==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE ESTERASE 13-JUL-96 1GPL . COMPND 2 MOLECULE: RP2 LIPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CAVIA PORCELLUS; . AUTHOR C.WITHERS-MARTINEZ,C.CAMBILLAU . 432 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17646.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 300 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 83 19.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 70 16.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 3 1 1 0 0 0 0 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 0 4 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 . 2 3 1 2 1 1 0 2 2 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 1 0 1 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 A 0 0 71 0, 0.0 12,-1.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 144.3 33.3 17.0 78.1 2 2 A E E -A 12 0A 130 10,-0.2 2,-0.3 11,-0.1 10,-0.2 -0.924 360.0-166.9-130.7 155.7 32.3 20.6 77.1 3 3 A V E -A 11 0A 37 8,-1.5 8,-2.6 -2,-0.3 2,-0.4 -0.942 12.5-156.6-135.7 148.1 34.0 24.0 77.0 4 4 A a E -A 10 0A 71 -2,-0.3 2,-0.5 6,-0.3 6,-0.2 -0.998 4.6-163.3-134.3 137.5 32.1 27.2 76.6 5 5 A Y E >> -A 9 0A 33 4,-2.2 3,-2.8 -2,-0.4 4,-0.7 -0.966 41.8 -94.1-126.1 108.5 33.4 30.4 75.3 6 6 A S G >4 S- 0 0 106 -2,-0.5 3,-1.5 1,-0.3 -1,-0.3 0.279 105.7 -0.8 22.8-120.6 31.3 33.5 76.0 7 7 A H G 34 S+ 0 0 96 1,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.258 122.5 72.5 -78.6 9.7 29.0 34.3 73.1 8 8 A L G <4 S- 0 0 12 -3,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.490 94.5-146.0 -96.7 -9.4 30.1 31.3 71.0 9 9 A G E << -A 5 0A 32 -3,-1.5 -4,-2.2 -4,-0.7 -1,-0.3 -0.310 34.4 -33.2 78.6-158.6 28.3 29.0 73.3 10 10 A a E -A 4 0A 68 -6,-0.2 2,-0.4 -3,-0.1 -6,-0.3 -0.656 44.0-159.7-105.4 160.0 29.5 25.5 74.2 11 11 A F E -A 3 0A 2 -8,-2.6 -8,-1.5 -2,-0.2 2,-0.2 -0.999 8.9-157.7-137.4 132.4 31.3 22.7 72.4 12 12 A S E -A 2 0A 23 -2,-0.4 -10,-0.2 -10,-0.2 15,-0.1 -0.610 21.2-146.8-107.9 160.2 31.4 19.0 73.2 13 13 A D + 0 0 18 -12,-1.5 2,-0.2 -2,-0.2 -11,-0.1 0.074 69.6 111.0-108.2 18.5 33.9 16.2 72.3 14 14 A E S > S- 0 0 103 -13,-0.3 3,-1.8 1,-0.2 -2,-0.1 -0.493 71.9 -34.7 -86.7 163.8 31.0 13.7 72.2 15 15 A K T 3 S+ 0 0 141 1,-0.3 -1,-0.2 2,-0.2 4,-0.1 -0.269 123.7 24.7 -60.9 150.3 29.9 12.1 68.9 16 16 A P T 3 S+ 0 0 29 0, 0.0 -1,-0.3 0, 0.0 4,-0.1 -0.963 123.0 59.0 -83.8 13.4 29.7 13.0 66.1 17 17 A W S < S- 0 0 35 -3,-1.8 2,-0.3 1,-0.1 -2,-0.2 0.619 121.0 -17.2 -76.1 -18.6 32.4 15.4 67.0 18 18 A A S S+ 0 0 1 8,-0.1 8,-0.2 -4,-0.1 7,-0.1 -0.958 108.6 58.3-174.0 169.7 35.0 12.9 68.1 19 19 A G S S+ 0 0 36 4,-0.5 2,-0.2 5,-0.4 -4,-0.1 0.677 83.4 109.8 70.2 18.7 35.4 9.3 69.2 20 20 A T S S- 0 0 27 3,-1.8 -1,-0.2 -4,-0.1 -3,-0.0 -0.589 85.9-103.1-114.2 178.6 33.9 8.0 66.0 21 21 A S S S+ 0 0 106 -2,-0.2 162,-0.1 1,-0.2 -2,-0.1 0.861 124.8 44.3 -70.6 -31.5 35.5 6.1 63.0 22 22 A Q S S+ 0 0 70 1,-0.3 161,-0.7 164,-0.1 -1,-0.2 0.858 131.5 21.2 -77.6 -40.1 35.4 9.4 61.0 23 23 A R S S+ 0 0 0 1,-0.1 -3,-1.8 159,-0.1 -4,-0.5 -0.683 76.3 161.7-130.7 73.9 36.7 11.6 63.9 24 24 A P + 0 0 70 0, 0.0 -5,-0.4 0, 0.0 2,-0.4 0.884 47.0 84.4 -63.2 -46.1 38.5 9.2 66.2 25 25 A I S S- 0 0 87 -7,-0.1 2,-0.5 -6,-0.1 -5,-0.1 -0.493 74.7-138.1 -71.6 116.5 40.7 11.5 68.3 26 26 A K + 0 0 111 -2,-0.4 2,-0.3 -8,-0.2 -8,-0.1 -0.638 45.6 135.0 -76.4 119.7 38.8 13.0 71.2 27 27 A S - 0 0 26 -2,-0.5 3,-0.0 -10,-0.1 91,-0.0 -0.969 43.1-129.7-159.0 163.5 39.7 16.6 71.6 28 28 A L - 0 0 38 -2,-0.3 93,-0.1 -26,-0.1 94,-0.1 -0.870 38.3 -89.5-119.3 154.3 38.0 20.0 72.2 29 29 A P - 0 0 2 0, 0.0 93,-0.1 0, 0.0 -18,-0.1 -0.371 49.1-112.5 -65.0 138.0 38.3 23.3 70.2 30 30 A S - 0 0 29 88,-0.3 95,-0.1 1,-0.2 81,-0.0 -0.106 45.7 -70.7 -63.3 170.3 41.1 25.5 71.6 31 30BA D >> - 0 0 62 1,-0.1 4,-2.4 2,-0.0 3,-1.7 -0.367 38.5-124.6 -64.4 134.6 40.5 28.8 73.2 32 31 A P H 3>>S+ 0 0 14 0, 0.0 4,-2.3 0, 0.0 5,-0.6 0.759 112.8 55.2 -48.6 -33.3 39.2 31.6 70.9 33 32 A K H 345S+ 0 0 156 2,-0.2 -2,-0.0 1,-0.2 -3,-0.0 0.733 107.3 46.1 -74.4 -29.2 42.2 33.7 72.1 34 33 A K H <45S+ 0 0 147 -3,-1.7 -1,-0.2 1,-0.1 -4,-0.0 0.865 117.7 44.6 -80.3 -36.9 44.8 31.1 71.2 35 34 A I H <5S- 0 0 0 -4,-2.4 75,-1.0 76,-0.1 76,-0.5 0.889 89.4-168.6 -71.6 -38.6 43.0 30.7 67.7 36 35 A N T <5 - 0 0 93 -4,-2.3 2,-0.3 -5,-0.3 74,-0.2 0.918 7.3-154.8 47.0 59.8 42.8 34.5 67.4 37 36 A T < - 0 0 14 -5,-0.6 2,-0.3 71,-0.2 71,-0.2 -0.464 15.4-167.2 -63.7 121.1 40.4 34.6 64.5 38 37 A R E -B 107 0B 48 69,-2.8 69,-2.8 -2,-0.3 2,-0.6 -0.883 17.3-140.8-117.0 148.9 41.0 38.0 62.7 39 38 A F E -BC 106 53B 8 14,-0.7 14,-1.8 -2,-0.3 2,-0.8 -0.910 14.0-167.1-111.9 105.2 39.0 39.8 60.0 40 39 A L E -BC 105 52B 0 65,-3.0 65,-2.7 -2,-0.6 2,-0.4 -0.812 12.6-153.8 -96.3 108.1 41.1 41.6 57.4 41 40 A L E +BC 104 51B 0 10,-3.2 10,-1.8 -2,-0.8 2,-0.4 -0.685 17.0 176.5 -91.3 133.2 39.0 44.0 55.3 42 41 A Y E +B 103 0B 19 61,-2.6 61,-3.4 -2,-0.4 2,-0.3 -0.954 7.2 173.2-127.0 137.3 39.7 45.0 51.7 43 42 A T E > -BC 102 46B 0 3,-1.6 3,-1.4 -2,-0.4 59,-0.1 -0.880 52.0 -95.8-135.0 171.7 37.4 47.3 49.7 44 43 A N T 3 S+ 0 0 25 57,-0.5 3,-0.3 -2,-0.3 58,-0.1 0.786 128.1 53.2 -60.0 -25.0 37.6 48.9 46.3 45 44 A E T 3 S+ 0 0 101 1,-0.3 -1,-0.3 20,-0.1 2,-0.2 0.526 119.4 29.9 -86.8 -14.1 38.8 52.0 48.3 46 45 A N E < S+C 43 0B 20 -3,-1.4 -3,-1.6 1,-0.1 -1,-0.3 -0.715 70.3 149.1-145.3 84.7 41.6 50.2 50.2 47 46 A Q E + 0 0 71 -3,-0.3 3,-0.1 -2,-0.2 46,-0.1 0.708 68.8 46.8 -91.4 -23.2 42.9 47.4 48.0 48 47 A N E S+ 0 0 142 1,-0.2 2,-0.4 2,-0.0 -1,-0.1 0.846 114.8 31.3 -93.9 -35.7 46.5 47.2 49.0 49 48 A S E S- 0 0 86 -8,-0.0 -1,-0.2 0, 0.0 2,-0.0 -0.975 80.6-124.9-125.5 138.4 46.4 47.2 52.8 50 49 A Y E - 0 0 73 -2,-0.4 2,-0.5 -8,-0.1 -8,-0.2 -0.269 8.4-135.5 -79.4 164.0 43.6 45.8 55.0 51 50 A Q E -C 41 0B 53 -10,-1.8 -10,-3.2 -5,-0.1 2,-0.3 -0.983 24.1-128.3-117.7 127.3 41.5 47.3 57.7 52 51 A L E -C 40 0B 92 -2,-0.5 2,-0.3 -12,-0.2 -12,-0.2 -0.648 29.3-177.1 -78.1 131.2 41.1 45.3 60.9 53 52 A I E -C 39 0B 1 -14,-1.8 -14,-0.7 -2,-0.3 2,-0.3 -0.956 7.4-167.6-129.6 147.0 37.5 44.8 62.0 54 53 A T > - 0 0 58 3,-0.5 3,-0.8 -2,-0.3 7,-0.4 -0.981 23.8-139.1-132.8 147.9 36.1 43.0 65.1 55 54 A A T 3 S+ 0 0 13 -2,-0.3 3,-0.2 1,-0.2 -1,-0.1 0.804 100.1 63.4 -74.7 -29.8 32.6 42.0 66.0 56 54AA T T 3 S+ 0 0 102 1,-0.2 -1,-0.2 2,-0.1 2,-0.2 0.357 106.8 43.4 -77.7 5.3 32.9 43.1 69.7 57 55 A D X> - 0 0 82 -3,-0.8 3,-2.1 1,-0.1 4,-0.7 -0.673 63.3-171.9-153.3 85.5 33.5 46.7 68.8 58 56 A I H 3> S+ 0 0 51 1,-0.3 4,-2.0 -3,-0.2 5,-0.2 0.727 80.9 76.0 -54.5 -21.6 31.1 48.0 66.1 59 57 A A H 3> S+ 0 0 56 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.844 90.8 54.6 -59.4 -36.4 33.1 51.2 66.0 60 58 A T H <> S+ 0 0 39 -3,-2.1 4,-0.6 -6,-0.2 -1,-0.2 0.943 108.6 48.2 -63.7 -44.4 35.9 49.4 64.0 61 59 A I H < S+ 0 0 3 -4,-0.7 5,-0.3 -7,-0.4 3,-0.2 0.823 114.4 46.1 -65.8 -31.4 33.3 48.3 61.4 62 60 A K H < S+ 0 0 134 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.788 110.1 51.0 -82.9 -29.5 31.9 51.9 61.1 63 61 A A H < S+ 0 0 89 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.474 102.3 81.5 -84.1 -6.8 35.2 53.7 60.9 64 62 A S S < S- 0 0 17 -4,-0.6 -3,-0.0 -3,-0.2 -11,-0.0 -0.367 97.9-101.9 -91.1 177.6 36.3 51.3 58.1 65 63 A N S S+ 0 0 59 -2,-0.1 -20,-0.1 -24,-0.1 -21,-0.1 0.340 70.2 141.0 -81.7 6.5 35.5 51.3 54.4 66 64 A F - 0 0 19 -5,-0.3 2,-0.5 1,-0.1 -23,-0.1 -0.289 41.4-152.2 -51.5 132.2 32.9 48.6 54.9 67 65 A N > - 0 0 57 4,-0.1 3,-1.2 1,-0.1 35,-0.1 -0.948 16.2-157.7-119.0 120.8 30.1 49.6 52.6 68 66 A L T 3 S+ 0 0 91 -2,-0.5 -1,-0.1 1,-0.2 4,-0.1 0.559 92.5 58.0 -72.4 -9.5 26.5 48.6 53.4 69 67 A N T 3 S+ 0 0 155 2,-0.1 2,-0.3 74,-0.1 -1,-0.2 0.417 97.2 74.6 -99.3 1.4 25.4 48.9 49.8 70 68 A R S < S- 0 0 34 -3,-1.2 31,-0.2 1,-0.1 -3,-0.1 -0.829 87.9-106.8-113.7 152.2 27.9 46.4 48.5 71 69 A K E -d 101 0B 60 29,-0.6 31,-2.1 -2,-0.3 2,-0.4 -0.283 33.0-132.9 -71.5 159.8 27.8 42.7 48.8 72 70 A T E -de 102 148B 0 75,-2.5 77,-2.1 29,-0.2 2,-0.5 -0.980 18.5-171.5-122.8 129.0 30.3 41.0 51.2 73 71 A R E -de 103 149B 15 29,-2.6 31,-2.8 -2,-0.4 2,-0.3 -0.986 6.9-158.4-124.7 124.9 32.6 38.1 50.5 74 72 A F E -de 104 150B 0 75,-2.7 77,-3.5 -2,-0.5 2,-0.5 -0.800 2.6-157.0 -98.2 145.4 34.6 36.3 53.1 75 73 A I E -de 105 151B 0 29,-2.9 31,-2.8 -2,-0.3 2,-0.5 -0.977 9.8-171.6-126.5 117.7 37.6 34.2 52.2 76 74 A I E -de 106 152B 0 75,-3.0 77,-2.5 -2,-0.5 80,-0.1 -0.939 9.7-149.7-114.9 120.5 38.7 31.5 54.7 77 75 A H - 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