==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 10-APR-03 1P0B . COMPND 2 MOLECULE: QUEUINE TRNA-RIBOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ZYMOMONAS MOBILIS; . AUTHOR R.BRENK,M.T.STUBBS,A.HEINE,K.REUTER,G.KLEBE . 369 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15285.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 7.9 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 . 3 0.8 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 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 35.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.7 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 2 4 0 2 1 0 2 0 1 1 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 3 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 0 PARALLEL BRIDGES PER LADDER . 0 1 1 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 2 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 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 11 A R 0 0 163 0, 0.0 22,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 171.5 8.4 -10.3 25.8 2 12 A P - 0 0 50 0, 0.0 3,-0.2 0, 0.0 180,-0.0 -0.357 360.0-108.5 -79.6 166.1 9.9 -8.4 28.7 3 13 A R S S- 0 0 67 1,-0.3 20,-0.5 19,-0.2 2,-0.3 0.900 101.6 -10.4 -59.6 -41.4 9.2 -4.8 29.5 4 14 A F E +A 22 0A 24 18,-0.2 2,-0.3 19,-0.1 -1,-0.3 -0.875 65.3 163.5-165.3 126.7 12.7 -4.1 28.3 5 15 A S E -A 21 0A 52 16,-1.5 16,-2.8 -2,-0.3 2,-0.6 -0.869 13.2-166.9-149.9 112.9 15.8 -6.1 27.5 6 16 A F E -A 20 0A 28 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.884 12.7-179.2-102.7 124.3 18.8 -4.8 25.6 7 17 A S E -A 19 0A 53 12,-2.7 12,-2.3 -2,-0.6 2,-0.6 -0.988 19.6-145.2-126.0 132.3 21.2 -7.5 24.4 8 18 A I E +A 18 0A 41 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.874 17.7 177.4 -98.7 120.5 24.4 -6.9 22.4 9 19 A A E + 0 0 86 8,-2.0 2,-0.3 -2,-0.6 9,-0.2 0.785 64.2 6.1 -91.9 -33.2 25.1 -9.7 20.0 10 20 A A E -A 17 0A 25 7,-1.8 7,-2.5 2,-0.0 2,-0.3 -0.992 59.0-165.5-152.3 154.8 28.3 -8.5 18.3 11 21 A R E -A 16 0A 132 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.954 10.2-177.9-139.7 157.5 30.8 -5.7 18.5 12 22 A E E > S-A 15 0A 47 3,-1.8 3,-2.0 -2,-0.3 2,-0.1 -0.824 72.4 -43.9-156.6 110.4 33.6 -4.1 16.5 13 23 A G T 3 S- 0 0 81 -2,-0.3 -1,-0.1 1,-0.3 248,-0.1 -0.440 124.8 -24.0 62.4-130.7 35.6 -1.3 18.1 14 24 A K T 3 S+ 0 0 95 246,-0.6 -1,-0.3 -2,-0.1 247,-0.1 0.594 117.7 103.6 -87.0 -10.5 33.0 1.0 19.7 15 25 A A E < -A 12 0A 1 -3,-2.0 -3,-1.8 245,-0.2 2,-0.3 -0.401 49.7-173.9 -74.1 147.6 30.2 -0.2 17.4 16 26 A R E -A 11 0A 6 247,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.985 12.4-164.9-140.4 149.6 27.6 -2.7 18.6 17 27 A T E +A 10 0A 7 -7,-2.5 -8,-2.0 -2,-0.3 -7,-1.8 -0.997 35.6 104.9-135.1 139.8 24.7 -4.6 17.1 18 28 A G E -AB 8 29A 6 11,-1.9 11,-2.6 -2,-0.4 2,-0.3 -0.867 53.9 -76.3-174.3-148.3 21.9 -6.2 19.0 19 29 A T E -AB 7 28A 40 -12,-2.3 -12,-2.7 -2,-0.3 2,-0.5 -0.989 11.2-149.3-145.1 150.7 18.3 -6.1 20.0 20 30 A I E -AB 6 27A 0 7,-2.3 7,-2.6 -2,-0.3 2,-0.5 -0.986 22.2-155.9-117.6 116.5 15.9 -4.3 22.4 21 31 A E E +AB 5 26A 72 -16,-2.8 -16,-1.5 -2,-0.5 2,-0.3 -0.846 21.4 165.2 -96.7 129.5 13.0 -6.5 23.3 22 32 A M E > -AB 4 25A 1 3,-1.9 3,-1.5 -2,-0.5 -19,-0.2 -0.874 51.3 -97.2-134.8 167.5 9.9 -4.8 24.5 23 33 A K T 3 S+ 0 0 80 -20,-0.5 -20,-0.1 159,-0.3 3,-0.1 0.892 122.8 44.4 -55.8 -42.6 6.3 -5.8 25.0 24 34 A R T 3 S- 0 0 104 1,-0.2 -1,-0.3 -21,-0.2 2,-0.3 0.441 126.3 -60.1 -84.9 2.1 5.2 -4.5 21.6 25 35 A G E < -B 22 0A 0 -3,-1.5 -3,-1.9 62,-0.2 2,-0.4 -0.850 57.5 -60.5 148.2 176.7 8.1 -5.9 19.7 26 36 A V E -B 21 0A 43 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.790 33.0-155.5-100.9 139.1 11.8 -6.2 18.9 27 37 A I E -B 20 0A 0 -7,-2.6 -7,-2.3 -2,-0.4 2,-0.4 -0.962 11.0-145.5-115.1 119.4 14.0 -3.4 17.9 28 38 A R E -B 19 0A 78 -2,-0.5 -9,-0.2 -9,-0.2 27,-0.1 -0.693 32.1-108.6 -85.5 134.9 17.2 -4.2 15.9 29 39 A T E S+B 18 0A 0 -11,-2.6 -11,-1.9 -2,-0.4 2,-0.2 -0.929 99.5 49.2-123.7 148.4 20.1 -2.0 16.6 30 40 A P S S- 0 0 0 0, 0.0 2,-0.3 0, 0.0 235,-0.2 0.401 93.1-174.3 -57.4 142.3 21.7 0.2 15.4 31 41 A A E -c 265 0B 3 233,-2.6 235,-2.1 -2,-0.2 2,-0.5 -0.905 26.6-154.3-122.6 143.9 18.2 1.5 14.7 32 42 A F E -c 266 0B 2 -2,-0.3 24,-0.3 233,-0.2 23,-0.3 -0.969 14.3-154.3-114.3 128.7 16.8 4.4 12.8 33 43 A M E -c 267 0B 0 233,-3.1 235,-0.7 -2,-0.5 24,-0.2 -0.889 12.2-136.2-106.1 113.9 13.4 5.7 14.0 34 44 A P - 0 0 0 0, 0.0 24,-2.7 0, 0.0 2,-0.5 -0.425 29.5-115.3 -64.0 145.4 11.2 7.5 11.4 35 45 A V B -d 58 0B 11 233,-0.5 2,-0.6 22,-0.2 7,-0.4 -0.707 26.9-167.5 -89.2 126.7 9.7 10.6 12.9 36 46 A G > + 0 0 2 22,-3.1 3,-0.6 -2,-0.5 24,-0.4 -0.723 11.6 174.0-117.6 84.4 5.9 10.8 13.2 37 47 A T T 3 S+ 0 0 25 -2,-0.6 3,-0.3 3,-0.4 5,-0.1 -0.669 71.4 22.1 -88.2 140.8 4.7 14.3 14.0 38 48 A A T 3 S- 0 0 48 -2,-0.3 -1,-0.2 1,-0.2 3,-0.1 0.857 135.1 -68.2 70.3 35.8 0.9 14.9 14.2 39 49 A A S < S+ 0 0 14 -3,-0.6 2,-0.3 1,-0.1 -1,-0.2 0.813 118.0 87.3 51.8 38.4 0.5 11.1 14.8 40 50 A T S S- 0 0 57 -3,-0.3 2,-1.0 5,-0.0 -3,-0.4 -0.940 78.0-127.1-162.4 137.3 1.7 10.3 11.3 41 51 A V > - 0 0 3 3,-0.4 3,-2.0 -2,-0.3 -5,-0.2 -0.828 63.9 -96.8 -82.7 111.3 5.0 9.6 9.5 42 52 A K T 3 S- 0 0 89 -2,-1.0 -1,-0.1 -7,-0.4 3,-0.1 0.046 95.8 -4.3 -40.7 124.5 4.3 12.1 6.7 43 53 A A T 3 S+ 0 0 40 1,-0.1 2,-0.4 291,-0.0 -1,-0.3 0.588 111.9 101.8 68.8 14.8 2.8 10.8 3.5 44 54 A L < - 0 0 16 -3,-2.0 -3,-0.4 290,-0.1 -1,-0.1 -0.988 66.5-133.4-134.0 136.1 3.1 7.1 4.6 45 55 A K >> - 0 0 133 -2,-0.4 4,-1.9 1,-0.1 3,-0.9 -0.536 36.2-113.9 -74.0 152.5 0.6 4.6 5.9 46 56 A P H 3> S+ 0 0 35 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.829 117.8 58.0 -56.8 -34.6 2.0 2.7 9.0 47 57 A E H 3> S+ 0 0 137 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.826 106.1 49.9 -67.1 -29.7 2.1 -0.6 7.0 48 58 A T H <> S+ 0 0 28 -3,-0.9 4,-1.7 2,-0.2 -1,-0.2 0.897 108.3 51.7 -74.2 -41.5 4.4 1.2 4.5 49 59 A V H <>S+ 0 0 1 -4,-1.9 5,-1.4 1,-0.2 3,-0.4 0.948 113.0 46.3 -58.7 -44.9 6.6 2.5 7.3 50 60 A R H ><5S+ 0 0 82 -4,-2.6 3,-1.6 1,-0.2 -2,-0.2 0.892 106.7 58.6 -64.8 -38.4 6.8 -1.1 8.5 51 61 A A H 3<5S+ 0 0 79 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.820 97.4 60.3 -62.0 -30.7 7.5 -2.4 5.0 52 62 A T T 3<5S- 0 0 18 -4,-1.7 -1,-0.3 -3,-0.4 -2,-0.2 0.638 126.6-100.3 -71.4 -14.0 10.6 -0.3 4.7 53 63 A G T < 5 + 0 0 17 -3,-1.6 -3,-0.2 -4,-0.4 -2,-0.1 0.415 68.0 154.3 111.4 0.4 12.0 -2.2 7.7 54 64 A A < - 0 0 0 -5,-1.4 -1,-0.3 1,-0.1 3,-0.1 -0.396 22.3-174.5 -65.3 134.7 11.3 0.2 10.6 55 65 A D S S+ 0 0 6 -23,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.617 71.5 13.3 -99.8 -20.9 11.0 -1.5 14.0 56 66 A I - 0 0 1 -24,-0.3 -1,-0.3 31,-0.1 2,-0.3 -0.986 64.4-154.6-154.3 151.4 10.0 1.6 15.9 57 67 A I E - e 0 89B 3 31,-1.3 33,-2.5 -2,-0.3 2,-0.4 -0.868 20.8-116.2-127.6 162.9 8.9 5.2 15.2 58 68 A L E -de 35 90B 2 -24,-2.7 -22,-3.1 -2,-0.3 2,-0.3 -0.830 24.1-172.9-105.3 139.2 9.1 8.5 17.1 59 69 A G E - e 0 91B 3 31,-3.1 33,-2.6 -2,-0.4 2,-0.5 -0.784 19.4-127.7-118.9 165.1 6.2 10.5 18.4 60 70 A N E > - e 0 92B 7 -24,-0.4 4,-1.8 -2,-0.3 5,-0.2 -0.960 8.9-156.7-128.0 125.2 6.3 13.9 20.0 61 71 A T H > S+ 0 0 0 31,-1.8 4,-1.9 -2,-0.5 5,-0.2 0.918 94.7 54.3 -56.9 -45.9 4.9 15.1 23.3 62 72 A Y H > S+ 0 0 3 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.935 111.2 38.7 -56.7 -57.6 4.8 18.8 22.2 63 73 A H H > S+ 0 0 40 1,-0.2 4,-2.7 2,-0.2 3,-0.4 0.901 118.0 49.1 -64.8 -40.7 2.8 18.5 18.9 64 74 A L H <>S+ 0 0 1 -4,-1.8 5,-2.4 1,-0.2 -1,-0.2 0.795 103.6 57.9 -72.2 -28.6 0.4 15.9 20.2 65 75 A M H <5S+ 0 0 25 -4,-1.9 5,-0.3 -5,-0.2 -1,-0.2 0.805 115.0 40.4 -71.3 -23.5 -0.4 17.7 23.5 66 76 A L H <5S+ 0 0 48 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.2 0.892 118.0 47.6 -87.1 -47.2 -1.5 20.6 21.2 67 77 A R T <5S- 0 0 188 -4,-2.7 -1,-0.3 -5,-0.1 -29,-0.1 -0.950 133.6 -8.3-147.6 124.1 -3.3 18.7 18.5 68 78 A P T 5S- 0 0 35 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 -0.992 106.1-116.7 -85.6 -0.4 -5.3 16.5 19.0 69 79 A G >< - 0 0 14 -5,-2.4 4,-2.1 -6,-0.1 -4,-0.2 0.038 9.5-111.9 111.7 138.9 -4.5 16.6 22.7 70 80 A A H > S+ 0 0 1 -5,-0.3 4,-2.3 2,-0.2 5,-0.2 0.931 116.0 48.0 -68.5 -48.5 -3.0 14.0 25.1 71 81 A E H > S+ 0 0 80 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.883 111.8 52.1 -61.0 -37.5 -6.1 13.4 27.1 72 82 A R H > S+ 0 0 156 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.926 108.4 49.4 -65.4 -45.7 -8.1 13.0 23.9 73 83 A I H <>S+ 0 0 0 -4,-2.1 5,-2.9 1,-0.2 4,-0.3 0.910 110.6 51.8 -61.5 -37.4 -5.7 10.4 22.5 74 84 A A H ><5S+ 0 0 36 -4,-2.3 3,-1.7 1,-0.2 -2,-0.2 0.948 108.3 50.6 -62.8 -46.1 -6.0 8.5 25.8 75 85 A K H 3<5S+ 0 0 182 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.828 108.8 53.1 -59.8 -33.5 -9.8 8.6 25.6 76 86 A L T 3<5S- 0 0 96 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.453 132.0 -88.1 -83.4 -1.2 -9.6 7.2 22.0 77 87 A G T < 5S- 0 0 54 -3,-1.7 4,-0.4 -4,-0.3 -3,-0.2 0.459 72.2 -65.7 113.5 0.7 -7.4 4.3 23.1 78 88 A G >< - 0 0 9 -5,-2.9 4,-2.4 -6,-0.2 57,-0.2 -0.150 59.5 -74.4 103.5 159.7 -3.8 5.5 22.9 79 89 A L H > S+ 0 0 3 55,-2.6 4,-2.9 1,-0.2 5,-0.4 0.876 124.6 58.3 -61.6 -40.0 -1.5 6.7 20.1 80 90 A H H >>S+ 0 0 14 54,-0.5 4,-1.6 1,-0.2 5,-1.5 0.944 113.2 37.8 -56.0 -53.0 -0.9 3.1 18.7 81 91 A S H 45S+ 0 0 87 -4,-0.4 -1,-0.2 3,-0.2 -2,-0.2 0.905 114.9 57.5 -64.3 -42.6 -4.6 2.5 18.1 82 92 A F H <5S+ 0 0 89 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.939 120.8 24.3 -55.1 -54.1 -5.1 6.1 17.0 83 93 A M H <5S- 0 0 28 -4,-2.9 -1,-0.2 2,-0.2 -2,-0.2 0.547 107.9-115.9 -93.7 -7.3 -2.6 6.1 14.1 84 94 A G T <5S+ 0 0 51 -4,-1.6 2,-0.5 -5,-0.4 -3,-0.2 0.854 70.3 130.1 79.0 33.3 -2.6 2.3 13.5 85 95 A W < - 0 0 9 -5,-1.5 -1,-0.2 -6,-0.3 -2,-0.2 -0.987 29.8-179.2-119.4 115.8 1.0 1.5 14.5 86 96 A D + 0 0 126 -2,-0.5 3,-0.1 -3,-0.1 -1,-0.1 0.331 54.4 84.5 -99.8 8.4 1.1 -1.5 16.9 87 97 A R S S- 0 0 69 1,-0.2 -62,-0.2 -7,-0.1 -31,-0.1 -0.329 94.9 -53.6 -98.4-178.5 4.9 -1.7 17.4 88 98 A P - 0 0 0 0, 0.0 -31,-1.3 0, 0.0 2,-0.4 -0.251 50.7-166.4 -59.9 146.3 7.1 0.3 19.8 89 99 A I E -e 57 0B 1 -33,-0.2 48,-2.1 46,-0.1 49,-1.9 -0.998 8.5-153.7-133.3 131.9 6.9 4.1 19.7 90 100 A L E -ef 58 138B 0 -33,-2.5 -31,-3.1 -2,-0.4 2,-0.5 -0.918 13.3-154.7-105.0 131.8 9.4 6.3 21.4 91 101 A T E -ef 59 139B 0 47,-2.4 49,-1.0 -2,-0.5 -31,-0.2 -0.927 10.6-133.8-110.1 130.0 8.1 9.7 22.4 92 102 A D E -e 60 0B 17 -33,-2.6 -31,-1.8 -2,-0.5 -30,-0.1 -0.472 21.6-124.2 -74.4 157.1 10.3 12.8 22.7 93 103 A S - 0 0 0 48,-0.4 -1,-0.1 -33,-0.1 37,-0.1 0.593 33.6-115.1 -79.9 -14.4 9.6 14.8 25.9 94 104 A G S > S+ 0 0 1 -33,-0.1 4,-2.4 48,-0.0 5,-0.3 0.228 82.7 122.9 95.6 -11.7 8.9 18.1 24.4 95 105 A G T 4 S+ 0 0 5 46,-0.2 50,-0.6 1,-0.2 4,-0.2 0.806 82.8 30.8 -51.5 -34.6 12.0 19.5 26.1 96 106 A Y T >> S+ 0 0 85 48,-0.2 3,-1.3 2,-0.1 4,-0.8 0.915 118.0 51.3 -89.4 -56.0 13.4 20.5 22.7 97 107 A Q H >>>S+ 0 0 30 1,-0.3 4,-2.7 2,-0.2 3,-0.6 0.802 98.3 65.5 -54.6 -37.7 10.3 21.4 20.7 98 108 A V H 3<5S+ 0 0 1 -4,-2.4 4,-0.4 1,-0.3 -1,-0.3 0.800 110.0 39.0 -59.5 -28.6 8.8 23.7 23.2 99 109 A M H <45S+ 0 0 75 -3,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.572 118.6 49.3 -95.9 -11.6 11.7 26.1 22.8 100 110 A S H <<5S+ 0 0 61 -4,-0.8 -2,-0.2 -3,-0.6 -3,-0.2 0.795 124.4 19.9 -95.8 -34.3 11.9 25.6 19.0 101 111 A L T <5S+ 0 0 91 -4,-2.7 -3,-0.2 -5,-0.1 -2,-0.1 0.624 93.0 107.6-112.5 -19.7 8.3 26.0 17.8 102 112 A S < - 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