==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-NOV-11 3UUF . COMPND 2 MOLECULE: LIP1, SECRETORY LIPASE (FAMILY 3); . SOURCE 2 ORGANISM_SCIENTIFIC: MALASSEZIA GLOBOSA; . AUTHOR T.XU,J.XU,S.HOU,J.LIU . 278 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11189.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 13.3 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 . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 . 20 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 57 20.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 0 0 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 1 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 0 PARALLEL BRIDGES PER LADDER . 2 4 0 0 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 . 1 0 1 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 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 27 A R 0 0 203 0, 0.0 3,-0.1 0, 0.0 180,-0.1 0.000 360.0 360.0 360.0 97.9 35.5 -11.7 -5.7 2 28 A G + 0 0 35 1,-0.2 179,-0.1 178,-0.2 181,-0.0 0.193 360.0 104.1 91.1 -7.4 32.7 -10.5 -8.1 3 29 A G S S- 0 0 32 177,-0.1 2,-0.4 212,-0.0 -1,-0.2 0.209 77.2-104.2 -96.1-159.6 34.2 -13.1 -10.5 4 30 A S - 0 0 45 -3,-0.1 234,-0.2 235,-0.0 235,-0.1 -0.925 31.8-128.3-138.5 113.1 33.6 -16.5 -11.9 5 31 A S - 0 0 22 232,-2.4 235,-2.0 -2,-0.4 236,-0.3 -0.281 15.9-168.1 -60.5 140.4 35.7 -19.4 -10.6 6 32 A T + 0 0 92 233,-0.2 -1,-0.1 234,-0.1 230,-0.1 0.530 42.6 131.9-106.7 -13.7 37.4 -21.4 -13.4 7 33 A D - 0 0 99 1,-0.1 234,-0.2 228,-0.1 -2,-0.0 0.138 63.9 -96.7 -38.3 146.5 38.4 -24.4 -11.1 8 34 A Q - 0 0 137 1,-0.1 -1,-0.1 226,-0.1 2,-0.1 -0.470 39.9-104.7 -76.6 136.0 37.8 -28.0 -12.0 9 35 A P - 0 0 24 0, 0.0 225,-0.2 0, 0.0 2,-0.2 -0.332 39.1-155.5 -44.8 131.9 34.6 -29.8 -10.6 10 36 A V E -A 233 0A 79 223,-2.2 223,-2.9 1,-0.2 0, 0.0 -0.631 30.1 -74.4-111.0 170.5 35.3 -32.3 -7.8 11 37 A A E -A 232 0A 82 221,-0.2 221,-0.2 -2,-0.2 -1,-0.2 -0.264 62.2 -91.6 -52.8 152.2 33.6 -35.4 -6.5 12 38 A N - 0 0 36 219,-0.8 -1,-0.1 1,-0.2 4,-0.1 -0.609 42.5-178.3 -74.1 107.5 30.4 -34.7 -4.5 13 39 A P + 0 0 89 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.511 42.9 113.8 -79.8 -7.7 31.4 -34.4 -0.8 14 40 A Y S S- 0 0 29 1,-0.1 2,-1.1 2,-0.1 3,-0.1 -0.265 78.7-105.6 -78.7 152.5 27.9 -33.8 0.6 15 41 A N >> - 0 0 64 1,-0.2 4,-2.1 2,-0.1 3,-0.5 -0.622 33.3-164.3 -77.0 107.7 26.0 -36.1 2.9 16 42 A T H 3> S+ 0 0 62 -2,-1.1 4,-2.3 1,-0.3 -1,-0.2 0.703 84.8 54.9 -72.2 -21.7 23.4 -37.5 0.4 17 43 A K H 3> S+ 0 0 114 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.838 110.1 48.0 -81.2 -28.6 21.1 -39.0 3.0 18 44 A E H <> S+ 0 0 15 -3,-0.5 4,-2.8 2,-0.2 -2,-0.2 0.887 112.4 48.4 -73.8 -39.5 20.9 -35.5 4.6 19 45 A I H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.944 112.7 49.9 -62.1 -46.1 20.3 -34.0 1.2 20 46 A S H X S+ 0 0 13 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.941 113.4 45.2 -52.6 -56.4 17.6 -36.6 0.6 21 47 A L H >X S+ 0 0 8 -4,-2.5 4,-2.4 2,-0.2 3,-0.6 0.928 110.4 51.5 -52.5 -58.9 16.0 -35.9 3.9 22 48 A A H 3X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.3 5,-0.2 0.888 106.4 57.0 -52.6 -42.8 16.1 -32.0 3.6 23 49 A A H 3X S+ 0 0 0 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.3 0.919 108.3 47.0 -51.9 -44.8 14.4 -32.4 0.2 24 50 A G H < S+ 0 0 0 -4,-2.0 3,-1.9 -5,-0.2 4,-0.2 0.838 105.4 60.0 -91.4 -32.0 10.9 -29.0 2.0 27 53 A Q H >< S+ 0 0 0 -4,-2.8 3,-1.7 1,-0.3 -2,-0.2 0.885 99.5 63.6 -54.3 -32.5 8.5 -30.9 -0.4 28 54 A Q G >< S+ 0 0 2 -4,-1.7 3,-1.3 1,-0.3 -1,-0.3 0.588 83.8 72.4 -72.8 -11.8 6.2 -31.0 2.6 29 55 A T G < S+ 0 0 0 -3,-1.9 28,-0.3 1,-0.3 -1,-0.3 0.561 90.8 61.3 -82.3 -3.9 5.9 -27.3 2.7 30 56 A Y G < S+ 0 0 18 -3,-1.7 -1,-0.3 -4,-0.2 2,-0.2 0.427 100.6 63.3 -94.0 -0.5 3.7 -27.6 -0.4 31 57 A a S < S- 0 0 10 -3,-1.3 2,-0.2 -4,-0.1 236,-0.0 -0.710 104.6 -83.1-119.0 161.7 1.1 -29.8 1.5 32 58 A D - 0 0 118 -2,-0.2 3,-0.2 1,-0.1 -2,-0.1 -0.567 48.2-168.7 -73.6 141.2 -1.0 -28.8 4.5 33 59 A S + 0 0 3 -2,-0.2 -1,-0.1 1,-0.2 14,-0.1 -0.025 62.3 81.8-139.8 30.5 1.1 -29.2 7.7 34 60 A T + 0 0 90 2,-0.1 2,-1.3 25,-0.1 -1,-0.2 -0.044 54.1 131.0-112.8 27.0 -0.6 -29.0 11.1 35 61 A E > - 0 0 105 -3,-0.2 3,-1.2 1,-0.0 2,-0.2 -0.726 69.1-127.6 -54.1 90.2 -1.4 -32.5 10.3 36 62 A N T 3 S+ 0 0 120 -2,-1.3 10,-0.1 1,-0.2 -2,-0.1 -0.367 76.9 14.1 -82.5 129.4 -0.1 -33.1 13.9 37 63 A G T 3 S+ 0 0 39 8,-0.8 -1,-0.2 -2,-0.2 9,-0.1 0.397 84.6 168.7 93.5 4.1 2.6 -35.6 14.7 38 64 A L < - 0 0 22 -3,-1.2 7,-2.4 7,-0.2 2,-0.4 -0.065 21.8-148.3 -59.5 152.1 3.6 -36.0 11.1 39 65 A K E +B 44 0A 133 5,-0.2 2,-0.4 22,-0.0 5,-0.2 -0.987 19.0 175.3-130.4 126.3 6.8 -37.9 10.3 40 66 A I E > -B 43 0A 2 3,-1.8 3,-2.8 -2,-0.4 234,-0.1 -0.997 66.9 -44.1-133.3 126.5 9.2 -37.3 7.3 41 67 A G T 3 S- 0 0 40 -2,-0.4 234,-0.0 1,-0.3 -19,-0.0 -0.218 126.7 -22.3 38.0-138.0 12.5 -39.3 7.2 42 68 A D T 3 S+ 0 0 55 -3,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.406 121.8 109.1 -67.6 5.3 13.9 -39.2 10.7 43 69 A S E < -B 40 0A 0 -3,-2.8 -3,-1.8 20,-0.1 2,-0.6 -0.576 57.2-152.5-104.9 144.4 11.9 -36.0 11.4 44 70 A E E -BC 39 62A 68 18,-2.7 18,-1.9 -2,-0.2 2,-0.4 -0.948 24.4-131.9-109.4 118.5 8.8 -35.0 13.4 45 71 A L E + C 0 61A 2 -7,-2.4 -8,-0.8 -2,-0.6 16,-0.3 -0.544 31.5 173.7 -64.7 117.6 6.8 -32.0 12.1 46 72 A L E - 0 0 20 14,-3.0 2,-0.3 -2,-0.4 15,-0.2 0.669 53.6 -10.2-100.9 -23.5 6.3 -29.8 15.1 47 73 A Y E - C 0 60A 84 13,-1.3 13,-2.1 -14,-0.1 -1,-0.3 -0.965 54.0-161.6-176.3 161.2 4.7 -26.6 13.8 48 74 A T E + C 0 59A 19 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.985 5.8 179.1-160.4 152.4 3.6 -24.6 10.7 49 75 A M E + C 0 58A 15 9,-1.3 9,-2.6 -2,-0.3 -2,-0.0 -0.977 49.4 32.8-157.4 159.6 2.6 -21.2 9.4 50 76 A G - 0 0 18 -2,-0.3 7,-0.2 7,-0.2 6,-0.2 -0.145 58.9-136.1 75.6-178.4 1.7 -19.5 6.1 51 77 A E - 0 0 86 4,-1.3 5,-0.2 6,-0.1 -1,-0.1 0.199 42.5 -97.8-163.3 1.5 -0.2 -21.4 3.5 52 78 A G S S+ 0 0 17 3,-2.4 4,-0.2 1,-0.1 24,-0.1 0.736 105.6 84.3 78.5 20.8 1.5 -20.5 0.2 53 79 A Y S S+ 0 0 209 2,-0.7 3,-0.1 22,-0.0 -1,-0.1 0.707 111.5 1.5-117.1 -51.5 -1.0 -17.8 -0.8 54 80 A A S S+ 0 0 70 1,-0.4 2,-0.3 2,-0.0 -4,-0.0 0.598 141.7 16.9-108.9 -27.2 0.2 -14.6 0.9 55 81 A R S S- 0 0 65 64,-0.0 -3,-2.4 3,-0.0 -4,-1.3 -0.971 90.3 -96.1-138.1 162.3 3.3 -16.1 2.5 56 82 A Q - 0 0 3 -2,-0.3 2,-0.3 59,-0.2 -26,-0.1 -0.400 45.0-105.5 -72.7 147.1 5.3 -19.2 2.0 57 83 A R - 0 0 30 -28,-0.3 16,-3.0 -7,-0.2 2,-0.5 -0.610 36.8-162.2 -70.3 137.4 4.5 -22.2 4.2 58 84 A V E -CD 49 72A 0 -9,-2.6 -9,-1.3 -2,-0.3 2,-0.5 -0.991 2.8-164.0-119.0 124.9 7.2 -22.7 6.8 59 85 A N E -CD 48 71A 0 12,-1.9 12,-3.0 -2,-0.5 2,-0.5 -0.917 7.5-154.9-107.7 136.4 7.5 -26.0 8.6 60 86 A I E +CD 47 70A 0 -13,-2.1 -14,-3.0 -2,-0.5 -13,-1.3 -0.962 23.6 174.7-102.1 120.4 9.5 -26.5 11.9 61 87 A Y E -CD 45 69A 0 8,-2.7 8,-2.1 -2,-0.5 2,-0.4 -0.775 26.7-134.0-112.2 163.4 10.6 -30.1 12.3 62 88 A H E +CD 44 68A 42 -18,-1.9 -18,-2.7 -2,-0.3 6,-0.2 -0.994 28.3 176.1-116.5 137.0 12.8 -31.8 14.9 63 89 A S E > - D 0 67A 0 4,-1.6 4,-1.7 -2,-0.4 -20,-0.1 -0.997 35.7-142.6-139.3 132.7 15.4 -34.3 13.5 64 90 A P T 4 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.953 109.1 37.1 -63.0 -41.7 18.2 -36.3 15.3 65 91 A S T 4 S+ 0 0 22 1,-0.2 -47,-0.0 2,-0.1 -22,-0.0 0.842 129.8 29.0 -76.4 -36.8 20.5 -35.6 12.2 66 92 A L T 4 S- 0 0 0 1,-0.3 74,-0.2 74,-0.1 102,-0.2 0.376 91.0-144.5-108.3 4.9 19.5 -32.0 11.4 67 93 A G E < S-D 63 0A 0 -4,-1.7 -4,-1.6 72,-0.1 2,-0.6 -0.395 72.0 -2.1 74.3-154.8 18.4 -30.5 14.8 68 94 A I E S-De 62 139A 0 70,-2.5 72,-3.1 -6,-0.2 2,-0.6 -0.656 82.7-155.2 -66.2 116.7 15.5 -28.0 14.6 69 95 A A E -De 61 140A 0 -8,-2.1 -8,-2.7 -2,-0.6 2,-0.6 -0.892 11.1-163.1-110.0 121.6 14.8 -27.8 10.8 70 96 A V E -De 60 141A 0 70,-3.2 72,-3.4 -2,-0.6 2,-0.5 -0.887 10.9-168.6-100.2 112.3 13.1 -24.8 9.3 71 97 A A E -De 59 142A 0 -12,-3.0 -12,-1.9 -2,-0.6 2,-0.6 -0.870 5.1-159.2-111.0 132.7 11.7 -25.4 5.8 72 98 A I E -De 58 143A 0 70,-2.6 72,-1.4 -2,-0.5 -14,-0.2 -0.921 13.9-135.5-116.3 119.2 10.6 -22.6 3.5 73 99 A E - 0 0 7 -16,-3.0 -17,-0.1 -2,-0.6 -46,-0.1 -0.294 7.9-156.3 -65.8 153.4 8.2 -23.3 0.6 74 100 A G + 0 0 5 72,-0.2 72,-0.8 -48,-0.1 -1,-0.1 -0.287 31.3 152.3-127.2 48.0 8.9 -21.7 -2.7 75 101 A T - 0 0 20 1,-0.1 2,-1.8 70,-0.1 3,-0.3 -0.192 61.2 -88.5 -71.9 173.4 5.6 -21.6 -4.5 76 102 A N + 0 0 111 1,-0.2 -1,-0.1 -24,-0.1 3,-0.1 -0.486 60.4 151.4 -94.5 70.9 5.1 -18.8 -7.1 77 103 A L S S+ 0 0 57 -2,-1.8 2,-0.3 1,-0.2 -1,-0.2 0.817 88.1 7.9 -59.6 -30.8 3.8 -16.0 -5.0 78 104 A F S S- 0 0 36 -3,-0.3 2,-0.4 10,-0.0 -1,-0.2 -0.932 89.7-109.6-146.5 170.4 5.6 -14.1 -7.9 79 105 A S > - 0 0 45 -2,-0.3 3,-0.6 -3,-0.1 -3,-0.0 -0.819 7.8-154.1-114.8 137.5 7.2 -15.2 -11.0 80 106 A L T 3 S+ 0 0 11 -2,-0.4 -1,-0.1 1,-0.2 4,-0.0 0.586 93.6 49.4 -92.1 -8.8 10.8 -15.2 -11.9 81 107 A N T 3 S+ 0 0 113 126,-0.1 -1,-0.2 2,-0.0 3,-0.1 0.061 89.0 107.0-109.0 24.3 10.6 -14.9 -15.8 82 108 A S S < S- 0 0 56 -3,-0.6 2,-0.5 1,-0.2 -4,-0.0 -0.135 91.8 -41.8 -79.7-170.9 8.2 -12.0 -15.6 83 109 A D > - 0 0 108 1,-0.2 3,-2.7 2,-0.1 6,-0.2 -0.405 49.4-150.4 -70.5 110.3 9.3 -8.4 -16.5 84 110 A L T 3 S+ 0 0 70 -2,-0.5 -1,-0.2 1,-0.3 -2,-0.0 0.433 89.8 73.0 -64.7 0.1 12.7 -7.9 -14.9 85 111 A H T 3 S+ 0 0 149 5,-0.0 -1,-0.3 3,-0.0 -2,-0.1 0.638 73.2 111.7 -79.2 -19.4 11.9 -4.2 -14.6 86 112 A D S X S- 0 0 88 -3,-2.7 3,-2.6 1,-0.1 4,-0.3 -0.257 82.5-114.4 -62.6 145.1 9.4 -4.8 -11.7 87 113 A A G > S+ 0 0 40 1,-0.3 3,-1.6 2,-0.2 23,-0.3 0.774 111.0 74.1 -42.3 -36.0 10.1 -3.6 -8.2 88 114 A K G 3 S+ 0 0 65 1,-0.2 23,-2.6 22,-0.2 24,-0.3 0.785 98.5 45.9 -47.6 -34.3 10.3 -7.3 -7.1 89 115 A F G < S+ 0 0 5 -3,-2.6 -1,-0.2 -6,-0.2 -2,-0.2 0.411 86.8 113.0 -96.0 -1.4 13.7 -7.6 -8.8 90 116 A W < - 0 0 161 -3,-1.6 20,-2.7 -4,-0.3 2,-0.2 -0.449 66.5-121.9 -74.3 145.9 15.4 -4.4 -7.5 91 117 A Q E +J 109 0B 58 18,-0.2 2,-0.3 121,-0.2 18,-0.2 -0.581 38.5 170.0 -79.8 148.6 18.4 -4.5 -5.1 92 118 A E E -J 108 0B 54 16,-1.4 16,-2.6 -2,-0.2 3,-0.1 -0.945 36.4 -84.4-153.2 166.2 17.9 -2.8 -1.8 93 119 A D - 0 0 87 -2,-0.3 14,-0.1 14,-0.2 3,-0.1 -0.288 58.8 -81.8 -69.8 159.9 19.7 -2.5 1.5 94 120 A P - 0 0 9 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 -0.375 58.3 -90.2 -58.4 142.6 19.3 -5.1 4.3 95 121 A N >> - 0 0 38 1,-0.1 4,-1.4 -3,-0.1 3,-1.2 -0.137 38.5-111.5 -41.7 148.2 16.2 -4.6 6.4 96 122 A E T 34 S+ 0 0 165 1,-0.2 4,-0.5 2,-0.2 -1,-0.1 0.774 111.3 74.5 -61.9 -26.3 16.9 -2.5 9.4 97 123 A R T 34 S+ 0 0 97 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.880 120.8 6.6 -57.3 -34.5 16.4 -5.5 11.7 98 124 A Y T X4 S+ 0 0 0 -3,-1.2 3,-1.6 2,-0.1 -1,-0.2 0.303 92.4 107.7-135.4 9.2 19.8 -6.9 10.7 99 125 A I G >< S+ 0 0 64 -4,-1.4 3,-2.1 1,-0.3 -3,-0.1 0.863 74.1 70.6 -55.4 -34.4 21.6 -4.3 8.5 100 126 A Q G 3 S+ 0 0 142 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.805 96.2 54.1 -54.7 -27.8 24.0 -3.6 11.4 101 127 A Y G < S+ 0 0 85 -3,-1.6 -1,-0.3 2,-0.0 -2,-0.2 0.415 95.3 79.3 -89.0 6.8 25.5 -7.1 10.8 102 128 A Y S < S- 0 0 8 -3,-2.1 4,-0.1 -4,-0.1 3,-0.1 -0.822 85.3 -96.4-119.7 153.1 26.4 -6.8 7.1 103 129 A P > - 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