==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-AUG-05 2ANE . COMPND 2 MOLECULE: ATP-DEPENDENT PROTEASE LA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.LI,F.RASULOVA,E.E.MELNIKOV,T.V.ROTANOVA,A.GUSTCHINA, . 875 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39106.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 624 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 330 37.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.9 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 . 1 0.1 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 . 103 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.9 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 1 5 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 8 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 . 8 2 5 10 3 10 4 0 0 0 8 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 0 0 0 6 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 8 A R 0 0 255 0, 0.0 2,-0.3 0, 0.0 107,-0.2 0.000 360.0 360.0 360.0 135.0 22.6 34.1 44.7 2 9 A I E -A 107 0A 51 105,-3.3 105,-2.8 2,-0.0 2,-0.4 -0.869 360.0-135.1-136.6 168.4 23.0 31.9 47.8 3 10 A E E +A 106 0A 131 -2,-0.3 103,-0.2 103,-0.3 101,-0.0 -1.000 40.6 167.0-122.2 126.5 22.0 31.6 51.4 4 11 A I E -A 105 0A 8 101,-2.7 101,-2.5 -2,-0.4 39,-0.1 -0.992 40.0-101.3-149.3 146.3 25.0 30.7 53.7 5 12 A P E -A 104 0A 19 0, 0.0 39,-3.3 0, 0.0 2,-0.5 -0.447 39.0-139.3 -64.1 140.0 26.1 30.6 57.4 6 13 A V E -Ab 103 44A 1 97,-2.0 97,-0.6 37,-0.2 39,-0.2 -0.894 13.8-165.4-110.5 127.8 28.1 33.6 58.5 7 14 A L E - b 0 45A 2 37,-2.5 39,-2.3 -2,-0.5 2,-0.3 -0.946 19.4-137.4-110.6 117.1 31.2 33.4 60.7 8 15 A P E - b 0 46A 8 0, 0.0 2,-0.5 0, 0.0 39,-0.2 -0.567 14.4-159.1 -79.2 137.2 32.3 36.7 62.2 9 16 A L E + b 0 47A 7 37,-2.6 39,-1.7 -2,-0.3 5,-0.0 -0.966 18.8 169.5-117.4 126.0 36.0 37.4 62.2 10 17 A R S S+ 0 0 35 -2,-0.5 -1,-0.1 37,-0.2 122,-0.1 0.836 76.7 36.4 -99.8 -49.0 37.5 40.0 64.6 11 18 A D S S+ 0 0 5 120,-0.1 121,-2.2 122,-0.1 2,-0.3 0.730 116.1 29.3 -82.7 -27.9 41.2 39.4 64.4 12 19 A V - 0 0 5 119,-0.2 2,-0.4 2,-0.0 119,-0.1 -0.871 59.5-138.8-132.3 165.6 42.0 38.5 60.7 13 20 A V - 0 0 38 117,-0.3 2,-0.4 -2,-0.3 33,-0.0 -0.996 20.5-157.8-126.0 129.1 40.6 39.2 57.2 14 21 A V - 0 0 6 -2,-0.4 33,-0.1 31,-0.1 31,-0.1 -0.925 9.7-171.3-111.2 134.8 40.6 36.2 54.8 15 22 A Y > - 0 0 54 -2,-0.4 3,-2.0 1,-0.1 72,-0.4 -0.726 40.4 -66.2-118.6 170.0 40.5 36.6 51.0 16 23 A P T 3 S+ 0 0 27 0, 0.0 72,-0.3 0, 0.0 -1,-0.1 -0.240 121.1 18.9 -56.0 142.2 40.1 34.3 48.1 17 24 A H T 3 S+ 0 0 85 70,-3.5 2,-0.4 1,-0.2 71,-0.1 0.238 92.6 122.7 79.0 -11.0 43.0 31.8 47.8 18 25 A M < - 0 0 37 -3,-2.0 69,-2.6 2,-0.0 2,-0.5 -0.679 46.5-159.1 -82.2 134.6 44.2 32.3 51.4 19 26 A V E +C 86 0A 26 -2,-0.4 67,-0.2 67,-0.2 218,-0.1 -0.961 21.8 167.0-111.3 131.5 44.3 29.0 53.4 20 27 A I E -C 85 0A 15 65,-2.2 65,-2.4 -2,-0.5 2,-0.6 -0.988 38.1-129.5-150.9 135.0 44.2 29.6 57.2 21 28 A P E -C 84 0A 37 0, 0.0 101,-0.3 0, 0.0 2,-0.3 -0.748 35.3-165.2 -80.5 122.5 43.7 27.6 60.4 22 29 A L E -C 83 0A 3 61,-3.4 61,-2.1 -2,-0.6 2,-0.4 -0.767 12.0-139.8-108.3 160.7 41.1 29.5 62.4 23 30 A F E -C 82 0A 22 97,-2.8 2,-0.4 -2,-0.3 59,-0.2 -0.960 15.8-169.4-119.7 131.7 40.2 29.0 66.1 24 31 A V E +C 81 0A 9 57,-2.6 57,-2.9 -2,-0.4 135,-0.1 -0.987 17.3 163.9-126.0 129.5 36.6 29.2 67.3 25 32 A G + 0 0 10 -2,-0.4 135,-2.1 55,-0.2 2,-0.4 0.235 50.4 86.8-128.1 14.0 35.5 29.3 71.0 26 33 A R > - 0 0 19 133,-0.2 4,-1.8 1,-0.1 3,-0.2 -0.955 68.3-137.0-120.4 136.4 31.9 30.4 71.0 27 34 A E H > S+ 0 0 133 -2,-0.4 4,-2.7 133,-0.4 5,-0.2 0.842 102.3 55.7 -58.9 -41.4 29.0 28.1 70.6 28 35 A K H > S+ 0 0 36 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.937 110.4 47.0 -60.2 -42.3 27.0 30.1 68.2 29 36 A S H > S+ 0 0 18 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.853 108.8 55.1 -68.1 -32.6 30.0 30.2 65.9 30 37 A I H X S+ 0 0 15 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.934 107.1 50.3 -64.1 -43.6 30.4 26.4 66.3 31 38 A R H X S+ 0 0 78 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.884 107.6 53.6 -61.0 -38.5 26.8 26.0 65.3 32 39 A C H X S+ 0 0 1 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.927 107.9 50.5 -62.7 -41.2 27.4 28.1 62.2 33 40 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.895 111.5 49.0 -63.5 -37.8 30.4 25.9 61.3 34 41 A E H X S+ 0 0 63 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.903 104.7 56.8 -71.0 -37.5 28.1 22.9 61.6 35 42 A A H < S+ 0 0 30 -4,-2.6 -1,-0.2 1,-0.2 3,-0.2 0.930 110.1 46.2 -59.3 -43.7 25.4 24.3 59.5 36 43 A A H >X>S+ 0 0 0 -4,-2.0 3,-2.4 1,-0.2 5,-2.3 0.963 109.1 54.6 -63.1 -47.4 27.9 24.7 56.7 37 44 A M H 3<5S+ 0 0 67 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.789 102.6 59.0 -53.8 -31.6 29.2 21.1 57.3 38 45 A D T 3<5S+ 0 0 142 -4,-2.0 -1,-0.3 -3,-0.2 -2,-0.2 0.283 119.6 25.0 -84.5 13.6 25.6 19.9 56.9 39 46 A H T <45S- 0 0 152 -3,-2.4 -2,-0.2 -5,-0.1 -3,-0.1 0.430 133.5 -35.6-134.1 -84.0 25.4 21.3 53.5 40 47 A D T <5S- 0 0 75 -4,-0.9 -3,-0.2 2,-0.2 3,-0.1 0.151 74.4-106.9-138.6 14.5 28.4 21.9 51.3 41 48 A K S - 0 0 82 11,-3.3 3,-2.4 -2,-0.3 85,-0.1 -0.491 49.4 -72.2 -81.7 149.6 33.0 46.5 62.8 50 57 A E T 3 S+ 0 0 108 1,-0.3 84,-0.1 -2,-0.2 140,-0.1 0.419 116.7 2.0 7.2 -95.2 35.4 48.8 64.9 51 58 A A T 3 S+ 0 0 58 84,-0.1 -1,-0.3 82,-0.1 85,-0.1 -0.042 86.0 143.2-108.7 33.0 34.6 48.2 68.5 52 59 A S < - 0 0 13 -3,-2.4 82,-0.1 8,-0.2 -4,-0.1 -0.336 47.3-119.3 -68.2 152.6 31.9 45.5 68.5 53 60 A T - 0 0 53 2,-0.2 111,-0.1 1,-0.1 -1,-0.1 0.080 32.5 -91.1 -80.1-166.1 32.1 42.9 71.3 54 61 A D S S+ 0 0 6 109,-2.1 110,-0.1 1,-0.3 109,-0.1 0.498 124.3 60.4 -86.6 -1.4 32.5 39.2 71.0 55 62 A E S S- 0 0 81 108,-0.1 -1,-0.3 2,-0.0 -2,-0.2 -0.615 84.8-173.2-118.8 67.3 28.8 38.9 71.0 56 63 A P - 0 0 6 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 -0.241 16.0-139.7 -65.5 149.8 28.1 41.0 67.8 57 64 A G > - 0 0 31 1,-0.1 3,-2.0 -4,-0.0 4,-0.3 -0.528 37.0 -95.6 -96.8 171.6 24.6 41.9 66.6 58 65 A V G > S+ 0 0 48 1,-0.3 3,-1.4 -2,-0.2 -1,-0.1 0.894 126.5 57.4 -59.8 -30.1 23.8 41.8 62.9 59 66 A N G 3 S+ 0 0 130 1,-0.3 -1,-0.3 -10,-0.0 0, 0.0 0.603 95.3 66.8 -76.2 -5.8 24.5 45.5 62.6 60 67 A D G < S+ 0 0 59 -3,-2.0 -11,-3.3 2,-0.1 2,-0.3 0.452 88.8 82.8 -90.0 -2.8 28.0 44.9 63.9 61 68 A L B < S-G 48 0B 4 -3,-1.4 -13,-0.2 -4,-0.3 -14,-0.1 -0.755 81.9-109.2-104.9 151.6 29.1 42.9 60.8 62 69 A F - 0 0 84 -15,-2.6 -1,-0.1 -2,-0.3 -2,-0.1 -0.202 22.5-127.7 -68.6 165.7 30.3 44.1 57.4 63 70 A T S S+ 0 0 101 29,-0.0 30,-2.9 -17,-0.0 2,-0.3 0.211 90.1 54.1-105.5 17.0 28.1 43.8 54.3 64 71 A V E + E 0 92A 39 28,-0.2 -17,-0.5 -17,-0.1 2,-0.3 -0.926 64.3 158.7-142.3 154.1 30.7 42.0 52.2 65 72 A G E - E 0 91A 3 26,-1.9 26,-2.1 -2,-0.3 2,-0.5 -0.918 40.5 -93.0-161.0-173.9 32.7 38.8 53.0 66 73 A T E -DE 45 90A 1 -21,-2.1 -21,-2.9 -2,-0.3 2,-0.4 -0.974 29.4-140.1-120.0 117.9 34.7 35.9 51.6 67 74 A V E -DE 44 89A 0 22,-3.1 21,-3.0 -2,-0.5 22,-1.4 -0.680 33.9-178.2 -73.7 132.1 32.9 32.7 50.9 68 75 A A E -DE 43 87A 0 -25,-3.1 -25,-2.6 -2,-0.4 2,-0.4 -0.917 26.1-122.4-133.6 160.5 35.3 29.9 52.0 69 76 A S E -DE 42 86A 26 17,-2.6 17,-2.1 -2,-0.3 2,-1.0 -0.836 23.4-126.2-102.0 138.2 35.4 26.1 52.1 70 77 A I E + E 0 85A 2 -29,-2.9 15,-0.2 -2,-0.4 3,-0.1 -0.737 29.6 176.6 -83.7 107.5 35.9 24.2 55.3 71 78 A L E + 0 0 31 13,-2.5 2,-0.3 -2,-1.0 14,-0.2 0.742 67.6 0.3 -80.7 -30.5 38.9 21.9 54.5 72 79 A Q E - E 0 84A 86 12,-1.4 12,-2.6 2,-0.0 2,-0.4 -0.971 58.6-170.8-160.2 143.9 39.1 20.5 58.0 73 80 A M E - E 0 83A 42 -2,-0.3 2,-0.4 10,-0.2 10,-0.2 -0.975 4.5-179.8-143.1 128.6 37.3 20.8 61.3 74 81 A L E - E 0 82A 100 8,-2.7 8,-2.6 -2,-0.4 2,-0.7 -0.993 15.8-151.3-131.4 124.1 38.3 19.3 64.7 75 82 A K E - E 0 81A 119 -2,-0.4 6,-0.2 6,-0.2 -2,-0.0 -0.853 18.5-145.4 -96.5 115.0 36.3 19.8 67.9 76 83 A L > - 0 0 57 4,-2.3 3,-1.7 -2,-0.7 4,-0.2 -0.403 21.6-115.6 -76.6 155.9 38.6 19.6 70.9 77 84 A P T 3 S+ 0 0 139 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 0.883 111.0 70.5 -57.7 -35.0 37.3 18.1 74.2 78 85 A D T 3 S- 0 0 61 1,-0.1 81,-0.2 2,-0.0 3,-0.1 0.356 120.4-103.1 -66.0 8.2 37.6 21.5 75.9 79 86 A G S < S+ 0 0 52 -3,-1.7 2,-0.2 1,-0.3 -1,-0.1 0.580 87.0 117.7 80.5 11.5 34.6 22.8 73.8 80 87 A T - 0 0 0 -4,-0.2 -4,-2.3 79,-0.1 2,-0.3 -0.681 52.7-141.8-108.0 158.3 36.8 24.8 71.4 81 88 A V E -CE 24 75A 1 -57,-2.9 -57,-2.6 -2,-0.2 2,-0.5 -0.957 8.4-158.0-127.4 145.0 37.1 24.2 67.6 82 89 A K E -CE 23 74A 81 -8,-2.6 -8,-2.7 -2,-0.3 2,-0.4 -0.988 20.7-179.8-120.1 119.6 40.0 24.3 65.1 83 90 A V E -CE 22 73A 0 -61,-2.1 -61,-3.4 -2,-0.5 2,-0.6 -0.984 19.6-150.2-130.6 124.8 38.8 24.8 61.5 84 91 A L E -CE 21 72A 12 -12,-2.6 -13,-2.5 -2,-0.4 -12,-1.4 -0.841 25.3-175.6 -91.7 119.5 41.0 25.0 58.4 85 92 A V E -CE 20 70A 0 -65,-2.4 -65,-2.2 -2,-0.6 2,-0.5 -0.843 20.6-156.0-120.5 155.0 39.4 27.2 55.7 86 93 A E E -CE 19 69A 58 -17,-2.1 -17,-2.6 -2,-0.3 2,-0.3 -0.986 24.0-129.4-127.3 121.0 40.2 28.2 52.1 87 94 A G E + E 0 68A 1 -69,-2.6 -70,-3.5 -2,-0.5 -19,-0.3 -0.513 29.8 173.9 -70.2 133.1 38.8 31.5 50.8 88 95 A L E - 0 0 67 -21,-3.0 2,-0.3 1,-0.4 -20,-0.2 0.852 55.0 -23.6-105.1 -51.6 37.1 30.9 47.4 89 96 A Q E - E 0 67A 88 -22,-1.4 -22,-3.1 -73,-0.1 -1,-0.4 -0.988 60.7-104.6-163.0 152.8 35.4 34.1 46.3 90 97 A R E - E 0 66A 85 -2,-0.3 20,-2.3 -24,-0.3 2,-0.3 -0.431 35.2-171.2 -80.2 157.6 34.0 37.3 47.7 91 98 A A E -FE 109 65A 0 -26,-2.1 -26,-1.9 18,-0.3 2,-0.4 -0.979 21.0-125.5-148.0 158.2 30.3 38.0 48.0 92 99 A R E -FE 108 64A 148 16,-2.9 16,-2.4 -2,-0.3 2,-0.6 -0.855 22.5-136.5-105.3 136.8 27.9 40.8 48.8 93 100 A I E +F 107 0A 20 -30,-2.9 14,-0.2 -2,-0.4 3,-0.2 -0.851 23.2 175.8 -97.0 122.5 25.4 40.4 51.6 94 101 A S E S+ 0 0 105 12,-2.3 2,-0.3 -2,-0.6 -1,-0.2 0.756 78.1 15.4 -92.8 -29.4 21.9 41.7 50.8 95 102 A A E -F 106 0A 46 11,-1.3 11,-2.1 2,-0.0 2,-0.5 -0.951 64.4-168.5-148.4 124.5 20.3 40.4 54.0 96 103 A L E +F 105 0A 40 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.949 18.8 175.8-114.1 130.7 22.1 39.3 57.2 97 104 A S E -F 104 0A 40 7,-3.3 7,-2.7 -2,-0.5 2,-0.6 -0.908 32.3-142.4-134.7 163.2 20.0 37.6 59.8 98 105 A D E -F 103 0A 65 -2,-0.3 5,-0.2 5,-0.2 -40,-0.0 -0.969 17.8-174.2-122.9 105.9 20.3 35.9 63.1 99 106 A N - 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