==== 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 13-APR-06 2GOP . COMPND 2 MOLECULE: TRILOBED PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR J.BOSCH,T.TAMURA,N.TAMURA,W.BAUMEISTER,L.-O.ESSEN . 624 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31172.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 390 62.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 300 48.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 16 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 6 1.0 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 . 52 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.0 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 5 3 12 13 3 5 0 1 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 0 10 0 0 0 2 0 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 10 A T 0 0 200 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -38.3 49.4 21.1 46.4 2 11 A F + 0 0 144 2,-0.0 0, 0.0 1,-0.0 0, 0.0 0.990 360.0 123.0 -62.2 -81.3 50.4 23.9 43.9 3 12 A A + 0 0 22 1,-0.1 22,-0.1 21,-0.0 -1,-0.0 0.646 17.0 139.6 -8.6 90.2 47.3 25.5 42.2 4 13 A K + 0 0 172 2,-0.1 -1,-0.1 20,-0.1 2,-0.1 0.223 52.0 103.0-106.9 6.8 47.5 29.2 43.1 5 14 A F S S- 0 0 60 1,-0.0 20,-0.5 19,-0.0 2,-0.5 -0.337 72.1-121.9-105.7 166.8 46.4 30.1 39.6 6 15 A A - 0 0 6 18,-0.1 2,-0.6 -2,-0.1 18,-0.2 -0.926 27.7-153.8-101.3 129.4 43.5 31.3 37.5 7 16 A Y E -A 23 0A 37 16,-3.2 16,-2.2 -2,-0.5 2,-0.3 -0.927 8.4-159.1-113.2 114.0 42.6 28.8 34.7 8 17 A L E +A 22 0A 0 -2,-0.6 2,-0.3 291,-0.4 14,-0.2 -0.706 17.9 163.0 -95.9 139.6 41.0 30.3 31.6 9 18 A S E +A 21 0A 5 12,-2.1 12,-2.9 -2,-0.3 272,-0.1 -0.969 43.8 26.4-148.7 161.0 38.9 28.4 29.1 10 19 A D E - 0 0 17 -2,-0.3 -1,-0.2 270,-0.2 2,-0.1 0.911 65.3-154.5 57.2 64.6 36.4 28.7 26.3 11 20 A P E - 0 0 3 0, 0.0 2,-0.3 0, 0.0 9,-0.2 -0.427 17.1-180.0 -72.2 139.9 37.0 32.2 24.8 12 21 A R E -A 19 0A 50 7,-2.7 7,-2.5 -2,-0.1 2,-0.3 -0.977 10.1-173.2-140.1 150.6 34.0 33.8 23.1 13 22 A T E +A 18 0A 0 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.993 12.1 166.6-148.5 139.9 33.2 37.0 21.3 14 23 A K E > -A 17 0A 56 3,-1.9 3,-2.5 -2,-0.3 2,-0.1 -0.942 69.9 -39.0-144.0 131.6 30.3 38.9 19.8 15 24 A G T 3 S- 0 0 16 -2,-0.3 271,-0.3 1,-0.3 272,-0.2 -0.330 126.0 -20.6 57.5-122.7 30.3 42.5 18.8 16 25 A E T 3 S+ 0 0 78 -2,-0.1 25,-3.4 270,-0.1 2,-0.4 0.200 119.5 96.4-103.7 13.4 32.3 44.4 21.4 17 26 A L E < -AB 14 40A 17 -3,-2.5 -3,-1.9 23,-0.2 2,-0.3 -0.838 48.2-175.3-103.1 140.2 31.9 41.7 24.1 18 27 A V E -AB 13 39A 0 21,-2.6 21,-3.0 -2,-0.4 2,-0.3 -0.948 7.3-176.6-121.5 150.7 34.3 39.0 25.0 19 28 A A E +AB 12 38A 0 -7,-2.5 -7,-2.7 -2,-0.3 2,-0.3 -0.977 7.5 160.9-141.6 159.6 33.5 36.2 27.5 20 29 A Y E - B 0 37A 0 17,-1.8 17,-3.0 -2,-0.3 2,-0.5 -0.970 40.0 -96.3-164.3 167.4 35.4 33.3 29.0 21 30 A V E -AB 9 36A 2 -12,-2.9 -12,-2.1 -2,-0.3 2,-0.5 -0.854 28.7-162.2 -98.3 127.2 35.5 30.8 31.9 22 31 A L E -AB 8 35A 9 13,-3.5 13,-2.4 -2,-0.5 2,-0.4 -0.963 8.7-167.6-106.3 120.0 37.7 31.7 34.8 23 32 A T E +AB 7 34A 0 -16,-2.2 -16,-3.2 -2,-0.5 2,-0.3 -0.944 16.9 157.3-114.5 136.2 38.4 28.7 37.1 24 33 A K E - B 0 33A 109 9,-1.7 9,-2.7 -2,-0.4 2,-0.4 -0.990 44.4 -96.2-158.3 149.1 40.0 29.1 40.5 25 34 A A E - B 0 32A 40 -20,-0.5 2,-1.0 -2,-0.3 7,-0.3 -0.615 28.3-142.1 -74.5 123.1 40.4 27.5 43.9 26 35 A N E >> - B 0 31A 32 5,-3.5 4,-1.7 -2,-0.4 5,-1.1 -0.818 12.5-163.4 -81.2 103.4 37.9 28.7 46.5 27 36 A L T 45S+ 0 0 133 -2,-1.0 -1,-0.1 2,-0.2 5,-0.1 0.640 85.4 51.1 -62.7 -19.0 40.2 28.7 49.5 28 37 A K T 45S+ 0 0 163 3,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.940 119.8 30.3 -82.9 -56.6 37.2 28.9 51.8 29 38 A D T 45S- 0 0 105 2,-0.2 -2,-0.2 1,-0.0 -1,-0.1 0.526 104.6-129.8 -79.9 -8.1 35.1 26.0 50.4 30 39 A N T <5 + 0 0 136 -4,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.942 70.0 92.2 56.4 56.5 38.3 24.1 49.4 31 40 A K E -B 17 0A 42 5,-2.8 4,-1.8 -2,-0.4 5,-0.3 -0.819 11.2-151.4 -89.9 122.1 33.2 45.0 27.3 41 50 A L T 4 S+ 0 0 29 -25,-3.4 -1,-0.1 -2,-0.6 -24,-0.1 0.719 88.8 59.3 -68.7 -23.2 36.1 45.8 24.9 42 51 A K T 4 S+ 0 0 159 -26,-0.4 -1,-0.2 1,-0.1 -25,-0.1 0.954 127.6 8.6 -71.3 -50.9 35.4 49.5 24.8 43 52 A N T 4 S- 0 0 105 2,-0.1 -2,-0.2 -3,-0.1 -1,-0.1 0.348 94.3-121.4-113.4 2.2 35.7 50.3 28.5 44 53 A N < + 0 0 99 -4,-1.8 -3,-0.2 1,-0.2 2,-0.1 0.595 55.6 159.9 63.7 13.8 37.1 47.0 29.9 45 54 A A - 0 0 45 -5,-0.3 -5,-2.8 -6,-0.1 2,-0.3 -0.400 25.7-147.7 -67.8 141.8 34.0 46.8 32.2 46 55 A R E -C 39 0A 94 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.817 17.1-170.7-116.6 151.7 33.4 43.2 33.5 47 56 A R E -C 38 0A 81 -9,-1.9 -9,-3.0 -2,-0.3 2,-0.4 -0.957 14.5-149.3-134.4 153.9 30.3 41.2 34.5 48 57 A F E -C 37 0A 128 -2,-0.3 2,-0.4 -11,-0.2 -11,-0.2 -0.958 15.2-167.6-130.3 140.5 30.3 37.8 36.2 49 58 A I E -C 36 0A 20 -13,-2.5 -13,-2.8 -2,-0.4 3,-0.4 -0.963 28.0-141.7-122.5 113.1 28.1 34.7 36.2 50 59 A E E S+C 35 0A 152 -2,-0.4 -15,-0.2 -15,-0.2 3,-0.1 -0.315 73.2 13.9 -72.0 152.6 29.0 32.4 39.1 51 60 A N S S+ 0 0 88 -17,-0.9 2,-0.3 1,-0.2 -16,-0.2 0.901 100.4 119.1 56.7 51.9 29.1 28.6 39.0 52 61 A A + 0 0 1 -18,-1.4 2,-0.2 -3,-0.4 16,-0.2 -0.993 35.4 174.6-151.2 147.9 28.9 28.4 35.2 53 62 A T E +D 67 0B 29 14,-2.2 14,-3.1 -2,-0.3 -17,-0.1 -0.788 57.5 60.4-137.1-174.8 30.7 27.2 32.0 54 63 A M E - 0 0 25 -2,-0.2 2,-0.2 12,-0.2 -1,-0.1 0.920 67.2-162.8 56.9 50.4 29.9 27.1 28.2 55 64 A P E + 0 0 0 0, 0.0 2,-0.4 0, 0.0 11,-0.2 -0.460 12.0 179.7 -65.2 128.7 29.4 30.8 27.8 56 65 A R E -D 65 0B 28 9,-2.2 9,-2.6 -2,-0.2 2,-0.4 -0.940 13.6-155.1-133.7 108.4 27.6 31.6 24.5 57 66 A I E -D 64 0B 5 -2,-0.4 7,-0.2 7,-0.2 45,-0.2 -0.712 24.3-118.3 -83.8 132.6 26.9 35.3 23.8 58 67 A S > - 0 0 0 5,-2.6 3,-3.0 -2,-0.4 5,-0.1 -0.411 27.5-110.9 -65.6 143.8 24.0 35.9 21.5 59 68 A P T 3 S+ 0 0 41 0, 0.0 -1,-0.1 0, 0.0 45,-0.1 0.833 119.5 51.9 -43.3 -38.0 24.9 37.6 18.2 60 69 A D T 3 S- 0 0 73 1,-0.1 -2,-0.1 -45,-0.1 -46,-0.0 0.395 108.1-125.8 -84.3 3.2 23.1 40.8 19.3 61 70 A G S < S+ 0 0 20 -3,-3.0 -1,-0.1 2,-0.2 -47,-0.0 0.569 83.2 107.8 66.4 10.6 25.0 40.9 22.6 62 71 A K S S+ 0 0 93 21,-0.1 21,-1.5 1,-0.1 22,-0.8 0.628 76.7 33.6 -94.4 -16.7 21.7 41.0 24.6 63 72 A K E - E 0 82B 38 19,-0.2 -5,-2.6 20,-0.2 2,-0.4 -0.938 57.2-157.1-135.4 159.6 21.8 37.5 26.1 64 73 A I E -DE 57 81B 0 17,-2.4 17,-3.2 -2,-0.3 2,-0.3 -0.986 8.0-159.2-136.3 128.7 24.2 34.8 27.3 65 74 A A E +DE 56 80B 0 -9,-2.6 -9,-2.2 -2,-0.4 2,-0.3 -0.775 23.6 162.8 -96.5 149.9 23.4 31.1 27.4 66 75 A F E - E 0 79B 0 13,-2.2 13,-3.0 -2,-0.3 2,-0.4 -0.973 33.2-109.9-158.4 172.2 25.5 28.9 29.7 67 76 A M E -DE 53 78B 24 -14,-3.1 -14,-2.2 -2,-0.3 2,-0.4 -0.890 20.7-167.6-113.8 140.4 25.7 25.6 31.5 68 77 A R E - E 0 77B 43 9,-2.9 9,-3.2 -2,-0.4 2,-0.4 -0.993 15.3-139.8-128.0 128.3 25.4 24.8 35.2 69 78 A A E - E 0 76B 54 -2,-0.4 2,-0.8 7,-0.2 7,-0.2 -0.717 3.2-154.8 -86.1 130.8 26.3 21.5 36.8 70 79 A N E >> - E 0 75B 47 5,-2.9 4,-1.6 -2,-0.4 5,-1.4 -0.886 10.4-172.6-102.2 96.4 24.1 20.2 39.6 71 80 A E T 45S+ 0 0 165 -2,-0.8 -1,-0.1 1,-0.2 5,-0.0 0.807 81.8 50.6 -57.0 -35.0 26.5 17.9 41.5 72 81 A E T 45S+ 0 0 190 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.759 118.4 35.6 -81.2 -28.2 23.8 16.5 43.7 73 82 A K T 45S- 0 0 115 -3,-0.5 -2,-0.2 2,-0.2 -1,-0.2 0.570 100.4-129.6 -95.2 -14.9 21.4 15.5 40.9 74 83 A K T <5 + 0 0 140 -4,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.952 66.5 124.9 54.8 51.8 24.1 14.5 38.4 75 84 A V E < -E 70 0B 13 -5,-1.4 -5,-2.9 41,-0.1 2,-0.4 -0.983 57.3-136.1-136.1 151.2 22.5 16.7 35.7 76 85 A S E -EF 69 94B 16 18,-3.5 18,-2.4 -2,-0.3 2,-0.4 -0.903 23.7-153.4-103.9 135.4 23.8 19.6 33.5 77 86 A E E -EF 68 93B 17 -9,-3.2 -9,-2.9 -2,-0.4 2,-0.5 -0.892 7.8-143.2-114.7 138.4 21.5 22.5 33.2 78 87 A I E -EF 67 92B 0 14,-2.1 13,-3.2 -2,-0.4 14,-1.5 -0.867 26.4-177.3 -95.4 132.9 21.2 25.0 30.4 79 88 A W E -EF 66 90B 40 -13,-3.0 -13,-2.2 -2,-0.5 2,-0.4 -0.857 17.5-151.1-123.6 158.8 20.5 28.6 31.5 80 89 A V E -EF 65 89B 8 9,-2.2 9,-1.8 -2,-0.3 2,-0.4 -0.995 8.8-162.5-132.9 128.3 19.9 31.9 29.8 81 90 A A E -EF 64 88B 9 -17,-3.2 -17,-2.4 -2,-0.4 2,-0.8 -0.916 13.8-141.9-108.9 136.1 20.8 35.3 31.3 82 91 A D E >> -EF 63 87B 31 5,-3.8 4,-1.5 -2,-0.4 5,-1.1 -0.864 9.5-165.1 -98.1 107.0 19.4 38.5 30.0 83 92 A L T 45S+ 0 0 28 -21,-1.5 -20,-0.2 -2,-0.8 -1,-0.1 0.706 87.4 48.4 -68.7 -20.3 22.2 41.1 30.1 84 93 A E T 45S+ 0 0 130 -22,-0.8 -1,-0.2 1,-0.1 -21,-0.1 0.916 120.7 32.4 -82.3 -50.6 19.7 44.0 29.6 85 94 A T T 45S- 0 0 88 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.499 101.9-130.1 -86.4 -4.6 17.1 43.0 32.3 86 95 A L T <5 + 0 0 142 -4,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.925 64.2 124.7 53.6 50.2 19.8 41.4 34.6 87 96 A S E < -F 82 0B 70 -5,-1.1 -5,-3.8 2,-0.0 2,-0.3 -0.988 37.1-173.1-136.2 147.2 17.8 38.2 35.0 88 97 A S E +F 81 0B 61 -2,-0.3 2,-0.3 -7,-0.3 -7,-0.2 -0.978 3.9 178.7-137.9 152.4 18.7 34.5 34.4 89 98 A K E -F 80 0B 69 -9,-1.8 -9,-2.2 -2,-0.3 2,-0.3 -0.995 35.0-104.9-150.0 153.4 16.8 31.2 34.5 90 99 A K E +F 79 0B 83 -2,-0.3 -11,-0.3 -11,-0.2 3,-0.1 -0.625 34.2 174.9 -71.7 130.6 17.3 27.5 34.0 91 100 A I E + 0 0 24 -13,-3.2 2,-0.3 -2,-0.3 -12,-0.2 0.582 59.8 14.5-113.1 -15.3 15.7 26.5 30.7 92 101 A L E -F 78 0B 21 -14,-1.5 -14,-2.1 2,-0.0 2,-0.4 -0.992 53.6-150.4-161.3 149.7 16.6 22.8 30.4 93 102 A E E +F 77 0B 20 -2,-0.3 23,-0.4 -16,-0.2 2,-0.3 -0.983 26.7 157.4-123.9 135.5 17.9 19.8 32.3 94 103 A A E -F 76 0B 0 -18,-2.4 -18,-3.5 -2,-0.4 21,-0.2 -0.977 48.1-118.7-151.6 163.6 20.0 17.0 30.7 95 104 A K S S- 0 0 102 19,-2.0 2,-0.3 -2,-0.3 20,-0.2 0.966 97.8 -1.8 -66.8 -53.3 22.4 14.3 31.7 96 105 A N E -G 114 0C 84 18,-1.2 18,-2.7 -21,-0.1 2,-0.4 -0.984 63.9-142.8-141.5 148.1 25.2 15.6 29.5 97 106 A I E +G 113 0C 16 -2,-0.3 16,-0.3 16,-0.2 3,-0.1 -0.958 15.4 176.2-114.9 128.3 25.6 18.6 27.1 98 107 A R E + 0 0 110 14,-3.2 2,-0.3 -2,-0.4 15,-0.2 0.822 68.6 0.5 -94.3 -45.0 27.7 18.3 23.9 99 108 A S E -G 112 0C 31 13,-1.8 13,-2.2 2,-0.0 2,-0.3 -0.989 48.1-164.7-149.4 160.1 27.0 21.7 22.3 100 109 A L E +G 111 0C 5 -2,-0.3 2,-0.4 11,-0.2 11,-0.2 -0.964 22.6 166.2-148.0 117.2 25.3 25.0 22.8 101 110 A E E -G 110 0C 52 9,-2.2 9,-3.3 -2,-0.3 2,-0.3 -0.990 27.5-134.4-147.7 129.8 24.8 27.4 19.9 102 111 A W E -G 109 0C 19 -2,-0.4 7,-0.2 7,-0.2 2,-0.1 -0.593 24.4-122.2 -78.3 141.8 22.7 30.5 19.2 103 112 A N > - 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