==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(SERINE PROTEASE) 15-APR-93 1ARB . COMPND 2 MOLECULE: ACHROMOBACTER PROTEASE I; . SOURCE 2 ORGANISM_SCIENTIFIC: ACHROMOBACTER LYTICUS; . AUTHOR Y.KITAGAWA,Y.KATSUBE . 263 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9495.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 156 59.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 27.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 16 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 1 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 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 5 3 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 1 0 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 1 A G 0 0 22 0, 0.0 91,-2.3 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0-177.3 11.6 -9.0 10.1 2 2 A V + 0 0 82 149,-0.3 2,-0.3 89,-0.2 89,-0.1 -0.975 360.0 157.1-127.0 140.4 10.8 -5.9 12.1 3 3 A S - 0 0 10 -2,-0.4 148,-0.1 85,-0.4 151,-0.0 -0.873 51.3 -54.8-150.7 175.2 7.5 -4.1 12.7 4 4 A G > - 0 0 19 -2,-0.3 3,-1.8 1,-0.1 184,-0.1 -0.243 44.4-127.7 -56.3 140.2 6.0 -1.6 15.3 5 5 A S T 3 S+ 0 0 41 1,-0.3 79,-2.4 84,-0.1 80,-0.5 0.725 103.9 70.2 -67.3 -16.9 6.2 -2.8 18.9 6 6 A a T 3 S+ 0 0 1 77,-0.2 -1,-0.3 78,-0.2 -2,-0.1 0.597 81.2 104.0 -70.5 -13.8 2.5 -2.2 19.5 7 7 A N < - 0 0 0 -3,-1.8 2,-0.5 180,-0.2 77,-0.3 -0.326 68.4-132.6 -69.4 155.7 1.9 -5.2 17.2 8 8 A I E -A 157 0A 7 149,-0.6 149,-2.3 75,-0.1 74,-0.1 -0.950 12.5-125.8-117.9 121.7 0.8 -8.5 18.6 9 9 A D E > -A 156 0A 0 -2,-0.5 3,-1.9 72,-0.5 6,-0.2 -0.334 21.8-126.7 -60.5 141.1 2.4 -11.9 17.7 10 10 A V T 3 S+ 0 0 2 145,-1.4 5,-0.2 1,-0.3 -1,-0.1 0.748 108.0 62.0 -62.3 -31.1 -0.2 -14.5 16.5 11 11 A V T 3 S+ 0 0 53 66,-0.2 -1,-0.3 68,-0.1 69,-0.2 0.576 85.2 99.9 -72.2 -7.9 1.1 -17.0 19.0 12 12 A b S X S- 0 0 0 -3,-1.9 3,-2.3 67,-0.1 4,-0.3 -0.136 98.7 -93.6 -70.4 170.0 0.1 -14.6 21.9 13 13 A P G > S+ 0 0 87 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.810 120.3 74.2 -58.8 -25.9 -3.2 -15.2 23.8 14 14 A E G 3 S+ 0 0 68 1,-0.3 -4,-0.1 -5,-0.2 -3,-0.1 0.711 90.2 59.8 -59.7 -21.8 -5.0 -12.8 21.4 15 15 A G G X S+ 0 0 0 -3,-2.3 3,-2.2 -6,-0.2 -1,-0.3 0.592 77.1 116.0 -81.9 -9.8 -4.8 -15.5 18.8 16 16 A D T < S+ 0 0 100 -3,-2.2 -4,-0.0 -4,-0.3 -5,-0.0 -0.386 82.3 20.0 -61.9 137.2 -6.8 -18.0 20.9 17 17 A G T 3 S+ 0 0 57 -2,-0.0 -1,-0.3 1,-0.0 3,-0.1 0.325 118.2 70.4 86.7 -12.1 -10.0 -18.9 19.2 18 18 A R <> + 0 0 56 -3,-2.2 4,-2.1 2,-0.1 -2,-0.2 0.098 55.4 117.7-120.3 19.1 -8.6 -17.7 15.8 19 19 A R T 4 S+ 0 0 93 1,-0.2 4,-0.4 2,-0.2 -3,-0.1 0.645 76.5 53.0 -68.0 -14.5 -6.0 -20.5 15.2 20 20 A D T >4 S+ 0 0 41 2,-0.2 3,-1.4 1,-0.1 4,-0.2 0.935 110.9 42.3 -81.2 -58.1 -7.8 -21.6 12.0 21 21 A I G >4 S+ 0 0 1 1,-0.3 3,-2.0 2,-0.2 4,-0.5 0.818 103.5 66.8 -64.6 -28.1 -7.9 -18.1 10.3 22 22 A I G >< S+ 0 0 6 -4,-2.1 3,-1.1 1,-0.3 -1,-0.3 0.874 98.1 56.4 -56.1 -34.8 -4.3 -17.4 11.3 23 23 A R G < S+ 0 0 39 -3,-1.4 107,-1.0 -4,-0.4 -1,-0.3 0.421 95.0 65.7 -79.4 2.8 -3.4 -20.3 8.9 24 24 A A G < S+ 0 0 0 -3,-2.0 16,-2.3 105,-0.2 2,-0.4 0.608 86.1 89.2 -93.3 -13.9 -5.1 -18.6 5.9 25 25 A V E < +J 39 0B 0 -3,-1.1 49,-0.5 -4,-0.5 2,-0.3 -0.698 50.8 174.7 -94.4 138.0 -2.7 -15.7 5.8 26 26 A G E -JK 38 73B 0 12,-2.6 12,-2.4 -2,-0.4 2,-0.3 -0.937 24.8-134.1-137.3 156.8 0.6 -15.6 3.8 27 27 A A E -JK 37 72B 0 45,-2.0 45,-3.1 -2,-0.3 2,-0.3 -0.756 31.4-166.7 -95.8 154.9 3.3 -13.0 3.1 28 28 A Y E -JK 36 71B 0 8,-2.4 7,-3.0 -2,-0.3 8,-1.4 -0.991 18.9-136.9-150.8 159.2 4.5 -12.7 -0.6 29 29 A S E -JK 34 70B 0 41,-2.4 41,-1.2 -2,-0.3 2,-0.4 -0.743 11.2-151.0-106.3 150.3 7.2 -11.2 -2.8 30 30 A K E > S-J 33 0B 76 3,-2.5 3,-2.0 -2,-0.3 39,-0.1 -1.000 85.1 -11.5-121.7 121.4 6.7 -9.5 -6.2 31 31 A S T 3 S- 0 0 88 -2,-0.4 38,-0.1 34,-0.3 -1,-0.1 0.886 133.5 -52.9 53.3 37.2 9.5 -9.8 -8.6 32 32 A G T 3 S+ 0 0 60 36,-0.5 2,-0.4 1,-0.2 -1,-0.3 0.141 116.9 105.1 87.0 -14.0 11.7 -11.2 -5.8 33 33 A T E < S-J 30 0B 105 -3,-2.0 -3,-2.5 1,-0.0 -1,-0.2 -0.836 79.2-107.3-103.9 133.2 11.1 -8.4 -3.2 34 34 A L E +J 29 0B 70 -2,-0.4 -5,-0.3 -5,-0.3 -1,-0.0 -0.294 53.9 154.1 -55.9 134.6 8.8 -8.8 -0.2 35 35 A A E - 0 0 27 -7,-3.0 2,-0.3 1,-0.4 159,-0.2 0.725 41.8 -17.4-134.7 -52.0 5.7 -6.7 -0.9 36 36 A c E -J 28 0B 9 -8,-1.4 -8,-2.4 157,-0.1 -1,-0.4 -0.881 53.4-101.4-150.7-174.0 2.3 -7.4 0.6 37 37 A T E +J 27 0B 0 157,-2.8 18,-0.4 -2,-0.3 2,-0.3 -0.847 31.8 167.9-114.3 154.4 0.0 -9.8 2.4 38 38 A G E -J 26 0B 0 -12,-2.4 -12,-2.6 -2,-0.3 2,-0.3 -0.901 14.3-149.2-151.1-178.6 -2.8 -12.0 1.1 39 39 A S E -JL 25 53B 1 14,-1.8 14,-3.1 -2,-0.3 2,-0.3 -0.996 21.4-101.5-156.9 155.4 -5.0 -14.9 2.3 40 40 A L E - L 0 52B 0 -16,-2.3 92,-2.1 90,-0.4 2,-0.4 -0.640 32.4-163.4 -79.5 142.0 -6.9 -17.9 1.2 41 41 A V B -p 132 0C 3 10,-2.0 10,-0.4 -2,-0.3 92,-0.2 -0.937 15.1-127.7-126.9 140.6 -10.7 -17.9 0.9 42 42 A N - 0 0 2 90,-3.4 2,-0.3 -2,-0.4 90,-0.1 -0.334 21.2-152.6 -76.2 165.4 -13.2 -20.7 0.6 43 43 A N > - 0 0 2 -2,-0.1 3,-2.2 88,-0.1 206,-0.2 -0.900 33.0 -98.0-134.0 165.1 -15.7 -20.9 -2.2 44 44 A T T 3 S+ 0 0 19 204,-2.6 205,-0.1 1,-0.3 204,-0.1 0.677 119.8 61.6 -67.0 -13.9 -19.2 -22.5 -2.3 45 45 A A T 3 S- 0 0 48 203,-0.1 -1,-0.3 4,-0.0 204,-0.1 0.552 95.0-143.8 -83.2 -9.4 -17.9 -25.7 -4.0 46 46 A N < + 0 0 82 -3,-2.2 -2,-0.1 1,-0.1 -4,-0.1 0.846 54.1 136.3 49.2 46.1 -15.7 -26.3 -0.9 47 47 A D - 0 0 74 214,-0.0 -1,-0.1 -4,-0.0 -3,-0.1 0.281 69.2-115.5-110.1 10.8 -12.9 -27.7 -3.2 48 48 A R + 0 0 105 1,-0.2 75,-0.4 -5,-0.2 -6,-0.1 0.689 47.0 173.9 62.4 22.0 -9.7 -26.1 -1.8 49 49 A K - 0 0 80 1,-0.2 2,-2.2 73,-0.1 -1,-0.2 -0.353 43.0-113.0 -53.7 146.5 -9.1 -24.1 -4.9 50 50 A M + 0 0 7 69,-0.3 69,-2.5 -10,-0.1 2,-0.5 -0.231 51.4 165.7 -89.7 58.4 -6.0 -21.9 -4.1 51 51 A Y E - M 0 118B 10 -2,-2.2 -10,-2.0 -10,-0.4 2,-0.6 -0.657 14.1-171.2 -78.0 117.1 -7.9 -18.6 -4.3 52 52 A F E -LM 40 117B 0 65,-2.7 65,-2.9 -2,-0.5 2,-0.4 -0.967 7.0-154.7-119.8 107.9 -5.7 -15.9 -2.7 53 53 A L E +LM 39 116B 6 -14,-3.1 -14,-1.8 -2,-0.6 2,-0.2 -0.718 27.2 146.8 -87.3 136.5 -7.2 -12.5 -2.0 54 54 A T E - M 0 115B 0 61,-2.8 61,-2.5 -2,-0.4 2,-0.4 -0.785 48.8 -69.6-149.7-171.9 -4.9 -9.5 -1.9 55 55 A A E > - M 0 114B 0 -18,-0.4 3,-1.9 59,-0.3 5,-0.4 -0.797 26.9-138.0 -93.6 137.9 -5.0 -5.7 -2.7 56 56 A H G > S+ 0 0 62 57,-1.2 3,-2.5 -2,-0.4 5,-0.4 0.848 102.0 64.6 -58.2 -40.1 -5.1 -4.4 -6.3 57 57 A H G 3 S+ 0 0 82 1,-0.3 -1,-0.3 56,-0.3 57,-0.1 0.674 85.1 73.6 -65.0 -12.6 -2.6 -1.6 -5.3 58 58 A c G < S- 0 0 6 -3,-1.9 -1,-0.3 -21,-0.1 -2,-0.2 0.600 106.0-126.8 -72.8 -15.8 0.0 -4.3 -4.6 59 59 A G S < S+ 0 0 27 -3,-2.5 3,-0.2 -4,-0.2 -2,-0.1 0.681 73.2 121.5 87.1 17.3 0.3 -4.7 -8.4 60 60 A M + 0 0 0 -5,-0.4 2,-0.3 1,-0.2 6,-0.1 0.348 42.7 98.8 -92.1 -0.2 -0.3 -8.5 -8.8 61 61 A G + 0 0 19 -5,-0.4 2,-0.3 -6,-0.1 -1,-0.2 -0.077 67.2 81.0 -82.1 32.8 -3.3 -8.1 -11.1 62 62 A T S > S- 0 0 73 -2,-0.3 4,-2.9 -3,-0.2 5,-0.3 -0.963 85.7-118.2-129.3 149.9 -1.3 -8.7 -14.3 63 63 A A H > S+ 0 0 84 -2,-0.3 4,-1.7 1,-0.2 40,-0.2 0.902 112.7 48.3 -54.3 -44.2 -0.3 -12.1 -15.8 64 64 A S H > S+ 0 0 101 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.901 115.2 41.2 -65.2 -43.9 3.4 -11.2 -15.6 65 65 A T H >4 S+ 0 0 31 1,-0.2 3,-0.8 2,-0.2 4,-0.4 0.922 113.5 53.5 -73.9 -36.9 3.4 -10.0 -12.0 66 66 A A H >< S+ 0 0 0 -4,-2.9 3,-1.3 1,-0.3 37,-0.6 0.873 104.2 56.9 -60.3 -37.7 1.2 -12.7 -10.8 67 67 A A H 3< S+ 0 0 61 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.813 102.7 57.4 -66.2 -24.3 3.6 -15.3 -12.3 68 68 A S T << S+ 0 0 36 -4,-0.9 -36,-0.5 -3,-0.8 -1,-0.3 0.439 79.4 123.6 -85.6 -4.2 6.4 -13.9 -10.2 69 69 A I < - 0 0 1 -3,-1.3 33,-2.6 -4,-0.4 2,-0.4 -0.246 38.2-170.6 -61.4 144.2 4.8 -14.4 -6.8 70 70 A V E -KN 29 101B 29 -41,-1.2 -41,-2.4 31,-0.2 2,-0.4 -0.991 12.4-155.4-126.4 126.0 6.4 -16.4 -4.0 71 71 A V E -KN 28 100B 1 29,-3.1 29,-1.5 -2,-0.4 2,-0.6 -0.857 1.0-155.8 -99.0 143.8 4.1 -17.0 -1.0 72 72 A Y E -KN 27 99B 43 -45,-3.1 -45,-2.0 -2,-0.4 3,-0.4 -0.959 14.3-162.3-119.7 111.3 5.7 -17.6 2.5 73 73 A W E +K 26 0B 2 25,-2.9 25,-0.5 -2,-0.6 -47,-0.1 -0.640 65.2 14.2 -91.9 153.7 3.4 -19.6 4.8 74 74 A N S S+ 0 0 39 -49,-0.5 2,-1.0 -2,-0.2 21,-0.4 0.811 74.3 158.2 56.6 39.1 3.6 -19.8 8.6 75 75 A Y + 0 0 11 -3,-0.4 80,-2.4 19,-0.1 2,-0.3 -0.809 25.1 120.7 -96.7 101.2 6.0 -16.9 8.9 76 76 A Q - 0 0 45 -2,-1.0 19,-0.3 78,-0.3 80,-0.1 -0.987 68.5 -79.9-160.6 156.8 5.6 -15.8 12.6 77 77 A N - 0 0 7 78,-0.4 -66,-0.2 -2,-0.3 15,-0.0 -0.336 34.4-135.7 -64.0 142.7 7.6 -15.4 15.8 78 78 A S S S+ 0 0 85 1,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.761 86.6 32.8 -74.6 -20.4 8.1 -18.7 17.7 79 79 A T S S- 0 0 86 -67,-0.0 2,-0.7 0, 0.0 -67,-0.1 -0.922 93.8 -97.8-136.3 152.5 7.2 -17.1 21.1 80 80 A b - 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