==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE PROTEASE 16-OCT-97 1KLT . COMPND 2 MOLECULE: CHYMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.E.MCGRATH . 226 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10434.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 145 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 34.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.3 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 . 22 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 5.3 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 0 0 0 0 0 0 1 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 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 . 4 3 1 5 1 2 1 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 . 0 0 0 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 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 16 A I 0 0 1 0, 0.0 2,-0.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 128.3 -0.9 34.0 8.8 2 17 A I B +A 176 0A 19 174,-3.6 174,-1.5 1,-0.2 130,-0.1 -0.827 360.0 2.2-104.0 132.6 -2.4 37.0 7.0 3 18 A G S S+ 0 0 50 128,-0.4 -1,-0.2 -2,-0.4 172,-0.2 0.761 102.8 111.9 68.7 30.3 -5.6 36.9 4.9 4 19 A G - 0 0 29 -3,-0.3 2,-0.3 140,-0.1 140,-0.2 -0.257 57.9-107.5-114.6-158.5 -6.4 33.2 5.6 5 20 A T E -B 143 0B 93 138,-2.2 138,-2.0 -2,-0.1 2,-0.1 -0.930 36.0 -86.9-134.7 164.6 -8.8 30.9 7.3 6 21 A E E -B 142 0B 104 -2,-0.3 136,-0.3 136,-0.2 135,-0.1 -0.424 49.1-119.7 -69.5 131.4 -9.1 28.7 10.3 7 22 A S - 0 0 4 134,-3.8 -1,-0.1 -2,-0.1 134,-0.1 -0.276 31.9 -98.9 -66.1 157.7 -7.9 25.1 9.5 8 23 A K > - 0 0 165 1,-0.1 3,-1.8 2,-0.0 4,-0.2 -0.678 62.4 -87.7 -73.7 141.1 -10.3 22.3 9.9 9 24 A P T 3 S- 0 0 75 0, 0.0 -1,-0.1 0, 0.0 49,-0.1 -0.292 104.1 -4.8 -55.3 131.8 -9.3 21.0 13.4 10 25 A H T 3 S+ 0 0 50 47,-0.3 48,-0.1 2,-0.1 47,-0.0 0.610 91.3 126.4 62.3 15.5 -6.6 18.3 13.3 11 26 A S S < S+ 0 0 53 -3,-1.8 -1,-0.1 1,-0.3 93,-0.0 0.571 75.4 46.3 -77.6 -10.5 -6.6 18.3 9.5 12 27 A R > + 0 0 68 -4,-0.2 3,-2.1 92,-0.1 -1,-0.3 -0.591 69.8 175.5-132.0 75.0 -2.8 18.9 9.6 13 28 A P T 3 S+ 0 0 32 0, 0.0 93,-2.3 0, 0.0 43,-0.2 0.480 72.5 65.7 -60.1 -6.2 -1.5 16.4 12.2 14 29 A Y T 3 S+ 0 0 22 91,-0.2 20,-1.5 93,-0.1 2,-0.3 0.443 72.2 119.4 -96.2 -2.0 2.2 17.4 11.6 15 30 A M E < -I 33 0C 6 -3,-2.1 41,-0.7 18,-0.2 2,-0.4 -0.532 44.9-168.2 -70.9 126.0 1.7 20.9 13.0 16 31 A A E -IJ 32 55C 0 16,-2.3 16,-0.7 -2,-0.3 2,-0.5 -0.932 12.2-150.9-115.4 133.7 3.9 21.5 15.9 17 32 A Y E -IJ 31 54C 33 37,-2.6 37,-2.8 -2,-0.4 2,-0.5 -0.949 16.5-156.3-104.0 127.4 3.5 24.5 18.2 18 33 A L E -IJ 30 53C 0 12,-2.9 12,-1.6 -2,-0.5 2,-0.6 -0.926 9.0-162.8-110.1 127.7 6.8 25.6 19.8 19 34 A E E -IJ 29 52C 63 33,-3.1 33,-1.9 -2,-0.5 2,-0.4 -0.931 20.2-163.8-103.3 125.0 7.0 27.6 23.1 20 35 A I E -IJ 28 51C 0 8,-2.6 8,-1.3 -2,-0.6 2,-0.5 -0.918 16.1-154.7-121.2 137.9 10.5 29.0 23.4 21 36 A V E -IJ 27 50C 59 29,-3.0 28,-2.5 -2,-0.4 29,-1.0 -0.909 18.6-166.1-106.3 127.9 12.4 30.5 26.3 22 36AA T - 0 0 48 4,-0.8 2,-1.6 -2,-0.5 26,-0.1 -0.702 34.8-109.1-108.9 162.0 15.1 33.0 25.5 23 36BA S S S+ 0 0 105 -2,-0.2 2,-0.3 2,-0.1 -2,-0.0 -0.479 103.7 20.5 -85.7 61.0 18.0 34.5 27.6 24 36CA N S S+ 0 0 133 -2,-1.6 -2,-0.3 2,-0.1 0, 0.0 -0.944 117.7 22.3 166.4-165.7 16.1 37.9 27.7 25 37 A G S S- 0 0 54 -2,-0.3 -2,-0.1 -4,-0.1 0, 0.0 0.070 99.1-102.1 -27.6 76.0 12.6 39.2 27.1 26 38 A P - 0 0 100 0, 0.0 -4,-0.8 0, 0.0 2,-0.1 0.218 66.8 -12.7 29.7-151.6 10.7 36.0 27.8 27 39 A S E -I 21 0C 60 -6,-0.2 2,-0.3 21,-0.0 -6,-0.2 -0.339 46.8-177.9 -78.9 157.9 9.2 33.5 25.5 28 40 A K E -I 20 0C 76 -8,-1.3 -8,-2.6 -2,-0.1 2,-0.3 -0.854 20.9-132.4-140.0 171.1 8.4 33.7 21.7 29 41 A F E -I 19 0C 62 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.907 18.4-175.9-133.3 163.9 6.7 31.1 19.6 30 42 A a E -I 18 0C 5 -12,-1.6 -12,-2.9 -2,-0.3 153,-0.2 -0.965 22.8-123.4-151.9 160.9 7.1 29.3 16.3 31 43 A G E +I 17 0C 0 151,-2.8 12,-0.4 -2,-0.3 2,-0.3 -0.464 38.7 151.4 -92.7 173.6 5.5 26.8 14.1 32 44 A G E -I 16 0C 0 -16,-0.7 -16,-2.3 -2,-0.2 2,-0.3 -0.944 31.6-114.5 175.1 174.5 7.3 23.6 13.0 33 45 A F E -IK 15 41C 0 8,-2.7 8,-3.6 -2,-0.3 2,-0.5 -0.986 16.5-116.7-141.5 151.1 6.5 20.1 11.9 34 46 A L E + K 0 40C 0 -20,-1.5 74,-1.5 72,-0.4 6,-0.2 -0.709 29.4 169.3 -81.0 121.2 7.0 16.5 13.0 35 47 A I E S+ 0 0 12 4,-2.4 2,-0.3 -2,-0.5 5,-0.2 0.580 71.8 0.5-106.7 -21.6 9.1 14.4 10.6 36 48 A R E > S- K 0 39C 81 3,-1.7 3,-1.7 70,-0.1 -1,-0.4 -0.965 91.1 -81.2-156.8 172.9 9.5 11.4 12.8 37 49 A R T 3 S+ 0 0 91 -2,-0.3 62,-2.5 1,-0.3 60,-0.1 0.821 127.1 21.1 -51.6 -38.7 8.4 10.3 16.3 38 50 A N T 3 S+ 0 0 16 60,-0.2 57,-1.9 58,-0.1 2,-0.4 -0.067 113.1 80.8-121.4 36.9 11.2 12.2 18.2 39 51 A F E < -KL 36 94C 0 -3,-1.7 -4,-2.4 55,-0.2 -3,-1.7 -0.969 47.0-177.1-149.8 128.6 12.1 14.9 15.6 40 52 A V E -KL 34 93C 0 53,-2.1 53,-2.7 -2,-0.4 2,-0.4 -0.940 17.9-142.4-119.5 142.5 10.6 18.2 14.6 41 53 A L E +KL 33 92C 0 -8,-3.6 -8,-2.7 -2,-0.4 2,-0.2 -0.885 36.4 140.7-108.9 137.3 11.8 20.4 11.8 42 54 A T E - L 0 91C 0 49,-2.3 49,-2.4 -2,-0.4 2,-0.3 -0.820 51.5 -65.5-153.4-171.7 11.7 24.2 12.3 43 55 A A > - 0 0 0 -12,-0.4 3,-1.5 47,-0.3 47,-0.3 -0.655 31.8-129.5 -89.4 151.3 13.7 27.3 11.5 44 56 A A G > S+ 0 0 2 1,-0.3 3,-1.4 -2,-0.3 -1,-0.1 0.735 108.1 70.1 -66.7 -25.1 17.1 28.0 13.1 45 57 A H G 3 S+ 0 0 94 1,-0.3 -1,-0.3 41,-0.1 137,-0.1 0.484 88.7 64.8 -70.6 -3.9 15.7 31.5 14.0 46 58 A a G < S+ 0 0 0 -3,-1.5 -1,-0.3 2,-0.1 2,-0.2 0.143 76.2 127.3-107.0 18.0 13.5 29.6 16.5 47 59 A A < + 0 0 30 -3,-1.4 2,-0.3 -27,-0.1 -27,-0.1 -0.521 31.4 143.6 -78.1 143.8 16.5 28.5 18.7 48 60 A G - 0 0 22 -2,-0.2 -26,-0.2 1,-0.1 3,-0.1 -0.897 59.4 -71.6-160.8-170.8 16.5 29.2 22.4 49 61 A R S S- 0 0 180 -28,-2.5 2,-0.3 1,-0.3 -27,-0.2 0.933 110.3 -12.8 -61.2 -53.8 17.2 28.4 26.0 50 63 A S E -J 21 0C 58 -29,-1.0 -29,-3.0 -3,-0.0 2,-0.3 -0.970 68.2-160.2-148.5 156.1 14.6 25.7 26.3 51 64 A I E -J 20 0C 6 -2,-0.3 21,-1.8 21,-0.3 2,-0.4 -1.000 5.7-163.5-145.6 142.0 11.7 24.7 24.1 52 65 A T E -JM 19 71C 43 -33,-1.9 -33,-3.1 -2,-0.3 2,-0.5 -0.963 12.5-149.6-125.3 140.9 8.5 22.7 24.5 53 66 A V E -JM 18 70C 0 17,-2.4 17,-2.4 -2,-0.4 2,-0.6 -0.919 1.7-156.9-115.9 131.3 6.4 21.4 21.6 54 67 A T E -JM 17 69C 1 -37,-2.8 -37,-2.6 -2,-0.5 2,-0.3 -0.926 15.9-169.2-108.2 121.8 2.7 20.9 21.6 55 68 A L E +JM 16 68C 0 13,-3.5 13,-1.9 -2,-0.6 -39,-0.1 -0.835 62.8 24.3-110.6 145.8 1.5 18.3 19.1 56 69 A G S S+ 0 0 3 -41,-0.7 2,-0.2 -2,-0.3 10,-0.2 0.635 85.6 139.0 76.6 23.9 -2.1 17.7 18.1 57 70 A A + 0 0 10 -42,-0.3 -47,-0.3 -3,-0.2 -1,-0.2 -0.543 28.6 169.8 -98.8 158.3 -3.5 21.1 19.0 58 71 A H S S+ 0 0 13 1,-0.4 2,-0.8 4,-0.3 83,-0.8 0.498 84.6 29.4-119.9 -72.1 -6.0 23.3 17.2 59 72 A N B > S-O 140 0D 23 3,-0.3 3,-1.1 81,-0.2 -1,-0.4 -0.868 75.9-156.0 -90.2 111.2 -6.8 26.1 19.6 60 73 A I T 3 S+ 0 0 38 79,-2.6 -1,-0.1 -2,-0.8 80,-0.1 0.463 86.1 63.5 -71.8 3.1 -3.6 26.4 21.7 61 74 A T T 3 S+ 0 0 84 78,-0.3 2,-0.5 1,-0.2 -1,-0.2 0.693 101.2 49.0-100.8 -16.5 -5.5 27.9 24.6 62 75 A E S < S- 0 0 119 -3,-1.1 -4,-0.3 77,-0.2 -3,-0.3 -0.967 80.3-139.6-125.7 117.2 -7.7 24.9 25.4 63 76 A E - 0 0 168 -2,-0.5 2,-0.3 -3,-0.1 -6,-0.0 -0.283 21.1-175.6 -71.3 158.8 -6.2 21.5 25.7 64 77 A E > - 0 0 79 -8,-0.0 3,-1.1 -6,-0.0 -1,-0.0 -0.878 45.6 -91.9-141.7 174.6 -8.0 18.5 24.3 65 78 A D T 3 S+ 0 0 177 -2,-0.3 -2,-0.0 1,-0.3 -9,-0.0 0.561 121.4 66.0 -67.8 -12.8 -7.3 14.7 24.4 66 79 A T T 3 S+ 0 0 32 -10,-0.2 -1,-0.3 38,-0.1 -9,-0.1 0.791 79.4 110.6 -78.0 -30.3 -5.4 15.1 21.1 67 80 A W < + 0 0 44 -3,-1.1 2,-0.3 -11,-0.1 -11,-0.2 -0.071 38.6 174.4 -48.8 139.7 -2.7 17.2 22.9 68 81 A Q E -M 55 0C 40 -13,-1.9 -13,-3.5 2,-0.0 2,-0.5 -0.904 8.6-169.4-150.0 114.0 0.8 15.8 23.4 69 82 A K E +M 54 0C 119 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.941 12.1 178.6-111.9 118.5 3.4 18.2 24.9 70 83 A L E -M 53 0C 7 -17,-2.4 -17,-2.4 -2,-0.5 2,-0.3 -0.877 26.3-116.8-122.3 157.2 7.0 17.0 24.8 71 84 A E E -M 52 0C 111 -2,-0.3 25,-2.7 -19,-0.2 2,-0.6 -0.650 25.2-122.8 -89.5 149.7 10.3 18.5 25.9 72 85 A V E -N 95 0C 24 -21,-1.8 -21,-0.3 -2,-0.3 23,-0.3 -0.845 23.1-173.0 -91.8 117.0 13.1 19.2 23.4 73 86 A I E + 0 0 106 21,-2.6 2,-0.3 -2,-0.6 22,-0.2 0.648 68.0 7.9 -84.1 -17.9 16.2 17.3 24.5 74 87 A K E -N 94 0C 100 20,-1.2 20,-2.4 2,-0.0 2,-0.6 -0.921 59.8-140.3-166.6 142.1 18.6 18.8 21.9 75 88 A Q E -N 93 0C 64 -2,-0.3 2,-1.3 18,-0.2 18,-0.2 -0.886 8.6-166.5-108.7 108.9 18.7 21.6 19.2 76 89 A F E -N 92 0C 35 16,-3.1 16,-2.2 -2,-0.6 2,-0.1 -0.692 18.6-177.2 -93.5 83.5 20.5 20.8 16.0 77 90 A R E -N 91 0C 110 -2,-1.3 14,-0.2 14,-0.2 12,-0.1 -0.477 39.9 -97.2 -73.6 155.4 20.8 24.3 14.5 78 91 A H > - 0 0 17 12,-1.4 3,-1.9 10,-0.3 -1,-0.1 -0.667 31.2-144.7 -73.2 127.9 22.3 24.6 11.1 79 92 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.769 100.8 52.6 -64.0 -28.0 26.0 25.5 11.8 80 93 A K T 3 S+ 0 0 149 8,-0.1 2,-0.4 2,-0.1 7,-0.1 0.299 79.8 132.4 -89.3 7.0 26.2 27.7 8.7 81 94 A Y < - 0 0 20 -3,-1.9 2,-0.5 9,-0.1 7,-0.2 -0.488 40.5-167.4 -59.6 121.6 23.1 29.4 10.0 82 95 A N > - 0 0 73 5,-1.7 4,-1.6 -2,-0.4 5,-0.2 -0.953 26.2-152.7-124.0 126.8 24.0 33.1 9.7 83 96 A T T 4 S+ 0 0 106 -2,-0.5 -1,-0.1 2,-0.2 -2,-0.0 0.562 95.3 52.2 -71.6 -5.9 22.0 35.9 11.3 84 97 A S T 4 S+ 0 0 75 3,-0.1 -1,-0.2 1,-0.1 -3,-0.0 0.914 122.7 21.5 -95.1 -60.2 23.2 38.3 8.6 85 98 A T T 4 S- 0 0 32 2,-0.1 -2,-0.2 1,-0.1 3,-0.1 0.605 95.2-138.0 -79.6 -11.7 22.4 36.6 5.3 86 99 A L < + 0 0 39 -4,-1.6 3,-0.4 1,-0.2 -3,-0.2 0.637 47.7 159.7 59.8 22.3 19.8 34.5 7.2 87 100 A H + 0 0 26 1,-0.2 -5,-1.7 -5,-0.2 -1,-0.2 -0.427 52.4 22.8 -76.2 143.5 21.0 31.6 5.2 88 101 A H S S+ 0 0 31 -7,-0.2 2,-2.0 1,-0.2 -10,-0.3 0.913 70.4 175.0 67.1 47.3 20.4 28.0 6.3 89 102 A D + 0 0 2 -3,-0.4 2,-0.3 -46,-0.1 -1,-0.2 -0.545 38.4 110.3 -85.4 72.3 17.5 28.9 8.5 90 103 A I + 0 0 0 -2,-2.0 -12,-1.4 -47,-0.3 2,-0.3 -0.987 38.4 174.5-146.9 146.8 16.7 25.4 9.4 91 104 A M E -LN 42 77C 0 -49,-2.4 -49,-2.3 -2,-0.3 2,-0.4 -0.984 20.6-140.6-153.8 146.5 17.0 23.4 12.6 92 105 A L E -LN 41 76C 0 -16,-2.2 -16,-3.1 -2,-0.3 2,-0.5 -0.905 15.2-154.0-112.2 139.5 16.1 19.9 13.8 93 106 A L E -LN 40 75C 0 -53,-2.7 -53,-2.1 -2,-0.4 2,-0.4 -0.964 3.3-149.8-116.2 126.0 14.7 19.3 17.3 94 107 A K E -LN 39 74C 47 -20,-2.4 -21,-2.6 -2,-0.5 -20,-1.2 -0.738 17.2-138.3 -95.8 130.5 15.0 16.0 19.2 95 108 A L E - 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