==== 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 24-APR-89 1P10 . COMPND 2 MOLECULE: ALPHA-LYTIC PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LYSOBACTER ENZYMOGENES; . AUTHOR R.BONE,D.A.AGARD . 201 2 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7862.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 132 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 40.3 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 . 4 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 2.0 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 . 10 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 3.5 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 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 0 RESIDUES PER ALPHA HELIX . 2 0 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 PARALLEL BRIDGES PER LADDER . 2 3 2 4 2 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 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 15AA A 0 0 54 0, 0.0 73,-2.0 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 153.9 22.6 11.7 6.5 2 15BA N E -a 74 0A 97 71,-0.2 2,-0.8 73,-0.0 73,-0.2 -0.844 360.0-135.5 -91.8 125.8 25.9 13.7 6.1 3 16 A I E +a 75 0A 0 71,-3.5 73,-1.7 -2,-0.5 2,-0.4 -0.838 35.7 163.7 -92.8 109.5 26.0 16.3 8.9 4 17 A V E > - 0 0 12 -2,-0.8 3,-1.6 71,-0.1 15,-0.3 -0.950 43.3-102.1-123.4 142.2 27.1 19.6 7.5 5 18 A G E 3 S+a 79 0A 0 73,-3.3 75,-3.6 -2,-0.4 15,-0.2 -0.341 103.9 26.6 -59.4 141.7 26.7 23.1 9.1 6 19 A G T 3 S+ 0 0 4 13,-2.9 -1,-0.2 1,-0.3 102,-0.2 0.216 86.8 125.2 95.0 -15.1 23.9 25.1 7.7 7 29 A I < - 0 0 46 -3,-1.6 12,-2.4 97,-0.1 -1,-0.3 -0.366 62.0-100.2 -84.2 157.8 21.5 22.3 6.4 8 30 A E E +C 18 0B 83 10,-0.2 2,-0.3 -2,-0.1 10,-0.2 -0.443 37.9 171.1 -76.7 147.4 17.9 22.0 7.4 9 31 A Y E -C 17 0B 1 8,-1.9 8,-2.3 -2,-0.1 2,-0.3 -0.940 21.6-139.0-146.9 152.5 16.5 19.6 10.0 10 32 A S E -CD 16 45B 19 35,-2.0 35,-1.8 -2,-0.3 2,-0.4 -0.732 9.1-139.6-111.6 161.8 12.9 19.4 11.4 11 33 A I E >> S-CD 15 44B 7 4,-1.8 3,-1.8 -2,-0.3 4,-0.7 -0.991 80.4 -16.6-124.2 122.7 11.9 18.8 15.1 12 34 A N T 34 S- 0 0 88 31,-2.6 -1,-0.1 -2,-0.4 32,-0.1 0.834 117.9 -69.9 48.7 40.9 8.9 16.6 15.9 13 35 A N T 34 S+ 0 0 115 30,-0.4 -1,-0.3 1,-0.1 3,-0.1 0.700 127.4 73.1 52.9 28.4 7.8 16.9 12.3 14 39 A A T <4 S+ 0 0 77 -3,-1.8 -2,-0.2 1,-0.3 -1,-0.1 0.522 80.1 43.9-128.9 -88.5 6.9 20.6 12.8 15 40 A S E < -C 11 0B 71 -4,-0.7 -4,-1.8 22,-0.1 2,-0.4 -0.149 63.9-141.6 -65.5 163.1 9.5 23.4 13.2 16 41 A L E +C 10 0B 66 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.946 25.2 161.6-124.5 144.7 12.6 23.8 11.0 17 42 A a E -C 9 0B 6 -8,-2.3 -8,-1.9 -2,-0.4 2,-0.3 -0.840 33.9-106.6-146.5-179.2 16.1 24.9 12.2 18 43 A S E -C 8 0B 0 125,-2.6 16,-0.3 -2,-0.3 -10,-0.2 -0.907 31.4-106.3-120.2 147.1 19.6 24.7 10.8 19 44 A V - 0 0 0 -12,-2.4 -13,-2.9 -2,-0.3 127,-0.9 -0.460 27.5-165.1 -69.1 138.9 22.5 22.5 11.9 20 45 A G - 0 0 0 12,-1.9 2,-0.3 125,-0.3 126,-0.3 0.908 56.6 -30.6 -83.7 -83.8 25.3 24.4 13.7 21 46 A F E -E 32 0B 4 11,-0.9 11,-2.2 -16,-0.1 -1,-0.3 -0.995 56.1-111.3-145.5 142.2 28.4 22.2 13.9 22 47 A S E +E 31 0B 4 54,-0.5 174,-2.4 -2,-0.3 2,-0.3 -0.548 47.3 166.1 -69.8 136.0 29.2 18.5 14.0 23 48 A V E -EF 30 195B 0 7,-2.3 7,-1.8 172,-0.3 2,-0.3 -0.883 25.1-138.6-145.3 170.4 30.7 17.5 17.4 24 48AA T E -EF 29 194B 47 170,-2.2 170,-2.6 -2,-0.3 2,-0.3 -0.904 5.5-161.5-135.0 160.5 31.4 14.4 19.4 25 48BA R E > S-E 28 0B 117 3,-2.7 3,-2.0 -2,-0.3 2,-0.1 -0.841 72.9 -58.8-137.8 87.2 31.0 13.4 23.0 26 48CA G T 3 S- 0 0 70 -2,-0.3 -1,-0.3 1,-0.3 168,-0.1 -0.492 122.9 -17.5 66.4-137.4 33.3 10.4 23.6 27 48DA A T 3 S+ 0 0 107 -3,-0.1 2,-0.4 -2,-0.1 -1,-0.3 0.453 118.2 101.8 -75.6 -3.7 31.9 7.8 21.1 28 49 A T E < -E 25 0B 58 -3,-2.0 -3,-2.7 40,-0.0 2,-0.2 -0.719 62.7-144.0 -90.0 138.0 28.6 9.7 20.6 29 50 A K E +E 24 0B 64 40,-0.5 40,-2.1 -2,-0.4 2,-0.3 -0.586 32.9 144.7 -91.8 152.0 28.0 11.8 17.5 30 51 A G E -EG 23 68B 0 -7,-1.8 -7,-2.3 38,-0.3 2,-0.3 -0.956 37.0-129.6-168.0-178.2 26.0 15.0 17.6 31 52 A F E -EG 22 67B 0 36,-1.3 36,-2.2 -2,-0.3 2,-0.3 -0.967 23.9-125.5-146.4 147.9 25.6 18.6 16.3 32 53 A V E +EG 21 66B 0 -11,-2.2 -12,-1.9 -2,-0.3 -11,-0.9 -0.686 40.8 151.7 -96.5 149.5 25.2 21.8 18.3 33 54 A T E - G 0 65B 0 32,-2.6 32,-2.0 -2,-0.3 2,-0.3 -0.837 46.5 -53.3-155.8-168.8 22.2 24.0 17.6 34 55 A A > - 0 0 0 -16,-0.3 3,-1.9 30,-0.2 4,-0.3 -0.676 35.0-138.5 -88.9 137.7 19.9 26.6 19.2 35 56 A G G > S+ 0 0 0 23,-0.4 3,-1.2 -2,-0.3 24,-0.2 0.812 101.5 61.8 -60.8 -39.1 18.0 25.8 22.4 36 57 A H G 3 S+ 0 0 41 1,-0.3 -1,-0.3 22,-0.2 3,-0.1 0.564 88.4 77.1 -69.2 -9.3 14.8 27.3 21.2 37 58 A a G < S- 0 0 11 -3,-1.9 2,-0.3 1,-0.1 -1,-0.3 0.717 109.1 -14.6 -72.6 -28.7 14.7 24.8 18.4 38 59 A G < - 0 0 9 -3,-1.2 2,-0.3 -4,-0.3 -1,-0.1 -0.984 60.7-114.2-158.8 170.3 13.5 21.8 20.5 39 62 A T > - 0 0 76 -2,-0.3 3,-2.5 1,-0.2 15,-0.3 -0.735 61.1 -66.8-106.3 164.3 13.0 20.4 24.1 40 63 A V T 3 S+ 0 0 69 1,-0.3 15,-0.2 -2,-0.3 -1,-0.2 -0.101 123.7 16.9 -49.0 143.1 15.0 17.5 25.4 41 64 A N T 3 S+ 0 0 117 13,-3.2 -1,-0.3 1,-0.3 14,-0.1 0.321 85.5 143.2 66.6 2.5 14.0 14.2 23.6 42 65 A A < - 0 0 3 -3,-2.5 12,-2.4 1,-0.1 2,-0.5 -0.399 55.5-112.9 -64.8 151.7 12.4 16.0 20.6 43 65AA T E - H 0 53B 34 10,-0.2 -31,-2.6 -3,-0.1 -30,-0.4 -0.770 23.7-152.2 -92.9 127.7 13.1 14.1 17.4 44 66 A A E -DH 11 52B 0 8,-2.5 7,-2.0 -2,-0.5 8,-1.2 -0.810 12.9-169.1 -98.4 137.9 15.3 15.6 14.7 45 67 A R E -DH 10 50B 50 -35,-1.8 -35,-2.0 -2,-0.4 2,-0.4 -0.943 10.0-161.6-129.8 146.6 14.8 14.5 11.1 46 80 A I E > S- H 0 49B 24 3,-2.5 3,-1.9 -2,-0.3 -37,-0.1 -0.995 81.9 -14.4-133.9 113.4 17.0 15.2 8.0 47 81 A G T 3 S- 0 0 83 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.862 130.7 -52.6 61.0 44.6 15.4 14.8 4.7 48 82 A G T 3 S+ 0 0 66 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.237 116.2 110.4 78.7 -11.1 12.5 12.9 6.3 49 83 A A E < S-H 46 0B 55 -3,-1.9 -3,-2.5 1,-0.0 2,-0.3 -0.755 74.1-112.2-100.6 146.5 14.7 10.4 8.2 50 84 A V E +H 45 0B 77 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.575 38.5 168.6 -71.8 131.0 15.2 10.3 11.9 51 85 A V E - 0 0 1 -7,-2.0 19,-2.5 1,-0.4 2,-0.3 0.639 56.4 -54.5-116.4 -26.8 18.9 11.2 12.8 52 86 A G E -HI 44 69B 4 -8,-1.2 -8,-2.5 17,-0.3 -1,-0.4 -0.958 50.8 -97.8 173.5-166.8 18.7 11.7 16.6 53 87 A T E -HI 43 68B 51 15,-1.9 15,-2.5 -2,-0.3 2,-0.3 -0.939 44.6 -84.8-139.2 162.6 17.0 13.5 19.5 54 88 A F E - I 0 67B 0 -12,-2.4 -13,-3.2 -15,-0.3 13,-0.3 -0.585 38.0-174.2 -67.6 124.5 17.7 16.6 21.5 55 89 A A E - 0 0 36 11,-2.6 2,-0.3 1,-0.4 12,-0.2 0.783 64.2 -12.9 -92.0 -33.5 20.0 15.6 24.4 56 90 A A E + I 0 66B 21 10,-1.3 10,-1.7 -17,-0.1 -1,-0.4 -0.969 61.7 176.0-158.8 160.3 20.1 18.8 26.3 57 91 A R E - I 0 65B 74 -2,-0.3 2,-0.4 8,-0.2 8,-0.2 -0.976 18.9-153.0-165.6 159.4 19.2 22.5 25.9 58 93 A V E + I 0 64B 37 6,-2.5 6,-2.5 -2,-0.3 -23,-0.4 -0.951 25.8 179.8-136.5 119.3 19.1 25.8 27.7 59 94 A F + 0 0 24 -2,-0.4 2,-0.2 4,-0.2 4,-0.1 -0.801 55.5 17.9-168.7 127.8 16.5 28.4 26.6 60 99AA P S S+ 0 0 48 0, 0.0 2,-1.6 0, 0.0 68,-0.2 0.569 120.8 42.1 -85.7-152.3 15.8 31.1 27.5 61 100 A G B S+j 128 0C 33 66,-2.8 68,-2.5 -2,-0.2 2,-0.2 -0.566 136.1 11.6 92.3 -69.3 18.7 32.6 29.6 62 101 A N S S- 0 0 51 -2,-1.6 2,-0.2 66,-0.2 68,-0.1 -0.636 79.4-133.5-119.6-176.6 21.1 31.1 27.0 63 102 A D + 0 0 1 -2,-0.2 2,-0.3 -4,-0.1 -4,-0.2 -0.616 53.4 127.0-144.3 77.4 20.0 29.7 23.6 64 103 A R E + I 0 58B 20 -6,-2.5 -6,-2.5 -30,-0.3 2,-0.3 -0.981 22.1 157.1-141.7 155.0 21.8 26.3 23.2 65 104 A A E -GI 33 57B 0 -32,-2.0 -32,-2.6 -2,-0.3 2,-0.3 -0.986 20.6-152.2-162.5 164.3 21.4 22.7 22.4 66 105 A W E -GI 32 56B 11 -10,-1.7 -11,-2.6 -2,-0.3 -10,-1.3 -0.992 12.9-151.5-140.4 140.3 23.1 19.5 21.2 67 106 A V E -GI 31 54B 0 -36,-2.2 -36,-1.3 -2,-0.3 2,-0.5 -0.963 14.8-138.8-111.5 130.6 21.2 16.6 19.4 68 107 A S E -GI 30 53B 28 -15,-2.5 -15,-1.9 -2,-0.4 -38,-0.3 -0.871 23.9-151.0 -96.5 135.4 22.8 13.2 19.8 69 108 A L E - I 0 52B 13 -40,-2.1 -40,-0.5 -2,-0.5 -17,-0.3 -0.579 16.1-103.4 -98.5 160.9 22.7 11.2 16.6 70 109 A T > - 0 0 69 -19,-2.5 3,-1.8 -2,-0.2 -1,-0.1 -0.271 42.4-100.8 -74.9 168.8 22.5 7.5 15.8 71 110 A S T 3 S+ 0 0 105 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.694 114.0 71.2 -59.8 -28.6 25.7 5.8 14.7 72 111 A A T 3 S+ 0 0 75 -21,-0.1 -1,-0.3 2,-0.1 2,-0.1 0.486 75.7 101.6 -73.1 -10.0 24.7 5.8 11.0 73 112 A Q < - 0 0 11 -3,-1.8 2,-0.6 -22,-0.2 -71,-0.2 -0.463 67.0-138.9 -79.0 147.4 25.2 9.6 10.7 74 113 A T E -a 2 0A 66 -73,-2.0 -71,-3.5 -2,-0.1 2,-0.4 -0.963 14.8-150.0-107.3 110.7 28.4 10.9 9.1 75 114 A L E -a 3 0A 30 -2,-0.6 -71,-0.1 -73,-0.2 -44,-0.0 -0.718 15.7-168.5 -82.2 135.9 29.8 13.9 10.8 76 115 A L E - 0 0 35 -73,-1.7 2,-1.2 -2,-0.4 -54,-0.5 -0.947 30.7-131.4-130.6 144.5 31.8 16.3 8.7 77 116 A P E S+ 0 0 17 0, 0.0 11,-2.7 0, 0.0 2,-0.3 -0.289 75.5 103.9 -81.5 47.5 34.0 19.3 9.5 78 117 A R E - B 0 87A 91 -2,-1.2 -73,-3.3 -75,-0.3 2,-0.4 -0.949 55.0-153.3-137.5 156.7 32.2 21.5 7.0 79 118 A V E -aB 5 86A 0 7,-1.7 7,-2.1 -2,-0.3 -73,-0.2 -0.985 35.5-110.5-123.1 136.8 29.6 24.3 6.7 80 119 A A E + B 0 85A 20 -75,-3.6 2,-0.3 -2,-0.4 5,-0.2 -0.383 33.7 174.1 -71.1 141.1 27.5 24.8 3.5 81 120 A N E > - 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