==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 01-FEB-10 3LMV . COMPND 2 MOLECULE: D-TYROSYL-TRNA(TYR) DEACYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR Y.MANICKAM,S.KHAN,T.K.BHATT,A.SHARMA . 880 16 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37115.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 698 79.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 7.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 258 29.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 4 0.5 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 . 112 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 169 19.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.0 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 6 0 1 0 0 5 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 6 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 . 11 3 4 0 4 1 6 0 3 1 0 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 6 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, 0.0 148,-2.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 136.4 -8.4 -11.2 4.6 2 2 A R E -AB 34 148A 46 32,-2.7 32,-3.7 146,-0.2 2,-0.4 -0.952 360.0-177.3-121.8 143.4 -6.3 -8.7 2.7 3 3 A V E -AB 33 147A 1 144,-2.2 144,-1.9 -2,-0.4 2,-0.6 -0.997 17.1-159.5-137.8 136.5 -3.0 -7.1 3.6 4 4 A V E -AB 32 146A 0 28,-2.3 28,-3.0 -2,-0.4 2,-0.5 -0.972 20.8-165.5-107.9 120.3 -0.7 -4.6 2.0 5 5 A I E -AB 31 145A 0 140,-2.9 140,-2.9 -2,-0.6 2,-0.4 -0.932 5.1-172.4-110.3 126.1 2.7 -4.9 3.5 6 6 A Q E -AB 30 144A 0 24,-2.9 24,-2.3 -2,-0.5 2,-0.3 -0.977 22.7-128.6-124.5 131.7 5.3 -2.2 2.9 7 7 A R E -A 29 0A 24 136,-2.2 133,-2.6 -2,-0.4 136,-0.5 -0.551 38.0-178.8 -72.5 130.8 9.0 -2.2 3.8 8 8 A V E -AB 28 139A 0 20,-2.7 20,-2.0 -2,-0.3 131,-0.2 -0.928 43.0-149.1-135.5 153.8 9.9 0.9 5.8 9 9 A K E S- 0 0 63 129,-2.8 2,-0.3 1,-0.4 18,-0.2 0.646 90.9 -28.3 -89.9 -20.3 12.8 2.6 7.4 10 10 A G E - B 0 138A 9 128,-0.8 128,-2.6 18,-0.1 -1,-0.4 -0.933 55.8-152.2-178.2 166.2 10.3 4.0 9.9 11 11 A A E -CB 25 137A 0 14,-2.6 14,-2.5 -2,-0.3 2,-0.5 -0.986 3.0-159.6-149.7 143.5 6.7 5.1 10.4 12 12 A I E -CB 24 136A 15 124,-2.3 124,-2.0 -2,-0.3 2,-0.4 -0.931 11.5-157.4-129.6 111.7 5.1 7.6 12.7 13 13 A L E +CB 23 135A 0 10,-2.2 9,-2.4 -2,-0.5 10,-1.4 -0.726 14.9 177.2 -94.5 131.2 1.4 7.2 13.5 14 14 A S E -CB 21 134A 10 120,-2.6 120,-3.1 -2,-0.4 2,-0.3 -0.934 12.3-162.4-129.4 152.3 -0.7 10.2 14.6 15 15 A V E -CB 20 133A 18 5,-2.5 5,-2.9 -2,-0.3 118,-0.2 -0.878 34.2 -91.4-127.0 163.5 -4.4 10.8 15.5 16 16 A R 0 0 68 116,-0.7 116,-0.0 -2,-0.3 -1,-0.0 -0.431 360.0 360.0 -73.4 147.4 -6.4 14.1 15.8 17 17 A K 0 0 125 -2,-0.1 -1,-0.1 0, 0.0 3,-0.0 0.834 360.0 360.0 -91.4 360.0 -6.7 15.9 19.1 18 ! 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 19 27 A L 0 0 91 0, 0.0 2,-0.4 0, 0.0 -3,-0.2 0.000 360.0 360.0 360.0 144.4 -2.4 15.9 15.6 20 28 A E E -C 15 0A 105 -5,-2.9 -5,-2.5 114,-0.0 2,-0.2 -0.995 360.0-120.0-140.2 136.4 -0.7 13.8 18.2 21 29 A I E +C 14 0A 96 -2,-0.4 -7,-0.3 -7,-0.2 3,-0.1 -0.499 36.3 157.6 -75.5 137.2 1.7 10.8 18.0 22 30 A I E + 0 0 75 -9,-2.4 2,-0.3 1,-0.4 104,-0.2 0.395 64.5 29.5-134.9 -8.6 0.6 7.5 19.5 23 31 A S E +C 13 0A 16 -10,-1.4 -10,-2.2 102,-0.1 -1,-0.4 -0.993 57.3 173.0-155.5 148.8 2.8 5.0 17.7 24 32 A E E -C 12 0A 65 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.965 4.8-178.4-159.2 137.9 6.1 4.7 16.0 25 33 A I E -C 11 0A 4 -14,-2.5 -14,-2.6 -2,-0.3 3,-0.1 -0.960 11.9-155.7-129.6 156.6 8.5 2.2 14.5 26 34 A K S S- 0 0 44 1,-0.4 -18,-0.1 -2,-0.3 -16,-0.1 0.180 73.8 -1.6 -93.0-136.4 11.9 2.3 12.9 27 35 A N S S+ 0 0 53 -18,-0.2 47,-2.3 -17,-0.1 -1,-0.4 -0.238 101.8 74.9 -56.0 138.3 12.9 -0.4 10.4 28 36 A G E S-Ad 8 74A 0 -20,-2.0 -20,-2.7 45,-0.2 2,-0.4 -0.988 78.3 -46.0 155.1-159.1 10.2 -2.9 9.8 29 37 A L E -Ad 7 75A 0 45,-2.2 47,-2.8 -2,-0.3 2,-0.5 -0.846 27.2-153.2-110.8 140.7 6.9 -3.5 8.1 30 38 A I E -Ad 6 76A 0 -24,-2.3 -24,-2.9 -2,-0.4 2,-0.6 -0.969 21.4-162.8-104.2 129.8 3.8 -1.4 7.9 31 39 A C E -Ad 5 77A 2 45,-2.8 47,-3.2 -2,-0.5 2,-0.7 -0.940 12.3-159.0-120.4 111.0 0.8 -3.7 7.4 32 40 A F E -Ad 4 78A 0 -28,-3.0 -28,-2.3 -2,-0.6 2,-0.6 -0.799 22.5-162.1 -86.0 118.0 -2.5 -2.4 6.2 33 41 A L E -Ad 3 79A 5 45,-3.6 47,-3.1 -2,-0.7 2,-0.5 -0.922 13.9-169.5-115.8 118.6 -4.9 -5.1 7.2 34 42 A G E -A 2 0A 0 -32,-3.7 -32,-2.7 -2,-0.6 2,-0.5 -0.926 12.2-150.7-107.3 124.4 -8.4 -5.5 5.8 35 43 A I - 0 0 15 -2,-0.5 64,-2.0 -34,-0.2 2,-0.1 -0.824 14.1-139.3 -97.9 127.9 -10.7 -8.0 7.6 36 44 A H B > -L 98 0B 19 -2,-0.5 3,-1.5 62,-0.2 62,-0.2 -0.440 19.9-115.4 -89.6 156.4 -13.3 -9.7 5.5 37 45 A K T 3 S+ 0 0 77 60,-2.5 61,-0.1 1,-0.3 63,-0.1 0.847 117.0 37.2 -51.3 -40.9 -17.0 -10.5 6.4 38 46 A N T 3 S+ 0 0 117 59,-0.2 2,-0.3 61,-0.1 -1,-0.3 -0.046 84.0 141.8-108.1 29.7 -16.3 -14.3 6.2 39 47 A D < - 0 0 11 -3,-1.5 2,-0.2 4,-0.0 -4,-0.0 -0.567 31.7-161.0 -78.6 133.8 -12.8 -14.4 7.7 40 48 A T >> - 0 0 75 -2,-0.3 4,-1.6 1,-0.1 3,-0.8 -0.598 37.4-101.6 -99.6 168.6 -11.9 -17.3 10.0 41 49 A W H 3> S+ 0 0 100 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.818 123.9 63.0 -59.6 -30.3 -9.0 -17.4 12.5 42 50 A E H 3> S+ 0 0 95 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.872 100.6 53.2 -61.0 -35.6 -7.2 -19.6 9.9 43 51 A D H <> S+ 0 0 23 -3,-0.8 4,-1.7 2,-0.2 -2,-0.2 0.938 111.0 44.9 -62.6 -48.0 -7.3 -16.5 7.7 44 52 A A H X S+ 0 0 0 -4,-1.6 4,-2.7 1,-0.2 5,-0.2 0.903 109.7 55.1 -64.2 -41.1 -5.8 -14.3 10.4 45 53 A L H X S+ 0 0 50 -4,-2.9 4,-2.9 1,-0.2 -1,-0.2 0.932 106.3 53.0 -55.7 -45.1 -3.1 -17.0 11.2 46 54 A Y H X S+ 0 0 64 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.930 110.0 46.2 -58.5 -49.5 -2.0 -16.9 7.6 47 55 A I H X S+ 0 0 3 -4,-1.7 4,-2.6 1,-0.2 5,-0.2 0.948 113.8 48.4 -55.8 -54.6 -1.6 -13.2 7.5 48 56 A I H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.911 111.0 51.7 -54.6 -42.6 0.3 -13.1 10.7 49 57 A R H X S+ 0 0 37 -4,-2.9 4,-1.4 -5,-0.2 -1,-0.2 0.941 112.8 44.4 -61.2 -47.6 2.6 -16.0 9.5 50 58 A K H X S+ 0 0 16 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.841 111.0 52.5 -70.7 -34.6 3.4 -14.2 6.2 51 59 A C H < S+ 0 0 0 -4,-2.6 17,-0.4 1,-0.2 -1,-0.2 0.923 115.5 41.8 -63.4 -42.9 4.0 -10.8 7.9 52 60 A L H < S+ 0 0 0 -4,-2.2 17,-0.8 -5,-0.2 -2,-0.2 0.734 125.0 33.3 -76.8 -20.8 6.5 -12.4 10.3 53 61 A N H < S+ 0 0 36 -4,-1.4 2,-0.2 -5,-0.2 -2,-0.2 0.586 77.3 116.4-121.4 -13.0 8.2 -14.7 7.9 54 62 A L < - 0 0 0 -4,-1.9 2,-1.2 -5,-0.2 14,-0.5 -0.423 63.5-133.0 -58.6 128.0 8.4 -13.1 4.4 55 63 A R E +M 67 0C 77 192,-2.8 12,-0.3 9,-0.2 -1,-0.1 -0.706 46.9 150.1 -91.1 93.3 12.0 -12.5 3.6 56 64 A L E + 0 0 0 -2,-1.2 2,-0.3 10,-0.8 -1,-0.2 0.318 46.0 76.8-111.7 2.4 12.0 -8.9 2.3 57 65 A W E S-M 66 0C 14 9,-2.0 8,-2.7 -3,-0.1 9,-2.2 -0.878 73.4-128.8-113.9 147.2 15.4 -7.7 3.3 58 66 A N E - 0 0 88 -2,-0.3 2,-0.3 6,-0.2 5,-0.3 -0.609 21.7-160.9 -84.1 155.3 18.7 -8.5 1.5 59 67 A N E > -M 62 0C 74 3,-2.9 3,-2.4 -2,-0.2 2,-0.3 -0.869 47.8 -53.3-144.9 120.0 21.6 -9.8 3.5 60 68 A D T 3 S- 0 0 103 -2,-0.3 -2,-0.0 1,-0.3 -1,-0.0 -0.474 127.0 -9.2 61.7-119.8 25.3 -9.8 2.5 61 69 A N T 3 S+ 0 0 110 -2,-0.3 -1,-0.3 -3,-0.1 2,-0.2 0.639 126.2 85.6 -77.1 -14.6 25.5 -11.4 -0.9 62 70 A K E < -M 59 0C 35 -3,-2.4 -3,-2.9 1,-0.0 2,-0.3 -0.571 58.6-156.4-103.0 150.3 21.9 -12.5 -0.7 63 71 A T E S+ 0 0 67 -5,-0.3 -5,-0.2 1,-0.2 -6,-0.1 -0.788 77.1 16.0-116.6 165.0 18.5 -10.9 -1.5 64 72 A W E S+ 0 0 39 -2,-0.3 -1,-0.2 -8,-0.1 -6,-0.2 0.938 96.4 123.2 36.1 58.8 14.9 -11.6 -0.3 65 73 A D E + 0 0 32 -8,-2.7 2,-0.4 -3,-0.3 -7,-0.2 0.757 48.0 54.0-118.8 -43.1 16.8 -13.4 2.4 66 74 A K E -M 57 0C 55 -9,-2.2 -9,-2.0 -4,-0.1 -10,-0.8 -0.811 62.5-149.9-108.0 140.6 15.9 -12.0 5.8 67 75 A N E > -M 55 0C 15 -2,-0.4 4,-1.5 -12,-0.3 6,-0.2 -0.512 38.0 -93.8 -99.1 173.6 12.5 -11.6 7.5 68 76 A V T 4>S+ 0 0 0 -14,-0.5 5,-2.7 -17,-0.4 -15,-0.1 0.786 125.0 47.8 -59.0 -31.5 11.4 -9.0 10.0 69 77 A K T >45S+ 0 0 64 -17,-0.8 3,-2.9 3,-0.2 -1,-0.2 0.941 103.9 59.4 -73.3 -50.2 12.2 -11.2 13.0 70 78 A D T 345S+ 0 0 89 1,-0.3 -2,-0.2 2,-0.1 -1,-0.2 0.851 112.7 40.7 -43.1 -41.0 15.7 -12.2 11.7 71 79 A L T 3<5S- 0 0 45 -4,-1.5 -1,-0.3 3,-0.0 -2,-0.2 0.391 111.1-121.1 -94.6 5.7 16.6 -8.5 11.8 72 80 A N T < 5 + 0 0 102 -3,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.843 61.0 155.3 55.2 35.0 14.8 -7.9 15.1 73 81 A Y < - 0 0 63 -5,-2.7 -45,-0.2 -6,-0.2 2,-0.2 -0.300 36.4-112.1 -87.7 173.1 12.7 -5.3 13.2 74 82 A E E -d 28 0A 29 -47,-2.3 -45,-2.2 -2,-0.1 2,-0.4 -0.541 12.0-139.7-106.6 168.0 9.2 -4.0 14.1 75 83 A L E -de 29 124A 0 48,-2.4 50,-3.0 -47,-0.2 2,-0.7 -0.994 1.8-160.6-128.4 128.2 5.6 -4.1 12.7 76 84 A L E -de 30 125A 0 -47,-2.8 -45,-2.8 -2,-0.4 2,-0.7 -0.930 18.9-158.6-101.8 109.9 3.1 -1.3 12.6 77 85 A I E -de 31 126A 0 48,-3.1 50,-1.1 -2,-0.7 2,-0.5 -0.805 11.7-176.1 -98.5 117.1 -0.3 -3.0 12.2 78 86 A V E -d 32 0A 0 -47,-3.2 -45,-3.6 -2,-0.7 2,-0.2 -0.940 24.4-129.1-122.7 126.9 -3.0 -0.9 10.8 79 87 A S E +d 33 0A 20 -2,-0.5 2,-0.2 -47,-0.2 -45,-0.2 -0.494 30.1 176.2 -70.8 132.8 -6.7 -1.7 10.2 80 88 A Q > + 0 0 8 -47,-3.1 3,-1.6 -2,-0.2 4,-0.1 -0.643 17.7 169.1-147.6 77.8 -7.7 -0.8 6.7 81 89 A F G > S+ 0 0 109 1,-0.3 3,-3.0 -2,-0.2 4,-0.2 0.787 72.1 80.2 -64.8 -25.9 -11.3 -1.7 5.6 82 90 A T G > S+ 0 0 4 1,-0.3 3,-1.7 2,-0.2 220,-0.3 0.677 74.3 77.9 -54.8 -16.4 -10.9 0.4 2.4 83 91 A L G < S+ 0 0 0 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.677 92.5 50.9 -69.7 -15.9 -9.0 -2.6 1.0 84 92 A F G < S+ 0 0 1 -3,-3.0 13,-0.5 -4,-0.1 2,-0.3 0.311 79.7 131.9 -99.2 6.3 -12.4 -4.2 0.5 85 93 A G < - 0 0 6 -3,-1.7 2,-0.5 215,-0.3 217,-0.3 -0.466 52.8-143.9 -55.4 117.3 -13.5 -1.0 -1.3 86 94 A N B +N 94 0D 43 8,-3.4 8,-1.6 -2,-0.3 -2,-0.1 -0.818 31.3 165.7 -92.6 126.0 -15.1 -2.4 -4.5 87 95 A T > + 0 0 8 -2,-0.5 3,-0.7 6,-0.2 -1,-0.1 0.197 47.5 102.6-124.2 8.1 -14.5 -0.2 -7.5 88 96 A K T 3 S+ 0 0 135 1,-0.3 2,-0.4 3,-0.0 -1,-0.1 0.884 87.4 38.1 -62.4 -40.5 -15.6 -2.6 -10.2 89 97 A K T 3 S- 0 0 101 1,-0.1 -1,-0.3 3,-0.1 2,-0.1 -0.478 125.4 -22.3-115.7 61.3 -18.9 -0.9 -10.7 90 98 A G S < S- 0 0 36 -3,-0.7 -1,-0.1 -2,-0.4 120,-0.0 -0.443 72.3 -81.5 122.2 164.8 -18.3 2.8 -10.5 91 99 A N S S+ 0 0 56 -2,-0.1 120,-3.4 119,-0.1 -1,-0.1 0.355 100.8 84.1 -89.8 5.5 -16.0 5.4 -9.1 92 100 A K S S- 0 0 88 118,-0.2 -3,-0.1 -3,-0.1 -6,-0.1 -0.912 81.3-133.6-107.2 107.4 -17.5 5.5 -5.6 93 101 A P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.293 20.2-160.1 -60.2 139.1 -15.8 2.6 -3.6 94 102 A D B -N 86 0D 57 -8,-1.6 -8,-3.4 -10,-0.1 3,-0.2 -0.965 10.8-158.8-122.6 145.7 -18.2 0.5 -1.6 95 103 A F > + 0 0 37 -2,-0.4 3,-1.0 -10,-0.2 -10,-0.1 -0.271 41.5 134.3-119.6 47.1 -17.2 -1.7 1.3 96 104 A H T 3 S+ 0 0 159 1,-0.2 -1,-0.2 -12,-0.2 -11,-0.1 0.782 74.2 57.2 -67.8 -24.9 -19.9 -4.4 1.6 97 105 A L T 3 S+ 0 0 67 -13,-0.5 -60,-2.5 -3,-0.2 2,-0.3 0.673 81.0 106.6 -79.0 -17.2 -17.4 -7.1 2.0 98 106 A A B < S-L 36 0B 18 -3,-1.0 -62,-0.2 -62,-0.2 6,-0.1 -0.488 82.4-110.1 -69.1 124.3 -15.7 -5.5 5.0 99 107 A K - 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