==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-NOV-99 1B12 . COMPND 2 MOLECULE: SIGNAL PEPTIDASE I; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.PAETZEL,R.DALBEY,N.C.J.STRYNADKA . 898 14 3 2 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44844.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 568 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 311 34.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 101 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 94 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.8 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 4 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 . 4 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 . 9 7 17 3 15 2 8 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 . 4 4 2 0 4 4 0 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 77 A R 0 0 199 0, 0.0 2,-0.6 0, 0.0 33,-0.2 0.000 360.0 360.0 360.0 120.9 67.5 24.8 41.0 2 78 A S B -A 33 0A 66 31,-3.4 31,-2.2 2,-0.0 2,-0.2 -0.913 360.0-162.0-113.4 107.7 70.0 23.0 38.8 3 79 A F - 0 0 74 -2,-0.6 2,-0.5 29,-0.2 29,-0.1 -0.545 10.2-137.0 -87.9 152.8 69.5 23.6 35.1 4 80 A I - 0 0 89 27,-0.4 25,-2.9 25,-0.3 2,-0.4 -0.936 16.4-158.0-112.9 131.2 70.9 21.4 32.3 5 81 A Y E -C 28 0B 36 -2,-0.5 23,-0.2 23,-0.2 900,-0.0 -0.867 9.0-176.0-112.6 142.6 72.4 23.0 29.2 6 82 A E E -C 27 0B 67 21,-2.6 21,-2.0 -2,-0.4 2,-0.2 -0.998 17.9-138.0-137.9 128.3 72.9 21.4 25.8 7 83 A P E -C 26 0B 56 0, 0.0 2,-0.4 0, 0.0 19,-0.2 -0.542 20.1-163.6 -83.8 156.6 74.6 22.8 22.8 8 84 A F E -C 25 0B 25 17,-2.5 17,-2.6 -2,-0.2 2,-0.2 -0.992 15.1-135.5-143.2 135.7 73.1 22.4 19.3 9 85 A Q E -C 24 0B 144 -2,-0.4 15,-0.2 15,-0.2 12,-0.1 -0.567 17.7-139.7 -82.6 151.6 74.5 22.8 15.8 10 86 A I + 0 0 11 13,-1.8 12,-2.4 -2,-0.2 13,-0.3 -0.877 31.4 163.8-113.1 96.6 72.2 24.7 13.4 11 87 A P + 0 0 95 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.657 57.4 56.4 -90.5 -11.2 72.5 22.9 10.0 12 88 A S S S- 0 0 75 8,-0.1 3,-0.5 1,-0.0 10,-0.1 -0.852 72.3-132.8-121.9 157.3 69.4 24.3 8.3 13 89 A G > + 0 0 7 -2,-0.3 3,-1.9 1,-0.2 6,-0.1 0.261 69.4 111.4 -92.2 17.6 68.2 27.8 7.5 14 90 A S T 3 S+ 0 0 24 1,-0.3 184,-2.4 183,-0.1 -1,-0.2 0.620 79.9 49.9 -68.4 -10.8 64.6 27.7 8.7 15 91 A M T >> S+ 0 0 4 -3,-0.5 4,-2.0 4,-0.3 3,-0.6 0.140 93.6 171.5-108.6 17.4 65.3 30.1 11.6 16 92 A M T <4 + 0 0 6 -3,-1.9 146,-0.5 1,-0.3 183,-0.1 -0.398 54.2 18.5 -67.9 151.1 67.1 32.8 9.5 17 93 A P T 34 S+ 0 0 8 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 -0.985 127.4 52.3 -87.4 -2.2 68.0 35.5 10.0 18 94 A T T <4 S+ 0 0 2 -3,-0.6 2,-0.4 142,-0.2 222,-0.3 0.907 125.0 19.1 -57.9 -48.3 67.8 34.8 13.8 19 95 A L S < S- 0 0 1 -4,-2.0 2,-0.3 -6,-0.1 -4,-0.3 -0.994 80.1-156.8-126.6 131.6 69.9 31.6 13.6 20 96 A L > - 0 0 11 -2,-0.4 3,-2.6 -3,-0.1 -10,-0.2 -0.763 33.9 -89.7-108.5 156.2 72.1 30.9 10.6 21 97 A I T 3 S+ 0 0 76 -2,-0.3 3,-0.1 1,-0.3 -8,-0.1 -0.423 119.7 33.9 -57.9 130.9 73.4 27.7 9.3 22 98 A G T 3 S+ 0 0 24 -12,-2.4 205,-1.7 1,-0.4 -1,-0.3 0.230 86.0 128.1 102.6 -16.9 76.7 27.3 11.1 23 99 A D E < - D 0 226B 2 -3,-2.6 -13,-1.8 -13,-0.3 2,-0.5 -0.463 47.0-152.8 -70.0 152.0 75.6 28.9 14.4 24 100 A F E -CD 9 225B 60 201,-3.0 200,-2.2 -15,-0.2 201,-1.7 -0.979 20.5-168.4-127.6 111.6 76.2 26.8 17.5 25 101 A I E -CD 8 223B 0 -17,-2.6 -17,-2.5 -2,-0.5 2,-0.4 -0.600 20.9-129.1-105.1 167.3 73.7 27.6 20.2 26 102 A L E -CD 7 222B 1 196,-2.3 195,-3.0 -19,-0.2 196,-1.3 -0.907 24.3-161.9-111.3 137.0 73.3 26.8 23.9 27 103 A V E -CD 6 220B 0 -21,-2.0 -21,-2.6 -2,-0.4 2,-0.7 -0.978 13.4-143.6-125.1 134.5 69.9 25.5 25.0 28 104 A E E -CD 5 219B 33 191,-3.2 191,-2.4 -2,-0.4 -23,-0.2 -0.884 27.6-129.5 -96.0 111.7 68.5 25.4 28.5 29 105 A K E - D 0 218B 64 -25,-2.9 -25,-0.3 -2,-0.7 189,-0.3 -0.262 7.8-133.8 -59.5 144.7 66.5 22.2 29.0 30 106 A F S S+ 0 0 20 187,-1.5 17,-2.7 16,-0.1 2,-0.4 0.858 88.1 77.3 -69.3 -34.5 63.0 22.7 30.4 31 107 A A E + B 0 46A 40 186,-0.4 -27,-0.4 15,-0.3 2,-0.3 -0.629 64.7 165.5 -79.1 128.7 63.4 19.9 32.9 32 108 A Y E - B 0 45A 35 13,-2.7 13,-2.6 -2,-0.4 2,-0.3 -0.913 31.0-114.2-140.0 167.1 65.5 20.9 35.9 33 109 A G E -AB 2 44A 8 -31,-2.2 -31,-3.4 -2,-0.3 2,-0.3 -0.784 20.9-171.1-107.3 149.5 66.3 19.7 39.4 34 110 A I E - B 0 43A 55 9,-2.9 9,-3.7 -2,-0.3 2,-0.6 -0.993 28.5-117.0-136.0 139.6 65.5 21.3 42.8 35 111 A K E - B 0 42A 114 -2,-0.3 7,-0.2 7,-0.2 3,-0.2 -0.724 32.7-129.6 -83.9 119.2 66.8 20.3 46.2 36 112 A D > - 0 0 35 5,-2.4 3,-0.6 -2,-0.6 4,-0.4 0.008 68.5 -29.1 -56.6 166.6 63.9 19.1 48.5 37 113 A P G > S- 0 0 99 0, 0.0 3,-0.7 0, 0.0 2,-0.4 -0.105 116.1 -57.1 -36.0 130.3 63.6 20.7 52.0 38 114 A I G 3 S+ 0 0 117 1,-0.3 -2,-0.1 -3,-0.2 -3,-0.0 -0.269 119.9 29.6 -72.7 83.2 67.1 21.2 52.5 39 115 A Y G < S+ 0 0 159 -3,-0.6 -1,-0.3 -2,-0.4 3,-0.1 0.358 97.6 11.1-179.2 131.5 68.4 18.6 52.2 40 116 A Q S < S+ 0 0 98 -3,-0.7 2,-0.4 -4,-0.4 -2,-0.1 0.649 78.1 67.2-101.8 -81.5 68.1 15.6 50.5 41 117 A K - 0 0 136 -4,-0.2 -5,-2.4 1,-0.0 2,-0.6 -0.648 61.8-140.6-122.0 100.6 65.8 14.4 47.7 42 118 A T E -B 35 0A 87 -2,-0.4 2,-0.3 -7,-0.2 -7,-0.2 -0.679 23.7-156.7 -77.1 119.2 66.6 16.1 44.4 43 119 A L E -B 34 0A 64 -9,-3.7 -9,-2.9 -2,-0.6 2,-0.6 -0.753 7.9-131.9-100.9 149.5 63.2 16.7 42.8 44 120 A I E +B 33 0A 119 -2,-0.3 2,-0.2 -11,-0.2 -11,-0.2 -0.888 26.2 176.5-107.0 119.8 62.6 17.2 39.1 45 121 A E E -B 32 0A 87 -13,-2.6 -13,-2.7 -2,-0.6 2,-0.4 -0.711 18.4-140.2-112.1 165.2 60.4 20.1 37.8 46 122 A T E -B 31 0A 81 -15,-0.2 -15,-0.3 -2,-0.2 -16,-0.1 -0.976 8.9-154.3-134.3 122.6 59.6 21.1 34.2 47 123 A G - 0 0 23 -17,-2.7 -17,-0.1 -2,-0.4 -16,-0.0 -0.181 15.9-133.4 -80.4-179.7 59.5 24.7 32.9 48 124 A H - 0 0 107 -18,-0.0 -1,-0.0 -2,-0.0 171,-0.0 -0.974 20.7 -95.5-139.3 153.1 57.4 25.7 29.9 49 125 A P - 0 0 8 0, 0.0 2,-0.3 0, 0.0 6,-0.0 -0.305 32.2-143.2 -63.6 146.0 57.9 27.9 26.7 50 126 A K > - 0 0 158 1,-0.1 3,-2.3 24,-0.0 21,-0.2 -0.775 42.7 -78.8-103.7 156.7 56.8 31.5 26.8 51 127 A R T 3 S+ 0 0 48 -2,-0.3 21,-0.2 1,-0.3 3,-0.1 -0.317 120.6 20.6 -57.8 133.9 55.3 32.9 23.7 52 128 A G T 3 S+ 0 0 2 19,-3.1 -1,-0.3 1,-0.3 20,-0.2 0.284 88.1 142.1 90.8 -11.9 58.0 33.8 21.2 53 129 A D < - 0 0 31 -3,-2.3 18,-2.9 18,-0.4 2,-0.6 -0.327 55.5-124.1 -62.9 147.7 60.6 31.5 22.8 54 130 A I E -E 70 0B 14 166,-0.3 166,-2.4 16,-0.2 2,-0.4 -0.847 41.3-168.7 -91.2 123.8 63.0 29.7 20.4 55 131 A V E -EF 69 219B 0 14,-3.5 14,-2.2 -2,-0.6 2,-0.5 -0.921 25.4-146.7-125.2 141.3 62.5 26.1 21.3 56 132 A V E +EF 68 218B 0 162,-2.8 161,-3.0 -2,-0.4 162,-1.8 -0.874 34.8 160.5-100.4 134.0 64.2 22.8 20.5 57 133 A F E -EF 67 216B 0 10,-2.4 10,-3.1 -2,-0.5 2,-0.5 -0.971 46.0 -94.1-149.6 163.6 61.8 19.9 20.3 58 134 A K E -E 66 0B 74 157,-2.9 8,-0.2 -2,-0.3 6,-0.1 -0.711 49.9-109.9 -82.9 122.9 61.6 16.4 18.9 59 135 A Y > - 0 0 34 6,-2.7 3,-1.9 -2,-0.5 6,-0.3 -0.343 25.5-139.9 -53.7 114.3 59.9 16.5 15.5 60 136 A P T 3 S+ 0 0 37 0, 0.0 -1,-0.1 0, 0.0 151,-0.0 0.857 98.8 50.7 -46.9 -46.6 56.4 14.9 16.1 61 137 A E T 3 S+ 0 0 128 1,-0.3 -2,-0.1 2,-0.1 -3,-0.0 0.583 132.5 13.9 -72.7 -9.2 56.4 12.9 12.9 62 138 A D X - 0 0 60 -3,-1.9 3,-2.4 3,-0.2 -3,-0.4 -0.423 68.6-168.7-166.3 80.0 59.8 11.5 13.6 63 139 A P T 3 S+ 0 0 73 0, 0.0 -2,-0.1 0, 0.0 -4,-0.1 0.477 79.1 79.9 -50.7 -8.6 60.9 12.0 17.2 64 140 A K T 3 S+ 0 0 186 -5,-0.1 2,-0.4 -6,-0.1 -6,-0.0 0.679 86.5 67.0 -77.9 -15.4 64.5 10.9 16.2 65 141 A L S < S- 0 0 78 -3,-2.4 -6,-2.7 -6,-0.3 2,-0.5 -0.849 75.6-141.1-107.9 140.9 65.1 14.4 14.8 66 142 A D E -E 58 0B 68 -2,-0.4 2,-0.3 -8,-0.2 -8,-0.2 -0.875 18.7-167.0-103.5 127.4 65.4 17.6 16.8 67 143 A Y E -E 57 0B 60 -10,-3.1 -10,-2.4 -2,-0.5 2,-0.4 -0.756 9.6-148.7-108.1 160.1 63.9 20.7 15.3 68 144 A I E +E 56 0B 22 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.981 33.9 139.2-132.8 118.5 64.3 24.3 16.4 69 145 A K E -E 55 0B 6 -14,-2.2 -14,-3.5 -2,-0.4 2,-0.4 -0.850 52.1 -89.1-145.5 179.6 61.5 26.8 15.9 70 146 A R E -EG 54 195B 11 125,-2.3 125,-2.3 -2,-0.3 2,-1.5 -0.834 32.1-130.0-100.1 134.4 59.7 29.7 17.6 71 147 A A E + G 0 194B 0 -18,-2.9 -19,-3.1 -2,-0.4 -18,-0.4 -0.683 42.2 158.9 -83.4 90.2 56.8 28.9 19.9 72 148 A V E + 0 0 0 -2,-1.5 2,-0.5 121,-1.2 -1,-0.2 0.725 60.3 52.3 -87.0 -22.6 54.3 31.4 18.4 73 149 A G E - G 0 193B 0 120,-2.1 120,-2.1 -3,-0.2 -1,-0.2 -0.966 67.6-166.1-121.4 128.9 51.2 29.6 19.7 74 150 A L > - 0 0 35 -2,-0.5 3,-2.8 118,-0.2 113,-0.3 -0.670 46.7 -64.8-105.4 160.7 50.6 28.6 23.3 75 151 A P T 3 S+ 0 0 50 0, 0.0 18,-0.3 0, 0.0 -1,-0.2 -0.146 125.6 19.1 -43.9 126.3 47.9 26.2 24.7 76 152 A G T 3 S+ 0 0 11 111,-3.1 18,-1.2 1,-0.3 2,-0.1 0.202 91.5 133.8 95.8 -19.3 44.5 27.7 24.1 77 153 A D < - 0 0 2 -3,-2.8 110,-2.8 16,-0.2 2,-0.7 -0.385 51.6-141.7 -69.1 143.0 45.6 30.2 21.4 78 154 A K E -IJ 91 186C 52 13,-1.9 13,-2.7 108,-0.2 2,-0.5 -0.928 27.6-165.6-100.5 117.0 43.6 30.6 18.2 79 155 A V E -IJ 90 185C 0 106,-3.9 106,-2.7 -2,-0.7 2,-0.4 -0.930 10.3-177.2-110.5 128.8 46.3 31.1 15.6 80 156 A T E -IJ 89 184C 37 9,-2.8 9,-2.2 -2,-0.5 2,-0.5 -0.986 8.4-162.0-126.8 134.8 45.6 32.3 12.1 81 157 A Y E -I 88 0C 2 102,-2.3 7,-0.2 -2,-0.4 3,-0.1 -0.975 8.9-152.6-118.8 124.3 48.1 32.7 9.3 82 158 A D E >> -I 87 0C 76 5,-2.4 4,-1.8 -2,-0.5 5,-1.0 -0.870 7.8-162.9 -93.3 107.3 47.3 35.0 6.4 83 159 A P T 45S+ 0 0 21 0, 0.0 86,-0.4 0, 0.0 -1,-0.1 0.686 85.2 52.7 -66.3 -19.5 49.3 33.4 3.6 84 160 A V T 45S+ 0 0 101 1,-0.1 -2,-0.0 84,-0.1 -3,-0.0 0.952 121.0 27.2 -82.0 -55.0 49.0 36.5 1.4 85 161 A S T 45S- 0 0 41 2,-0.1 -1,-0.1 1,-0.0 3,-0.1 0.653 100.3-135.8 -79.0 -15.3 50.2 39.1 3.9 86 162 A K T <5 + 0 0 18 -4,-1.8 2,-0.3 1,-0.2 113,-0.1 0.925 57.9 135.8 57.9 47.2 52.3 36.4 5.6 87 163 A E E < -I 82 0C 64 -5,-1.0 -5,-2.4 21,-0.0 2,-0.3 -0.953 49.6-132.1-128.0 146.6 51.2 37.7 9.0 88 164 A L E -I 81 0C 4 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.2 -0.672 10.5-164.6 -96.1 148.0 50.0 36.0 12.2 89 165 A T E -I 80 0C 74 -9,-2.2 -9,-2.8 -2,-0.3 2,-0.4 -0.996 14.0-168.8-128.4 129.5 46.9 36.8 14.2 90 166 A I E -I 79 0C 1 -2,-0.4 14,-2.7 14,-0.4 -11,-0.2 -0.988 13.2-172.3-129.3 129.6 46.8 35.3 17.7 91 167 A Q E > -I 78 0C 27 -13,-2.7 -13,-1.9 -2,-0.4 3,-1.1 -0.888 21.4-141.4-122.8 98.8 43.8 35.2 20.1 92 168 A P T 3 S+ 0 0 38 0, 0.0 -15,-0.2 0, 0.0 10,-0.1 -0.142 79.7 7.7 -56.0 146.8 44.8 33.9 23.6 93 169 A G T 3 S+ 0 0 59 -18,-0.3 2,-0.5 1,-0.2 -16,-0.2 0.729 84.6 129.8 52.1 28.2 42.3 31.6 25.3 94 170 A a < + 0 0 1 -18,-1.2 3,-0.3 -3,-1.1 -1,-0.2 -0.499 25.0 126.2-107.8 64.1 39.9 31.3 22.3 95 171 A S + 0 0 39 -2,-0.5 522,-1.8 1,-0.2 523,-0.5 0.196 51.6 68.7-107.2 15.2 39.7 27.5 22.4 96 172 A S S S- 0 0 30 521,-0.3 -1,-0.2 520,-0.2 3,-0.1 0.090 107.7-101.7-121.7 24.6 36.0 26.7 22.5 97 173 A G S S+ 0 0 47 -3,-0.3 522,-0.1 1,-0.2 2,-0.1 0.645 75.1 147.4 67.3 12.1 34.8 27.8 19.1 98 174 A Q - 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