==== 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/HYDROLASE INHIBITOR 16-DEC-04 1WVM . COMPND 2 MOLECULE: ALKALINE SERINE PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOALTEROMONAS SP.; . AUTHOR D.DONG,K.WATANABE . 879 6 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30306.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 586 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 119 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 99 11.3 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 . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.9 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 . 61 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 158 18.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 2 0 1 1 0 8 2 2 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 2 10 6 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 PARALLEL BRIDGES PER LADDER . 12 6 3 3 2 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 ANTIPARALLEL BRIDGES PER LADDER . 7 2 0 0 0 0 2 0 2 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 1 A A 0 0 109 0, 0.0 80,-0.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 140.6 66.6 53.5 42.0 2 2 A E B -a 81 0A 58 78,-0.2 2,-0.4 2,-0.0 80,-0.2 -0.927 360.0-151.6-114.2 133.0 70.0 52.3 40.7 3 3 A T - 0 0 20 78,-3.0 80,-0.5 -2,-0.4 77,-0.1 -0.812 7.0-146.9-106.2 142.1 71.8 49.2 42.1 4 4 A T - 0 0 63 -2,-0.4 5,-0.1 78,-0.2 78,-0.1 -0.901 25.5-134.7-106.4 103.2 75.5 48.6 42.2 5 5 A P >> - 0 0 13 0, 0.0 3,-1.3 0, 0.0 4,-1.0 -0.239 22.9-110.6 -56.9 147.2 76.1 44.9 41.7 6 6 A W H 3> S+ 0 0 38 1,-0.3 4,-2.6 2,-0.2 3,-0.3 0.823 114.1 63.3 -48.6 -39.0 78.6 43.3 44.1 7 7 A G H 3> S+ 0 0 1 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.868 98.2 54.4 -56.7 -39.8 81.1 42.8 41.4 8 8 A Q H <4>S+ 0 0 2 -3,-1.3 5,-1.3 1,-0.2 6,-0.8 0.889 112.6 43.3 -62.1 -40.5 81.5 46.5 40.8 9 9 A T H ><5S+ 0 0 75 -4,-1.0 3,-0.9 -3,-0.3 -2,-0.2 0.900 110.5 55.5 -72.3 -41.8 82.3 47.1 44.4 10 10 A F H 3<5S+ 0 0 89 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.827 107.4 47.7 -62.2 -35.8 84.6 44.2 44.8 11 11 A V T 3<5S- 0 0 1 -4,-1.8 410,-2.7 -5,-0.2 411,-0.3 0.557 112.5-118.0 -83.9 -8.0 87.0 45.2 42.0 12 12 A G T X>5S+ 0 0 11 -3,-0.9 3,-0.7 -4,-0.4 4,-0.6 0.609 72.4 132.4 84.0 14.3 87.2 48.7 43.3 13 13 A A G >4< + 0 0 7 -5,-1.3 3,-0.7 -6,-0.2 -4,-0.2 0.853 65.8 62.6 -65.7 -34.2 85.6 50.5 40.2 14 14 A T G 34 S+ 0 0 74 -6,-0.8 -1,-0.2 1,-0.2 -5,-0.1 0.744 100.4 51.9 -64.2 -26.4 83.3 52.6 42.4 15 15 A V G <4 S+ 0 0 100 -3,-0.7 -1,-0.2 -6,-0.1 -2,-0.2 0.663 103.0 65.9 -86.5 -18.0 86.1 54.4 44.2 16 16 A L S << S- 0 0 33 -3,-0.7 2,-0.4 -4,-0.6 366,-0.0 -0.389 79.8-123.8 -94.4 177.6 88.0 55.5 41.1 17 17 A S - 0 0 55 -2,-0.1 3,-0.4 364,-0.1 69,-0.1 -0.991 7.2-156.7-128.8 133.3 86.8 58.0 38.5 18 18 A D > + 0 0 4 -2,-0.4 3,-1.9 1,-0.2 4,-0.2 0.139 57.4 122.6 -90.9 21.0 86.4 57.4 34.7 19 19 A S T 3 S+ 0 0 65 1,-0.3 3,-0.2 2,-0.1 -1,-0.2 0.736 80.5 38.7 -55.6 -24.9 86.7 61.2 34.0 20 20 A Q T > S+ 0 0 116 -3,-0.4 3,-2.2 1,-0.1 -1,-0.3 0.370 81.9 107.8-106.6 3.8 89.7 60.6 31.7 21 21 A A G X + 0 0 0 -3,-1.9 3,-2.0 1,-0.3 71,-0.7 0.594 57.1 84.7 -59.4 -10.4 88.5 57.4 30.1 22 22 A G G 3 S+ 0 0 42 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.667 81.0 64.5 -66.0 -13.7 87.8 59.3 26.9 23 23 A N G < S+ 0 0 56 -3,-2.2 2,-0.3 361,-0.1 -1,-0.3 0.435 99.4 64.8 -88.7 2.6 91.5 58.7 26.2 24 24 A R < - 0 0 28 -3,-2.0 68,-1.7 -4,-0.1 2,-0.4 -0.880 63.1-159.3-124.0 155.5 90.9 54.9 26.0 25 25 A T E -b 92 0B 23 -2,-0.3 99,-3.0 66,-0.1 100,-2.0 -0.993 5.0-167.3-136.2 125.8 88.8 52.7 23.7 26 26 A I E -bc 93 125B 0 66,-2.5 68,-2.4 -2,-0.4 2,-0.5 -0.954 8.9-152.4-115.8 132.6 87.6 49.2 24.5 27 27 A a E -bc 94 126B 0 98,-3.0 100,-2.7 -2,-0.5 2,-0.7 -0.914 2.7-153.2-108.3 129.5 86.2 46.9 21.9 28 28 A I E -bc 95 127B 3 66,-2.6 68,-2.1 -2,-0.5 2,-0.9 -0.883 4.6-166.5-104.9 109.3 83.7 44.2 22.7 29 29 A I E +bc 96 128B 0 98,-2.0 100,-0.6 -2,-0.7 2,-0.2 -0.856 50.7 94.0 -94.2 108.7 83.8 41.2 20.4 30 30 A D E S-b 97 0B 2 66,-1.8 68,-2.4 -2,-0.9 69,-1.5 -0.668 89.2 -43.6-162.4-144.0 80.5 39.5 21.3 31 31 A S S S- 0 0 0 1,-0.3 66,-0.2 66,-0.2 36,-0.1 0.103 90.9 -86.4 -97.9 22.8 76.8 39.1 20.4 32 32 A G - 0 0 3 64,-0.3 2,-0.4 -4,-0.2 -1,-0.3 -0.316 39.1 -89.9 102.2 174.5 76.0 42.8 19.8 33 33 A Y - 0 0 0 23,-2.8 2,-1.8 -2,-0.1 3,-0.1 -0.988 22.7-135.1-134.1 119.0 74.9 45.8 21.9 34 34 A D > + 0 0 12 -2,-0.4 3,-1.7 1,-0.2 24,-0.2 -0.563 26.2 179.5 -77.7 89.6 71.3 46.7 22.6 35 35 A R T 3 S+ 0 0 88 -2,-1.8 -1,-0.2 22,-1.2 23,-0.1 0.621 73.1 68.9 -66.3 -13.1 71.7 50.4 22.0 36 36 A S T 3 S+ 0 0 76 21,-0.4 -1,-0.3 -3,-0.1 2,-0.2 0.640 75.8 109.0 -80.8 -12.8 68.0 51.0 22.7 37 37 A H S X> S- 0 0 2 -3,-1.7 4,-3.0 1,-0.1 3,-1.9 -0.419 73.3-133.3 -67.2 133.6 68.5 50.1 26.4 38 38 A N T 34 S+ 0 0 96 1,-0.3 4,-0.3 2,-0.2 -1,-0.1 0.763 106.5 49.9 -58.6 -27.6 68.2 53.1 28.7 39 39 A D T 34 S+ 0 0 0 1,-0.1 37,-2.6 2,-0.1 -1,-0.3 0.403 123.9 29.0 -93.1 4.5 71.4 52.1 30.5 40 40 A L T X4 S+ 0 0 0 -3,-1.9 3,-1.4 35,-0.2 -2,-0.2 0.549 94.2 86.4-134.2 -20.9 73.4 51.8 27.3 41 41 A N T 3< S+ 0 0 90 -4,-3.0 4,-0.2 1,-0.3 -3,-0.1 0.883 91.4 46.2 -53.1 -48.9 71.9 54.1 24.7 42 42 A A T 3 S+ 0 0 47 -4,-0.3 -1,-0.3 -5,-0.2 2,-0.1 0.062 83.9 118.3 -89.2 25.5 73.9 57.3 25.6 43 43 A N S < S- 0 0 14 -3,-1.4 2,-2.3 -8,-0.1 49,-0.1 -0.458 82.6-102.0 -83.9 164.4 77.3 55.8 25.9 44 44 A N E S+d 92 0B 64 47,-0.6 49,-2.7 -2,-0.1 2,-0.4 -0.526 73.0 153.1 -83.7 70.9 80.2 56.9 23.6 45 45 A V E +d 93 0B 17 -2,-2.3 2,-0.3 -4,-0.2 49,-0.2 -0.863 20.6 162.7-113.8 139.7 79.6 53.7 21.6 46 46 A T E -d 94 0B 78 47,-2.5 49,-2.3 -2,-0.4 2,-0.3 -0.834 11.3-170.1-138.1 174.1 80.2 52.9 17.9 47 47 A G E -d 95 0B 21 47,-0.3 2,-0.5 -2,-0.3 49,-0.2 -0.983 23.6-123.5-162.6 169.1 80.5 49.7 15.9 48 48 A T - 0 0 39 47,-1.9 49,-0.4 -2,-0.3 73,-0.0 -0.946 31.3-137.1-126.3 109.2 81.4 48.1 12.6 49 49 A N - 0 0 79 -2,-0.5 2,-0.4 47,-0.1 6,-0.1 -0.237 12.1-155.4 -64.6 151.7 78.7 46.0 11.0 50 50 A N > - 0 0 21 4,-0.7 3,-1.9 47,-0.1 4,-0.4 -0.987 23.6-124.4-128.7 137.7 79.5 42.7 9.3 51 51 A S T 3 S+ 0 0 117 -2,-0.4 3,-0.4 1,-0.3 55,-0.1 0.739 109.0 53.8 -52.9 -26.1 77.4 41.2 6.6 52 52 A G T 3 S+ 0 0 30 1,-0.2 -1,-0.3 2,-0.1 54,-0.1 0.612 112.9 38.4 -88.7 -9.0 76.8 38.0 8.6 53 53 A T S < S- 0 0 3 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.129 89.6-139.2-129.8 24.4 75.5 39.6 11.8 54 54 A G - 0 0 46 -4,-0.4 -4,-0.7 -3,-0.4 2,-0.4 -0.279 67.3 -0.3 58.7-134.0 73.2 42.5 10.8 55 55 A N > - 0 0 46 3,-0.3 3,-1.8 -6,-0.1 -7,-0.0 -0.784 55.7-144.2 -95.8 132.8 73.5 45.6 12.9 56 56 A W T 3 S+ 0 0 16 -2,-0.4 -23,-2.8 1,-0.3 -1,-0.1 0.792 103.2 55.6 -61.1 -28.2 76.0 45.7 15.9 57 57 A Y T 3 S+ 0 0 60 -25,-0.2 -22,-1.2 1,-0.2 -21,-0.4 0.323 101.3 62.3 -88.4 6.9 73.4 47.8 17.8 58 58 A Q < - 0 0 107 -3,-1.8 -3,-0.3 -24,-0.2 -1,-0.2 -0.820 58.7-177.0-133.9 92.1 70.6 45.2 17.4 59 59 A P - 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0 0 41 -4,-1.4 3,-2.1 -5,-0.1 -1,-0.3 -0.938 54.8 -88.7-176.8 166.3 129.1 12.7 24.3 868 432 B h T 3 S+ 0 0 39 1,-0.3 -35,-0.1 -2,-0.3 -4,-0.1 0.712 130.8 45.0 -61.8 -17.9 125.5 12.8 25.4 869 433 B T T 3 S- 0 0 86 1,-0.3 -1,-0.3 -5,-0.1 -5,-0.1 0.258 111.1-129.7-107.9 10.6 125.7 16.6 24.7 870 434 B G < - 0 0 0 -3,-2.1 -1,-0.3 -7,-0.3 -7,-0.1 -0.256 59.4 -6.3 74.8-164.4 127.4 16.2 21.4 871 435 B P 0 0 77 0, 0.0 -4,-0.0 0, 0.0 -8,-0.0 -0.276 360.0 360.0 -63.5 150.9 130.6 18.1 20.4 872 436 B T 0 0 176 -6,-0.0 -5,-0.0 0, 0.0 -6,-0.0 0.926 360.0 360.0 -93.4 360.0 131.9 20.8 22.8 873 !* 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 0.0 874 1 C F 0 0 99 0, 0.0 -742,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 360.0 83.5 28.4 17.6 875 ! 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 0.0 876 2 C X 0 0 132 0, 0.0 -745,-2.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 168.3 80.9 29.8 21.6 877 3 C L B L 130 0D 43 -747,-0.2 -747,-0.3 1,-0.2 -508,-0.1 -0.614 360.0 360.0 -71.4 163.2 80.1 32.6 24.1 878 4 C X 0 0 24 -749,-2.0 -509,-2.2 -2,-0.3 -508,-0.4 0.481 360.0 360.0-141.6 360.0 81.4 31.9 27.6 879 !* 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 0.0 880 1 D F 0 0 97 0, 0.0 -312,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 360.0 90.1 12.2 19.3 881 ! 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 0.0 882 2 D X 0 0 137 0, 0.0 -315,-2.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 168.3 92.0 10.5 15.2 883 3 D L B M 566 0P 45 -317,-0.2 -317,-0.3 1,-0.2 -78,-0.1 -0.572 360.0 360.0 -68.0 161.1 94.8 8.5 13.5 884 4 D X 0 0 23 -319,-2.2 -79,-2.4 -2,-0.3 -78,-0.4 0.506 360.0 360.0-139.4 360.0 97.2 10.8 11.5