==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 03-FEB-12 4DJZ . COMPND 2 MOLECULE: MANNAN-BINDING LECTIN SERINE PROTEASE 1 HEAVY CHA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.HEJA,V.HARMAT,K.FODOR,M.WILMANNS,J.DOBO,K.A.KEKESI,P.ZAVOD . 865 6 22 20 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40697.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 471 54.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 256 29.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 12 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 58 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 35 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 0 0 0 0 3 0 0 1 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 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 . 16 14 12 9 10 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 . 6 3 2 0 0 2 0 0 0 0 2 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 1 297 A T 0 0 145 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -36.8 -81.7 0.2 -20.7 2 298 A G - 0 0 46 1,-0.1 2,-0.4 23,-0.1 53,-0.1 0.002 360.0 -42.0-116.7-132.1 -80.3 2.6 -23.3 3 299 A N - 0 0 91 51,-0.1 22,-0.6 -2,-0.1 54,-0.1 -0.859 60.5-115.8-105.4 145.2 -78.3 1.8 -26.4 4 300 A E E -A 24 0A 110 -2,-0.4 20,-0.2 20,-0.2 18,-0.0 -0.438 23.3-148.8 -84.3 152.5 -75.6 -0.9 -26.5 5 301 A a E -A 23 0A 7 18,-2.9 18,-0.7 -2,-0.1 53,-0.2 -0.943 30.1 -88.1-127.4 141.8 -71.9 -0.2 -27.2 6 302 A P - 0 0 79 0, 0.0 2,-0.1 0, 0.0 -1,-0.0 -0.118 49.0-101.9 -54.1 135.1 -69.2 -2.4 -28.9 7 303 A E - 0 0 86 1,-0.1 2,-0.2 14,-0.0 15,-0.1 -0.386 48.0-114.0 -56.9 127.0 -67.3 -4.7 -26.6 8 304 A L - 0 0 32 -3,-0.1 -1,-0.1 -2,-0.1 8,-0.0 -0.440 12.6-137.5 -79.0 138.0 -64.0 -3.1 -26.0 9 305 A Q - 0 0 144 -2,-0.2 -1,-0.1 1,-0.0 54,-0.1 -0.833 31.5-127.0 -93.1 111.5 -60.7 -4.5 -27.1 10 306 A P - 0 0 70 0, 0.0 5,-0.1 0, 0.0 2,-0.1 -0.134 23.4-105.7 -61.5 151.8 -58.2 -4.1 -24.2 11 307 A P > - 0 0 14 0, 0.0 3,-1.3 0, 0.0 2,-0.3 -0.416 39.4 -94.1 -76.4 155.7 -54.8 -2.3 -24.7 12 308 A V T 3 S+ 0 0 108 1,-0.3 54,-0.6 -2,-0.1 3,-0.1 -0.546 112.3 7.3 -69.9 129.1 -51.6 -4.2 -24.9 13 309 A H T 3 S+ 0 0 91 -2,-0.3 21,-2.4 1,-0.2 2,-0.3 0.841 117.7 102.2 66.1 38.2 -50.0 -4.3 -21.4 14 310 A G < - 0 0 12 -3,-1.3 19,-0.3 19,-0.3 -1,-0.2 -0.949 59.1-139.8-160.8 135.5 -53.1 -2.7 -19.9 15 311 A K - 0 0 116 -2,-0.3 17,-1.1 -5,-0.1 2,-0.3 -0.085 11.0-148.2 -76.4 177.2 -56.3 -3.4 -18.0 16 312 A I E -B 31 0B 27 15,-0.2 15,-0.2 -6,-0.1 3,-0.1 -0.925 20.3-132.2-147.0 126.9 -59.8 -2.1 -18.3 17 313 A E E S+B 30 0B 139 13,-2.0 13,-3.5 -2,-0.3 2,-0.1 -0.981 79.6 30.5-129.0 147.0 -62.3 -1.5 -15.5 18 314 A P S S- 0 0 55 0, 0.0 2,-0.5 0, 0.0 -1,-0.2 0.561 76.9-154.8 -84.4 143.3 -65.1 -2.2 -15.0 19 315 A S + 0 0 99 -3,-0.1 2,-0.3 -2,-0.1 3,-0.1 -0.692 24.2 172.4 -80.8 127.9 -65.2 -5.4 -17.0 20 316 A Q - 0 0 87 -2,-0.5 3,-0.1 1,-0.1 0, 0.0 -0.959 44.9-126.9-137.9 152.7 -68.7 -6.0 -18.2 21 317 A A S S+ 0 0 110 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.958 99.0 7.5 -59.6 -54.4 -70.6 -8.4 -20.4 22 318 A K - 0 0 35 -3,-0.1 2,-0.4 -15,-0.1 -1,-0.2 -0.904 69.6-141.7-128.4 159.1 -72.2 -5.5 -22.3 23 319 A Y E -A 5 0A 12 -18,-0.7 -18,-2.9 -2,-0.3 2,-0.2 -0.974 22.5-175.5-122.9 135.7 -71.8 -1.7 -22.2 24 320 A F E > -A 4 0A 57 -2,-0.4 3,-1.4 -20,-0.2 29,-0.2 -0.538 37.0 -55.3-121.4-176.6 -74.7 0.7 -22.5 25 321 A F T 3 S+ 0 0 90 -22,-0.6 29,-0.2 1,-0.2 -1,-0.2 -0.325 120.1 18.2 -60.4 141.9 -75.5 4.4 -22.8 26 322 A K T 3 S+ 0 0 81 27,-1.8 -1,-0.2 1,-0.3 28,-0.1 0.215 93.5 130.0 80.2 -12.7 -74.0 6.6 -19.9 27 323 A D < - 0 0 52 -3,-1.4 26,-2.0 27,-0.1 2,-0.3 -0.385 37.6-167.4 -69.9 150.8 -71.5 3.9 -19.0 28 324 A Q E - C 0 52B 114 24,-0.2 2,-0.3 -3,-0.1 24,-0.2 -0.999 3.5-164.9-146.2 139.5 -67.8 4.9 -18.6 29 325 A V E - C 0 51B 3 22,-2.2 22,-1.4 -2,-0.3 2,-0.4 -0.787 14.3-131.7-125.1 164.0 -64.6 2.9 -18.3 30 326 A L E -BC 17 50B 74 -13,-3.5 -13,-2.0 -2,-0.3 2,-0.6 -0.973 11.5-150.8-121.8 128.4 -61.0 3.4 -17.2 31 327 A V E +BC 16 49B 2 18,-2.4 18,-1.1 -2,-0.4 2,-0.2 -0.851 23.9 173.9 -98.7 119.4 -58.0 2.3 -19.2 32 328 A S E - C 0 48B 32 -17,-1.1 2,-0.3 -2,-0.6 16,-0.1 -0.756 19.5-137.2-118.3 168.4 -54.9 1.5 -17.1 33 329 A b - 0 0 22 14,-0.5 -19,-0.3 -19,-0.3 4,-0.1 -0.909 29.7 -92.5-124.1 156.0 -51.5 -0.0 -17.9 34 330 A D > - 0 0 74 -21,-2.4 3,-1.9 -2,-0.3 2,-0.3 -0.044 60.6 -73.3 -54.5 161.3 -49.3 -2.6 -16.1 35 331 A T T 3 S+ 0 0 111 1,-0.3 -1,-0.2 3,-0.0 3,-0.1 -0.475 127.3 32.3 -56.2 120.2 -46.7 -1.6 -13.5 36 332 A G T 3 S+ 0 0 4 1,-0.3 33,-2.7 -2,-0.3 2,-0.3 0.438 107.3 86.5 105.0 4.6 -43.9 -0.1 -15.6 37 333 A Y E < -D 68 0C 55 -3,-1.9 -1,-0.3 31,-0.2 2,-0.3 -0.986 54.1-161.6-136.1 145.2 -46.1 1.3 -18.3 38 334 A K E -D 67 0C 86 29,-2.2 29,-1.5 -2,-0.3 2,-0.4 -0.783 31.3-101.5-116.5 166.9 -48.1 4.6 -18.9 39 335 A V E -DE 66 46C 0 7,-3.2 7,-2.4 -2,-0.3 2,-0.7 -0.764 31.7-149.2 -91.1 129.6 -51.0 5.4 -21.2 40 336 A L E +DE 65 45C 29 25,-3.2 25,-1.2 -2,-0.4 2,-0.6 -0.887 22.1 170.4-105.9 111.2 -50.1 7.3 -24.4 41 337 A K E > - E 0 44C 65 3,-2.2 3,-3.3 -2,-0.7 -2,-0.0 -0.978 67.0 -59.0-109.7 111.9 -52.6 9.7 -25.9 42 338 A D T 3 S- 0 0 110 -2,-0.6 -2,-0.0 1,-0.4 3,-0.0 0.017 123.3 -6.7 -32.8 113.6 -50.7 11.6 -28.6 43 339 A N T 3 S+ 0 0 165 0, 0.0 -1,-0.4 0, 0.0 2,-0.3 -0.832 117.1 72.3-124.6 34.5 -48.5 12.9 -27.3 44 340 A V E < -E 41 0C 96 -3,-3.3 -3,-2.2 0, 0.0 2,-0.8 -0.847 57.5-134.1-121.0 144.2 -48.7 12.6 -23.5 45 341 A E E +E 40 0C 61 -2,-0.3 -5,-0.2 -5,-0.2 2,-0.2 -0.819 34.9 167.7-100.0 105.1 -48.1 9.8 -20.9 46 342 A M E -E 39 0C 69 -7,-2.4 -7,-3.2 -2,-0.8 3,-0.1 -0.661 40.8-123.9-112.9 168.0 -50.9 9.6 -18.3 47 343 A D S S+ 0 0 113 -2,-0.2 -14,-0.5 -9,-0.2 2,-0.3 0.906 91.5 8.6 -81.4 -46.3 -51.9 7.0 -15.7 48 344 A T E -C 32 0B 66 -16,-0.1 2,-0.3 -9,-0.1 -16,-0.2 -0.887 63.2-155.4-126.6 162.8 -55.5 6.4 -16.7 49 345 A F E -C 31 0B 28 -18,-1.1 -18,-2.4 -2,-0.3 2,-0.3 -0.987 15.3-145.9-141.1 134.7 -57.5 7.4 -19.7 50 346 A Q E +C 30 0B 106 -2,-0.3 2,-0.3 -20,-0.2 -20,-0.2 -0.761 17.2 175.4-110.4 143.1 -61.3 7.7 -19.7 51 347 A I E -C 29 0B 2 -22,-1.4 -22,-2.2 -2,-0.3 2,-0.2 -0.995 9.7-161.0-140.3 140.7 -64.1 7.1 -22.3 52 348 A E E -C 28 0B 30 -2,-0.3 8,-2.5 -24,-0.2 2,-0.5 -0.662 23.9-113.9-106.3 167.4 -67.9 7.2 -22.1 53 349 A a B -F 59 0D 3 -26,-2.0 -27,-1.8 -29,-0.2 6,-0.2 -0.929 32.5-139.1-105.7 135.6 -70.5 5.7 -24.3 54 350 A L > - 0 0 64 4,-2.7 3,-2.2 -2,-0.5 -51,-0.1 -0.270 25.9-101.2 -91.7 168.3 -72.8 8.0 -26.2 55 351 A K T 3 S+ 0 0 65 1,-0.3 -30,-0.1 2,-0.1 -1,-0.1 0.848 121.5 59.6 -55.1 -37.4 -76.5 8.1 -27.0 56 352 A D T 3 S- 0 0 108 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.298 119.1-111.7 -76.8 6.1 -75.8 6.8 -30.5 57 353 A G S < S+ 0 0 5 -3,-2.2 2,-0.2 1,-0.3 -2,-0.1 0.453 78.6 119.9 81.4 2.1 -74.1 3.7 -29.0 58 354 A T - 0 0 69 -53,-0.2 -4,-2.7 1,-0.1 -1,-0.3 -0.601 68.0-102.2 -97.7 159.4 -70.6 4.6 -30.0 59 355 A W B -F 53 0D 34 -6,-0.2 -6,-0.2 -2,-0.2 3,-0.1 -0.547 22.8-128.4 -79.5 147.0 -67.5 5.1 -27.8 60 356 A S S S+ 0 0 47 -8,-2.5 2,-0.3 -2,-0.2 -1,-0.1 0.771 87.0 6.9 -66.1 -30.3 -66.4 8.7 -27.1 61 357 A N S S- 0 0 80 -9,-0.3 -1,-0.1 3,-0.0 2,-0.0 -0.989 80.6 -98.4-150.2 155.4 -62.8 8.0 -28.1 62 358 A K - 0 0 76 -2,-0.3 -2,-0.0 1,-0.1 0, 0.0 -0.288 53.7 -89.9 -65.6 158.1 -60.6 5.2 -29.6 63 359 A I - 0 0 65 -54,-0.1 -1,-0.1 1,-0.1 2,-0.0 -0.589 43.5-142.8 -72.6 126.2 -58.5 3.0 -27.3 64 360 A P - 0 0 11 0, 0.0 2,-0.3 0, 0.0 -23,-0.2 -0.214 16.0-116.2 -80.3-179.2 -55.1 4.5 -26.6 65 361 A T E -D 40 0C 93 -25,-1.2 -25,-3.2 -54,-0.1 2,-0.7 -0.852 16.4-113.9-124.1 154.4 -51.9 2.4 -26.2 66 362 A b E -D 39 0C 21 -54,-0.6 2,-0.4 -2,-0.3 -27,-0.2 -0.793 26.0-163.0 -92.6 115.4 -49.4 1.7 -23.4 67 363 A K E -D 38 0C 51 -29,-1.5 -29,-2.2 -2,-0.7 3,-0.1 -0.828 28.6-108.1 -95.1 135.5 -45.9 3.1 -23.9 68 364 A I E -D 37 0C 66 -2,-0.4 2,-0.3 -31,-0.2 -31,-0.2 -0.196 33.6-101.6 -61.9 147.2 -43.2 1.6 -21.7 69 365 A V - 0 0 20 -33,-2.7 24,-0.6 49,-0.1 2,-0.5 -0.566 39.4-166.3 -67.7 127.2 -41.6 3.7 -18.9 70 366 A D B -G 92 0E 55 -2,-0.3 2,-0.6 22,-0.2 22,-0.2 -0.916 14.4-163.8-124.8 105.1 -38.2 4.9 -20.0 71 367 A c - 0 0 4 20,-1.0 52,-0.1 -2,-0.5 51,-0.1 -0.804 30.3-140.8 -80.2 122.7 -35.8 6.4 -17.5 72 368 A R - 0 0 184 -2,-0.6 -1,-0.2 50,-0.2 51,-0.0 0.948 52.1 -10.8 -64.4 -96.8 -33.4 8.2 -19.9 73 369 A A - 0 0 81 51,-0.0 -1,-0.2 3,-0.0 3,-0.1 -0.933 66.5-116.8-117.5 128.5 -29.7 8.2 -19.4 74 370 A P - 0 0 17 0, 0.0 8,-0.1 0, 0.0 2,-0.0 -0.298 41.9-100.7 -59.4 141.6 -27.8 7.1 -16.2 75 371 A G - 0 0 41 1,-0.1 2,-0.0 49,-0.1 0, 0.0 -0.319 43.2 -99.2 -64.9 145.9 -25.9 9.9 -14.5 76 372 A E - 0 0 91 -3,-0.1 2,-0.5 1,-0.1 -1,-0.1 -0.310 28.7-144.6 -68.4 146.9 -22.2 10.1 -15.1 77 373 A L > - 0 0 23 3,-0.2 3,-1.4 23,-0.1 2,-0.2 -0.973 16.8-126.5-113.9 123.8 -19.7 8.7 -12.6 78 374 A E T 3 S+ 0 0 147 -2,-0.5 58,-0.3 1,-0.3 3,-0.1 -0.509 98.1 4.8 -69.8 131.9 -16.4 10.5 -12.1 79 375 A H T 3 S+ 0 0 69 1,-0.3 23,-1.4 -2,-0.2 2,-0.3 0.885 122.5 101.5 55.0 42.0 -13.5 8.1 -12.5 80 376 A G E < -H 101 0F 10 -3,-1.4 2,-0.3 21,-0.3 21,-0.3 -0.938 59.1-146.7-148.2 163.9 -16.2 5.6 -13.4 81 377 A L E -H 100 0F 106 19,-2.5 19,-3.0 -2,-0.3 2,-0.4 -0.999 12.7-135.6-141.1 142.7 -17.7 3.9 -16.4 82 378 A I E -H 99 0F 40 -2,-0.3 2,-0.4 17,-0.2 17,-0.2 -0.802 18.6-172.3 -97.6 133.9 -21.3 2.6 -17.2 83 379 A T E -H 98 0F 72 15,-1.6 15,-2.6 -2,-0.4 2,-0.2 -0.992 12.9-140.7-126.7 140.4 -21.9 -0.8 -18.8 84 380 A F E -H 97 0F 62 -2,-0.4 13,-0.2 13,-0.2 7,-0.1 -0.562 15.4-133.2 -98.7 157.7 -25.3 -2.1 -20.0 85 381 A S S S+ 0 0 84 11,-1.4 2,-0.3 5,-0.2 12,-0.1 0.406 91.8 50.6 -89.3 1.9 -26.8 -5.5 -19.8 86 382 A T S > S- 0 0 59 10,-0.2 3,-1.0 4,-0.1 -2,-0.2 -0.987 75.2-132.9-139.2 150.0 -27.8 -5.3 -23.5 87 383 A R T 3 S+ 0 0 107 -2,-0.3 -1,-0.1 1,-0.2 -3,-0.0 0.823 107.1 59.1 -66.3 -34.7 -26.0 -4.5 -26.8 88 384 A N T 3 S- 0 0 93 -3,-0.0 -1,-0.2 1,-0.0 -3,-0.0 0.427 113.8-116.7 -76.4 0.3 -28.9 -2.2 -27.9 89 385 A N < - 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