==== 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 14-SEP-98 1BU8 . COMPND 2 MOLECULE: PROTEIN (PANCREATIC LIPASE RELATED PROTEIN 2); . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR A.ROUSSEL,C.CAMBILLAU . 446 2 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18555.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 295 66.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 18.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 35 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 68 15.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.1 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 4 2 0 0 0 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 1 3 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 PARALLEL BRIDGES PER LADDER . 4 3 2 1 1 1 1 3 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 . 1 0 0 2 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 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 K 0 0 180 0, 0.0 12,-2.2 0, 0.0 13,-0.4 0.000 360.0 360.0 360.0 174.8 -21.7 3.9 12.0 2 2 A E E -A 12 0A 118 10,-0.3 2,-0.4 11,-0.1 10,-0.3 -0.996 360.0-145.3-154.9 148.3 -19.3 1.0 12.3 3 3 A V E -A 11 0A 35 8,-1.9 8,-3.3 -2,-0.3 2,-0.5 -0.939 22.8-148.4-109.8 138.0 -16.9 -1.1 10.3 4 4 A a E -A 10 0A 70 -2,-0.4 2,-0.4 6,-0.3 6,-0.3 -0.944 11.2-168.3-113.7 131.9 -16.7 -4.8 11.2 5 5 A Y > - 0 0 50 4,-3.2 3,-2.3 -2,-0.5 4,-0.1 -0.592 39.1-111.1-118.2 69.0 -13.5 -6.8 10.8 6 6 A G G > S+ 0 0 68 -2,-0.4 3,-1.7 1,-0.3 -1,-0.3 -0.126 96.9 8.2 49.2-121.5 -14.4 -10.4 11.3 7 7 A H G 3 S+ 0 0 102 1,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.539 124.8 64.7 -69.5 -9.0 -13.1 -12.0 14.5 8 8 A L G < S- 0 0 5 -3,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.333 102.5-137.1 -94.8 5.7 -11.8 -8.6 15.8 9 9 A G < - 0 0 31 -3,-1.7 -4,-3.2 -4,-0.1 -1,-0.3 -0.187 33.7 -40.8 75.0-163.3 -15.4 -7.3 16.0 10 10 A a E -A 4 0A 57 -6,-0.3 2,-0.5 -3,-0.1 -6,-0.3 -0.734 39.4-148.5-107.3 153.9 -16.8 -4.0 15.0 11 11 A F E -A 3 0A 0 -8,-3.3 -8,-1.9 -2,-0.3 2,-0.1 -0.953 15.6-156.3-126.8 106.1 -15.4 -0.5 15.3 12 12 A S E -A 2 0A 21 -2,-0.5 -10,-0.3 -10,-0.3 -8,-0.0 -0.422 10.5-156.3 -78.3 155.4 -17.9 2.4 15.8 13 13 A N + 0 0 16 -12,-2.2 2,-0.1 -2,-0.1 -11,-0.1 0.221 61.6 96.7-117.0 10.2 -17.2 6.0 14.9 14 14 A D S > S- 0 0 81 -13,-0.4 3,-1.8 1,-0.2 4,-0.5 -0.444 78.0 -15.6 -93.4 173.4 -19.8 7.7 17.2 15 15 A K T 3 S+ 0 0 154 1,-0.3 -1,-0.2 2,-0.2 4,-0.1 -0.210 127.3 11.4 -49.8 137.0 -19.2 9.2 20.6 16 16 A P T 3 S+ 0 0 23 0, 0.0 -1,-0.3 0, 0.0 4,-0.1 -0.972 124.7 57.9 -96.5 10.3 -16.9 8.7 22.4 17 17 A W S < S- 0 0 21 -3,-1.8 2,-0.3 1,-0.1 -2,-0.2 0.784 123.1 -11.1 -67.1 -29.7 -14.8 7.0 19.7 18 18 A A S S+ 0 0 0 -4,-0.5 8,-0.2 1,-0.1 -1,-0.1 -0.962 108.0 61.4-161.3 167.4 -14.8 9.9 17.3 19 19 A G S S+ 0 0 29 4,-1.2 2,-0.3 6,-0.4 -4,-0.1 0.890 77.1 123.4 73.8 36.9 -16.6 13.2 16.9 20 20 A M B > S-B 23 0B 46 3,-2.6 3,-0.9 5,-0.1 -1,-0.3 -0.841 79.2 -99.8-121.9 168.2 -15.3 14.7 20.1 21 21 A L T 3 S+ 0 0 170 -2,-0.3 -1,-0.0 1,-0.3 -2,-0.0 0.858 124.8 45.2 -56.9 -39.9 -13.3 17.8 20.9 22 22 A Q T 3 S+ 0 0 64 1,-0.3 -1,-0.3 161,-0.1 161,-0.2 0.693 132.0 20.3 -78.2 -19.4 -10.1 15.8 21.1 23 23 A R B < +B 20 0B 2 -3,-0.9 -3,-2.6 1,-0.1 -4,-1.2 -0.702 66.9 163.8-152.5 83.7 -10.8 13.8 18.0 24 24 A P + 0 0 97 0, 0.0 -3,-0.1 0, 0.0 -1,-0.1 0.857 47.9 98.4 -72.5 -38.6 -13.4 15.5 15.7 25 25 A L - 0 0 80 1,-0.1 -6,-0.4 -7,-0.1 -5,-0.1 -0.297 60.8-155.1 -55.2 126.0 -12.7 13.5 12.5 26 26 A K + 0 0 93 -8,-0.2 -1,-0.1 -7,-0.1 -8,-0.1 0.022 46.8 131.3 -95.4 29.9 -15.3 10.6 12.2 27 27 A I - 0 0 51 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.189 53.9-116.9 -71.6 172.2 -13.1 8.3 10.1 28 28 A F - 0 0 57 1,-0.1 94,-0.1 -26,-0.0 93,-0.1 -0.717 28.4 -92.8-111.5 160.8 -12.7 4.6 11.0 29 29 A P - 0 0 1 0, 0.0 93,-0.1 0, 0.0 -1,-0.1 -0.376 51.7-102.6 -66.9 152.6 -9.6 2.6 12.0 30 30 A W - 0 0 75 88,-0.3 95,-0.1 1,-0.1 81,-0.0 -0.159 46.9 -83.5 -66.2 171.9 -7.9 0.9 9.0 31 30AA S > - 0 0 19 1,-0.1 4,-1.9 -27,-0.0 3,-0.3 -0.404 34.9-113.9 -76.8 156.4 -8.4 -2.8 8.4 32 31 A P H >>S+ 0 0 8 0, 0.0 4,-2.4 0, 0.0 5,-0.6 0.882 120.0 55.7 -56.9 -34.9 -6.3 -5.4 10.3 33 32 A E H 45S+ 0 0 139 1,-0.2 -3,-0.0 2,-0.2 0, 0.0 0.888 108.0 45.7 -64.1 -43.0 -4.8 -6.2 7.0 34 33 A D H 45S+ 0 0 78 -3,-0.3 -1,-0.2 1,-0.2 -4,-0.0 0.765 114.8 46.6 -74.0 -26.1 -3.7 -2.6 6.3 35 34 A I H <5S- 0 0 0 -4,-1.9 76,-0.8 76,-0.1 75,-0.5 0.853 90.9-159.5 -81.0 -35.5 -2.2 -2.1 9.8 36 35 A D T <5 - 0 0 80 -4,-2.4 74,-0.2 -5,-0.3 -3,-0.1 0.944 6.0-157.6 55.9 55.2 -0.4 -5.5 9.5 37 36 A T < - 0 0 12 -5,-0.6 2,-0.4 71,-0.1 71,-0.2 -0.411 8.0-162.4 -62.4 132.8 0.1 -6.1 13.3 38 37 A R E -C 107 0C 54 69,-2.4 69,-2.6 -2,-0.1 2,-0.8 -0.990 12.5-153.3-125.0 129.0 3.0 -8.5 13.7 39 38 A F E -CD 106 53C 8 14,-0.5 14,-2.2 -2,-0.4 2,-0.8 -0.913 15.1-167.1-102.9 106.1 3.7 -10.4 17.0 40 39 A L E -CD 105 52C 12 65,-2.9 65,-2.4 -2,-0.8 2,-0.3 -0.820 7.1-153.5-101.3 102.7 7.4 -11.1 17.1 41 40 A L E +CD 104 51C 0 10,-2.0 10,-1.4 -2,-0.8 2,-0.4 -0.540 17.0 174.6 -81.7 129.8 8.3 -13.6 19.8 42 41 A Y E +C 103 0C 23 61,-2.5 61,-2.6 -2,-0.3 2,-0.3 -0.950 4.8 178.9-127.8 142.7 11.7 -13.6 21.3 43 42 A T E > -CD 102 46C 0 3,-0.9 3,-0.6 -2,-0.4 59,-0.1 -0.921 48.6 -93.7-138.0 166.2 12.6 -15.9 24.2 44 43 A N T 3 S+ 0 0 32 57,-0.5 58,-0.1 -2,-0.3 -1,-0.0 0.862 129.2 47.3 -49.0 -37.6 15.8 -16.5 26.2 45 44 A E T 3 S+ 0 0 101 1,-0.3 -1,-0.3 20,-0.2 3,-0.1 0.797 121.7 34.3 -76.1 -33.6 16.6 -19.3 23.8 46 45 A N E < S+D 43 0C 23 -3,-0.6 -3,-0.9 1,-0.1 -1,-0.3 -0.624 71.3 143.5-122.0 72.0 15.8 -17.3 20.6 47 46 A P E S+ 0 0 33 0, 0.0 -1,-0.1 0, 0.0 46,-0.1 0.630 71.9 42.8 -84.6 -14.8 16.9 -13.7 21.5 48 47 A N E S+ 0 0 114 1,-0.2 2,-0.4 -3,-0.1 -2,-0.1 0.827 113.5 41.6 -98.5 -43.1 18.3 -12.7 18.1 49 48 A N E S- 0 0 126 2,-0.0 -1,-0.2 -8,-0.0 2,-0.1 -0.933 79.6-133.9-110.8 133.9 15.7 -14.0 15.6 50 49 A Y E - 0 0 98 -2,-0.4 2,-0.5 -8,-0.1 -8,-0.2 -0.282 2.2-139.7 -81.8 168.5 12.0 -13.7 16.2 51 50 A Q E -D 41 0C 64 -10,-1.4 -10,-2.0 -5,-0.1 2,-0.3 -0.973 24.1-134.4-128.3 105.0 9.3 -16.3 15.7 52 51 A K E -D 40 0C 95 -2,-0.5 2,-0.4 -12,-0.2 -12,-0.2 -0.507 24.7-164.0 -65.4 125.8 6.2 -14.8 14.2 53 52 A I E -D 39 0C 2 -14,-2.2 -14,-0.5 -2,-0.3 2,-0.4 -0.908 7.3-166.1-116.2 144.7 3.1 -15.9 16.1 54 53 A S - 0 0 15 3,-0.5 3,-0.5 -2,-0.4 7,-0.3 -0.994 20.6-151.9-133.3 131.7 -0.5 -15.7 14.9 55 54 A A S S+ 0 0 10 -2,-0.4 -1,-0.1 1,-0.2 75,-0.0 0.799 102.0 53.6 -68.6 -29.4 -3.7 -16.2 16.9 56 55 A T S S+ 0 0 82 1,-0.3 -1,-0.2 2,-0.1 77,-0.0 0.657 112.0 45.7 -79.3 -18.7 -5.5 -17.3 13.8 57 55AA E S > S- 0 0 116 -3,-0.5 3,-2.5 1,-0.1 -3,-0.5 -0.648 71.3-176.1-124.5 74.2 -2.9 -20.0 13.1 58 56 A P T >> S+ 0 0 37 0, 0.0 4,-2.5 0, 0.0 3,-0.7 0.657 74.6 73.1 -44.0 -27.1 -2.3 -21.7 16.5 59 57 A D H 3> S+ 0 0 94 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.828 85.6 64.3 -62.5 -30.3 0.5 -23.9 15.1 60 58 A T H <4 S+ 0 0 47 -3,-2.5 -1,-0.2 -6,-0.3 4,-0.2 0.896 110.6 39.0 -60.2 -35.0 2.8 -20.9 14.9 61 59 A I H X4 S+ 0 0 5 -3,-0.7 3,-1.4 -4,-0.5 5,-0.5 0.934 114.1 52.9 -78.7 -48.0 2.5 -20.8 18.7 62 60 A K H 3< S+ 0 0 122 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.881 114.8 42.2 -55.8 -40.6 2.6 -24.6 19.2 63 61 A F T 3< S+ 0 0 165 -4,-3.1 -1,-0.3 -5,-0.2 -2,-0.2 0.454 102.6 88.6 -87.8 -1.4 5.8 -24.9 17.1 64 62 A S S < S- 0 0 21 -3,-1.4 -3,-0.1 -5,-0.2 -12,-0.0 -0.300 91.7-106.9 -87.5 179.9 7.5 -21.8 18.7 65 63 A N + 0 0 47 -2,-0.1 2,-0.3 -24,-0.1 -20,-0.2 0.092 68.1 142.1 -94.0 20.7 9.6 -21.7 21.8 66 64 A F - 0 0 17 -5,-0.5 2,-0.6 -23,-0.1 -23,-0.1 -0.493 42.9-146.7 -64.1 124.9 6.7 -20.0 23.8 67 65 A Q > - 0 0 65 -2,-0.3 3,-1.5 4,-0.1 35,-0.1 -0.874 12.9-159.5-103.5 119.2 6.8 -21.5 27.3 68 66 A L T 3 S+ 0 0 85 -2,-0.6 -1,-0.1 1,-0.3 4,-0.1 0.587 93.3 58.8 -68.1 -12.8 3.5 -21.9 29.0 69 67 A D T 3 S+ 0 0 133 2,-0.1 2,-0.3 74,-0.1 -1,-0.3 0.094 97.5 74.7-103.8 20.1 5.3 -22.0 32.4 70 68 A R S < S- 0 0 37 -3,-1.5 31,-0.2 31,-0.0 2,-0.1 -0.911 86.5-104.4-129.2 152.6 6.9 -18.5 31.9 71 69 A K E -e 101 0C 79 29,-0.6 31,-2.4 -2,-0.3 2,-0.4 -0.370 32.3-137.2 -70.7 160.0 5.4 -15.0 32.1 72 70 A T E -ef 102 148C 0 75,-2.8 77,-2.8 29,-0.2 2,-0.5 -0.979 16.3-171.7-125.5 129.9 4.7 -13.1 28.9 73 71 A R E -ef 103 149C 9 29,-2.4 31,-2.0 -2,-0.4 2,-0.4 -0.982 8.4-157.1-123.9 120.4 5.4 -9.4 28.3 74 72 A F E -ef 104 150C 0 75,-2.9 77,-3.0 -2,-0.5 2,-0.5 -0.785 6.4-158.8 -90.5 139.8 4.2 -7.7 25.2 75 73 A I E -ef 105 151C 0 29,-2.6 31,-3.0 -2,-0.4 2,-0.4 -0.987 10.3-171.3-123.4 119.4 6.1 -4.5 24.2 76 74 A V E -ef 106 152C 0 75,-2.9 77,-2.4 -2,-0.5 31,-0.1 -0.943 8.5-146.6-118.1 129.0 4.3 -2.1 21.9 77 75 A H + 0 0 3 29,-1.0 2,-0.2 -2,-0.4 3,-0.1 -0.233 20.5 168.1 -83.8 177.7 5.8 0.9 20.2 78 76 A G + 0 0 1 1,-0.4 76,-0.2 77,-0.2 -1,-0.1 -0.317 66.7 22.8-151.0-122.0 4.3 4.3 19.4 79 77 A F S S- 0 0 19 -2,-0.2 2,-0.6 1,-0.1 -1,-0.4 -0.306 70.6-159.4 -57.7 125.9 6.5 7.3 18.2 80 78 A I - 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