==== 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 29-APR-05 1ZJK . COMPND 2 MOLECULE: MANNAN-BINDING LECTIN SERINE PROTEASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.GAL,V.HARMAT,A.KOCSIS,T.BIAN,L.BARNA,G.AMBRUS,B.VEGH,J.BAL . 389 2 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19204.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 220 56.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 113 29.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 1 0.3 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 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 5 4 5 6 4 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 . 3 1 1 0 0 1 0 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 1 296 A T 0 0 126 0, 0.0 2,-0.5 0, 0.0 24,-0.0 0.000 360.0 360.0 360.0 54.8 -44.2 67.2 52.4 2 297 A A + 0 0 79 22,-0.0 2,-0.2 23,-0.0 53,-0.1 -0.942 360.0 164.1-125.0 108.9 -41.5 65.1 54.0 3 298 A H - 0 0 97 -2,-0.5 22,-0.5 53,-0.1 2,-0.1 -0.747 34.7 -86.4-127.2 171.3 -42.7 61.8 55.7 4 299 A A - 0 0 61 -2,-0.2 20,-0.3 20,-0.2 -1,-0.1 -0.329 26.6-139.1 -81.7 152.5 -41.3 58.6 57.1 5 300 A a B -A 23 0A 8 18,-2.8 18,-0.5 1,-0.1 53,-0.1 -0.801 46.6 -77.4-101.9 151.1 -40.6 55.3 55.3 6 301 A P - 0 0 83 0, 0.0 -1,-0.1 0, 0.0 16,-0.0 -0.182 60.7 -95.9 -47.1 131.9 -41.5 51.9 56.9 7 302 A Y - 0 0 127 1,-0.1 2,-0.5 14,-0.1 14,-0.0 -0.326 44.9-115.8 -58.1 125.1 -38.8 51.1 59.5 8 303 A P - 0 0 8 0, 0.0 2,-0.6 0, 0.0 8,-0.1 -0.502 26.9-163.1 -72.6 114.7 -36.3 48.8 57.8 9 304 A M - 0 0 155 -2,-0.5 6,-0.1 6,-0.1 54,-0.0 -0.881 20.2-131.5 -97.4 117.6 -36.2 45.3 59.3 10 305 A A - 0 0 39 -2,-0.6 3,-0.1 1,-0.1 5,-0.1 -0.251 21.7-110.2 -64.1 151.4 -33.0 43.5 58.2 11 306 A P > - 0 0 18 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.319 51.2 -70.7 -70.4 163.5 -33.2 40.0 56.8 12 307 A P T 3 S+ 0 0 105 0, 0.0 54,-0.5 0, 0.0 3,-0.1 -0.362 123.5 14.8 -52.0 134.3 -31.8 37.0 58.8 13 308 A N T 3 S+ 0 0 60 1,-0.2 21,-1.8 -3,-0.1 2,-0.3 0.779 116.1 88.7 63.6 31.0 -28.0 37.1 58.9 14 309 A G E < -B 33 0B 17 -3,-1.4 2,-0.3 19,-0.2 -1,-0.2 -0.955 56.0-157.5-145.9 166.0 -27.9 40.7 57.8 15 310 A H E -B 32 0B 106 17,-1.6 17,-2.0 -2,-0.3 2,-0.4 -0.978 23.1-111.8-146.5 159.0 -28.0 44.2 59.3 16 311 A V E -B 31 0B 18 -2,-0.3 15,-0.2 15,-0.2 3,-0.1 -0.774 24.5-145.3 -93.1 131.7 -28.8 47.8 58.4 17 312 A S S S+ 0 0 54 13,-1.8 2,-0.9 -2,-0.4 -1,-0.1 0.981 86.1 38.0 -69.5 -67.8 -25.8 50.1 58.3 18 313 A P S S- 0 0 48 0, 0.0 2,-1.0 0, 0.0 -1,-0.2 -0.800 76.3-159.0 -83.5 106.8 -27.1 53.5 59.6 19 314 A V + 0 0 111 -2,-0.9 2,-0.3 -3,-0.1 10,-0.0 -0.792 21.4 173.3 -86.1 102.3 -29.6 52.6 62.4 20 315 A Q - 0 0 64 -2,-1.0 3,-0.1 1,-0.1 0, 0.0 -0.758 43.2-124.2-106.8 156.7 -31.8 55.7 62.7 21 316 A A S S+ 0 0 101 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.834 97.0 1.7 -66.4 -33.5 -34.9 56.1 64.9 22 317 A K - 0 0 64 -15,-0.0 2,-0.4 -16,-0.0 -1,-0.2 -0.987 65.9-144.1-153.5 148.9 -36.8 57.1 61.7 23 318 A Y B +A 5 0A 2 -18,-0.5 -18,-2.8 -2,-0.3 2,-0.2 -0.961 24.2 171.5-117.3 132.7 -36.1 57.4 57.9 24 319 A I > - 0 0 33 -2,-0.4 3,-1.6 -20,-0.3 29,-0.3 -0.512 45.0 -32.1-123.6-167.8 -37.6 60.1 55.7 25 320 A L T 3 S+ 0 0 82 -22,-0.5 -1,-0.2 1,-0.2 29,-0.2 -0.133 125.8 9.6 -50.5 139.9 -37.3 61.5 52.2 26 321 A K T 3 S+ 0 0 75 27,-2.4 -1,-0.2 1,-0.2 28,-0.1 0.127 99.3 125.6 77.5 -20.8 -33.8 61.3 50.6 27 322 A D < - 0 0 59 -3,-1.6 26,-1.3 26,-0.1 2,-0.3 0.005 41.9-159.7 -65.7 176.5 -32.5 59.2 53.5 28 323 A S E -C 52 0C 46 24,-0.2 2,-0.3 -3,-0.1 24,-0.2 -0.975 18.2-173.2-156.2 159.1 -30.8 55.9 52.9 29 324 A F E -C 51 0C 4 22,-1.6 22,-2.4 -2,-0.3 2,-0.3 -0.957 9.8-154.4-158.6 149.2 -29.8 52.5 54.3 30 325 A S E -C 50 0C 18 -2,-0.3 -13,-1.8 20,-0.2 2,-0.5 -0.796 12.3-135.1-118.2 162.7 -27.7 49.5 53.2 31 326 A I E -B 16 0B 0 18,-1.2 18,-0.4 -2,-0.3 2,-0.4 -0.983 17.9-174.8-121.8 128.6 -27.7 45.9 54.1 32 327 A F E -B 15 0B 92 -17,-2.0 -17,-1.6 -2,-0.5 2,-0.1 -0.978 16.2-139.3-123.1 134.4 -24.5 43.9 54.8 33 328 A b E -B 14 0B 28 -2,-0.4 -19,-0.2 -19,-0.2 3,-0.1 -0.481 25.4 -97.6 -90.0 159.3 -24.5 40.2 55.5 34 329 A E > - 0 0 101 -21,-1.8 3,-1.8 1,-0.2 -1,-0.1 -0.204 60.6 -72.9 -61.6 164.3 -22.4 38.2 58.0 35 330 A T T 3 S+ 0 0 110 1,-0.3 -1,-0.2 33,-0.0 3,-0.1 -0.414 124.3 25.0 -60.6 133.1 -19.2 36.5 56.8 36 331 A G T 3 S+ 0 0 5 1,-0.3 33,-3.0 -2,-0.1 2,-0.3 0.404 105.3 97.9 90.4 -2.9 -20.0 33.5 54.6 37 332 A Y E < -D 68 0D 63 -3,-1.8 2,-0.3 31,-0.3 -1,-0.3 -0.888 58.4-152.6-116.4 151.0 -23.4 34.9 53.7 38 333 A E E -D 67 0D 71 29,-2.7 29,-2.1 -2,-0.3 2,-0.3 -0.931 21.2-107.8-129.3 147.9 -24.2 36.7 50.4 39 334 A L E -D 66 0D 20 -2,-0.3 7,-1.5 7,-0.3 2,-0.4 -0.547 41.3-178.2 -71.1 128.5 -26.8 39.3 49.3 40 335 A L E -DE 65 45D 26 25,-2.1 25,-3.0 -2,-0.3 2,-0.6 -0.990 26.1-173.2-135.0 126.1 -29.4 37.8 47.0 41 336 A Q E > S- E 0 44D 66 3,-2.4 3,-1.2 -2,-0.4 2,-0.5 -0.912 83.2 -45.4-108.8 97.5 -32.3 39.4 45.2 42 337 A G T 3 S- 0 0 70 -2,-0.6 23,-0.1 1,-0.2 0, 0.0 -0.689 121.9 -26.8 77.6-127.1 -33.9 36.2 43.9 43 338 A H T 3 S+ 0 0 100 -2,-0.5 -1,-0.2 -3,-0.1 -3,-0.0 0.246 118.6 100.8-100.9 10.2 -31.2 34.0 42.4 44 339 A L E < -E 41 0D 116 -3,-1.2 -3,-2.4 0, 0.0 2,-0.2 -0.867 66.4-141.2-104.2 117.5 -29.0 37.0 41.7 45 340 A P E -E 40 0D 76 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.544 23.1-138.7 -68.1 139.4 -26.0 37.9 43.9 46 341 A L - 0 0 50 -7,-1.5 -7,-0.3 -2,-0.2 3,-0.1 -0.786 15.6-138.5-103.2 145.7 -25.7 41.7 44.4 47 342 A K S S- 0 0 217 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.957 87.7 -37.1 -55.1 -52.2 -22.5 43.8 44.5 48 343 A S - 0 0 74 -3,-0.1 2,-0.4 2,-0.0 -1,-0.3 -0.942 60.0-120.0-159.6 177.1 -24.2 45.6 47.3 49 344 A F + 0 0 6 -18,-0.4 -18,-1.2 -2,-0.3 2,-0.3 -0.995 28.6 161.3-133.5 131.4 -27.6 46.8 48.5 50 345 A T E -C 30 0C 63 -2,-0.4 2,-0.4 -20,-0.2 -20,-0.2 -0.896 16.8-162.1-148.4 117.6 -28.8 50.4 49.3 51 346 A A E -C 29 0C 0 -22,-2.4 -22,-1.6 -2,-0.3 2,-0.4 -0.832 6.2-158.3-101.2 138.4 -32.4 51.5 49.4 52 347 A V E -C 28 0C 59 -2,-0.4 8,-0.9 -24,-0.2 2,-0.6 -0.964 18.6-125.8-121.3 128.7 -33.4 55.1 49.2 53 348 A a B -F 59 0E 2 -26,-1.3 -27,-2.4 -2,-0.4 6,-0.2 -0.613 33.8-163.2 -75.2 114.8 -36.7 56.6 50.5 54 349 A Q - 0 0 29 4,-0.9 -27,-0.1 -2,-0.6 -1,-0.1 0.024 40.6 -82.4 -85.0-166.8 -38.4 58.5 47.7 55 350 A K S S+ 0 0 81 -30,-0.1 -52,-0.1 -53,-0.1 -30,-0.1 0.729 109.6 82.1 -70.7 -22.5 -41.2 61.0 47.7 56 351 A D S S- 0 0 127 2,-0.2 -53,-0.1 1,-0.1 4,-0.1 -0.045 97.2-108.0 -68.0 179.2 -43.6 58.1 47.8 57 352 A G S S+ 0 0 43 2,-0.1 2,-0.2 -52,-0.1 -1,-0.1 0.631 95.5 71.3 -82.6 -15.8 -44.5 56.3 51.0 58 353 A S S S- 0 0 39 -53,-0.1 -4,-0.9 1,-0.1 -2,-0.2 -0.562 85.9-104.3-103.9 162.7 -42.5 53.2 50.0 59 354 A W B -F 53 0E 47 -2,-0.2 -6,-0.2 -6,-0.2 -1,-0.1 -0.464 28.4-126.5 -73.6 156.1 -38.9 52.3 49.7 60 355 A D S S+ 0 0 95 -8,-0.9 -1,-0.1 -2,-0.1 -7,-0.1 0.739 92.4 37.0 -78.5 -22.8 -37.5 52.1 46.1 61 356 A R S S- 0 0 57 -9,-0.1 -1,-0.1 3,-0.0 2,-0.1 -0.983 80.0-125.1-133.2 142.0 -36.2 48.5 46.6 62 357 A P - 0 0 87 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.384 45.6 -80.5 -78.6 161.8 -37.5 45.5 48.5 63 358 A M - 0 0 74 -2,-0.1 2,-0.1 1,-0.1 -53,-0.0 -0.404 45.7-146.4 -65.8 132.0 -35.5 43.6 51.2 64 359 A P - 0 0 6 0, 0.0 2,-0.2 0, 0.0 -23,-0.2 -0.394 19.6-104.0 -86.8 172.3 -32.9 41.2 49.8 65 360 A A E -D 40 0D 45 -25,-3.0 -25,-2.1 -2,-0.1 2,-0.5 -0.641 10.9-146.9 -92.7 153.8 -31.9 37.9 51.4 66 361 A b E +D 39 0D 8 -54,-0.5 2,-0.3 -2,-0.2 -27,-0.2 -0.891 36.5 175.4-114.7 95.2 -28.7 37.2 53.3 67 362 A S E -D 38 0D 43 -29,-2.1 -29,-2.7 -2,-0.5 3,-0.1 -0.805 34.6 -96.3-113.8 144.0 -28.2 33.5 52.4 68 363 A I E -D 37 0D 57 -2,-0.3 -31,-0.3 -31,-0.2 2,-0.1 -0.184 43.4-105.9 -62.3 142.3 -25.4 31.2 53.2 69 364 A V - 0 0 5 -33,-3.0 24,-2.0 48,-0.1 2,-0.5 -0.443 33.1-154.9 -68.2 139.8 -22.7 30.7 50.5 70 365 A D B -G 92 0F 89 22,-0.2 22,-0.2 -2,-0.1 -1,-0.0 -0.971 16.9-168.5-124.8 119.2 -22.9 27.4 48.7 71 366 A c - 0 0 20 20,-2.5 52,-0.3 -2,-0.5 21,-0.1 0.561 42.9-135.8 -82.0 -8.5 -19.8 25.9 47.1 72 367 A G - 0 0 15 19,-0.4 -1,-0.2 50,-0.1 3,-0.1 -0.004 44.6 -28.7 80.3 172.0 -22.0 23.4 45.3 73 368 A P S S- 0 0 103 0, 0.0 2,-0.1 0, 0.0 18,-0.1 -0.363 76.7-107.3 -59.0 135.5 -21.5 19.6 44.9 74 369 A P - 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