==== 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 07-AUG-09 3ILN . COMPND 2 MOLECULE: LAMINARINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOTHERMUS MARINUS; . AUTHOR L.BLEICHER,A.GOLUBEV,A.L.ROJAS,A.S.NASCIMENTO,I.POLIKARPOV . 502 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19491.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 355 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 202 40.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 11 2.2 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 0.2 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 . 64 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 7 0 6 5 5 4 6 0 2 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 2 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 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 7 A R 0 0 201 0, 0.0 250,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 159.7 22.4 -8.2 -14.7 2 8 A L - 0 0 143 249,-0.1 2,-0.4 1,-0.0 248,-0.1 -0.853 360.0-102.3 -93.8 140.0 25.2 -8.7 -12.2 3 9 A P + 0 0 72 0, 0.0 2,-0.3 0, 0.0 248,-0.2 -0.501 68.0 134.1 -64.3 120.2 23.9 -9.9 -8.8 4 10 A H E -A 250 0A 75 246,-2.1 246,-2.6 -2,-0.4 2,-0.6 -0.988 62.9 -88.5-161.6 160.2 24.0 -6.9 -6.5 5 11 A W E -A 249 0A 64 -2,-0.3 2,-0.5 244,-0.2 244,-0.2 -0.705 45.0-154.6 -75.4 120.7 22.1 -4.9 -3.9 6 12 A E E -A 248 0A 61 242,-3.3 242,-2.6 -2,-0.6 2,-0.2 -0.867 15.9-120.9-102.1 131.9 20.0 -2.4 -5.8 7 13 A L E +A 247 0A 85 -2,-0.5 240,-0.3 240,-0.2 3,-0.1 -0.533 41.4 159.9 -69.3 131.7 18.9 0.8 -4.1 8 14 A V E + 0 0 61 238,-2.6 2,-0.3 1,-0.4 239,-0.2 0.523 64.6 11.1-126.5 -22.2 15.1 1.0 -4.1 9 15 A W E +A 246 0A 29 237,-1.8 237,-3.3 72,-0.0 -1,-0.4 -0.970 65.7 153.7-158.9 139.8 14.4 3.6 -1.4 10 16 A S E -A 245 0A 29 -2,-0.3 2,-0.4 235,-0.2 235,-0.2 -0.983 28.4-154.5-161.7 155.2 16.5 6.0 0.7 11 17 A D E +A 244 0A 6 233,-2.6 233,-2.6 -2,-0.3 -2,-0.0 -0.961 10.0 179.3-130.1 119.4 16.5 9.2 2.6 12 18 A E - 0 0 50 -2,-0.4 -1,-0.1 231,-0.2 233,-0.1 0.380 38.6-132.1 -96.0 -0.5 19.8 10.9 2.7 13 19 A F + 0 0 0 1,-0.1 41,-0.2 231,-0.1 39,-0.2 0.895 55.3 148.3 49.3 48.0 18.3 13.8 4.8 14 20 A D + 0 0 126 39,-0.1 -1,-0.1 40,-0.1 2,-0.1 0.336 50.4 73.8 -92.4 6.7 20.0 16.3 2.5 15 21 A Y S S- 0 0 52 37,-0.1 2,-0.4 2,-0.0 39,-0.3 -0.325 77.7-110.7-110.3-169.6 17.2 18.8 3.0 16 22 A N + 0 0 134 36,-0.1 2,-0.4 -2,-0.1 36,-0.2 -0.988 67.6 20.9-133.5 135.3 15.9 21.1 5.6 17 23 A G B S+B 51 0A 31 34,-2.3 34,-3.5 -2,-0.4 3,-0.1 -0.905 99.6 3.1 120.0-145.3 12.7 21.1 7.8 18 24 A L S S- 0 0 68 -2,-0.4 32,-0.2 32,-0.2 28,-0.1 -0.393 91.4 -77.8 -74.8 153.5 10.4 18.3 8.8 19 25 A P - 0 0 0 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 -0.293 66.5 -87.7 -46.1 129.9 11.0 14.7 7.7 20 26 A D >> - 0 0 48 1,-0.2 4,-2.6 -3,-0.1 3,-1.8 -0.260 35.1-147.0 -46.8 113.4 10.0 14.3 4.1 21 27 A P T 34 S+ 0 0 85 0, 0.0 -1,-0.2 0, 0.0 23,-0.0 0.611 96.0 62.6 -65.0 -14.3 6.2 13.5 4.2 22 28 A A T 34 S+ 0 0 66 1,-0.1 3,-0.1 3,-0.0 -2,-0.1 0.695 119.3 24.7 -80.3 -20.8 6.6 11.4 1.1 23 29 A K T <4 S+ 0 0 54 -3,-1.8 2,-0.4 1,-0.2 58,-0.2 0.649 123.2 48.2-112.4 -24.6 9.0 9.1 2.9 24 30 A W < + 0 0 2 -4,-2.6 2,-0.2 56,-0.1 53,-0.2 -0.958 47.9 172.4-131.5 136.5 8.0 9.5 6.6 25 31 A D E -I 76 0B 60 51,-3.3 51,-2.5 -2,-0.4 2,-0.4 -0.693 30.0-114.8-122.7-176.5 4.9 9.6 8.7 26 32 A Y E -I 75 0B 19 -2,-0.2 2,-0.6 49,-0.2 49,-0.2 -0.921 2.2-137.3-125.0 147.2 4.7 9.7 12.5 27 33 A D E -I 74 0B 12 47,-2.6 47,-0.5 -2,-0.4 2,-0.4 -0.921 36.1-164.8 -92.2 126.2 3.5 7.6 15.3 28 34 A V + 0 0 36 -2,-0.6 2,-0.2 45,-0.1 14,-0.2 -0.959 33.2 65.1-123.8 128.7 1.6 10.0 17.5 29 35 A G B -P 41 0C 7 12,-2.2 12,-3.0 -2,-0.4 3,-0.1 -0.716 56.9-127.9 147.1 165.0 0.5 9.5 21.1 30 36 A G + 0 0 14 10,-0.3 10,-0.1 -2,-0.2 -1,-0.1 -0.125 61.6 125.2-130.7 36.8 1.7 9.0 24.7 31 37 A H S S- 0 0 133 1,-0.1 3,-0.3 5,-0.0 5,-0.2 0.437 89.8 -96.0 -80.1 1.8 -0.4 5.9 25.6 32 38 A G > > - 0 0 3 7,-0.4 5,-2.3 1,-0.2 3,-2.1 0.139 40.6-119.5 106.1 -19.8 2.7 4.0 26.6 33 39 A W T 3 5 - 0 0 37 1,-0.3 -1,-0.2 2,-0.2 186,-0.0 0.800 67.6 -61.6 53.2 36.4 3.2 2.2 23.3 34 40 A G T 3 5S+ 0 0 74 -3,-0.3 -1,-0.3 3,-0.1 -2,-0.1 0.579 137.6 71.7 74.0 10.0 2.8 -1.2 24.9 35 41 A N T < 5S- 0 0 34 -3,-2.1 188,-2.9 2,-0.1 -2,-0.2 0.256 108.1-107.7-140.5 8.8 5.9 -0.7 27.1 36 42 A Q T 5 + 0 0 88 186,-0.3 186,-0.7 1,-0.2 -3,-0.2 0.801 57.0 177.4 65.0 28.9 4.7 1.9 29.7 37 43 A E B < -S 221 0D 3 -5,-2.3 184,-0.2 184,-0.2 -1,-0.2 -0.289 28.1-144.5 -66.3 152.3 6.9 4.5 27.9 38 44 A L + 0 0 20 182,-3.4 32,-0.7 -3,-0.1 31,-0.6 0.605 64.1 94.9 -96.2 -14.9 6.8 8.0 29.3 39 45 A Q E - q 0 70C 0 181,-0.5 2,-0.7 30,-0.1 -7,-0.4 -0.389 66.3-134.2 -85.2 154.8 7.1 10.0 26.1 40 46 A Y E - q 0 71C 42 30,-2.3 32,-2.2 -2,-0.1 2,-0.6 -0.943 22.4-141.5-100.3 111.6 4.5 11.6 23.8 41 47 A Y E -Pq 29 72C 0 -12,-3.0 -12,-2.2 -2,-0.7 32,-0.2 -0.651 26.8-150.9 -70.5 117.8 5.4 10.8 20.2 42 48 A T - 0 0 1 30,-3.2 2,-0.5 -2,-0.6 32,-0.4 -0.504 7.6-120.6 -97.4 160.9 4.6 14.0 18.4 43 49 A R S S- 0 0 150 1,-0.2 3,-0.1 -2,-0.2 6,-0.1 -0.877 81.8 -23.7-102.4 132.7 3.5 14.6 14.8 44 50 A A S S+ 0 0 42 -2,-0.5 2,-0.6 1,-0.2 -1,-0.2 0.801 88.0 153.6 37.5 46.4 5.5 16.8 12.5 45 51 A R >> - 0 0 38 -3,-0.2 4,-2.3 1,-0.1 3,-2.0 -0.921 41.0-151.5-105.5 116.4 7.1 18.7 15.4 46 52 A I T 34 S+ 0 0 76 -2,-0.6 -1,-0.1 1,-0.3 -2,-0.1 0.743 94.7 65.2 -59.3 -24.8 10.5 20.1 14.6 47 53 A E T 34 S+ 0 0 65 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.775 116.8 26.9 -65.9 -25.6 11.5 19.8 18.2 48 54 A N T <4 S+ 0 0 0 -3,-2.0 11,-2.2 1,-0.3 2,-0.3 0.647 133.7 26.0-113.2 -22.6 11.2 16.0 17.9 49 55 A A E < S+ C 0 58A 1 -4,-2.3 2,-0.3 9,-0.2 -1,-0.3 -0.808 71.3 152.0-149.6 102.7 11.9 15.4 14.2 50 56 A R E - C 0 57A 51 7,-2.0 7,-2.9 -2,-0.3 2,-0.5 -0.973 28.9-147.4-133.9 146.1 14.0 17.8 12.2 51 57 A V E +BC 17 56A 6 -34,-3.5 -34,-2.3 -2,-0.3 2,-0.3 -0.955 42.2 110.2-117.3 130.1 16.2 17.5 9.1 52 58 A G E > + C 0 55A 24 3,-2.7 3,-1.5 -2,-0.5 -36,-0.1 -0.898 52.3 45.6 174.8 158.4 19.3 19.6 8.6 53 59 A G T 3 S- 0 0 81 1,-0.3 3,-0.1 -2,-0.3 -39,-0.1 0.794 129.3 -59.4 63.9 28.4 23.0 19.6 8.4 54 60 A G T 3 S+ 0 0 32 -39,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.512 119.7 82.3 80.3 5.9 22.8 16.5 6.4 55 61 A V E < S-C 52 0A 20 -3,-1.5 -3,-2.7 -40,-0.2 2,-0.4 -0.897 71.7-121.8-136.5 165.6 21.0 14.5 9.0 56 62 A L E -CD 51 241A 0 185,-2.3 185,-3.2 -2,-0.3 2,-0.5 -0.892 24.8-158.0 -95.2 137.2 17.7 13.6 10.6 57 63 A I E -CD 50 240A 27 -7,-2.9 -7,-2.0 -2,-0.4 2,-0.6 -0.983 7.4-170.1-113.4 117.9 17.5 14.3 14.3 58 64 A I E -CD 49 239A 0 181,-3.1 181,-3.4 -2,-0.5 2,-0.5 -0.944 24.0-161.4 -94.5 127.4 14.9 12.4 16.2 59 65 A E E - D 0 238A 7 -11,-2.2 2,-0.5 -2,-0.6 179,-0.2 -0.959 20.1-149.6-126.4 126.3 14.9 14.1 19.6 60 66 A A E - D 0 237A 0 177,-3.2 177,-1.9 -2,-0.5 2,-0.4 -0.784 25.3-168.5 -87.3 127.9 13.7 13.0 23.0 61 67 A R E -R 71 0C 69 10,-3.0 10,-2.9 -2,-0.5 2,-1.0 -0.971 25.2-140.0-124.8 131.5 12.6 16.0 25.1 62 68 A R E +R 70 0C 137 -2,-0.4 2,-0.3 8,-0.2 8,-0.3 -0.785 57.7 123.3 -82.5 105.6 11.8 16.4 28.7 63 69 A E E S- 0 0 51 6,-1.1 2,-0.7 -2,-1.0 -2,-0.1 -0.968 70.6 -96.7-161.8 148.1 8.8 18.8 28.5 64 70 A S E + 0 0 119 -2,-0.3 2,-0.4 5,-0.1 5,-0.2 -0.595 57.6 159.2 -70.6 110.6 5.1 19.0 29.6 65 71 A Y E > -R 68 0C 56 3,-3.7 3,-2.9 -2,-0.7 5,-0.2 -0.969 60.5 -27.9-145.1 121.9 3.3 17.9 26.5 66 72 A E T 3 S- 0 0 140 -2,-0.4 3,-0.1 1,-0.3 -36,-0.1 0.852 128.1 -42.2 40.4 50.8 -0.3 16.5 26.0 67 73 A G T 3 S+ 0 0 83 1,-0.3 2,-0.3 -27,-0.0 -1,-0.3 0.454 121.8 109.5 82.6 0.1 -0.3 15.0 29.5 68 74 A R E < - R 0 65C 77 -3,-2.9 -3,-3.7 1,-0.1 -1,-0.3 -0.794 63.7-147.6-113.9 154.9 3.2 13.7 29.1 69 75 A E E S+ 0 0 120 -31,-0.6 -6,-1.1 -2,-0.3 2,-0.3 0.486 87.7 39.4 -97.2 -8.1 6.5 14.8 30.8 70 76 A Y E -qR 39 62C 11 -32,-0.7 -30,-2.3 -8,-0.3 2,-0.3 -0.982 64.7-159.7-137.5 151.0 8.5 14.0 27.7 71 77 A T E +qR 40 61C 0 -10,-2.9 -10,-3.0 -2,-0.3 2,-0.3 -0.866 20.6 152.7-120.0 164.6 8.0 14.2 23.9 72 78 A S E -q 41 0C 0 -32,-2.2 -30,-3.2 -2,-0.3 2,-0.4 -0.928 35.6-103.9-166.4-173.8 9.7 12.4 21.1 73 79 A A - 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