==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-JUN-00 1F6W . COMPND 2 MOLECULE: BILE SALT ACTIVATED LIPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.TERZYAN,X.ZHANG . 533 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21871.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 336 63.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 43 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 31 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 135 25.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.9 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 2 1 1 2 0 1 1 3 2 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 3 0 2 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 PARALLEL BRIDGES PER LADDER . 0 2 0 3 0 0 1 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 . 1 1 0 0 0 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 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 25 0, 0.0 2,-0.3 0, 0.0 88,-0.1 0.000 360.0 360.0 360.0-154.9 -25.0 8.2 40.7 2 2 A K - 0 0 137 1,-0.1 92,-0.1 24,-0.1 88,-0.0 -0.963 360.0-153.9-170.7 150.4 -25.7 9.3 37.1 3 3 A L + 0 0 37 -2,-0.3 2,-0.1 1,-0.2 -1,-0.1 0.723 29.1 177.2-101.7 -30.9 -25.2 12.2 34.7 4 4 A G + 0 0 27 2,-0.0 11,-0.7 10,-0.0 2,-0.3 -0.416 59.8 10.5 62.4-133.0 -28.1 11.6 32.4 5 5 A A E S-A 14 0A 50 9,-0.1 2,-0.4 -2,-0.1 9,-0.2 -0.621 71.4-167.0 -85.9 134.2 -28.2 14.3 29.7 6 6 A V E -A 13 0A 8 7,-2.0 7,-1.2 -2,-0.3 2,-0.5 -0.958 18.0-128.0-125.8 138.3 -25.3 16.8 29.4 7 7 A Y E +A 12 0A 150 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.706 31.1 171.9 -86.7 122.4 -25.0 20.1 27.6 8 8 A T E > -A 11 0A 1 3,-1.7 3,-2.7 -2,-0.5 169,-0.1 -0.831 50.6 -97.9-121.9 162.6 -22.1 20.4 25.2 9 9 A E T 3 S+ 0 0 78 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.875 126.8 49.2 -46.6 -43.2 -21.4 23.2 22.8 10 10 A G T 3 S- 0 0 11 1,-0.3 41,-1.8 24,-0.1 -1,-0.3 0.509 126.9 -88.5 -77.7 -3.7 -22.8 21.1 20.0 11 11 A G E < -A 8 0A 10 -3,-2.7 -3,-1.7 39,-0.2 -1,-0.3 -0.738 66.3 -25.7 126.9-177.3 -25.9 20.3 22.0 12 12 A F E -Ab 7 54A 94 41,-0.8 43,-1.5 -2,-0.2 2,-0.3 -0.242 54.1-169.4 -66.8 158.9 -27.1 17.7 24.6 13 13 A V E -Ab 6 55A 0 -7,-1.2 -7,-2.0 41,-0.2 2,-0.5 -0.971 8.8-152.1-152.9 135.1 -25.6 14.2 24.7 14 14 A E E -Ab 5 56A 65 41,-3.8 43,-2.9 -2,-0.3 -9,-0.1 -0.937 14.2-178.5-116.1 132.1 -26.6 11.0 26.5 15 15 A G - 0 0 10 -11,-0.7 2,-0.4 -2,-0.5 15,-0.2 0.020 32.4 -91.1-101.1-148.6 -24.3 8.3 27.6 16 16 A V E -C 29 0B 55 13,-0.8 13,-1.6 41,-0.1 2,-0.5 -0.964 24.7-142.7-137.0 114.2 -24.7 5.0 29.4 17 17 A N E -C 28 0B 37 -2,-0.4 2,-0.6 11,-0.2 11,-0.2 -0.666 18.3-161.1 -78.4 126.1 -24.6 4.6 33.2 18 18 A K E -C 27 0B 85 9,-2.2 9,-1.0 -2,-0.5 2,-0.1 -0.929 16.5-130.2-115.0 109.5 -22.9 1.3 34.0 19 19 A K E -C 26 0B 134 -2,-0.6 2,-0.6 7,-0.2 7,-0.3 -0.349 18.3-160.9 -58.0 125.7 -23.4 -0.1 37.5 20 20 A L - 0 0 57 5,-3.2 2,-0.3 -2,-0.1 5,-0.2 -0.697 64.8 -27.0-114.7 78.6 -20.1 -1.0 39.0 21 21 A G S S- 0 0 52 -2,-0.6 0, 0.0 1,-0.1 0, 0.0 -0.813 87.9 -79.2 112.3-157.2 -20.9 -3.3 41.9 22 22 A L S S+ 0 0 168 -2,-0.3 -1,-0.1 1,-0.1 -3,-0.0 0.339 109.2 77.0-126.7 6.1 -24.2 -3.3 43.8 23 23 A L S S- 0 0 116 -3,-0.2 -2,-0.1 2,-0.1 -1,-0.1 0.470 114.8 -85.3 -97.1 -1.2 -23.8 -0.3 46.2 24 24 A G S S+ 0 0 15 1,-0.4 -3,-0.1 -23,-0.0 2,-0.1 0.175 82.9 132.3 121.6 -19.5 -24.4 2.5 43.7 25 25 A D + 0 0 51 -5,-0.2 -5,-3.2 -6,-0.1 -1,-0.4 -0.376 29.0 148.8 -65.0 142.7 -20.9 3.2 42.2 26 26 A S E -CD 19 89B 3 63,-2.2 63,-2.6 -7,-0.3 2,-0.3 -0.853 40.2-119.5-156.0-169.4 -20.9 3.4 38.4 27 27 A V E -CD 18 88B 0 -9,-1.0 -9,-2.2 -2,-0.3 2,-0.5 -0.976 18.3-136.5-147.3 129.3 -19.3 4.9 35.4 28 28 A D E -CD 17 87B 4 59,-2.3 59,-2.1 -2,-0.3 2,-0.6 -0.784 24.3-160.2 -89.0 132.1 -20.9 7.1 32.8 29 29 A I E -CD 16 86B 11 -13,-1.6 -13,-0.8 -2,-0.5 2,-0.5 -0.900 13.9-179.5-122.0 109.0 -19.8 6.1 29.3 30 30 A F E + D 0 85B 1 55,-2.8 55,-2.6 -2,-0.6 2,-0.4 -0.912 8.1 176.0-107.8 124.4 -20.0 8.3 26.3 31 31 A K E +m 58 0C 45 26,-1.4 28,-0.5 -2,-0.5 53,-0.2 -0.957 59.9 22.6-124.4 142.6 -18.8 6.9 23.0 32 32 A G E + 0 0 2 -2,-0.4 52,-0.2 1,-0.2 -1,-0.2 0.834 68.3 159.5 77.3 31.0 -19.0 8.6 19.6 33 33 A I E - D 0 83B 0 50,-2.9 50,-3.0 -3,-0.2 2,-0.4 -0.768 38.4-129.4 -86.5 130.9 -19.2 12.3 20.5 34 34 A P E + D 0 82B 8 0, 0.0 48,-0.2 0, 0.0 -24,-0.1 -0.639 30.5 173.7 -81.9 132.9 -18.1 14.5 17.6 35 35 A F + 0 0 5 46,-2.0 2,-0.3 -2,-0.4 13,-0.3 0.426 69.5 27.3-115.5 -0.2 -15.5 17.1 18.3 36 36 A A S S- 0 0 1 45,-0.9 -1,-0.3 11,-0.2 12,-0.2 -0.988 89.5 -91.8-157.8 149.8 -15.0 18.2 14.8 37 37 A A - 0 0 15 9,-2.5 9,-0.3 -2,-0.3 44,-0.2 -0.148 63.3 -76.5 -58.3 156.3 -16.9 18.4 11.5 38 38 A P - 0 0 79 0, 0.0 2,-0.3 0, 0.0 8,-0.2 -0.216 65.5-105.4 -50.3 151.2 -16.7 15.5 9.1 39 39 A T - 0 0 15 39,-1.8 2,-0.4 -3,-0.1 5,-0.1 -0.635 20.1-146.5 -94.6 144.4 -13.3 15.8 7.4 40 40 A K > - 0 0 138 -2,-0.3 3,-1.9 4,-0.2 2,-0.1 -0.816 46.6 -87.0 -99.0 141.2 -12.5 16.9 3.9 41 41 A A T 3 S- 0 0 2 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 -0.253 105.3 -8.1 -54.7 124.5 -9.5 15.1 2.4 42 42 A L T 3 S+ 0 0 1 106,-0.5 2,-0.4 1,-0.2 -1,-0.3 0.704 107.5 119.9 61.4 22.8 -6.2 16.8 3.2 43 43 A E S < S- 0 0 69 -3,-1.9 -1,-0.2 216,-0.1 -3,-0.2 -0.914 71.9 -96.7-118.6 146.2 -7.9 19.8 4.8 44 44 A N - 0 0 58 -2,-0.4 -4,-0.2 1,-0.1 118,-0.1 -0.186 50.3 -94.4 -56.5 147.0 -7.7 21.1 8.4 45 45 A P - 0 0 12 0, 0.0 -1,-0.1 0, 0.0 -6,-0.1 -0.388 43.6-150.4 -65.8 142.7 -10.4 19.9 10.8 46 46 A Q - 0 0 118 -9,-0.3 -9,-2.5 -8,-0.2 -3,-0.0 -0.731 24.0 -84.7-114.9 162.7 -13.3 22.3 11.1 47 47 A P - 0 0 93 0, 0.0 -11,-0.2 0, 0.0 -1,-0.1 -0.153 47.6-106.1 -60.4 160.8 -15.7 23.1 14.0 48 48 A H - 0 0 41 -13,-0.3 3,-0.1 -12,-0.2 0, 0.0 -0.837 16.4-145.6 -97.8 126.1 -18.8 21.0 14.5 49 49 A P - 0 0 113 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.844 41.0-129.4 -49.3 -47.1 -22.1 22.5 13.5 50 50 A G - 0 0 19 -3,-0.1 2,-0.3 2,-0.0 -39,-0.2 -0.665 15.3-114.5 116.4-175.0 -24.1 20.8 16.2 51 51 A W - 0 0 47 -41,-1.8 2,-0.4 -2,-0.2 -39,-0.1 -0.898 25.3 -98.1-149.8 174.3 -27.3 18.7 16.1 52 52 A Q S S- 0 0 172 -2,-0.3 2,-0.4 -41,-0.1 -41,-0.0 -0.818 78.3 -13.4-107.7 144.3 -30.8 18.9 17.4 53 53 A G S S- 0 0 55 -2,-0.4 -41,-0.8 2,-0.1 2,-0.5 -0.590 111.4 -14.9 79.9-125.1 -32.2 17.3 20.5 54 54 A T E -b 12 0A 65 -2,-0.4 2,-0.5 -43,-0.1 -41,-0.2 -0.964 52.3-144.4-128.4 120.9 -30.2 14.6 22.2 55 55 A L E -b 13 0A 45 -43,-1.5 -41,-3.8 -2,-0.5 2,-1.0 -0.694 16.4-141.1 -81.1 125.4 -27.2 12.7 20.8 56 56 A K E -b 14 0A 120 -2,-0.5 2,-1.2 -43,-0.2 3,-0.4 -0.794 16.8-169.4 -88.3 104.5 -27.2 9.0 21.9 57 57 A A + 0 0 1 -43,-2.9 -26,-1.4 -2,-1.0 -41,-0.1 -0.632 42.9 120.4 -97.3 75.4 -23.5 8.4 22.6 58 58 A K B +m 31 0C 65 -2,-1.2 2,-0.4 -28,-0.2 -1,-0.2 0.613 60.7 52.4-113.3 -17.3 -23.6 4.6 23.0 59 59 A N S S- 0 0 121 -28,-0.5 -1,-0.1 -3,-0.4 -28,-0.0 -0.941 79.3-112.3-128.1 145.7 -21.4 3.2 20.3 60 60 A F - 0 0 28 -2,-0.4 2,-0.2 -29,-0.1 -2,-0.1 -0.147 37.8-132.5 -57.4 164.9 -17.9 3.9 19.2 61 61 A K - 0 0 92 1,-0.1 54,-0.2 19,-0.1 19,-0.1 -0.657 36.4 -65.4-114.7 176.2 -17.6 5.4 15.8 62 62 A K - 0 0 121 17,-0.3 20,-0.2 -2,-0.2 -1,-0.1 -0.292 48.4-121.6 -63.8 146.8 -15.5 4.5 12.8 63 63 A R - 0 0 44 1,-0.2 14,-0.9 50,-0.1 16,-0.2 -0.409 49.9 -77.5 -77.1 163.5 -11.8 4.9 13.1 64 64 A a B -n 77 0D 1 48,-0.4 14,-0.2 12,-0.2 48,-0.2 -0.360 62.8 -78.3 -68.9 149.6 -10.3 7.2 10.5 65 65 A L S S+ 0 0 4 12,-0.7 80,-0.3 11,-0.2 2,-0.3 -0.191 73.5 155.0 -46.2 116.8 -9.8 5.9 7.0 66 66 A Q E -O 75 0E 0 9,-2.3 9,-2.0 -3,-0.1 45,-0.1 -0.982 47.0 -84.2-151.8 161.5 -6.7 3.8 7.1 67 67 A A E -O 74 0E 8 43,-0.4 7,-0.2 -2,-0.3 2,-0.1 -0.254 49.7-119.7 -62.1 151.1 -4.8 0.9 5.5 68 68 A T > - 0 0 19 5,-2.0 3,-3.6 1,-0.1 -1,-0.1 -0.455 34.3 -87.5 -90.9 165.0 -5.7 -2.5 6.7 69 69 A I T 3 S+ 0 0 140 1,-0.3 -2,-0.1 -2,-0.1 -1,-0.1 0.841 133.1 36.7 -32.1 -54.4 -3.5 -5.0 8.5 70 70 A T T 3 S- 0 0 89 1,-0.0 -1,-0.3 3,-0.0 -3,-0.0 0.345 104.4-126.0 -87.1 4.3 -2.4 -6.4 5.1 71 71 A Q S < S+ 0 0 25 -3,-3.6 -2,-0.1 2,-0.1 3,-0.1 0.808 84.3 117.6 48.2 29.9 -2.3 -3.0 3.4 72 72 A D S S- 0 0 125 1,-0.1 2,-0.2 199,-0.0 -1,-0.1 0.846 79.7 -7.2 -87.1 -50.9 -4.6 -4.9 1.1 73 73 A S S S- 0 0 68 -7,-0.0 -5,-2.0 2,-0.0 2,-0.3 -0.691 76.0-104.7-136.8-173.6 -7.8 -2.9 1.5 74 74 A T E -O 67 0E 18 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.932 23.9-174.1-127.3 151.6 -9.0 -0.0 3.7 75 75 A Y E +O 66 0E 61 -9,-2.0 -9,-2.3 -2,-0.3 2,-0.4 -0.957 47.3 46.3-137.4 154.6 -11.3 0.2 6.7 76 76 A G S S- 0 0 14 -2,-0.3 2,-0.2 -11,-0.2 -12,-0.2 -0.918 71.1-104.4 120.0-144.2 -12.7 3.2 8.6 77 77 A D B -n 64 0D 48 -14,-0.9 -12,-0.7 -2,-0.4 3,-0.1 -0.861 17.1-116.1 176.4 147.8 -14.2 6.4 7.3 78 78 A E S S+ 0 0 37 -2,-0.2 -39,-1.8 1,-0.2 2,-0.7 0.466 106.1 74.1 -74.6 -0.7 -13.3 10.1 6.8 79 79 A D + 0 0 50 -41,-0.2 -17,-0.3 -16,-0.2 -1,-0.2 -0.616 65.7 116.4-110.7 71.8 -16.1 11.0 9.3 80 80 A a + 0 0 0 -2,-0.7 2,-2.8 -19,-0.1 62,-0.3 0.446 19.4 117.8-120.6 -5.0 -14.1 9.8 12.3 81 81 A L + 0 0 1 -3,-0.3 -46,-2.0 -44,-0.2 -45,-0.9 -0.371 46.5 129.0 -70.5 74.7 -13.4 12.7 14.6 82 82 A Y E -D 34 0B 22 -2,-2.8 60,-1.8 -48,-0.2 2,-0.3 -0.881 38.5-159.6-124.8 158.0 -15.2 11.4 17.6 83 83 A L E -DE 33 141B 0 -50,-3.0 -50,-2.9 -2,-0.3 2,-0.4 -0.876 6.4-142.5-134.1 168.1 -14.2 10.9 21.2 84 84 A N E - 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