==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIPASE PROTEIN COFACTOR 08-JUN-94 1PCN . COMPND 2 MOLECULE: PORCINE PANCREATIC PROCOLIPASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR J.N.BREG,L.SARDA,P.J.COZZONE,N.RUGANI,R.BOELENS,R.KAPTEIN . 93 1 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7200.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 48 51.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 12.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 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-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 23.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 4.3 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+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 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 . 3 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 . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 V 0 0 194 0, 0.0 2,-1.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 57.2 -28.6 -20.4 -2.2 2 2 A P - 0 0 96 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.069 360.0 -62.0 -26.8 52.5 -24.6 -20.9 -2.0 3 3 A D S S- 0 0 135 -2,-1.8 2,-0.4 2,-0.0 0, 0.0 0.212 80.1 -56.6 77.0 154.5 -23.4 -18.5 0.8 4 4 A P - 0 0 126 0, 0.0 2,-1.9 0, 0.0 3,-0.3 -0.460 48.7-139.7 -64.2 119.2 -23.8 -14.5 0.7 5 5 A R + 0 0 173 -2,-0.4 -2,-0.0 1,-0.2 3,-0.0 -0.394 54.0 134.3 -82.3 69.6 -22.1 -13.1 -2.5 6 6 A G + 0 0 57 -2,-1.9 2,-1.7 1,-0.1 -1,-0.2 0.609 42.5 91.5 -87.4 -14.9 -20.4 -10.0 -1.0 7 7 A I + 0 0 133 -3,-0.3 2,-1.3 1,-0.1 -1,-0.1 -0.424 47.9 159.6 -83.2 65.2 -16.9 -10.4 -2.7 8 8 A I + 0 0 154 -2,-1.7 2,-0.1 -3,-0.0 -1,-0.1 -0.589 27.7 121.6 -92.9 77.4 -17.7 -8.2 -5.8 9 9 A I + 0 0 80 -2,-1.3 14,-0.2 1,-0.0 13,-0.1 -0.363 1.2 111.2-122.4-163.4 -14.1 -7.3 -7.0 10 10 A N + 0 0 123 12,-1.4 2,-0.4 1,-0.2 13,-0.2 0.927 36.4 162.5 86.9 79.6 -11.7 -7.7 -10.1 11 11 A L B -a 23 0A 57 11,-0.6 13,-2.4 4,-0.0 14,-0.5 -0.977 33.3-125.3-124.9 132.4 -11.1 -4.2 -11.7 12 12 A D - 0 0 92 -2,-0.4 3,-0.4 11,-0.2 27,-0.2 -0.308 37.7 -88.5 -72.8 161.0 -8.1 -3.3 -14.2 13 13 A E S S+ 0 0 104 1,-0.2 27,-0.2 25,-0.1 -1,-0.1 -0.327 104.9 51.6 -72.7 152.8 -5.6 -0.4 -13.6 14 14 A G S S+ 0 0 22 25,-2.4 2,-0.3 1,-0.3 -1,-0.2 0.636 88.8 103.7 91.6 19.6 -6.5 3.2 -14.9 15 15 A E S S- 0 0 118 -3,-0.4 24,-2.5 24,-0.1 -1,-0.3 -0.923 81.4 -88.7-132.0 153.6 -10.0 3.3 -13.4 16 16 A L B -B 38 0B 115 -2,-0.3 2,-0.3 22,-0.2 22,-0.3 -0.445 50.7-179.8 -68.5 119.6 -11.6 5.2 -10.3 17 17 A a - 0 0 4 20,-2.0 20,-0.4 -2,-0.3 3,-0.1 -0.895 29.7-158.9-121.0 151.6 -11.3 3.0 -7.0 18 18 A L S S+ 0 0 135 -2,-0.3 2,-0.2 1,-0.2 39,-0.2 0.921 82.1 9.0 -89.0 -74.1 -12.3 3.4 -3.3 19 19 A N S > S- 0 0 33 37,-0.1 3,-0.7 38,-0.1 4,-0.3 -0.627 76.2-113.7 -97.2 171.8 -10.0 0.8 -1.5 20 20 A S G > S+ 0 0 0 1,-0.2 3,-0.5 -2,-0.2 7,-0.3 0.750 106.5 71.0 -77.1 -21.7 -7.0 -1.3 -2.9 21 21 A A G 3 S+ 0 0 38 1,-0.2 -1,-0.2 5,-0.1 -11,-0.2 0.371 87.3 67.4 -77.1 9.3 -8.7 -4.7 -2.5 22 22 A Q G < S+ 0 0 57 -3,-0.7 -12,-1.4 -13,-0.1 -11,-0.6 0.778 87.5 72.6 -94.8 -35.9 -11.2 -4.0 -5.4 23 23 A b B < S-a 11 0A 7 -3,-0.5 -11,-0.2 -4,-0.3 5,-0.1 -0.473 79.6-127.7 -80.2 154.1 -8.6 -4.0 -8.4 24 24 A K S S+ 0 0 124 -13,-2.4 2,-1.0 1,-0.2 -12,-0.1 0.969 112.0 51.2 -60.2 -54.5 -6.9 -7.1 -9.9 25 25 A S S S- 0 0 30 -14,-0.5 2,-1.7 2,-0.1 15,-0.2 -0.790 102.5-133.4 -82.2 102.5 -3.5 -5.3 -9.4 26 26 A N + 0 0 80 -2,-1.0 -5,-0.1 1,-0.1 -6,-0.1 -0.392 69.4 109.2 -69.9 84.1 -4.0 -4.5 -5.7 27 27 A c - 0 0 1 -2,-1.7 13,-2.5 -7,-0.3 2,-0.7 -0.514 42.1-175.6-161.3 77.3 -2.8 -0.8 -5.8 28 28 A a E -C 39 0B 0 28,-0.3 30,-2.7 11,-0.2 2,-0.5 -0.760 30.5-141.3 -79.4 112.9 -5.5 2.0 -5.4 29 29 A Q E -Cd 38 58B 57 9,-1.4 9,-1.9 -2,-0.7 2,-0.4 -0.718 4.9-139.6 -91.9 122.3 -3.3 5.1 -6.0 30 30 A H - 0 0 29 28,-2.6 2,-1.0 -2,-0.5 7,-0.1 -0.624 7.7-140.0 -82.3 124.0 -3.8 8.3 -4.0 31 31 A D - 0 0 61 -2,-0.4 3,-0.4 5,-0.4 5,-0.1 -0.034 66.6 -73.3 -73.1 38.1 -3.6 11.7 -5.8 32 32 A T S S- 0 0 112 -2,-1.0 2,-1.8 1,-0.2 -1,-0.1 0.986 92.8 -38.9 68.4 85.1 -1.7 13.4 -2.7 33 33 A I S S+ 0 0 121 1,-0.2 -1,-0.2 48,-0.1 -2,-0.1 -0.057 119.6 90.3 61.3 -29.7 -4.1 14.1 0.3 34 34 A L S S- 0 0 130 -2,-1.8 -1,-0.2 -3,-0.4 3,-0.1 0.783 84.9-140.1 -60.0 -30.3 -7.2 15.2 -1.9 35 35 A S + 0 0 81 1,-0.2 2,-1.5 0, 0.0 -1,-0.1 0.294 56.0 136.1 84.9 0.2 -8.4 11.5 -2.1 36 36 A L - 0 0 113 -5,-0.1 -5,-0.4 -4,-0.1 2,-0.3 -0.588 45.0-166.2 -74.8 92.5 -9.7 11.1 -5.8 37 37 A S - 0 0 5 -2,-1.5 -20,-2.0 -20,-0.4 2,-0.4 -0.683 19.3-175.7 -97.6 134.9 -8.0 7.6 -6.1 38 38 A R E -BC 16 29B 163 -9,-1.9 -9,-1.4 -2,-0.3 -22,-0.2 -0.987 32.3-104.8-128.1 132.0 -7.3 5.7 -9.4 39 39 A b E + C 0 28B 6 -24,-2.5 -25,-2.4 -2,-0.4 -11,-0.2 -0.228 43.5 167.2 -66.2 147.6 -5.8 2.1 -9.6 40 40 A A - 0 0 27 -13,-2.5 2,-0.2 -15,-0.2 -13,-0.1 -0.590 34.2 -80.6-136.6-170.9 -2.2 1.6 -10.8 41 41 A L - 0 0 95 -2,-0.2 20,-0.2 1,-0.1 2,-0.1 -0.655 46.9 -95.3 -99.8 163.1 0.6 -1.2 -10.9 42 42 A K - 0 0 102 -2,-0.2 21,-0.2 1,-0.1 22,-0.1 -0.392 53.1 -86.9 -72.9 156.1 2.9 -2.5 -8.0 43 43 A A B -e 63 0C 13 19,-2.1 21,-1.7 18,-0.2 2,-0.2 -0.288 37.0-147.7 -76.4 150.1 6.5 -1.0 -7.8 44 44 A R > - 0 0 184 19,-0.2 3,-2.0 1,-0.1 43,-0.4 -0.603 42.9 -53.7-110.4 168.3 9.7 -2.2 -9.6 45 45 A E T 3 S+ 0 0 102 1,-0.3 43,-0.2 -2,-0.2 -1,-0.1 -0.127 124.2 13.4 -52.0 127.2 13.5 -2.3 -8.7 46 46 A N T 3 S+ 0 0 116 41,-2.5 2,-0.3 1,-0.3 -1,-0.3 0.474 103.0 117.0 78.1 12.7 15.0 1.2 -7.6 47 47 A S S < S- 0 0 58 -3,-2.0 40,-2.2 40,-0.2 -1,-0.3 -0.765 72.8 -96.0-107.3 153.5 11.4 2.8 -7.2 48 48 A E E +F 86 0D 83 -2,-0.3 2,-0.3 38,-0.2 38,-0.2 -0.410 46.4 178.7 -67.6 134.1 9.7 4.2 -4.0 49 49 A d E -F 85 0D 0 36,-2.7 36,-1.9 -2,-0.2 2,-0.6 -0.987 34.8-115.9-139.0 144.3 7.3 1.7 -2.2 50 50 A S - 0 0 16 10,-1.7 13,-0.2 -2,-0.3 34,-0.1 -0.720 24.1-155.8 -79.4 119.9 5.1 1.8 1.0 51 51 A A S S+ 0 0 65 -2,-0.6 2,-0.3 11,-0.1 18,-0.1 0.817 77.1 41.9 -72.0 -31.6 6.7 -0.9 3.3 52 52 A F S S- 0 0 150 10,-0.0 2,-0.4 0, 0.0 -2,-0.0 -0.828 74.9-150.7-107.4 153.9 3.4 -1.6 5.3 53 53 A T - 0 0 80 -2,-0.3 2,-0.1 5,-0.0 4,-0.1 -0.984 7.0-165.5-127.6 140.8 -0.2 -1.8 3.8 54 54 A L - 0 0 108 -2,-0.4 2,-0.9 3,-0.1 -34,-0.0 -0.172 47.3 -83.4 -97.2-165.7 -3.6 -1.0 5.4 55 55 A Y S S+ 0 0 177 -2,-0.1 2,-0.3 -35,-0.1 -2,-0.0 -0.669 105.6 30.5 -99.4 71.8 -7.2 -1.9 4.2 56 56 A G S S- 0 0 8 -2,-0.9 -28,-0.3 -37,-0.1 2,-0.1 -0.966 96.2 -6.5 171.8-157.8 -7.2 1.0 1.7 57 57 A V - 0 0 28 -2,-0.3 2,-0.4 -39,-0.2 -28,-0.2 -0.409 50.1-144.3 -80.6 145.5 -5.5 3.5 -0.6 58 58 A Y B -d 29 0B 14 -30,-2.7 -28,-2.6 -2,-0.1 3,-0.2 -0.855 15.8-158.7-114.3 139.1 -1.7 3.8 -1.1 59 59 A Y S S+ 0 0 54 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.840 98.1 12.3 -78.8 -38.3 0.6 6.9 -1.8 60 60 A K S S- 0 0 73 -31,-0.0 -10,-1.7 -17,-0.0 -1,-0.3 -0.937 93.9-127.1-137.6 111.1 3.5 4.7 -3.2 61 61 A c - 0 0 6 -2,-0.3 -18,-0.2 -3,-0.2 -34,-0.1 -0.192 30.4 -95.5 -60.9 152.2 2.3 1.0 -4.0 62 62 A P - 0 0 38 0, 0.0 -19,-2.1 0, 0.0 -11,-0.1 -0.067 49.8 -80.7 -66.3 168.6 4.4 -2.1 -2.5 63 63 A e B -e 43 0C 21 -21,-0.2 -19,-0.2 -13,-0.2 3,-0.1 -0.167 45.7 -96.7 -72.9 161.3 7.2 -4.1 -4.5 64 64 A E > - 0 0 59 -21,-1.7 3,-2.0 1,-0.2 2,-0.2 -0.046 59.1 -60.4 -68.8 171.7 6.9 -6.9 -7.1 65 65 A R T 3 S+ 0 0 235 1,-0.2 -1,-0.2 3,-0.0 3,-0.1 -0.358 126.7 12.0 -61.7 119.6 7.0 -10.8 -6.7 66 66 A G T 3 S+ 0 0 26 1,-0.3 2,-0.3 -2,-0.2 -1,-0.2 0.198 108.2 101.6 95.0 -15.1 10.5 -11.7 -5.2 67 67 A L < - 0 0 27 -3,-2.0 -1,-0.3 22,-0.2 2,-0.2 -0.808 59.4-142.2-105.4 144.4 11.5 -8.0 -4.3 68 68 A T E -G 88 0D 52 20,-3.0 20,-2.0 -2,-0.3 2,-0.7 -0.675 17.0-120.2 -99.5 156.0 11.4 -6.3 -0.8 69 69 A d E -G 87 0D 28 -2,-0.2 2,-1.5 18,-0.2 18,-0.2 -0.846 23.4-149.8 -92.5 116.1 10.5 -2.7 0.2 70 70 A E E +G 86 0D 84 16,-2.2 2,-1.5 -2,-0.7 16,-0.7 -0.508 24.8 171.2 -93.4 74.2 13.6 -1.2 2.0 71 71 A G + 0 0 48 -2,-1.5 14,-0.2 14,-0.3 -1,-0.1 -0.499 22.8 132.4 -87.9 72.1 11.9 1.2 4.5 72 72 A D S S- 0 0 126 -2,-1.5 -1,-0.2 12,-0.1 13,-0.1 0.739 78.9 -35.6 -94.6 -30.8 14.8 2.4 6.7 73 73 A K + 0 0 133 11,-0.2 12,-0.1 3,-0.0 -2,-0.1 0.119 56.7 160.6-156.8 -81.4 14.6 6.3 7.0 74 74 A S + 0 0 54 9,-0.1 10,-0.3 1,-0.1 2,-0.2 0.783 36.7 125.8 42.1 46.7 13.4 8.6 4.0 75 75 A L + 0 0 91 8,-0.1 2,-1.7 3,-0.1 3,-0.4 -0.562 22.5 163.8-129.4 68.1 12.5 11.7 6.2 76 76 A V S S- 0 0 147 1,-0.3 7,-0.0 -2,-0.2 -2,-0.0 -0.476 87.9 -24.5 -86.1 69.9 14.5 14.8 4.7 77 77 A G S S- 0 0 66 -2,-1.7 2,-0.6 1,-0.1 -1,-0.3 0.919 87.3-152.1 84.4 71.3 12.4 17.5 6.5 78 78 A S + 0 0 61 -3,-0.4 -1,-0.1 1,-0.2 3,-0.1 -0.665 44.0 134.2 -90.6 116.5 9.0 15.7 7.2 79 79 A I S S+ 0 0 156 -2,-0.6 -1,-0.2 1,-0.1 -2,-0.0 0.651 71.9 41.3-114.5 -58.2 5.6 17.6 7.4 80 80 A T S S- 0 0 84 1,-0.1 2,-2.2 2,-0.1 -1,-0.1 -0.196 111.1 -76.0 -79.1 176.4 3.2 15.5 5.2 81 81 A N S S+ 0 0 79 1,-0.1 2,-0.6 -3,-0.1 -1,-0.1 -0.337 80.1 137.8 -73.4 63.8 3.0 11.6 5.1 82 82 A T + 0 0 60 -2,-2.2 2,-0.3 2,-0.0 -1,-0.1 -0.787 17.5 121.8-119.7 84.5 6.2 11.2 3.0 83 83 A N + 0 0 88 -2,-0.6 2,-0.3 -8,-0.1 -9,-0.1 -0.842 34.5 153.0-146.3 98.3 8.2 8.3 4.5 84 84 A F - 0 0 19 -10,-0.3 -11,-0.2 -2,-0.3 -34,-0.2 -0.972 32.8-134.9-139.9 150.1 9.0 5.4 1.9 85 85 A G E -F 49 0D 1 -36,-1.9 -36,-2.7 -2,-0.3 2,-0.4 -0.353 26.2-111.9 -90.2 176.4 11.4 2.5 1.1 86 86 A I E -FG 48 70D 59 -16,-0.7 -16,-2.2 -38,-0.2 2,-0.4 -0.904 28.5-113.3-112.8 139.7 13.1 1.4 -2.2 87 87 A e E + G 0 69D 0 -40,-2.2 -41,-2.5 -43,-0.4 2,-0.3 -0.542 46.5 159.1 -70.5 120.5 12.3 -1.9 -4.1 88 88 A H E > - G 0 68D 65 -20,-2.0 -20,-3.0 -2,-0.4 2,-1.7 -0.973 49.0-100.7-141.3 161.8 15.3 -4.4 -4.2 89 89 A N T 3 S+ 0 0 90 -2,-0.3 -22,-0.2 -22,-0.2 3,-0.1 -0.442 79.0 110.5 -91.7 75.8 15.8 -8.2 -4.8 90 90 A V T 3 + 0 0 96 -2,-1.7 2,-1.7 1,-0.1 3,-0.4 0.731 57.9 73.5-109.7 -42.6 16.3 -9.5 -1.1 91 91 A G S < S+ 0 0 52 -3,-0.5 -25,-0.2 1,-0.2 -1,-0.1 -0.365 77.6 80.7 -79.5 63.8 13.0 -11.6 -0.5 92 92 A R 0 0 183 -2,-1.7 -1,-0.2 -3,-0.1 -2,-0.1 0.616 360.0 360.0-129.6 -61.1 13.8 -14.7 -2.7 93 93 A S 0 0 147 -3,-0.4 -2,-0.1 -27,-0.1 0, 0.0 -0.642 360.0 360.0-140.2 360.0 16.1 -17.3 -0.9