==== 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 2ZPS . COMPND 2 MOLECULE: ANIONIC TRYPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ONCORHYNCHUS KETA; . AUTHOR D.IYAGUCHI,E.TOYOTA . 221 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9571.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 137 62.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 32.1 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 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 . 19 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 5.4 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 2 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 . 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 . 4 2 2 5 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 1 0 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 2 0, 0.0 2,-0.5 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 122.3 -3.2 3.2 23.5 2 2 A V B +A 170 0A 15 168,-3.1 168,-1.9 1,-0.2 123,-0.1 -0.882 360.0 4.7-106.2 129.5 -6.9 3.0 22.6 3 3 A G S S+ 0 0 46 121,-0.5 -1,-0.2 -2,-0.5 2,-0.1 0.662 101.3 113.7 78.2 17.2 -8.8 -0.2 22.8 4 4 A G - 0 0 30 -3,-0.3 2,-0.3 166,-0.1 133,-0.2 -0.082 61.7-111.2-101.4-157.4 -6.0 -2.3 24.3 5 5 A Y E -B 136 0B 113 131,-2.3 131,-3.4 -3,-0.1 2,-0.2 -0.916 41.3 -83.2-135.0 159.7 -5.5 -4.0 27.6 6 6 A E E -B 135 0B 80 -2,-0.3 129,-0.3 129,-0.2 128,-0.1 -0.466 47.2-122.9 -67.5 131.3 -3.1 -3.3 30.5 7 7 A a - 0 0 2 127,-2.5 2,-0.2 -2,-0.2 3,-0.1 -0.435 31.0-103.6 -68.9 150.1 0.3 -4.9 29.8 8 8 A K > - 0 0 155 1,-0.1 3,-2.2 -2,-0.1 4,-0.2 -0.534 57.5 -82.6 -70.4 143.0 1.5 -7.3 32.5 9 9 A A T 3 S- 0 0 51 1,-0.3 -1,-0.1 -2,-0.2 44,-0.1 -0.259 110.7 -2.1 -54.1 125.9 4.1 -5.4 34.5 10 10 A Y T 3 S+ 0 0 55 42,-0.3 -1,-0.3 2,-0.1 43,-0.1 0.642 90.3 126.1 67.9 18.6 7.5 -5.5 32.9 11 11 A S S < S+ 0 0 55 -3,-2.2 -2,-0.1 1,-0.3 -1,-0.1 0.565 77.1 46.8 -81.4 -6.9 6.3 -7.7 30.0 12 12 A Q S > S+ 0 0 35 -4,-0.2 3,-2.2 87,-0.1 -1,-0.3 -0.592 72.8 170.7-129.7 65.7 7.7 -5.0 27.6 13 13 A P T 3 S+ 0 0 34 0, 0.0 88,-1.2 0, 0.0 38,-0.3 0.580 73.2 58.8 -55.1 -14.8 11.2 -4.6 29.2 14 14 A H T 3 S+ 0 0 13 86,-0.2 15,-2.5 88,-0.1 2,-0.2 0.609 80.8 109.4 -89.9 -16.8 12.5 -2.5 26.3 15 15 A Q E < -J 28 0C 5 -3,-2.2 36,-0.5 13,-0.2 37,-0.4 -0.428 47.6-178.8 -65.4 128.1 9.7 0.1 26.8 16 16 A V E -J 27 0C 0 11,-2.4 11,-1.2 -2,-0.2 2,-0.5 -0.896 23.2-134.5-127.5 158.5 10.9 3.4 28.1 17 17 A S E -JK 26 49C 1 32,-2.4 32,-2.7 -2,-0.3 2,-0.6 -0.954 14.3-143.6-112.3 127.2 9.3 6.7 29.0 18 18 A L E -JK 25 48C 0 7,-3.2 6,-2.5 -2,-0.5 7,-1.0 -0.837 25.7-163.1 -90.6 122.9 10.9 9.9 27.9 19 19 A N E +JK 23 47C 20 28,-3.0 28,-1.9 -2,-0.6 2,-0.2 -0.927 31.1 161.3-118.9 131.5 10.4 12.5 30.6 20 20 A S S S- 0 0 67 2,-2.4 2,-1.4 -2,-0.4 -2,-0.0 -0.746 95.3 -42.3-141.6 83.3 10.6 16.3 30.6 21 21 A G S S+ 0 0 60 -2,-0.2 2,-0.3 3,-0.0 -2,-0.1 -0.274 141.8 17.5 84.7 -49.0 8.7 17.3 33.7 22 22 A Y S S- 0 0 199 -2,-1.4 -2,-2.4 -4,-0.1 2,-0.1 -0.921 104.3 -75.6-144.5 164.7 6.2 14.7 32.7 23 23 A H E +J 19 0C 36 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.449 53.5 160.3 -61.0 135.1 6.0 11.7 30.4 24 24 A F E + 0 0 47 -6,-2.5 150,-0.3 1,-0.5 2,-0.3 0.496 57.2 7.8-135.6 -13.4 5.8 13.0 26.8 25 25 A b E -J 18 0C 7 -7,-1.0 -7,-3.2 150,-0.1 -1,-0.5 -0.981 64.0-122.1-163.7 159.6 6.9 10.2 24.5 26 26 A G E +J 17 0C 1 150,-3.0 12,-0.4 -2,-0.3 2,-0.3 -0.431 26.8 179.6 -98.7 178.2 7.8 6.5 24.5 27 27 A G E -J 16 0C 0 -11,-1.2 -11,-2.4 -2,-0.1 2,-0.4 -0.962 22.5-120.7-167.3 171.1 11.0 4.9 23.3 28 28 A S E -JL 15 36C 1 8,-2.5 8,-3.1 -2,-0.3 2,-0.4 -0.989 17.4-133.3-131.8 126.6 12.7 1.5 23.0 29 29 A L E + L 0 35C 0 -15,-2.5 74,-2.7 -2,-0.4 6,-0.2 -0.626 26.2 172.8 -75.2 126.7 16.0 0.3 24.6 30 30 A V E - 0 0 19 4,-2.5 2,-0.3 1,-0.4 5,-0.2 0.469 68.8 -8.6-112.8 -7.6 18.1 -1.4 21.9 31 31 A N E > S- L 0 34C 27 3,-1.1 3,-0.9 70,-0.1 -1,-0.4 -0.932 88.1 -80.4-174.1 168.5 21.2 -1.8 24.0 32 32 A E T 3 S+ 0 0 77 -2,-0.3 62,-3.0 1,-0.2 60,-0.1 0.708 128.1 33.3 -57.0 -20.0 22.5 -0.7 27.4 33 33 A N T 3 S+ 0 0 47 60,-0.2 57,-2.7 1,-0.1 2,-0.4 0.499 110.7 65.2-115.3 -4.0 23.5 2.7 26.0 34 34 A W E < -LM 31 89C 7 -3,-0.9 -4,-2.5 55,-0.2 -3,-1.1 -0.965 47.3-172.1-133.7 143.0 20.9 3.5 23.3 35 35 A V E -LM 29 88C 0 53,-2.3 53,-2.7 -2,-0.4 2,-0.4 -0.967 16.1-144.8-125.5 136.9 17.2 4.2 23.0 36 36 A V E +LM 28 87C 1 -8,-3.1 -8,-2.5 -2,-0.4 2,-0.2 -0.868 33.8 146.7-102.4 134.6 15.2 4.5 19.7 37 37 A S E - M 0 86C 0 49,-2.6 49,-2.4 -2,-0.4 2,-0.3 -0.757 50.0 -67.8-146.4-168.7 12.3 7.0 19.6 38 38 A A > - 0 0 0 -12,-0.4 3,-1.7 47,-0.3 47,-0.3 -0.742 33.4-132.7 -93.8 141.4 10.6 9.3 17.1 39 39 A A G > S+ 0 0 1 -2,-0.3 3,-1.8 1,-0.3 -1,-0.1 0.811 105.1 63.1 -61.8 -30.8 12.4 12.3 15.7 40 40 A H G 3 S+ 0 0 71 1,-0.3 -1,-0.3 41,-0.1 44,-0.0 0.598 94.1 63.4 -73.0 -4.9 9.4 14.6 16.4 41 41 A b G < S+ 0 0 5 -3,-1.7 -1,-0.3 -15,-0.1 -2,-0.2 0.384 81.6 142.7 -92.7 0.2 9.9 13.8 20.1 42 42 A Y < + 0 0 75 -3,-1.8 2,-0.3 -4,-0.1 -3,-0.1 -0.004 19.5 162.5 -47.5 144.0 13.3 15.5 19.9 43 43 A K - 0 0 73 1,-0.1 3,-0.1 3,-0.0 -2,-0.0 -0.934 48.7-116.3-157.4 146.1 14.7 17.6 22.8 44 44 A T S S+ 0 0 109 -2,-0.3 2,-0.3 1,-0.2 26,-0.1 0.867 104.1 10.5 -57.2 -35.3 18.3 18.7 23.3 45 45 A R S S+ 0 0 200 24,-0.1 2,-0.3 -3,-0.1 -1,-0.2 -0.997 72.0 175.3-145.4 143.7 18.2 16.7 26.5 46 46 A V - 0 0 9 -2,-0.3 21,-2.2 -3,-0.1 2,-0.6 -0.986 29.9-121.3-146.8 154.4 15.7 14.2 28.0 47 47 A E E -KN 19 66C 60 -28,-1.9 -28,-3.0 -2,-0.3 2,-0.5 -0.886 25.9-148.1-100.4 122.2 15.5 11.9 31.0 48 48 A V E -KN 18 65C 0 17,-3.1 17,-3.0 -2,-0.6 2,-0.6 -0.798 8.3-160.8 -92.4 125.0 15.0 8.3 30.0 49 49 A R E +KN 17 64C 50 -32,-2.7 -32,-2.4 -2,-0.5 3,-0.3 -0.925 13.6 179.2-111.3 111.7 12.9 6.2 32.5 50 50 A L E + N 0 63C 1 13,-2.8 13,-2.0 -2,-0.6 -34,-0.1 -0.675 58.2 37.5-106.3 162.1 13.3 2.5 32.2 51 51 A G S S+ 0 0 3 -36,-0.5 10,-0.3 48,-0.4 2,-0.3 0.808 82.6 150.3 69.0 30.8 11.7 -0.3 34.3 52 52 A E + 0 0 11 -37,-0.4 -42,-0.3 -3,-0.3 -1,-0.2 -0.696 22.5 150.1 -99.5 146.1 8.4 1.5 34.4 53 53 A H S S+ 0 0 10 1,-0.3 81,-1.5 -2,-0.3 2,-0.8 0.409 83.8 30.4-128.2 -66.0 4.9 0.2 34.7 54 54 A N B > S-P 133 0D 17 79,-0.2 3,-0.8 3,-0.2 -1,-0.3 -0.879 72.5-163.6 -96.3 110.6 2.9 2.8 36.6 55 55 A I T 3 S+ 0 0 32 77,-2.3 -1,-0.1 -2,-0.8 78,-0.1 0.551 83.9 56.4 -74.4 -5.7 4.6 6.1 35.7 56 56 A K T 3 S+ 0 0 165 76,-0.3 2,-0.4 1,-0.1 -1,-0.2 0.603 106.4 50.0 -99.3 -13.7 3.1 8.0 38.5 57 57 A V S < S- 0 0 80 -3,-0.8 2,-0.5 75,-0.2 -4,-0.3 -0.963 82.6-116.6-129.5 143.9 4.3 5.8 41.4 58 58 A T + 0 0 116 -2,-0.4 -3,-0.1 1,-0.1 -6,-0.1 -0.661 31.9 172.9 -79.1 123.5 7.7 4.4 42.3 59 59 A E - 0 0 62 -2,-0.5 -1,-0.1 -8,-0.2 -4,-0.0 0.411 50.0-109.7-110.3 -4.0 7.6 0.6 42.1 60 60 A G S S+ 0 0 67 1,-0.0 -8,-0.1 0, 0.0 -2,-0.1 0.236 101.5 83.7 96.8 -14.7 11.3 -0.2 42.6 61 61 A S + 0 0 7 -10,-0.3 2,-0.1 38,-0.0 -9,-0.1 0.426 65.1 116.0-100.7 0.3 12.3 -1.3 39.1 62 62 A E - 0 0 33 -13,-0.0 2,-0.4 2,-0.0 -11,-0.2 -0.382 41.1-172.0 -76.3 148.3 12.8 2.1 37.7 63 63 A Q E -N 50 0C 35 -13,-2.0 -13,-2.8 -2,-0.1 2,-0.6 -0.977 8.7-159.8-136.6 116.9 16.1 3.5 36.4 64 64 A F E +N 49 0C 93 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.907 16.8 175.4-102.3 120.1 16.2 7.2 35.5 65 65 A I E -N 48 0C 17 -17,-3.0 -17,-3.1 -2,-0.6 2,-0.1 -0.986 24.6-133.0-132.1 126.9 19.0 8.1 33.2 66 66 A S E -N 47 0C 65 -2,-0.4 25,-2.6 -19,-0.2 26,-0.3 -0.432 30.8-109.4 -73.9 148.0 19.8 11.5 31.6 67 67 A S E -O 90 0C 17 -21,-2.2 23,-0.2 23,-0.2 3,-0.1 -0.413 23.2-171.0 -76.1 152.3 20.6 11.6 27.9 68 68 A S E S+ 0 0 61 21,-3.1 2,-0.3 1,-0.4 22,-0.2 0.479 77.9 15.3-116.0 -14.9 24.1 12.4 26.7 69 69 A R E -O 89 0C 105 20,-1.2 20,-2.9 2,-0.0 2,-0.4 -0.958 55.4-166.2-160.3 140.6 23.2 12.7 23.0 70 70 A V E -O 88 0C 20 -2,-0.3 2,-0.6 18,-0.2 18,-0.2 -0.957 16.2-175.3-132.3 110.9 19.9 13.0 21.0 71 71 A I E -O 87 0C 34 16,-3.3 16,-2.6 -2,-0.4 2,-0.1 -0.905 9.3-159.1-117.7 109.5 20.3 12.3 17.3 72 72 A R E -O 86 0C 116 -2,-0.6 14,-0.2 14,-0.2 12,-0.1 -0.480 42.2 -89.0 -77.9 151.8 17.5 12.8 14.9 73 73 A H > - 0 0 20 12,-2.1 3,-2.1 10,-0.3 -1,-0.1 -0.387 38.1-122.8 -59.8 137.1 17.7 11.0 11.5 74 74 A P T 3 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.781 110.0 45.8 -53.9 -29.2 19.6 13.3 9.1 75 75 A N T 3 S+ 0 0 105 8,-0.1 2,-0.1 2,-0.1 -2,-0.1 0.147 79.6 134.1-103.4 19.7 16.7 13.3 6.7 76 76 A Y < - 0 0 55 -3,-2.1 2,-0.4 9,-0.1 7,-0.2 -0.441 35.7-166.5 -66.4 141.0 13.9 13.8 9.2 77 77 A S B >>> -Q 82 0E 11 5,-1.6 4,-2.0 -2,-0.1 3,-0.9 -0.982 19.5-158.8-136.7 123.6 11.4 16.4 8.0 78 78 A S T 345S+ 0 0 94 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.659 87.1 71.8 -73.4 -16.9 8.8 18.0 10.2 79 79 A Y T 345S+ 0 0 200 1,-0.2 -1,-0.2 3,-0.1 0, 0.0 0.734 124.7 3.7 -73.6 -19.4 6.6 19.1 7.2 80 80 A N T <45S- 0 0 58 -3,-0.9 -2,-0.2 2,-0.1 -1,-0.2 0.402 96.1-116.0-140.6 -5.0 5.6 15.5 6.6 81 81 A I T ><5 + 0 0 33 -4,-2.0 3,-0.8 1,-0.2 -3,-0.2 0.746 53.5 167.5 69.7 26.3 7.2 13.4 9.4 82 82 A D B 3 < +Q 77 0E 31 -5,-0.8 -5,-1.6 1,-0.3 -1,-0.2 -0.453 65.9 12.6 -69.6 144.7 9.3 11.5 6.9 83 83 A N T 3 S- 0 0 17 -7,-0.2 2,-2.1 1,-0.2 -10,-0.3 0.916 79.4-179.7 52.4 50.2 12.1 9.5 8.6 84 84 A D < + 0 0 2 -3,-0.8 2,-0.3 74,-0.2 122,-0.2 -0.427 36.5 113.5 -81.6 65.6 10.6 10.0 12.0 85 85 A I + 0 0 0 -2,-2.1 -12,-2.1 -47,-0.3 2,-0.3 -0.980 37.7 176.5-138.0 149.1 13.2 8.1 13.9 86 86 A M E -MO 37 72C 1 -49,-2.4 -49,-2.6 -2,-0.3 2,-0.4 -0.994 20.8-135.4-153.5 152.2 15.8 9.2 16.4 87 87 A L E -MO 36 71C 0 -16,-2.6 -16,-3.3 -2,-0.3 2,-0.5 -0.920 12.0-163.4-114.5 138.5 18.6 7.8 18.7 88 88 A I E -MO 35 70C 0 -53,-2.7 -53,-2.3 -2,-0.4 2,-0.4 -0.982 9.4-150.7-121.2 122.4 19.1 8.8 22.3 89 89 A K E -MO 34 69C 58 -20,-2.9 -21,-3.1 -2,-0.5 -20,-1.2 -0.789 17.5-129.0 -94.0 136.3 22.4 7.9 24.0 90 90 A L E - 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