==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-AUG-03 1Q7L . COMPND 2 MOLECULE: AMINOACYLASE-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.A.LINDNER,V.V.LUNIN,A.ALARY,R.HECKER,M.CYGLER,R.MENARD . 557 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21782.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 398 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 9.0 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 . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 1 0.2 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 . 46 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 143 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.5 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 0 0 2 0 0 2 0 2 0 0 2 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 2 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 . 2 0 4 0 2 0 2 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 2 0 0 0 0 2 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 7 A E 0 0 186 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 145.7 25.8 40.1 24.1 2 8 A E + 0 0 195 3,-0.0 2,-0.3 2,-0.0 0, 0.0 -0.579 360.0 145.1 -71.4 128.0 22.7 41.3 22.1 3 9 A E - 0 0 36 -2,-0.3 5,-0.0 0, 0.0 0, 0.0 -0.949 57.2 -93.2-163.0 145.3 20.2 38.4 21.8 4 10 A H >> - 0 0 78 -2,-0.3 4,-2.1 1,-0.1 3,-0.9 -0.457 37.9-129.3 -64.8 133.2 16.5 37.9 21.8 5 11 A P H 3> S+ 0 0 85 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.812 107.3 58.5 -61.4 -27.4 15.4 37.2 25.4 6 12 A S H 3> S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.877 107.7 47.1 -63.9 -40.2 13.4 34.1 24.3 7 13 A V H <> S+ 0 0 0 -3,-0.9 4,-2.9 2,-0.2 5,-0.2 0.906 109.4 53.7 -64.5 -43.5 16.6 32.7 22.9 8 14 A T H X S+ 0 0 65 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.939 110.3 46.8 -58.2 -41.6 18.5 33.6 26.1 9 15 A L H X S+ 0 0 31 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.899 111.0 52.4 -65.1 -42.6 15.9 31.7 28.2 10 16 A F H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.932 110.3 47.5 -57.0 -48.3 16.0 28.7 25.8 11 17 A R H X S+ 0 0 20 -4,-2.9 4,-1.1 1,-0.2 -2,-0.2 0.888 109.5 54.1 -65.7 -39.0 19.8 28.6 26.2 12 18 A Q H >< S+ 0 0 100 -4,-2.4 3,-0.7 -5,-0.2 4,-0.5 0.943 111.3 44.7 -54.8 -49.3 19.6 28.9 30.0 13 19 A Y H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.900 107.3 59.2 -70.7 -33.2 17.2 25.9 30.1 14 20 A L H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 78,-0.2 0.783 100.1 58.9 -59.7 -26.8 19.4 23.9 27.7 15 21 A R T << S+ 0 0 110 -4,-1.1 2,-0.5 -3,-0.7 -1,-0.3 0.615 79.3 99.1 -83.1 -10.0 22.3 24.2 30.2 16 22 A I S < S- 0 0 26 -3,-1.4 2,-2.3 -4,-0.5 9,-0.0 -0.681 80.5-131.3 -78.4 123.8 20.3 22.5 32.9 17 23 A R + 0 0 130 -2,-0.5 7,-2.1 1,-0.2 2,-0.8 -0.380 46.8 154.4 -85.6 71.8 21.6 18.9 32.8 18 24 A T + 0 0 0 -2,-2.3 59,-2.1 5,-0.3 2,-0.4 -0.144 28.9 147.5 -85.9 41.5 18.4 16.9 32.8 19 25 A V B > -a 77 0A 22 -2,-0.8 3,-0.7 3,-0.3 59,-0.2 -0.641 44.3 -87.6 -85.4 134.3 20.2 14.1 31.1 20 26 A Q T 3 S+ 0 0 13 57,-2.6 450,-0.1 -2,-0.4 -1,-0.1 -0.359 101.1 37.4 -64.3 155.2 19.4 10.4 31.7 21 27 A P T 3 S+ 0 0 52 0, 0.0 -1,-0.3 0, 0.0 57,-0.0 -0.998 137.6 12.6 -88.4 -3.4 20.0 8.2 33.5 22 28 A K S < S- 0 0 195 -3,-0.7 -3,-0.3 2,-0.0 -2,-0.2 -0.629 81.4-166.9-130.0 74.0 20.2 10.7 36.5 23 29 A P - 0 0 19 0, 0.0 2,-2.2 0, 0.0 -5,-0.3 -0.277 31.1-117.5 -61.4 149.3 18.7 14.0 35.3 24 30 A D > + 0 0 83 -7,-2.1 4,-1.6 1,-0.2 3,-0.2 -0.485 53.5 156.9 -82.6 69.7 19.1 17.2 37.4 25 31 A Y H > + 0 0 25 -2,-2.2 4,-3.1 1,-0.2 5,-0.3 0.845 63.4 64.4 -67.1 -32.2 15.4 17.3 37.9 26 32 A G H > S+ 0 0 55 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.916 105.0 45.6 -58.3 -42.6 15.8 19.4 41.1 27 33 A A H > S+ 0 0 34 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.880 112.6 50.5 -69.9 -35.5 17.3 22.3 39.0 28 34 A A H X S+ 0 0 2 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.945 110.9 48.3 -66.6 -46.4 14.6 21.9 36.3 29 35 A V H X S+ 0 0 19 -4,-3.1 4,-2.7 1,-0.2 5,-0.2 0.934 111.8 50.6 -58.9 -43.1 11.7 22.1 38.9 30 36 A A H X S+ 0 0 50 -4,-2.3 4,-2.4 -5,-0.3 -1,-0.2 0.889 108.6 52.1 -62.3 -39.3 13.4 25.1 40.5 31 37 A F H X S+ 0 0 15 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.914 112.1 45.3 -62.2 -44.3 13.6 26.8 37.1 32 38 A F H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.880 111.7 52.1 -68.9 -36.8 9.9 26.3 36.4 33 39 A E H X S+ 0 0 73 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.904 112.7 45.0 -61.7 -45.9 8.9 27.5 39.9 34 40 A E H X S+ 0 0 74 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.903 112.3 51.9 -68.4 -37.3 10.9 30.7 39.5 35 41 A T H X S+ 0 0 13 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.919 107.9 52.1 -62.2 -43.2 9.5 31.1 36.0 36 42 A A H X>S+ 0 0 2 -4,-2.5 5,-2.7 1,-0.2 4,-1.2 0.906 110.3 48.8 -58.4 -42.6 6.0 30.7 37.4 37 43 A R H ><5S+ 0 0 170 -4,-2.0 3,-0.6 1,-0.2 -2,-0.2 0.951 113.1 46.7 -66.6 -45.2 6.7 33.4 40.0 38 44 A Q H 3<5S+ 0 0 132 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.898 117.7 42.4 -61.5 -35.3 8.1 35.8 37.3 39 45 A L H 3<5S- 0 0 24 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.571 110.6-118.9 -90.1 -7.9 5.2 35.2 34.9 40 46 A G T <<5 + 0 0 50 -4,-1.2 2,-0.3 -3,-0.6 -3,-0.2 0.930 63.4 146.3 64.1 49.5 2.5 35.4 37.7 41 47 A L < - 0 0 15 -5,-2.7 -1,-0.2 -6,-0.1 18,-0.2 -0.878 54.0-109.3-112.7 149.2 1.4 31.8 37.0 42 48 A G E -B 58 0B 41 16,-2.1 16,-2.1 -2,-0.3 2,-0.4 -0.423 34.6-153.8 -75.1 151.0 0.1 29.4 39.6 43 49 A C E +B 57 0B 57 14,-0.2 2,-0.4 -2,-0.1 14,-0.2 -0.995 16.0 178.7-133.6 125.3 2.5 26.5 40.3 44 50 A Q E -B 56 0B 82 12,-2.2 12,-2.9 -2,-0.4 2,-0.5 -0.998 12.7-157.0-126.5 131.8 1.7 23.0 41.6 45 51 A K E -B 55 0B 109 -2,-0.4 2,-0.5 10,-0.2 10,-0.2 -0.954 8.3-170.4-105.3 127.2 4.4 20.3 42.2 46 52 A V E -B 54 0B 2 8,-3.0 8,-3.2 -2,-0.5 2,-1.3 -0.952 10.7-155.5-123.9 109.7 3.0 16.8 42.1 47 53 A E E +B 53 0B 106 -2,-0.5 6,-0.3 6,-0.3 -2,-0.0 -0.682 16.6 176.2 -91.9 89.7 5.6 14.2 43.3 48 54 A V E S+ 0 0 16 4,-1.5 -1,-0.2 -2,-1.3 5,-0.1 0.731 72.3 5.4 -69.2 -25.6 4.2 11.1 41.5 49 55 A A E > S-B 52 0B 13 3,-0.9 3,-2.8 98,-0.2 2,-0.2 -0.947 104.7 -74.8-151.6 152.4 7.1 8.9 42.6 50 56 A P T 3 S+ 0 0 118 0, 0.0 3,-0.0 0, 0.0 -2,-0.0 -0.370 124.3 11.8 -62.1 121.3 10.0 9.7 45.0 51 57 A G T 3 S+ 0 0 45 -2,-0.2 2,-0.5 1,-0.1 -26,-0.1 0.411 107.4 100.6 95.4 1.7 12.3 11.9 43.1 52 58 A Y E < +B 49 0B 56 -3,-2.8 -4,-1.5 87,-0.1 -3,-0.9 -0.835 48.4 178.1-127.8 89.4 9.8 12.5 40.2 53 59 A V E -B 47 0B 32 -2,-0.5 2,-0.5 -6,-0.3 -6,-0.3 -0.812 16.6-155.3 -98.5 123.9 8.0 15.8 40.4 54 60 A V E -B 46 0B 0 -8,-3.2 -8,-3.0 -2,-0.5 2,-0.5 -0.844 14.8-152.3 -87.9 132.1 5.6 16.9 37.8 55 61 A T E -BC 45 137B 2 82,-2.3 82,-2.7 -2,-0.5 2,-0.5 -0.925 9.1-167.5-111.1 128.3 5.3 20.7 37.7 56 62 A V E -BC 44 136B 0 -12,-2.9 -12,-2.2 -2,-0.5 2,-0.5 -0.962 2.6-166.6-116.7 124.8 2.1 22.3 36.5 57 63 A L E -BC 43 135B 0 78,-2.9 78,-3.2 -2,-0.5 2,-0.4 -0.915 15.8-158.4-107.3 133.2 2.0 26.1 35.7 58 64 A T E -BC 42 134B 28 -16,-2.1 -16,-2.1 -2,-0.5 76,-0.2 -0.922 24.8-175.1-126.3 132.1 -1.5 27.5 35.3 59 65 A W E - C 0 133B 13 74,-3.1 74,-2.1 -2,-0.4 -18,-0.1 -0.916 32.3-139.4-117.0 94.3 -3.0 30.6 33.6 60 66 A P - 0 0 71 0, 0.0 69,-0.1 0, 0.0 72,-0.1 -0.368 15.0-136.0 -60.7 138.0 -6.7 30.5 34.6 61 67 A G - 0 0 6 69,-0.2 70,-0.2 5,-0.1 71,-0.2 -0.148 24.1-104.8 -80.2 176.0 -9.2 31.4 31.8 62 68 A T S S+ 0 0 84 67,-2.4 69,-0.1 1,-0.3 3,-0.1 0.649 119.9 43.2 -79.5 -14.4 -12.2 33.7 32.1 63 69 A N S > S+ 0 0 65 67,-2.6 3,-2.0 66,-0.3 69,-0.3 -0.747 72.0 176.4-124.6 79.6 -14.6 30.7 32.1 64 70 A P T 3 S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 68,-0.1 0.598 71.8 68.7 -71.8 -4.9 -12.8 28.3 34.5 65 71 A T T 3 S+ 0 0 96 -3,-0.1 2,-0.1 2,-0.1 3,-0.1 0.636 81.7 91.2 -84.8 -15.1 -15.5 25.7 34.4 66 72 A L S < S- 0 0 12 -3,-2.0 66,-0.4 64,-0.3 -5,-0.1 -0.421 95.0 -92.5 -65.7 153.0 -14.7 24.9 30.6 67 73 A S - 0 0 15 96,-0.1 96,-0.2 1,-0.1 95,-0.1 -0.292 51.2-114.8 -67.5 154.5 -12.2 22.1 30.2 68 74 A S E -d 163 0B 2 94,-2.3 96,-3.2 93,-0.5 97,-1.5 -0.415 8.1-116.7 -96.5 166.5 -8.6 23.3 29.9 69 75 A I E -de 165 133B 1 63,-2.8 65,-2.9 95,-0.2 2,-0.5 -0.890 27.5-153.4 -97.0 123.3 -5.8 23.3 27.3 70 76 A L E -de 166 134B 1 95,-3.2 97,-2.6 -2,-0.5 2,-0.7 -0.900 9.8-168.9-100.1 125.5 -2.8 21.3 28.3 71 77 A L E -de 167 135B 0 63,-2.9 65,-1.7 -2,-0.5 2,-0.3 -0.933 26.4-175.6-108.9 97.2 0.6 22.3 26.9 72 78 A N E + e 0 136B 0 95,-2.8 2,-0.3 -2,-0.7 65,-0.2 -0.718 14.8 156.9-105.5 152.7 2.7 19.3 27.9 73 79 A S E - 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