==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 07-APR-08 3CRM . COMPND 2 MOLECULE: TRNA DELTA(2)-ISOPENTENYLPYROPHOSPHATE . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR R.H.HUANG,W.XIE,C.ZHOU . 236 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11642.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 14 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 40.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.1 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 1 0 2 1 0 2 0 0 0 0 0 2 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 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 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A S 0 0 170 0, 0.0 115,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 123.8 69.1 43.3 41.6 2 4 A L - 0 0 92 1,-0.1 113,-0.2 113,-0.1 114,-0.2 -0.725 360.0-110.4 -92.2 136.5 69.1 40.5 39.1 3 5 A P - 0 0 43 0, 0.0 113,-2.6 0, 0.0 -1,-0.1 -0.220 42.7 -95.1 -61.1 154.1 67.3 41.0 35.7 4 6 A P E +a 116 0A 43 0, 0.0 2,-0.3 0, 0.0 113,-0.2 -0.296 42.6 170.9 -73.1 154.0 64.1 39.0 35.1 5 7 A A E -a 117 0A 0 111,-1.5 113,-2.4 89,-0.2 2,-0.4 -0.966 17.7-148.3-159.2 146.4 63.8 35.7 33.2 6 8 A I E -ab 118 96A 3 89,-2.9 91,-2.8 -2,-0.3 2,-0.5 -0.979 1.7-159.2-125.1 134.7 61.0 33.1 32.8 7 9 A F E -ab 119 97A 0 111,-2.7 113,-3.4 -2,-0.4 2,-0.5 -0.952 7.6-173.5-109.2 129.2 61.3 29.3 32.3 8 10 A L E +ab 120 98A 0 89,-3.5 91,-1.8 -2,-0.5 113,-0.2 -0.867 21.2 160.6-126.1 95.2 58.3 27.7 30.7 9 11 A M E +ab 121 99A 0 111,-2.8 113,-2.0 -2,-0.5 91,-0.2 -0.621 4.5 132.5-113.3 172.2 58.8 23.9 30.8 10 12 A G - 0 0 0 89,-0.8 113,-0.1 111,-0.2 3,-0.1 -0.886 52.8 -62.2 162.8 167.6 56.6 20.8 30.5 11 13 A P > - 0 0 0 0, 0.0 3,-1.8 0, 0.0 5,-0.2 -0.220 69.8 -73.4 -70.7 165.0 56.3 17.4 28.8 12 14 A T T 3 S+ 0 0 23 1,-0.3 122,-0.1 183,-0.2 187,-0.0 -0.319 119.5 16.5 -59.9 135.9 56.0 17.0 25.1 13 15 A A T 3 S+ 0 0 24 -3,-0.1 -1,-0.3 35,-0.1 110,-0.0 0.495 84.8 124.7 78.5 8.3 52.6 17.9 23.7 14 16 A A S < S- 0 0 6 -3,-1.8 -2,-0.1 108,-0.1 -1,-0.1 0.643 82.5-109.8 -72.4 -15.2 51.7 19.9 26.8 15 17 A G > + 0 0 29 -4,-0.2 4,-1.0 -5,-0.1 3,-0.3 0.835 62.7 152.9 89.5 36.2 50.9 23.1 24.8 16 18 A K H > + 0 0 29 -5,-0.2 4,-2.0 1,-0.2 3,-0.2 0.873 67.2 58.4 -64.9 -40.7 53.9 25.2 26.0 17 19 A T H > S+ 0 0 40 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.816 100.0 58.2 -61.9 -32.0 54.1 27.3 22.8 18 20 A D H > S+ 0 0 120 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.916 110.2 41.7 -65.1 -43.6 50.5 28.5 23.2 19 21 A L H X S+ 0 0 10 -4,-1.0 4,-2.4 -3,-0.2 -2,-0.2 0.849 110.6 58.1 -72.1 -33.5 51.2 30.0 26.7 20 22 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.902 106.5 48.6 -62.1 -41.2 54.5 31.4 25.4 21 23 A M H X S+ 0 0 34 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.912 109.5 51.7 -65.7 -42.3 52.7 33.3 22.8 22 24 A A H X S+ 0 0 33 -4,-1.6 4,-0.8 1,-0.2 -2,-0.2 0.914 112.5 46.4 -60.4 -43.2 50.2 34.7 25.3 23 25 A L H >X S+ 0 0 3 -4,-2.4 4,-2.7 1,-0.2 3,-0.8 0.911 109.4 54.0 -65.5 -42.0 53.1 35.8 27.5 24 26 A A H 3< S+ 0 0 26 -4,-2.5 5,-0.4 1,-0.3 -1,-0.2 0.798 108.9 49.4 -63.3 -29.5 54.9 37.4 24.5 25 27 A D H 3< S+ 0 0 112 -4,-1.7 -1,-0.3 1,-0.1 -2,-0.2 0.640 116.0 43.4 -83.8 -15.2 51.8 39.4 23.7 26 28 A A H << S+ 0 0 49 -3,-0.8 -2,-0.2 -4,-0.8 -3,-0.1 0.755 122.8 23.8 -99.1 -31.1 51.5 40.6 27.3 27 29 A L S < S- 0 0 29 -4,-2.7 2,-1.3 -5,-0.1 -1,-0.2 -0.933 90.3 -95.4-134.3 156.4 55.1 41.4 28.1 28 30 A P + 0 0 78 0, 0.0 66,-3.2 0, 0.0 2,-0.2 -0.588 63.1 169.6 -73.9 98.0 58.2 42.3 26.1 29 31 A C E -c 94 0A 21 -2,-1.3 2,-0.5 -5,-0.4 64,-0.0 -0.683 38.3-146.9-112.9 165.2 59.7 38.9 25.8 30 32 A E E -c 95 0A 14 64,-2.1 66,-2.7 -2,-0.2 2,-0.3 -0.946 26.6-139.3-129.5 104.8 62.5 37.1 23.9 31 33 A L E -cd 96 60A 6 28,-0.6 30,-2.9 -2,-0.5 2,-0.4 -0.516 21.6-176.4 -71.7 127.3 61.6 33.5 23.1 32 34 A I E -cd 97 61A 0 64,-2.5 66,-2.3 -2,-0.3 2,-0.3 -0.989 19.5-135.4-127.9 120.7 64.4 31.1 23.6 33 35 A S E -c 98 0A 4 28,-2.9 2,-0.5 -2,-0.4 66,-0.2 -0.579 12.6-167.7 -80.1 135.3 63.9 27.4 22.7 34 36 A V E +c 99 0A 0 64,-2.4 67,-1.8 -2,-0.3 66,-0.6 -0.766 46.0 119.2-120.0 78.3 65.2 24.8 25.2 35 37 A D > - 0 0 34 -2,-0.5 4,-0.7 27,-0.2 -2,-0.1 -0.932 54.8-152.1-150.5 121.3 64.9 21.7 23.0 36 38 A S T 4 S+ 0 0 56 -2,-0.3 132,-0.1 1,-0.2 -1,-0.1 0.588 100.5 43.7 -68.2 -11.2 67.7 19.3 21.8 37 39 A A T >4 S+ 0 0 13 2,-0.1 3,-1.6 10,-0.1 -1,-0.2 0.794 101.2 62.0-102.2 -39.3 65.6 18.4 18.7 38 40 A L T 34 S+ 0 0 18 1,-0.3 26,-2.0 9,-0.1 -2,-0.1 0.639 87.5 76.3 -64.6 -14.7 64.3 21.8 17.5 39 41 A I T 3< S+ 0 0 3 -4,-0.7 27,-2.3 24,-0.3 26,-1.3 0.758 79.3 93.4 -67.2 -22.0 67.9 23.0 16.9 40 42 A Y B X S-f 66 0B 6 -3,-1.6 3,-1.3 24,-0.2 27,-0.2 -0.617 70.5-140.3 -85.3 123.1 68.0 20.9 13.7 41 43 A R T 3 S+ 0 0 111 25,-2.8 -2,-0.1 -2,-0.5 3,-0.0 -0.433 90.5 30.6 -71.2 147.6 67.1 22.3 10.3 42 44 A G T 3 S+ 0 0 41 -2,-0.1 2,-0.5 25,-0.1 -1,-0.2 0.453 97.9 93.9 82.3 -1.3 65.1 19.8 8.2 43 45 A M < + 0 0 0 -3,-1.3 -3,-0.1 1,-0.1 21,-0.1 -0.754 44.3 120.1-124.6 82.8 63.5 18.2 11.2 44 46 A D > + 0 0 65 -2,-0.5 5,-2.3 4,-0.1 4,-0.1 0.776 67.2 44.0-112.8 -43.8 60.2 20.2 11.6 45 47 A I T > 5S+ 0 0 54 3,-0.2 3,-1.4 1,-0.2 101,-0.1 0.954 115.1 45.1 -72.4 -53.6 57.2 17.8 11.3 46 48 A G T 3 5S+ 0 0 8 1,-0.3 -1,-0.2 100,-0.1 125,-0.1 0.653 115.0 50.1 -67.1 -15.6 58.4 14.9 13.5 47 49 A T T 3 5S- 0 0 19 -10,-0.1 -1,-0.3 123,-0.1 -2,-0.2 0.366 107.0-123.3-101.7 1.7 59.6 17.4 16.2 48 50 A A T < 5 - 0 0 46 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.864 44.6-177.7 57.0 37.3 56.4 19.4 16.3 49 51 A K < - 0 0 19 -5,-2.3 -1,-0.2 1,-0.1 3,-0.1 -0.388 35.1 -96.6 -66.7 140.2 58.3 22.5 15.5 50 52 A P - 0 0 21 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.264 52.0 -93.2 -56.3 147.4 56.2 25.7 15.4 51 53 A S > - 0 0 56 1,-0.1 4,-2.8 -3,-0.1 5,-0.2 -0.152 28.5-114.1 -60.6 157.7 55.2 26.6 11.9 52 54 A R H > S+ 0 0 214 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.846 119.5 52.8 -61.6 -34.1 57.3 29.0 9.8 53 55 A E H > S+ 0 0 137 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.893 110.5 47.1 -68.5 -38.9 54.4 31.5 9.9 54 56 A L H > S+ 0 0 30 1,-0.2 4,-2.2 2,-0.2 3,-0.3 0.919 110.4 51.6 -68.5 -44.0 54.2 31.2 13.7 55 57 A L H < S+ 0 0 32 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.810 103.9 60.3 -62.7 -29.7 58.0 31.6 14.0 56 58 A A H < S+ 0 0 80 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.897 114.8 32.8 -64.9 -41.6 57.8 34.7 11.9 57 59 A R H < S+ 0 0 161 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.686 131.5 34.7 -88.4 -20.6 55.5 36.5 14.4 58 60 A Y S < S- 0 0 10 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.1 -0.675 85.0-156.2-134.4 77.0 57.0 34.8 17.5 59 61 A P - 0 0 75 0, 0.0 -28,-0.6 0, 0.0 2,-0.5 -0.274 5.5-157.1 -57.6 134.8 60.8 34.4 16.8 60 62 A H E > -d 31 0A 24 -5,-0.1 3,-0.7 -30,-0.1 -28,-0.3 -0.968 9.5-136.3-118.1 127.4 62.5 31.7 18.8 61 63 A R E 3 S+d 32 0A 100 -30,-2.9 -28,-2.9 -2,-0.5 3,-0.1 -0.517 86.2 27.9 -77.6 151.4 66.2 31.7 19.5 62 64 A L T 3 S+ 0 0 18 1,-0.2 2,-0.4 -30,-0.2 -27,-0.2 0.750 87.4 120.9 70.5 28.1 68.1 28.4 19.1 63 65 A I S < S+ 0 0 18 -3,-0.7 -24,-0.3 1,-0.2 -1,-0.2 -0.976 79.0 5.9-119.9 136.8 65.8 26.8 16.5 64 66 A D S S+ 0 0 58 -26,-2.0 -24,-0.2 -2,-0.4 -1,-0.2 0.876 88.3 127.5 60.6 42.5 67.2 25.7 13.2 65 67 A I + 0 0 43 -26,-1.3 2,-0.3 -3,-0.2 -25,-0.2 0.451 61.2 46.9-106.4 -2.8 70.8 26.5 14.2 66 68 A R B S-f 40 0B 56 -27,-2.3 -25,-2.8 4,-0.1 -2,-0.1 -0.970 74.0-123.8-140.1 153.1 72.4 23.2 13.3 67 69 A D > - 0 0 42 -2,-0.3 3,-2.7 -27,-0.2 -25,-0.1 -0.684 37.5-111.1 -89.9 150.0 72.4 20.7 10.4 68 70 A P T 3 S+ 0 0 3 0, 0.0 97,-0.5 0, 0.0 98,-0.2 0.662 116.4 64.5 -56.7 -15.9 71.4 17.1 11.4 69 71 A A T 3 S+ 0 0 42 96,-0.1 2,-0.2 90,-0.1 -3,-0.0 0.526 93.3 82.0 -84.5 -4.6 75.0 16.0 10.8 70 72 A E S < S- 0 0 84 -3,-2.7 2,-0.2 93,-0.1 95,-0.2 -0.646 71.5-135.5-101.5 157.5 76.1 18.1 13.7 71 73 A S - 0 0 72 -2,-0.2 2,-0.3 93,-0.1 -4,-0.1 -0.683 11.0-160.1-105.7 163.0 76.1 17.5 17.4 72 74 A Y - 0 0 17 -2,-0.2 2,-0.1 -36,-0.1 -33,-0.0 -0.902 8.3-155.9-148.1 114.0 75.0 19.9 20.2 73 75 A S > - 0 0 48 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.433 30.6-117.3 -89.8 163.6 76.0 19.5 23.9 74 76 A A H > S+ 0 0 26 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.778 119.9 58.3 -65.5 -25.8 74.3 20.8 27.0 75 77 A A H > S+ 0 0 68 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.883 106.3 46.4 -70.5 -38.7 77.5 22.8 27.4 76 78 A E H > S+ 0 0 69 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.889 111.9 50.5 -70.2 -40.3 76.9 24.5 24.0 77 79 A F H X S+ 0 0 2 -4,-2.3 4,-3.7 2,-0.2 5,-0.3 0.942 108.0 54.7 -60.0 -47.7 73.3 25.2 24.9 78 80 A R H X S+ 0 0 70 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.920 112.5 41.7 -50.0 -51.5 74.4 26.7 28.2 79 81 A A H X S+ 0 0 57 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.933 117.1 47.3 -64.7 -47.5 76.8 29.1 26.3 80 82 A D H X S+ 0 0 49 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.876 113.3 48.8 -62.4 -40.2 74.3 29.9 23.6 81 83 A A H X S+ 0 0 0 -4,-3.7 4,-2.8 -5,-0.2 5,-0.2 0.919 109.6 50.6 -68.0 -44.4 71.4 30.4 26.1 82 84 A L H X S+ 0 0 52 -4,-2.3 4,-2.1 -5,-0.3 -2,-0.2 0.895 112.2 48.2 -60.9 -39.0 73.4 32.7 28.3 83 85 A A H X S+ 0 0 64 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.901 112.7 47.8 -67.5 -41.6 74.4 34.8 25.3 84 86 A A H X S+ 0 0 15 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.882 112.0 50.0 -66.5 -39.7 70.8 35.0 24.1 85 87 A M H X S+ 0 0 1 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.891 111.2 48.4 -66.4 -39.7 69.6 35.9 27.5 86 88 A A H X S+ 0 0 50 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.911 111.5 49.6 -66.8 -42.5 72.2 38.7 27.9 87 89 A K H X S+ 0 0 134 -4,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.904 114.1 45.4 -62.7 -42.4 71.4 40.1 24.4 88 90 A A H ><>S+ 0 0 0 -4,-2.1 5,-2.6 1,-0.2 3,-0.7 0.919 112.9 50.2 -67.2 -45.2 67.7 40.1 25.2 89 91 A T H ><5S+ 0 0 41 -4,-2.6 3,-2.3 1,-0.3 -2,-0.2 0.893 103.8 58.6 -60.3 -42.0 68.2 41.7 28.7 90 92 A A H 3<5S+ 0 0 90 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.774 107.9 48.6 -59.7 -25.2 70.4 44.4 27.2 91 93 A R T <<5S- 0 0 154 -3,-0.7 -1,-0.3 -4,-0.7 -2,-0.2 0.251 120.5-109.1 -98.9 11.3 67.4 45.3 25.1 92 94 A G T < 5S+ 0 0 57 -3,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.619 75.3 136.0 73.0 11.4 65.0 45.3 28.0 93 95 A R < - 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