 A T E - I 0 64B 47 -2,-0.3 2,-0.3 8,-0.2 8,-0.2 -0.979 4.7-173.1-159.0 148.0 21.0 12.9 13.1 57 93 A S E + I 0 63B 31 6,-2.1 6,-2.0 -2,-0.3 -25,-0.4 -0.826 17.1 169.4-151.7 110.4 24.6 13.7 12.2 58 94 A F + 0 0 19 -2,-0.3 2,-0.2 -26,-0.2 4,-0.1 -0.827 54.5 25.9-165.9 134.7 25.9 13.3 8.6 59 99 A P S S+ 0 0 38 0, 0.0 2,-2.1 0, 0.0 69,-0.2 0.509 122.1 36.0 -73.3-152.7 28.5 14.1 7.2 60 100 A T B S+j 128 0C 73 67,-2.3 69,-2.9 -2,-0.2 2,-0.2 -0.467 137.0 16.1 75.4 -57.1 31.4 14.6 9.8 61 101 A N S S- 0 0 28 -2,-2.1 69,-0.1 67,-0.2 70,-0.0 -0.588 75.8-141.3-120.0 179.1 29.8 11.6 11.7 62 102 A D + 0 0 1 -2,-0.2 2,-0.3 -4,-0.1 111,-0.2 -0.449 56.3 103.9-141.6 75.6 27.3 9.1 10.4 63 103 A Y E + I 0 57B 26 -6,-2.0 -6,-2.1 -32,-0.3 2,-0.3 -0.964 31.8 169.4-146.1 162.0 24.8 8.3 13.1 64 104 A G E -GI 30 56B 0 -34,-1.6 -34,-2.2 -2,-0.3 2,-0.4 -0.957 20.2-135.8-162.0 166.4 21.2 9.1 14.1 65 105 A I E -GI 29 55B 1 -10,-2.0 -11,-2.6 -2,-0.3 -10,-1.4 -0.986 6.6-160.2-138.8 141.3 18.6 7.9 16.6 66 106 A V E -GI 28 53B 0 -38,-2.8 -38,-2.4 -2,-0.4 2,-0.4 -0.985 15.2-139.8-122.7 127.5 14.9 7.2 16.2 67 107 A R E -GI 27 52B 92 -15,-2.9 -15,-1.9 -2,-0.4 -40,-0.2 -0.756 24.4-121.3 -85.1 128.8 12.5 7.1 19.2 68 108 A Y E + I 0 51B 21 -42,-1.8 -17,-0.3 -2,-0.4 -42,-0.2 -0.556 33.9 173.7 -68.9 135.8 9.9 4.3 19.1 69 109 A T + 0 0 68 -19,-2.7 -18,-0.2 -2,-0.2 -1,-0.1 0.350 59.7 81.2-124.8 -0.1 6.4 5.7 19.2 70 110 A D S S- 0 0 80 -20,-1.2 -19,-0.1 -22,-0.1 -1,-0.1 0.256 103.3-111.1 -93.1 11.9 4.3 2.6 18.6 71 111 A G S S+ 0 0 79 1,-0.2 -21,-0.0 -21,-0.1 2,-0.0 0.466 70.3 141.1 74.3 5.6 4.4 1.4 22.3 72 112 A S - 0 0 45 -22,-0.2 -1,-0.2 -46,-0.1 -46,-0.2 -0.302 43.6-155.4 -77.9 162.1 6.6 -1.7 21.5 73 113 A S - 0 0 91 -48,-0.0 2,-0.1 -2,-0.0 -1,-0.0 -0.842 23.0-164.7-134.6 84.5 9.5 -3.0 23.6 74 114 A P - 0 0 19 0, 0.0 2,-0.1 0, 0.0 -72,-0.1 -0.373 26.6-100.1 -70.0 155.7 11.7 -4.9 21.0 75 115 A A - 0 0 57 1,-0.1 2,-1.9 -2,-0.1 -56,-0.2 -0.475 31.2-116.8 -72.8 150.8 14.4 -7.3 22.2 76 116 A G S S+ 0 0 8 -2,-0.1 12,-1.8 -74,-0.1 2,-0.3 -0.477 74.9 118.5 -82.0 62.9 17.9 -5.9 22.2 77 117 A T E - B 0 87A 16 -2,-1.9 -74,-2.7 10,-0.2 2,-0.4 -0.863 61.4-124.8-128.7 168.6 19.1 -8.4 19.5 78 118 A V E -aB 3 86A 0 8,-2.4 8,-2.6 -2,-0.3 2,-0.3 -0.958 32.0-116.4-113.6 132.1 20.5 -8.4 16.0 79 119 A D E - B 0 85A 42 -76,-3.0 6,-0.2 -2,-0.4 25,-0.0 -0.512 21.0-169.8 -68.7 126.3 18.8 -10.5 13.2 80 120 A L - 0 0 41 4,-2.1 29,-0.2 -2,-0.3 5,-0.2 0.362 35.3-130.1 -97.0 8.4 20.9 -13.3 11.8 81 120AA Y S S+ 0 0 71 3,-0.3 4,-0.1 1,-0.1 -2,-0.1 0.786 87.7 88.1 51.3 36.9 18.4 -13.8 9.0 82 120BA N S S- 0 0 108 2,-0.6 -1,-0.1 0, 0.0 3,-0.1 0.102 117.1 -79.0-146.2 20.9 18.2 -17.6 9.7 83 120CA G S S+ 0 0 84 1,-0.3 2,-0.2 0, 0.0 -2,-0.1 0.167 109.9 81.8 94.4 -16.7 15.5 -17.9 12.3 84 120DA S - 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