==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-JUL-08 2ZPR . COMPND 2 MOLECULE: ANIONIC TRYPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ONCORHYNCHUS KETA; . AUTHOR D.IYAGUCHI,E.TOYOTA . 442 2 12 12 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17553.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 274 62.0 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 . 140 31.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 34 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 6.1 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+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 2 0 2 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 . 8 5 3 10 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 . 0 0 0 0 0 2 1 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 1 A I 0 0 0 0, 0.0 2,-0.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 118.6 9.5 43.4 9.8 2 2 A V B +A 170 0A 12 168,-2.9 168,-2.0 1,-0.2 123,-0.1 -0.867 360.0 9.3-105.9 133.9 9.8 46.2 7.2 3 3 A G S S+ 0 0 40 121,-0.5 -1,-0.2 -2,-0.4 2,-0.1 0.674 104.0 112.9 76.4 17.1 6.8 48.0 5.8 4 4 A G - 0 0 23 -3,-0.3 2,-0.3 166,-0.1 133,-0.2 -0.180 60.6-114.7-104.3-161.1 4.5 46.5 8.3 5 5 A Y E -B 136 0B 110 131,-2.7 131,-3.7 -3,-0.1 2,-0.4 -0.914 37.1 -85.2-136.0 161.5 2.4 47.8 11.2 6 6 A E E -B 135 0B 92 -2,-0.3 129,-0.3 129,-0.2 128,-0.1 -0.545 51.9-121.7 -69.7 122.9 2.3 47.3 15.0 7 7 A a - 0 0 2 127,-2.6 2,-0.2 -2,-0.4 3,-0.1 -0.279 30.8 -96.7 -62.5 150.7 0.3 44.1 15.6 8 8 A K > - 0 0 166 1,-0.1 3,-2.1 2,-0.1 4,-0.3 -0.528 64.3 -85.3 -64.3 135.0 -2.8 44.5 17.9 9 9 A A T 3 S- 0 0 41 1,-0.3 -1,-0.1 -2,-0.2 44,-0.1 -0.200 108.2 -2.1 -50.6 126.1 -1.3 43.4 21.2 10 10 A Y T 3 S+ 0 0 57 42,-0.3 -1,-0.3 2,-0.1 43,-0.1 0.682 89.0 127.8 65.9 21.5 -1.4 39.6 21.7 11 11 A S S < S+ 0 0 48 -3,-2.1 -2,-0.1 1,-0.3 -1,-0.1 0.604 76.5 47.9 -80.7 -11.4 -3.2 39.1 18.3 12 12 A Q S > S+ 0 0 34 -4,-0.3 3,-2.0 1,-0.1 -1,-0.3 -0.596 70.6 167.9-125.0 65.9 -0.4 36.5 17.5 13 13 A P T 3 S+ 0 0 22 0, 0.0 88,-1.4 0, 0.0 38,-0.3 0.551 72.7 61.0 -58.7 -9.9 -0.4 34.5 20.8 14 14 A H T 3 S+ 0 0 14 86,-0.2 15,-2.7 88,-0.1 2,-0.2 0.674 80.0 107.2 -89.6 -20.8 1.8 31.8 19.2 15 15 A Q E < -J 28 0C 5 -3,-2.0 37,-0.5 13,-0.2 36,-0.4 -0.399 48.3-179.9 -63.9 126.4 4.6 34.2 18.6 16 16 A V E -J 27 0C 1 11,-2.2 11,-1.0 -2,-0.2 2,-0.5 -0.837 23.6-131.3-124.5 162.2 7.6 33.8 21.0 17 17 A S E -JK 26 49C 1 32,-2.2 32,-3.0 -2,-0.3 2,-0.5 -0.968 14.5-143.7-115.6 128.1 10.9 35.5 21.4 18 18 A L E -JK 25 48C 1 7,-2.9 6,-2.2 -2,-0.5 7,-1.0 -0.825 26.8-170.2 -91.6 126.0 14.1 33.4 21.6 19 19 A N E +JK 23 47C 19 28,-2.8 28,-2.1 -2,-0.5 4,-0.2 -0.964 32.7 161.2-128.7 136.1 16.5 35.1 24.0 20 20 A S S S- 0 0 16 2,-1.9 3,-0.1 -2,-0.4 -1,-0.1 -0.249 98.1 -38.2-140.2 44.3 20.1 34.6 25.0 21 21 A G S S+ 0 0 61 26,-0.0 2,-0.3 1,-0.0 -2,-0.1 0.045 139.6 13.2 118.1 -19.9 20.9 37.9 26.6 22 22 A Y S S- 0 0 59 -4,-0.0 -2,-1.9 0, 0.0 2,-0.3 -0.945 102.1 -69.8-169.9 167.8 18.8 39.7 24.0 23 23 A H E +J 19 0C 28 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.559 53.1 155.7 -71.9 129.2 16.2 38.9 21.4 24 24 A F E + 0 0 37 -6,-2.2 150,-0.3 1,-0.4 2,-0.3 0.579 59.2 7.4-128.2 -19.1 17.8 37.1 18.4 25 25 A b E -J 18 0C 6 -7,-1.0 -7,-2.9 150,-0.1 -1,-0.4 -0.981 61.5-124.1-157.6 165.0 15.0 35.1 16.7 26 26 A G E +J 17 0C 0 150,-3.6 12,-0.4 -2,-0.3 2,-0.3 -0.454 25.7 179.9-104.3-179.0 11.3 34.4 16.7 27 27 A G E -J 16 0C 0 -11,-1.0 -11,-2.2 -2,-0.2 2,-0.4 -0.967 22.7-120.2-170.4 170.0 9.4 31.2 17.0 28 28 A S E -JL 15 36C 1 8,-2.2 8,-3.0 -2,-0.3 2,-0.4 -0.976 17.2-135.1-131.7 122.3 5.9 29.7 17.1 29 29 A L E + L 0 35C 0 -15,-2.7 74,-2.8 -2,-0.4 6,-0.3 -0.593 24.1 176.3 -72.0 125.8 4.2 27.8 20.0 30 30 A V - 0 0 18 4,-2.7 2,-0.3 -2,-0.4 75,-0.2 0.498 66.7 -12.3-109.0 -8.5 2.5 24.7 18.4 31 31 A N S S- 0 0 46 3,-1.1 -1,-0.3 -17,-0.1 3,-0.3 -0.942 89.3 -74.5-173.0 176.0 1.3 23.2 21.7 32 32 A E S S+ 0 0 101 -2,-0.3 62,-2.8 1,-0.2 60,-0.1 0.748 129.3 32.0 -58.2 -22.2 1.9 23.5 25.4 33 33 A N S S+ 0 0 50 60,-0.2 57,-2.7 1,-0.1 2,-0.4 0.605 109.8 62.6-113.0 -13.1 5.3 21.9 25.1 34 34 A W E - M 0 89C 8 -3,-0.3 -4,-2.7 55,-0.2 -3,-1.1 -0.921 47.0-167.2-128.2 148.4 6.8 22.7 21.7 35 35 A V E -LM 29 88C 0 53,-2.6 53,-2.7 -2,-0.4 2,-0.5 -0.972 15.5-144.9-125.5 136.2 8.0 25.7 19.7 36 36 A V E +LM 28 87C 0 -8,-3.0 -8,-2.2 -2,-0.4 2,-0.2 -0.892 34.4 147.9-103.2 128.9 8.7 25.7 16.0 37 37 A S E - M 0 86C 0 49,-3.0 49,-2.9 -2,-0.5 2,-0.3 -0.713 48.8 -71.6-141.0-169.3 11.6 27.9 14.8 38 38 A A > - 0 0 0 -12,-0.4 3,-1.5 47,-0.3 47,-0.3 -0.723 30.8-132.7 -94.5 145.0 14.3 28.0 12.1 39 39 A A G > S+ 0 0 1 -2,-0.3 3,-1.8 1,-0.3 -1,-0.1 0.804 106.5 63.6 -64.6 -29.8 17.3 25.7 12.2 40 40 A H G 3 S+ 0 0 55 1,-0.3 -1,-0.3 41,-0.1 136,-0.0 0.573 94.3 63.1 -73.0 -4.6 19.7 28.6 11.6 41 41 A b G < S+ 0 0 4 -3,-1.5 -1,-0.3 2,-0.0 -2,-0.2 0.299 81.4 144.5 -96.6 6.8 18.4 30.0 14.9 42 42 A Y < + 0 0 73 -3,-1.8 2,-0.3 2,-0.0 -3,-0.1 -0.082 16.9 159.5 -53.5 143.4 19.9 27.0 16.7 43 43 A K - 0 0 50 1,-0.0 3,-0.1 3,-0.0 -2,-0.0 -0.927 47.1-121.5-160.2 139.5 21.5 27.3 20.1 44 44 A S S S+ 0 0 46 -2,-0.3 2,-0.3 1,-0.2 26,-0.1 0.826 102.2 16.1 -55.9 -32.5 22.1 24.4 22.6 45 45 A R S S+ 0 0 146 274,-0.1 2,-0.3 24,-0.0 -1,-0.2 -0.997 73.9 173.3-144.3 136.1 20.0 26.3 25.2 46 46 A V - 0 0 7 -2,-0.3 21,-2.4 -3,-0.1 2,-0.6 -0.985 30.9-123.0-144.7 154.2 17.6 29.2 24.7 47 47 A A E -KN 19 66C 28 -28,-2.1 -28,-2.8 -2,-0.3 2,-0.7 -0.864 24.8-150.2 -97.4 125.3 15.1 31.2 26.7 48 48 A V E -KN 18 65C 0 17,-3.3 17,-2.8 -2,-0.6 2,-0.7 -0.871 8.6-163.0 -99.1 116.9 11.6 31.1 25.2 49 49 A R E +KN 17 64C 62 -32,-3.0 -32,-2.2 -2,-0.7 3,-0.3 -0.880 14.0 177.4-105.2 110.0 9.7 34.3 25.9 50 50 A L E + N 0 63C 1 13,-2.8 13,-1.9 -2,-0.7 -34,-0.1 -0.642 56.3 38.6-106.2 164.6 5.9 33.9 25.4 51 51 A G S S+ 0 0 3 48,-0.4 2,-0.3 -36,-0.4 10,-0.2 0.810 84.0 147.2 66.9 31.8 3.0 36.4 25.9 52 52 A E + 0 0 11 -37,-0.5 -42,-0.3 -3,-0.3 -1,-0.2 -0.711 25.3 152.0-103.1 149.7 5.1 39.3 24.7 53 53 A H S S+ 0 0 13 1,-0.3 81,-2.4 -2,-0.3 2,-0.7 0.425 84.8 31.4-132.6 -55.5 4.2 42.4 22.8 54 54 A N B > -P 133 0D 23 3,-0.3 3,-0.9 79,-0.2 -1,-0.3 -0.942 68.8-166.9-108.5 108.7 6.9 44.9 23.9 55 55 A I T 3 S+ 0 0 25 77,-1.8 -1,-0.1 -2,-0.7 78,-0.1 0.518 86.1 54.5 -74.6 -3.9 10.0 42.9 24.6 56 56 A K T 3 S+ 0 0 134 76,-0.3 2,-0.4 1,-0.1 -1,-0.2 0.523 104.5 57.9-104.3 -10.4 11.7 45.8 26.3 57 57 A V S < S- 0 0 80 -3,-0.9 2,-0.5 75,-0.2 -3,-0.3 -0.968 81.7-122.6-125.6 137.6 8.9 46.5 28.9 58 58 A T + 0 0 127 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.674 33.4 169.5 -79.3 121.8 7.4 44.1 31.5 59 59 A E - 0 0 66 -2,-0.5 -1,-0.2 -5,-0.1 -7,-0.0 0.599 47.1-118.2-106.9 -18.6 3.7 43.9 30.8 60 60 A G S S+ 0 0 67 -9,-0.0 -2,-0.1 0, 0.0 -8,-0.1 0.372 97.2 91.0 94.5 -3.9 2.7 41.0 33.1 61 61 A S + 0 0 6 -10,-0.2 38,-0.1 38,-0.1 -9,-0.1 0.521 64.7 109.5 -97.9 -9.4 1.6 38.8 30.3 62 62 A E - 0 0 35 -13,-0.0 2,-0.4 2,-0.0 -11,-0.2 -0.252 46.0-169.0 -73.5 154.8 5.0 37.2 29.8 63 63 A Q E -N 50 0C 35 -13,-1.9 -13,-2.8 2,-0.1 2,-0.6 -0.958 9.0-159.5-140.7 116.7 6.1 33.7 30.5 64 64 A F E +N 49 0C 110 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.909 18.9 172.1-103.3 116.3 9.9 33.0 30.4 65 65 A I E -N 48 0C 6 -17,-2.8 -17,-3.3 -2,-0.6 2,-0.2 -0.990 25.5-134.8-130.1 129.7 10.6 29.3 29.9 66 66 A S E -N 47 0C 55 -2,-0.4 25,-2.7 -19,-0.2 26,-0.3 -0.518 28.8-110.2 -81.0 148.6 14.0 27.7 29.2 67 67 A S E -O 90 0C 1 -21,-2.4 23,-0.2 23,-0.2 3,-0.1 -0.347 22.7-170.7 -73.5 157.2 14.3 25.1 26.6 68 68 A S E S+ 0 0 53 21,-2.8 2,-0.3 1,-0.4 22,-0.2 0.389 78.0 20.9-124.1 -9.8 15.0 21.4 27.5 69 69 A R E -O 89 0C 95 20,-1.0 20,-2.8 2,-0.0 -1,-0.4 -0.932 58.4-169.2-159.8 135.8 15.6 20.2 24.0 70 70 A V E -O 88 0C 21 -2,-0.3 2,-0.6 18,-0.2 18,-0.2 -0.957 14.1-174.9-132.5 111.8 16.6 22.0 20.8 71 71 A I E -O 87 0C 36 16,-3.3 16,-2.5 -2,-0.4 2,-0.1 -0.899 11.1-158.8-119.4 107.6 16.4 19.8 17.6 72 72 A R E -O 86 0C 87 -2,-0.6 14,-0.2 14,-0.2 12,-0.1 -0.481 43.4 -91.1 -73.9 148.4 17.5 21.0 14.2 73 73 A H > - 0 0 18 12,-2.0 3,-1.9 10,-0.3 -1,-0.1 -0.371 35.4-124.5 -59.4 138.7 15.9 19.1 11.3 74 74 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.747 109.3 47.6 -59.5 -23.9 18.2 16.2 10.5 75 75 A N T 3 S+ 0 0 110 8,-0.1 -2,-0.1 2,-0.0 7,-0.1 0.215 79.1 135.4-102.9 15.1 18.5 17.3 6.8 76 76 A Y < - 0 0 25 -3,-1.9 2,-0.4 9,-0.1 7,-0.2 -0.388 33.0-171.7 -62.1 138.6 19.2 20.9 7.6 77 77 A S B > > -Q 82 0E 14 5,-1.9 5,-1.8 1,-0.1 3,-0.6 -0.941 13.4-162.5-138.4 112.6 22.1 22.2 5.4 78 78 A S G > 5S+ 0 0 0 -2,-0.4 3,-0.9 3,-0.2 -1,-0.1 0.798 80.5 71.7 -65.7 -33.2 23.5 25.7 6.2 79 79 A Y G 3 5S+ 0 0 84 1,-0.3 -1,-0.2 2,-0.1 326,-0.1 0.847 121.2 15.7 -55.5 -36.4 25.3 26.3 2.9 80 80 A N G < 5S- 0 0 36 -3,-0.6 -1,-0.3 2,-0.1 -2,-0.2 0.113 104.1-120.6-122.7 18.8 21.9 26.8 1.1 81 81 A I T X 5 + 0 0 18 -3,-0.9 3,-0.6 1,-0.2 2,-0.2 0.823 54.7 166.5 43.1 43.3 19.8 27.2 4.2 82 82 A D B 3 < +Q 77 0E 24 -5,-1.8 -5,-1.9 1,-0.2 3,-0.2 -0.602 56.9 13.4 -89.3 146.6 17.7 24.2 3.2 83 83 A N T 3 S- 0 0 22 -2,-0.2 2,-2.2 -7,-0.2 -10,-0.3 0.923 78.5-179.9 55.6 46.1 15.3 22.5 5.6 84 84 A D < + 0 0 2 -3,-0.6 2,-0.3 74,-0.2 122,-0.2 -0.449 32.6 117.3 -79.7 69.1 15.6 25.5 7.8 85 85 A I + 0 0 0 -2,-2.2 -12,-2.0 -47,-0.3 2,-0.3 -0.986 36.4 179.7-138.4 147.7 13.2 24.2 10.6 86 86 A M E -MO 37 72C 2 -49,-2.9 -49,-3.0 -2,-0.3 2,-0.4 -0.997 19.0-139.3-149.9 148.3 13.8 23.4 14.2 87 87 A L E -MO 36 71C 0 -16,-2.5 -16,-3.3 -2,-0.3 2,-0.5 -0.919 12.7-166.7-112.5 136.8 11.8 22.2 17.3 88 88 A I E -MO 35 70C 0 -53,-2.7 -53,-2.6 -2,-0.4 2,-0.4 -0.988 9.3-151.8-121.9 123.9 12.4 23.6 20.8 89 89 A K E -MO 34 69C 66 -20,-2.8 -21,-2.8 -2,-0.5 -20,-1.0 -0.829 18.4-126.9 -96.8 134.5 10.9 21.7 23.7 90 90 A L E - 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