==== 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 26-OCT-90 1P11 . COMPND 2 MOLECULE: ALPHA-LYTIC PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LYSOBACTER ENZYMOGENES; . AUTHOR R.BONE,D.A.AGARD . 205 4 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7859.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 140 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 4.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 40.0 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 . 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 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 3.9 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 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 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 3 3 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 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 15AE A 0 0 55 0, 0.0 73,-2.3 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 155.5 22.7 11.7 6.5 2 15BE N E -a 74 0A 98 71,-0.2 2,-0.8 73,-0.0 73,-0.2 -0.849 360.0-139.6 -89.9 124.8 26.0 13.7 6.1 3 16 E I E +a 75 0A 0 71,-3.2 73,-1.6 -2,-0.5 2,-0.4 -0.833 33.0 163.8 -93.9 111.2 25.9 16.3 8.8 4 17 E V E > - 0 0 13 -2,-0.8 3,-1.6 71,-0.1 15,-0.3 -0.942 44.7 -98.5-125.4 144.3 27.2 19.7 7.5 5 18 E G E 3 S+a 79 0A 0 73,-3.1 75,-3.1 -2,-0.4 15,-0.2 -0.344 105.3 27.3 -59.5 139.9 26.8 23.1 9.2 6 19 E G T 3 S+ 0 0 4 13,-3.4 -1,-0.2 1,-0.3 102,-0.1 0.246 85.7 126.8 96.4 -14.4 23.9 25.1 7.8 7 29 E I < - 0 0 43 -3,-1.6 12,-2.3 1,-0.1 -1,-0.3 -0.362 62.1-100.4 -82.9 160.1 21.6 22.3 6.5 8 30 E E E +C 18 0B 82 10,-0.2 2,-0.3 -2,-0.1 10,-0.2 -0.377 38.7 171.6 -74.3 148.7 17.9 22.0 7.4 9 31 E Y E -C 17 0B 2 8,-2.1 8,-2.4 37,-0.1 2,-0.3 -0.963 22.2-136.1-144.7 156.0 16.6 19.6 10.0 10 32 E S E -CD 16 45B 21 35,-2.1 35,-2.0 -2,-0.3 2,-0.5 -0.801 8.7-140.2-114.1 158.0 13.0 19.5 11.4 11 33 E I E >> S-CD 15 44B 9 4,-2.1 3,-2.3 -2,-0.3 4,-0.8 -0.988 80.4 -19.3-118.7 122.7 11.9 19.1 15.1 12 34 E N T 34 S- 0 0 83 31,-2.5 -1,-0.2 -2,-0.5 32,-0.1 0.802 117.7 -68.0 47.8 38.3 9.0 16.8 15.9 13 35 E N T 34 S+ 0 0 118 30,-0.4 -1,-0.3 1,-0.1 3,-0.1 0.739 129.5 71.3 57.0 26.2 7.8 17.1 12.3 14 39 E A T <4 S+ 0 0 75 -3,-2.3 -2,-0.2 1,-0.4 -1,-0.1 0.485 79.4 47.7-130.4 -82.1 7.0 20.7 12.8 15 40 E S E < -C 11 0B 55 -4,-0.8 -4,-2.1 22,-0.1 2,-0.4 -0.251 63.8-141.3 -69.9 155.8 9.6 23.4 13.2 16 41 E L E +C 10 0B 37 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.933 26.1 161.7-118.5 143.5 12.7 23.9 11.0 17 42 E a E -C 9 0B 4 -8,-2.4 -8,-2.1 -2,-0.4 2,-0.4 -0.831 32.8-112.5-141.6-179.0 16.1 24.9 12.2 18 43 E S E -C 8 0B 0 125,-3.2 16,-0.3 -2,-0.3 -10,-0.2 -0.936 29.9-107.9-119.5 152.1 19.7 24.7 10.8 19 44 E V - 0 0 0 -12,-2.3 -13,-3.4 -2,-0.4 127,-1.0 -0.457 26.0-166.5 -73.0 142.4 22.6 22.5 12.0 20 45 E G - 0 0 0 12,-2.0 2,-0.3 125,-0.3 126,-0.3 0.946 58.1 -23.1 -91.1 -79.7 25.4 24.5 13.7 21 46 E F E -E 32 0B 3 11,-0.9 11,-2.2 -16,-0.1 -1,-0.3 -0.998 55.7-113.0-142.9 143.1 28.4 22.2 14.0 22 47 E S E +E 31 0B 5 54,-0.5 174,-2.1 -2,-0.3 2,-0.3 -0.566 47.5 166.8 -68.2 137.4 29.3 18.5 14.0 23 48 E V E -EF 30 195B 0 7,-2.6 7,-2.1 -2,-0.3 2,-0.3 -0.915 26.4-139.9-145.5 164.4 30.7 17.5 17.4 24 48AE T E -EF 29 194B 48 170,-2.4 170,-2.9 -2,-0.3 2,-0.4 -0.948 5.9-165.1-129.3 154.5 31.5 14.4 19.4 25 48BE R E > S-E 28 0B 119 3,-2.7 3,-2.2 -2,-0.3 168,-0.1 -0.856 74.4 -58.3-130.4 87.2 31.0 13.6 23.1 26 48CE G T 3 S- 0 0 70 -2,-0.4 -1,-0.2 1,-0.3 168,-0.1 -0.472 121.9 -17.5 69.9-139.2 33.2 10.5 23.6 27 48DE A T 3 S+ 0 0 106 -3,-0.1 2,-0.3 -2,-0.1 -1,-0.3 0.525 117.6 105.0 -76.8 -7.5 31.9 7.9 21.1 28 49 E T E < -E 25 0B 52 -3,-2.2 -3,-2.7 40,-0.0 2,-0.3 -0.643 62.1-147.2 -78.6 133.3 28.6 9.8 20.7 29 50 E K E +EG 24 69B 61 40,-0.5 40,-2.6 -2,-0.3 2,-0.3 -0.679 32.9 149.2 -93.0 151.8 28.1 11.8 17.5 30 51 E G E -EG 23 68B 0 -7,-2.1 -7,-2.6 -2,-0.3 2,-0.3 -0.958 36.4-131.7-164.3 176.3 26.1 15.0 17.8 31 52 E F E -EG 22 67B 0 36,-1.6 36,-2.5 -2,-0.3 2,-0.3 -0.984 21.5-128.4-137.4 147.8 25.6 18.5 16.4 32 53 E V E +EG 21 66B 0 -11,-2.2 -12,-2.0 -2,-0.3 -11,-0.9 -0.643 40.4 150.6 -92.5 147.8 25.3 21.8 18.3 33 54 E T E - G 0 65B 0 32,-2.5 32,-1.9 -2,-0.3 2,-0.2 -0.838 47.5 -54.9-155.7-167.3 22.3 24.1 17.5 34 55 E A > - 0 0 0 -16,-0.3 3,-0.7 30,-0.3 4,-0.3 -0.592 34.3-137.9 -87.8 144.8 20.0 26.7 19.1 35 56 E G G > S+ 0 0 0 23,-0.3 3,-1.2 1,-0.3 24,-0.2 0.830 102.3 65.7 -68.4 -32.9 18.1 25.9 22.3 36 57 E H G 3 S+ 0 0 65 1,-0.3 -1,-0.3 22,-0.2 23,-0.1 0.790 88.6 72.6 -62.2 -27.4 15.0 27.6 20.9 37 58 E a G < S- 0 0 8 -3,-0.7 2,-0.3 1,-0.1 -1,-0.3 0.712 109.6 -13.4 -60.0 -33.1 14.8 24.8 18.3 38 59 E G < - 0 0 7 -3,-1.2 2,-0.2 -4,-0.3 -1,-0.1 -0.983 58.5-112.7-162.1 166.4 13.7 21.9 20.5 39 62 E T > - 0 0 74 -2,-0.3 3,-3.0 1,-0.2 15,-0.4 -0.633 60.3 -69.6-102.4 165.8 13.1 20.5 24.0 40 63 E V T 3 S+ 0 0 71 1,-0.3 15,-0.2 -2,-0.2 -1,-0.2 -0.222 124.0 16.4 -50.4 140.5 15.0 17.6 25.5 41 64 E N T 3 S+ 0 0 119 13,-3.2 -1,-0.3 1,-0.3 14,-0.1 0.306 86.4 145.2 72.1 0.9 14.1 14.4 23.7 42 65 E A < - 0 0 3 -3,-3.0 12,-2.1 1,-0.1 2,-0.5 -0.336 53.5-113.5 -66.0 150.9 12.5 16.2 20.7 43 65AE T E - H 0 53B 37 10,-0.2 -31,-2.5 -3,-0.1 -30,-0.4 -0.755 25.4-156.3 -88.5 124.8 13.1 14.2 17.4 44 66 E A E -DH 11 52B 0 8,-2.4 7,-2.5 -2,-0.5 8,-1.2 -0.840 10.8-170.7-103.4 139.7 15.3 15.7 14.7 45 67 E R E -DH 10 50B 50 -35,-2.0 -35,-2.1 -2,-0.4 2,-0.5 -0.969 11.3-161.5-128.7 146.2 14.9 14.6 11.1 46 80 E I E > S- H 0 49B 24 3,-2.5 3,-2.0 -2,-0.4 -37,-0.1 -0.998 82.6 -11.7-128.6 122.7 17.0 15.3 8.0 47 81 E G T 3 S- 0 0 86 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.872 131.4 -53.7 53.5 45.4 15.4 14.7 4.7 48 82 E G T 3 S+ 0 0 67 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.250 114.8 110.5 75.1 -8.1 12.6 12.9 6.3 49 83 E A E < S-H 46 0B 55 -3,-2.0 -3,-2.5 1,-0.0 2,-0.2 -0.810 74.0-112.0-102.9 142.5 14.7 10.4 8.3 50 84 E V E +H 45 0B 74 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.522 38.4 170.1 -65.8 127.6 15.1 10.4 12.1 51 85 E V E - 0 0 1 -7,-2.5 19,-2.3 1,-0.4 2,-0.3 0.600 55.4 -53.5-118.6 -18.8 18.8 11.3 12.8 52 86 E G E -HI 44 69B 5 -8,-1.2 -8,-2.4 17,-0.3 -1,-0.4 -0.965 52.0 -97.8 169.5-166.6 18.7 11.8 16.6 53 87 E T E -HI 43 68B 51 15,-1.9 15,-2.4 -2,-0.3 2,-0.3 -0.942 43.4 -84.8-141.7 162.5 17.1 13.6 19.5 54 88 E F E - I 0 67B 0 -12,-2.1 -13,-3.2 -15,-0.4 13,-0.3 -0.608 38.0-174.7 -65.8 120.9 17.8 16.7 21.6 55 89 E A E - 0 0 34 11,-2.6 2,-0.3 1,-0.3 12,-0.2 0.775 64.9 -14.3 -92.3 -28.0 20.1 15.6 24.4 56 90 E A E + I 0 66B 20 10,-1.3 10,-1.7 -17,-0.1 -1,-0.3 -0.955 62.5 175.4-162.1 156.1 20.2 18.9 26.3 57 91 E R E - I 0 65B 72 -2,-0.3 2,-0.4 8,-0.2 8,-0.3 -0.967 17.5-154.0-159.9 157.9 19.2 22.6 25.8 58 93 E V E - I 0 64B 38 6,-2.7 6,-1.9 -2,-0.3 -23,-0.3 -0.974 25.5-178.5-132.7 123.6 19.1 25.9 27.7 59 94 E F + 0 0 21 -2,-0.4 2,-0.2 4,-0.2 4,-0.1 -0.776 54.5 16.6-170.0 136.8 16.6 28.6 26.5 60 99AE P S S+ 0 0 48 0, 0.0 2,-1.4 0, 0.0 68,-0.2 0.625 121.8 44.1 -77.6-156.2 15.8 31.4 27.3 61 100 E G B S+j 128 0C 37 66,-2.4 68,-2.5 -2,-0.2 2,-0.2 -0.585 135.1 9.1 94.4 -72.8 18.7 32.7 29.5 62 101 E N S S- 0 0 54 -2,-1.4 2,-0.2 66,-0.2 68,-0.1 -0.606 78.9-133.7-120.6-176.4 21.2 31.2 27.0 63 102 E D + 0 0 0 -2,-0.2 2,-0.3 -4,-0.1 119,-0.2 -0.637 54.0 116.4-146.3 80.9 20.2 29.8 23.6 64 103 E R E + I 0 58B 19 -6,-1.9 -6,-2.7 -30,-0.3 2,-0.3 -0.988 23.9 158.5-148.4 158.0 22.0 26.4 23.0 65 104 E A E -GI 33 57B 0 -32,-1.9 -32,-2.5 -2,-0.3 2,-0.3 -0.968 21.8-144.3-163.9 169.4 21.5 22.7 22.5 66 105 E W E -GI 32 56B 9 -10,-1.7 -11,-2.6 -2,-0.3 -10,-1.3 -0.988 12.6-146.9-140.6 146.4 23.1 19.6 21.2 67 106 E V E -GI 31 54B 0 -36,-2.5 -36,-1.6 -2,-0.3 2,-0.5 -0.971 13.4-139.1-112.3 125.7 21.4 16.7 19.4 68 107 E S E -GI 30 53B 30 -15,-2.4 -15,-1.9 -2,-0.5 -38,-0.3 -0.774 26.0-152.8 -90.1 134.2 22.8 13.2 19.9 69 108 E L E -GI 29 52B 15 -40,-2.6 -40,-0.5 -2,-0.5 -17,-0.3 -0.630 18.7 -98.4-101.9 164.3 22.7 11.3 16.6 70 109 E T > - 0 0 65 -19,-2.3 3,-1.9 -2,-0.2 -1,-0.1 -0.342 39.8-109.3 -74.6 159.4 22.5 7.7 15.7 71 110 E S T 3 S+ 0 0 103 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.702 113.5 72.6 -66.4 -14.3 25.9 6.0 14.9 72 111 E A T 3 S+ 0 0 75 -21,-0.1 -1,-0.3 2,-0.1 2,-0.1 0.650 76.8 97.3 -75.1 -15.2 24.7 5.8 11.3 73 112 E Q S < S- 0 0 12 -3,-1.9 2,-0.6 -22,-0.2 -71,-0.2 -0.343 70.7-134.2 -69.9 151.5 25.2 9.6 10.7 74 113 E T E -a 2 0A 62 -73,-2.3 -71,-3.2 -2,-0.1 2,-0.3 -0.940 14.9-150.5-109.7 116.0 28.4 10.9 9.1 75 114 E L E -a 3 0A 28 -2,-0.6 -71,-0.1 -73,-0.2 -44,-0.0 -0.673 15.4-170.4 -85.6 139.0 29.9 13.9 10.9 76 115 E L E - 0 0 37 -73,-1.6 2,-1.7 -2,-0.3 -54,-0.5 -0.970 30.0-131.1-130.1 146.0 31.8 16.3 8.7 77 116 E P E S+ 0 0 16 0, 0.0 11,-2.8 0, 0.0 2,-0.3 -0.401 74.7 104.8 -86.6 52.0 34.1 19.2 9.6 78 117 E R E - B 0 87A 90 -2,-1.7 -73,-3.1 -75,-0.3 2,-0.4 -0.956 55.6-152.2-140.0 156.1 32.3 21.5 7.1 79 118 E V E -aB 5 86A 0 7,-2.0 7,-2.4 -2,-0.3 2,-0.2 -0.988 35.3-110.4-123.4 137.3 29.8 24.3 6.8 80 119 E A E + B 0 85A 18 -75,-3.1 2,-0.3 -2,-0.4 5,-0.2 -0.414 32.8 174.8 -70.7 135.8 27.7 24.8 3.6 81 120 E N E > - 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