==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-NOV-09 3KOB . COMPND 2 MOLECULE: D-TYROSYL-TRNA(TYR) DEACYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR Y.MANICKAM,T.K.BHATT,A.SHARMA . 912 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38150.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 697 76.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 243 26.6 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 . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 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 . 105 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 18.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 1 0 0 0 0 0 0 0 1 5 0 0 0 1 5 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 0 0 6 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 . 15 1 2 0 4 1 6 0 3 1 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 0 0 0 3 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 M 0 0 2 0, 0.0 147,-2.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 153.1 -8.5 11.2 -4.4 2 2 A R E +AB 33 147A 45 31,-3.2 31,-3.7 145,-0.2 2,-0.4 -0.976 360.0 176.9-136.1 130.0 -6.3 8.5 -2.9 3 3 A V E -AB 32 146A 2 143,-2.2 143,-2.0 -2,-0.4 2,-0.5 -0.996 16.3-165.1-138.4 137.5 -2.9 7.1 -3.6 4 4 A V E -AB 31 145A 0 27,-1.8 27,-3.2 -2,-0.4 2,-0.6 -0.991 16.9-164.7-115.0 127.8 -0.6 4.6 -2.1 5 5 A I E -AB 30 144A 1 139,-2.3 139,-1.6 -2,-0.5 2,-0.5 -0.962 5.4-173.9-120.7 112.7 2.8 4.9 -3.6 6 6 A Q E -AB 29 143A 0 23,-2.8 23,-3.2 -2,-0.6 2,-0.3 -0.971 22.9-130.1-116.7 128.9 5.2 2.1 -3.0 7 7 A R E -A 28 0A 17 135,-1.9 132,-2.1 -2,-0.5 135,-0.4 -0.560 36.4-172.2 -75.9 133.0 8.7 2.3 -4.0 8 8 A V E -AB 27 138A 0 19,-2.7 19,-2.2 -2,-0.3 130,-0.2 -0.957 44.3-147.8-138.8 144.8 9.7 -0.8 -6.0 9 9 A K E S- 0 0 63 128,-2.1 2,-0.3 -2,-0.3 129,-0.1 0.716 92.2 -39.3 -69.2 -24.8 12.7 -2.7 -7.6 10 10 A G E - B 0 137A 5 127,-0.6 127,-1.7 17,-0.1 -1,-0.3 -0.933 56.1-141.1 170.8 167.3 10.1 -3.8 -10.2 11 11 A A E -CB 24 136A 0 13,-2.8 13,-2.0 -2,-0.3 2,-0.5 -0.986 2.0-162.3-156.4 144.9 6.5 -4.9 -10.8 12 12 A I E -CB 23 135A 47 123,-1.5 123,-1.7 -2,-0.3 2,-0.3 -0.928 13.2-157.7-137.5 106.2 4.7 -7.4 -13.0 13 13 A L E -CB 22 134A 0 9,-1.8 8,-2.6 -2,-0.5 9,-1.8 -0.678 13.6-174.0 -93.2 140.8 0.9 -7.1 -13.4 14 14 A S E -CB 20 133A 8 119,-1.3 119,-2.3 -2,-0.3 6,-0.2 -0.990 12.7-167.3-142.4 139.8 -1.2 -10.0 -14.5 15 15 A V E C 19 0A 14 4,-2.1 4,-2.8 -2,-0.3 117,-0.1 -0.496 360.0 360.0-111.6-177.4 -4.8 -10.8 -15.5 16 16 A R 0 0 218 115,-0.3 -1,-0.1 2,-0.3 114,-0.0 -0.211 360.0 360.0-107.0 360.0 -6.7 -14.2 -15.9 17 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 18 27 A L 0 0 136 0, 0.0 2,-0.4 0, 0.0 -2,-0.3 0.000 360.0 360.0 360.0 130.6 -2.7 -15.9 -15.6 19 28 A E E -C 15 0A 120 -4,-2.8 -4,-2.1 0, 0.0 2,-0.4 -0.952 360.0-132.3-137.4 128.4 -0.9 -13.4 -17.9 20 29 A I E +C 14 0A 108 -2,-0.4 -6,-0.3 -6,-0.2 3,-0.1 -0.471 36.6 155.2 -55.8 114.4 1.7 -10.7 -17.5 21 30 A I E + 0 0 88 -8,-2.6 2,-0.4 -2,-0.4 -7,-0.2 0.485 60.6 47.1-118.8 -8.5 0.5 -7.6 -19.4 22 31 A S E +C 13 0A 12 -9,-1.8 -9,-1.8 102,-0.1 2,-0.3 -0.983 56.5 167.0-137.1 148.4 2.5 -5.0 -17.4 23 32 A E E +C 12 0A 84 -2,-0.4 2,-0.3 -11,-0.2 -11,-0.2 -0.987 9.3 172.0-156.1 137.4 5.9 -4.5 -16.2 24 33 A I E -C 11 0A 0 -13,-2.0 -13,-2.8 -2,-0.3 3,-0.1 -0.965 15.5-156.9-131.9 147.5 8.2 -1.9 -14.7 25 34 A K S S+ 0 0 104 1,-0.4 -17,-0.1 -2,-0.3 -1,-0.1 0.215 74.9 2.5 -86.5-133.0 11.7 -2.5 -13.4 26 35 A N S S+ 0 0 45 -16,-0.1 47,-1.5 -2,-0.1 -1,-0.4 -0.197 102.4 74.4 -56.4 139.0 12.8 0.2 -10.9 27 36 A G E S-Ad 8 73A 0 -19,-2.2 -19,-2.7 45,-0.2 2,-0.4 -0.986 77.1 -45.2 161.7-147.0 10.2 2.8 -10.1 28 37 A L E -Ad 7 74A 0 45,-1.6 47,-2.8 -2,-0.3 2,-0.4 -0.959 31.0-148.0-124.4 137.6 6.9 3.5 -8.2 29 38 A I E -Ad 6 75A 0 -23,-3.2 -23,-2.8 -2,-0.4 2,-0.5 -0.894 19.2-161.1-104.5 139.8 3.7 1.5 -7.9 30 39 A C E -Ad 5 76A 2 45,-3.1 47,-3.0 -2,-0.4 2,-0.7 -0.944 13.4-161.9-135.6 107.8 0.7 3.6 -7.5 31 40 A F E -Ad 4 77A 0 -27,-3.2 -27,-1.8 -2,-0.5 2,-0.7 -0.836 21.2-160.8 -92.3 113.7 -2.6 2.5 -6.2 32 41 A L E -Ad 3 78A 4 45,-3.4 47,-2.6 -2,-0.7 2,-0.4 -0.850 12.5-175.7-113.9 105.5 -5.1 5.0 -7.3 33 42 A G E -A 2 0A 0 -31,-3.7 -31,-3.2 -2,-0.7 2,-0.5 -0.786 12.0-153.2 -98.1 141.1 -8.5 5.5 -5.6 34 43 A I - 0 0 11 -2,-0.4 64,-2.7 -33,-0.2 73,-0.1 -0.888 6.1-144.7-126.3 99.2 -10.9 8.0 -7.1 35 44 A H B > -L 97 0B 24 -2,-0.5 3,-1.2 62,-0.2 62,-0.2 -0.104 26.1-116.3 -50.8 151.8 -13.6 9.6 -4.9 36 45 A K T 3 S+ 0 0 108 60,-1.6 -1,-0.1 1,-0.2 61,-0.1 0.670 115.4 47.0 -66.3 -19.2 -17.1 10.3 -6.5 37 46 A N T 3 S+ 0 0 98 59,-0.3 -1,-0.2 2,-0.1 2,-0.2 -0.008 77.7 134.7-115.0 24.3 -16.4 14.1 -6.0 38 47 A D < - 0 0 9 -3,-1.2 2,-0.3 3,-0.0 -4,-0.0 -0.568 40.7-154.8 -70.1 137.5 -12.9 14.3 -7.3 39 48 A T >> - 0 0 81 -2,-0.2 3,-2.8 1,-0.1 4,-0.9 -0.837 36.5 -97.9-107.6 154.2 -12.5 17.3 -9.6 40 49 A W H >> S+ 0 0 28 -2,-0.3 4,-1.4 1,-0.3 3,-1.2 0.841 123.1 66.3 -40.7 -47.2 -9.7 17.3 -12.3 41 50 A E H 3> S+ 0 0 102 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.826 95.0 57.5 -39.0 -43.2 -7.6 19.3 -9.9 42 51 A D H <> S+ 0 0 22 -3,-2.8 4,-1.9 1,-0.2 -1,-0.3 0.927 105.3 50.4 -57.7 -43.4 -7.5 16.3 -7.6 43 52 A A H - 0 0 0 -2,-0.3 4,-1.5 -12,-0.2 6,-0.2 -0.393 38.6 -84.1-103.6 179.9 12.4 11.6 -7.7 67 76 A V T >4>S+ 0 0 0 -14,-0.7 5,-1.8 -16,-0.6 3,-0.6 0.948 125.6 53.0 -51.2 -53.1 11.1 9.1 -10.4 68 77 A K G >45S+ 0 0 0 -17,-0.7 3,-3.2 1,-0.3 -1,-0.2 0.917 105.3 52.9 -52.1 -61.9 11.8 11.4 -13.3 69 78 A D G 345S+ 0 0 20 1,-0.3 -1,-0.3 2,-0.1 -2,-0.2 0.812 110.5 47.4 -34.6 -48.8 15.4 12.2 -12.4 70 79 A L G <<5S- 0 0 48 -4,-1.5 -1,-0.3 -3,-0.6 -2,-0.2 0.409 110.8-121.2 -87.3 9.0 16.3 8.5 -12.2 71 80 A N T < 5 + 0 0 67 -3,-3.2 2,-0.2 -4,-0.3 -3,-0.2 0.823 59.8 158.1 55.9 36.2 14.5 7.8 -15.5 72 81 A Y < - 0 0 60 -5,-1.8 -45,-0.2 -6,-0.2 -1,-0.2 -0.574 36.4-120.9 -94.6 153.9 12.3 5.3 -13.7 73 82 A E E -d 27 0A 42 -47,-1.5 -45,-1.6 -2,-0.2 2,-0.3 -0.154 15.0-140.1 -83.6 177.8 8.8 3.9 -14.6 74 83 A L E -de 28 123A 0 48,-0.7 50,-3.5 -47,-0.2 2,-0.8 -0.992 0.7-151.6-141.7 129.9 5.4 4.0 -12.8 75 84 A L E -de 29 124A 0 -47,-2.8 -45,-3.1 -2,-0.3 2,-0.7 -0.878 15.9-164.8-105.6 105.9 2.8 1.3 -12.5 76 85 A I E +d 30 0A 1 48,-3.4 50,-0.5 -2,-0.8 2,-0.4 -0.803 10.3 178.0 -94.4 115.7 -0.6 3.0 -12.1 77 86 A V E -d 31 0A 0 -47,-3.0 -45,-3.4 -2,-0.7 2,-0.3 -0.975 29.1-124.3-116.8 131.9 -3.3 0.6 -10.8 78 87 A S E -d 32 0A 22 -2,-0.4 -45,-0.2 -47,-0.2 2,-0.2 -0.570 32.1-179.2 -71.5 134.0 -6.8 1.7 -10.1 79 88 A Q > + 0 0 7 -47,-2.6 3,-1.5 -2,-0.3 4,-0.1 -0.592 21.9 167.7-145.4 85.0 -7.9 0.9 -6.5 80 89 A F G > S+ 0 0 83 1,-0.3 3,-3.4 -2,-0.2 -1,-0.1 0.713 71.0 83.2 -68.1 -21.8 -11.4 1.7 -5.1 81 90 A T G > S+ 0 0 0 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.643 75.2 77.0 -60.7 -10.6 -10.8 -0.5 -2.0 82 91 A L G < S+ 0 0 0 -3,-1.5 -1,-0.3 1,-0.3 215,-0.3 0.752 90.0 52.9 -71.8 -24.7 -9.1 2.7 -0.8 83 92 A F G < S+ 0 0 9 -3,-3.4 13,-0.3 -4,-0.1 -1,-0.3 0.192 79.9 138.2 -95.0 16.4 -12.5 4.1 -0.1 84 93 A G < - 0 0 7 -3,-1.4 2,-0.6 211,-0.3 10,-0.2 -0.423 51.3-140.4 -48.1 122.5 -13.2 1.0 1.8 85 94 A N B +N 93 0D 42 8,-1.4 8,-0.9 -2,-0.1 4,-0.3 -0.896 25.7 176.8 -95.7 121.7 -15.0 2.2 4.8 86 95 A T + 0 0 9 -2,-0.6 -1,-0.1 211,-0.2 -2,-0.1 -0.166 62.3 81.6-113.8 36.1 -13.9 0.4 8.0 87 96 A K S S+ 0 0 120 216,-0.0 -1,-0.1 3,-0.0 3,-0.1 0.682 87.4 53.2-112.9 -30.8 -16.0 2.3 10.5 88 97 A K S S- 0 0 44 1,-0.2 2,-0.2 -3,-0.1 -2,-0.1 0.949 119.4 -67.1 -57.2 -87.7 -19.3 0.5 10.1 89 98 A G - 0 0 5 2,-0.8 -1,-0.2 -4,-0.3 4,-0.1 -0.650 62.6 -52.7-151.2-157.5 -17.9 -3.0 10.6 90 99 A N S S+ 0 0 27 -2,-0.2 116,-2.3 115,-0.1 399,-0.1 0.735 114.4 71.8 -72.4 -20.5 -15.8 -5.9 9.5 91 100 A K S S- 0 0 92 114,-0.2 -2,-0.8 116,-0.0 2,-0.5 -0.844 86.4-137.5 -87.7 131.8 -17.4 -5.8 6.1 92 101 A P - 0 0 4 0, 0.0 2,-0.5 0, 0.0 -6,-0.2 -0.830 8.9-152.7 -94.3 126.2 -16.2 -2.7 4.2 93 102 A D B -N 85 0D 61 -8,-0.9 -8,-1.4 -2,-0.5 3,-0.3 -0.855 2.7-163.3 -95.9 132.3 -18.7 -0.6 2.2 94 103 A F > + 0 0 40 -2,-0.5 3,-2.3 -10,-0.2 -10,-0.1 0.072 44.4 130.5-103.1 20.5 -17.1 1.3 -0.8 95 104 A H T 3 + 0 0 148 1,-0.3 -1,-0.2 -10,-0.1 -11,-0.1 0.868 63.1 64.0 -39.2 -56.6 -19.9 3.8 -1.3 96 105 A L T 3 S+ 0 0 93 -13,-0.3 -60,-1.6 -3,-0.3 -59,-0.3 0.456 83.0 97.9 -60.8 -2.2 -17.7 6.8 -1.3 97 106 A A B < S-L 35 0B 18 -3,-2.3 -62,-0.2 -62,-0.2 2,-0.1 -0.604 85.2 -98.3 -86.9 149.6 -15.8 5.7 -4.5 98 107 A K - 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