==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-FEB-10 3LT3 . COMPND 2 MOLECULE: POSSIBLE MEMBRANE-ASSOCIATED SERINE PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS H37RV; . AUTHOR T.BISWAS,J.SMALL,O.VANDAL,S.EHRT,O.V.TSODIKOV . 404 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19003.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 265 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 143 35.4 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 . 5 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 32 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 35 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 0 2 0 0 0 0 0 1 0 1 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 2 4 7 5 4 0 2 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 0 0 0 0 2 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 1 181 A V 0 0 104 0, 0.0 182,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 129.0 -11.1 15.9 8.5 2 182 A I - 0 0 66 1,-0.0 2,-0.2 124,-0.0 124,-0.0 -0.704 360.0-125.2 -81.4 123.5 -8.5 18.6 8.2 3 183 A P + 0 0 113 0, 0.0 2,-0.3 0, 0.0 -1,-0.0 -0.493 35.4 170.1 -75.6 136.4 -8.8 20.5 5.0 4 184 A V - 0 0 22 -2,-0.2 121,-0.1 119,-0.1 119,-0.0 -0.904 40.4 -76.9-135.6 166.1 -5.8 20.9 2.6 5 185 A A - 0 0 63 -2,-0.3 145,-0.1 1,-0.1 3,-0.1 -0.222 60.5 -89.8 -58.2 150.1 -5.2 22.1 -0.9 6 186 A S - 0 0 71 1,-0.1 -1,-0.1 116,-0.0 116,-0.1 -0.345 55.1 -92.0 -60.8 142.5 -6.2 19.9 -3.8 7 187 A P - 0 0 23 0, 0.0 116,-0.1 0, 0.0 -1,-0.1 -0.264 42.6-101.1 -59.8 144.5 -3.5 17.4 -4.9 8 188 A D > - 0 0 72 114,-0.3 3,-1.8 1,-0.2 114,-0.1 -0.565 27.0-152.5 -67.2 113.7 -1.1 18.5 -7.7 9 189 A P G > S+ 0 0 99 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.715 88.8 73.4 -64.1 -20.7 -2.5 16.7 -10.9 10 190 A A G > S+ 0 0 60 1,-0.2 3,-1.5 2,-0.1 4,-0.4 0.609 72.3 87.5 -66.9 -14.0 1.1 16.8 -12.4 11 191 A L G < S+ 0 0 5 -3,-1.8 3,-0.3 1,-0.3 -1,-0.2 0.645 72.2 71.9 -62.8 -17.9 2.1 14.0 -9.9 12 192 A V G < S+ 0 0 59 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.1 0.790 103.3 40.2 -68.3 -28.4 0.9 11.3 -12.3 13 193 A N S < S+ 0 0 140 -3,-1.5 -1,-0.2 -4,-0.2 -2,-0.2 0.434 85.1 124.3-100.9 -3.6 3.9 12.0 -14.7 14 194 A N S >> S- 0 0 50 -4,-0.4 3,-2.8 -3,-0.3 4,-0.6 -0.391 72.0-122.7 -59.5 130.1 6.5 12.5 -11.9 15 195 A P H 3> S+ 0 0 17 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.672 107.2 76.5 -48.8 -21.5 9.4 10.1 -12.4 16 196 A V H 3> S+ 0 0 1 1,-0.2 4,-1.0 2,-0.2 5,-0.1 0.802 91.1 54.6 -60.6 -29.9 8.7 8.8 -8.9 17 197 A V H <> S+ 0 0 11 -3,-2.8 4,-2.1 -6,-0.2 3,-0.4 0.941 109.9 43.0 -69.2 -50.6 5.7 6.8 -10.4 18 198 A A H < S+ 0 0 46 -4,-0.6 -2,-0.2 1,-0.2 -1,-0.2 0.770 111.2 57.5 -67.2 -27.7 7.8 5.0 -13.1 19 199 A A H < S+ 0 0 19 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.790 118.7 29.2 -72.5 -30.2 10.6 4.3 -10.5 20 200 A T H >X S+ 0 0 4 -4,-1.0 3,-1.4 -3,-0.4 4,-0.5 0.656 97.4 90.3-105.0 -20.9 8.2 2.5 -8.1 21 201 A E G >< S+ 0 0 84 -4,-2.1 3,-1.6 1,-0.3 -2,-0.1 0.832 82.2 54.2 -47.3 -51.3 5.7 1.1 -10.7 22 202 A P G 34 S+ 0 0 58 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.791 109.6 50.0 -58.8 -26.8 7.4 -2.3 -11.4 23 203 A S G <4 S+ 0 0 3 -3,-1.4 16,-2.2 -4,-0.1 2,-0.6 0.469 92.5 86.1 -90.6 -5.1 7.5 -3.1 -7.7 24 204 A V E << -A 38 0A 0 -3,-1.6 2,-0.3 -4,-0.5 14,-0.3 -0.891 67.3-169.2-101.5 119.1 3.8 -2.3 -7.1 25 205 A V E -A 37 0A 0 12,-2.1 12,-2.6 -2,-0.6 2,-0.4 -0.743 22.7-124.2-117.3 152.0 1.7 -5.4 -7.9 26 206 A K E -AB 36 61A 24 35,-2.1 35,-3.0 -2,-0.3 2,-0.4 -0.754 26.4-153.3 -90.2 140.8 -2.0 -6.3 -8.4 27 207 A I E -AB 35 60A 0 8,-2.4 8,-2.4 -2,-0.4 2,-0.4 -0.970 13.1-176.5-121.7 128.1 -3.4 -9.1 -6.2 28 208 A R E +AB 34 59A 85 31,-2.2 31,-3.0 -2,-0.4 2,-0.3 -0.992 11.3 180.0-119.6 126.1 -6.3 -11.4 -7.1 29 209 A S E AB 33 58A 1 4,-2.8 4,-2.0 -2,-0.4 29,-0.2 -0.957 360.0 360.0-128.7 148.0 -7.5 -13.9 -4.4 30 210 A L 0 0 130 27,-1.2 -1,-0.1 -2,-0.3 28,-0.1 0.697 360.0 360.0-117.7 360.0 -10.2 -16.6 -4.4 31 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 32 217 A V 0 0 143 0, 0.0 2,-0.4 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 -38.9 -13.2 -12.4 -6.6 33 218 A L E -A 29 0A 88 -4,-2.0 -4,-2.8 18,-0.1 2,-0.4 -0.750 360.0-174.7 -92.0 135.3 -11.3 -10.3 -4.1 34 219 A E E +A 28 0A 60 -2,-0.4 2,-0.2 -6,-0.2 -6,-0.2 -0.983 14.3 133.4-138.4 138.3 -8.8 -7.8 -5.6 35 220 A G E -A 27 0A 1 -8,-2.4 -8,-2.4 -2,-0.4 2,-0.3 -0.798 41.8 -88.6-157.4-161.8 -6.3 -5.4 -4.2 36 221 A T E +A 26 0A 0 122,-2.7 12,-0.7 -10,-0.2 2,-0.3 -0.910 32.1 169.2-127.2 152.1 -2.7 -4.0 -4.4 37 222 A G E -AC 25 47A 0 -12,-2.6 -12,-2.1 -2,-0.3 2,-0.3 -0.891 15.5-146.5-144.6 178.4 0.6 -4.9 -2.9 38 223 A F E -AC 24 46A 0 8,-1.6 8,-2.4 -2,-0.3 2,-0.4 -0.989 30.9 -94.5-149.0 156.1 4.3 -4.0 -3.3 39 224 A V E + C 0 45A 0 -16,-2.2 54,-2.8 -2,-0.3 6,-0.2 -0.563 38.1 170.1 -72.3 120.4 7.7 -5.7 -3.0 40 225 A I E S- 0 0 40 4,-2.0 -1,-0.2 1,-0.4 5,-0.2 0.668 70.8 -5.4-102.0 -26.3 9.1 -5.3 0.5 41 226 A S E > S- C 0 44A 46 3,-1.2 3,-2.6 50,-0.1 -1,-0.4 -0.953 104.2 -53.4-158.5 162.4 12.0 -7.7 0.1 42 227 A P T 3 S- 0 0 100 0, 0.0 3,-0.1 0, 0.0 43,-0.0 -0.167 124.8 -5.5 -45.9 121.3 13.2 -10.2 -2.5 43 228 A D T 3 S+ 0 0 56 45,-0.5 42,-2.7 47,-0.3 2,-0.4 0.661 112.9 109.8 66.2 21.2 10.3 -12.6 -3.4 44 229 A R E < -CD 41 84A 95 -3,-2.6 -4,-2.0 40,-0.2 -3,-1.2 -0.993 46.4-168.7-132.4 128.6 8.1 -11.1 -0.7 45 230 A V E -CD 39 83A 0 38,-2.5 38,-3.3 -2,-0.4 2,-0.5 -0.954 11.1-148.5-118.1 129.4 5.0 -8.9 -1.2 46 231 A M E +CD 38 82A 0 -8,-2.4 -8,-1.6 -2,-0.4 2,-0.2 -0.846 31.7 156.7 -94.6 132.1 3.2 -7.0 1.5 47 232 A T E -CD 37 81A 0 34,-3.0 34,-2.9 -2,-0.5 2,-0.4 -0.800 47.9 -65.5-140.3-178.7 -0.6 -6.6 1.0 48 233 A N E >> - D 0 80A 14 -12,-0.7 4,-1.2 110,-0.4 3,-0.6 -0.624 36.9-145.0 -75.0 126.8 -3.9 -5.9 2.7 49 234 A A H 3> S+ 0 0 1 30,-3.1 4,-0.6 -2,-0.4 31,-0.2 0.810 96.7 58.1 -63.7 -33.2 -4.8 -8.8 5.1 50 235 A H H 34 S+ 0 0 102 29,-0.5 -1,-0.2 1,-0.2 3,-0.1 0.778 102.1 55.5 -69.9 -28.1 -8.5 -8.5 4.4 51 236 A V H <4 S+ 0 0 13 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.906 119.6 29.6 -68.2 -43.7 -8.0 -9.0 0.7 52 237 A V H >< S+ 0 0 0 -4,-1.2 3,-2.3 3,-0.0 -2,-0.2 0.310 83.0 150.1-102.3 6.7 -6.2 -12.4 1.1 53 238 A A T 3< S- 0 0 45 -4,-0.6 -3,-0.1 1,-0.3 -4,-0.0 -0.201 81.6 -16.9 -51.7 107.5 -7.9 -13.5 4.4 54 239 A G T 3 S+ 0 0 80 1,-0.2 2,-0.4 -2,-0.2 -1,-0.3 0.767 97.6 151.0 68.1 30.2 -7.9 -17.3 4.3 55 240 A S < - 0 0 21 -3,-2.3 16,-0.4 1,-0.1 -1,-0.2 -0.775 32.4-177.9 -99.2 136.9 -7.3 -17.6 0.6 56 241 A N S S+ 0 0 103 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.467 78.8 61.4-104.6 -8.1 -5.5 -20.6 -1.0 57 242 A N + 0 0 81 -5,-0.0 -27,-1.2 2,-0.0 2,-0.5 -0.690 65.8 155.0-122.4 76.0 -5.6 -19.2 -4.5 58 243 A V E -BE 29 69A 1 11,-0.6 11,-2.2 -2,-0.4 2,-0.4 -0.908 19.0-170.0-106.8 127.1 -3.6 -15.9 -4.5 59 244 A T E -BE 28 68A 21 -31,-3.0 -31,-2.2 -2,-0.5 2,-0.5 -0.940 8.6-152.4-116.9 139.1 -2.1 -14.6 -7.7 60 245 A V E -BE 27 67A 0 7,-3.3 7,-2.2 -2,-0.4 2,-0.7 -0.947 2.8-159.1-111.9 125.9 0.4 -11.6 -8.0 61 246 A Y E +BE 26 66A 55 -35,-3.0 -35,-2.1 -2,-0.5 3,-0.1 -0.911 16.4 170.3-106.6 109.6 0.6 -9.6 -11.2 62 247 A A S S- 0 0 10 3,-1.8 -1,-0.2 -2,-0.7 -38,-0.1 0.969 80.6 -2.7 -82.9 -62.0 3.9 -7.7 -11.5 63 248 A G S S- 0 0 58 2,-0.4 -1,-0.2 -40,-0.1 -38,-0.1 -0.513 124.9 -63.0-130.3 64.2 3.9 -6.3 -15.0 64 249 A D S S+ 0 0 101 1,-0.2 -3,-0.0 -3,-0.1 -39,-0.0 0.492 116.1 110.0 64.2 6.3 0.7 -7.7 -16.5 65 250 A K - 0 0 76 2,-0.0 -3,-1.8 0, 0.0 -2,-0.4 -0.940 69.0-122.3-114.6 133.4 2.3 -11.1 -15.9 66 251 A P E -E 61 0A 84 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.433 24.5-177.5 -79.4 144.3 1.1 -13.6 -13.2 67 252 A F E -E 60 0A 37 -7,-2.2 -7,-3.3 -2,-0.1 2,-0.3 -0.997 30.9-115.0-136.7 135.9 3.1 -15.1 -10.4 68 253 A E E -E 59 0A 104 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.576 36.7-169.4 -76.7 129.5 1.8 -17.6 -7.9 69 254 A A E -E 58 0A 2 -11,-2.2 -11,-0.6 -2,-0.3 2,-0.4 -0.766 12.3-157.8-116.6 160.6 1.7 -16.3 -4.3 70 255 A T E -F 84 0A 84 14,-0.9 14,-3.0 -2,-0.3 2,-0.8 -0.990 25.5-122.0-140.2 129.2 1.2 -17.8 -0.9 71 256 A V E +F 83 0A 39 -16,-0.4 12,-0.2 -2,-0.4 3,-0.2 -0.615 41.7 162.2 -68.6 107.4 0.0 -16.1 2.3 72 257 A V E + 0 0 76 10,-2.0 2,-0.4 -2,-0.8 133,-0.3 0.578 65.4 42.9-104.5 -16.1 2.9 -16.9 4.6 73 258 A S E +F 82 0A 12 9,-1.5 9,-1.7 -3,-0.1 2,-0.4 -0.877 67.6 151.1-136.8 101.5 2.2 -14.3 7.2 74 259 A Y + 0 0 84 -2,-0.4 7,-0.1 7,-0.2 131,-0.0 -0.997 10.7 170.6-133.5 131.0 -1.4 -13.8 8.4 75 260 A D > - 0 0 31 -2,-0.4 3,-2.2 5,-0.4 -26,-0.1 -0.975 29.8-143.2-138.4 120.9 -2.6 -12.5 11.7 76 261 A P T 3 S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 -23,-0.0 0.668 102.7 58.1 -56.7 -19.4 -6.3 -11.6 12.3 77 262 A S T 3 S+ 0 0 44 63,-0.1 2,-0.3 118,-0.1 121,-0.0 0.268 98.3 76.5 -93.1 9.7 -5.2 -8.8 14.6 78 263 A V < - 0 0 5 -3,-2.2 -3,-0.2 62,-0.1 62,-0.1 -0.942 65.8-149.3-128.3 141.5 -3.1 -7.1 11.8 79 264 A D S S+ 0 0 3 -2,-0.3 -30,-3.1 -30,-0.1 -29,-0.5 0.725 80.4 64.0 -78.3 -25.8 -4.1 -5.0 8.7 80 265 A V E -D 48 0A 2 -32,-0.3 -5,-0.4 -31,-0.2 2,-0.3 -0.695 61.0-166.8-105.7 154.6 -1.2 -6.2 6.6 81 266 A A E -D 47 0A 0 -34,-2.9 -34,-3.0 -2,-0.3 2,-0.5 -0.977 15.7-131.7-136.9 151.5 -0.2 -9.6 5.2 82 267 A I E -DF 46 73A 15 -9,-1.7 -10,-2.0 -2,-0.3 -9,-1.5 -0.894 16.3-161.6-105.9 131.0 3.0 -11.1 3.6 83 268 A L E -DF 45 71A 0 -38,-3.3 -38,-2.5 -2,-0.5 2,-0.6 -0.914 14.6-137.8-108.2 136.5 2.9 -13.1 0.4 84 269 A A E +DF 44 70A 12 -14,-3.0 -14,-0.9 -2,-0.4 -40,-0.2 -0.859 26.2 177.3 -92.5 117.9 5.7 -15.4 -0.7 85 270 A V > - 0 0 0 -42,-2.7 3,-1.0 -2,-0.6 -16,-0.1 -0.801 15.3-152.4-128.4 88.3 6.2 -14.9 -4.4 86 271 A P T 3 S+ 0 0 74 0, 0.0 -18,-0.1 0, 0.0 -43,-0.1 -0.264 76.8 13.6 -62.2 144.3 9.2 -17.0 -5.9 87 272 A H T 3 S+ 0 0 164 1,-0.2 0, 0.0 -20,-0.1 0, 0.0 0.744 79.9 160.6 63.0 29.5 11.0 -15.7 -9.0 88 273 A L < - 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