==== 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 TRANSFERASE 25-JUN-10 3NOM . COMPND 2 MOLECULE: GLUTAMINE CYCLOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ZYMOMONAS MOBILIS; . AUTHOR C.PARTHIER,D.R.CARRILLO,M.T.STUBBS . 468 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20220.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 308 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 203 43.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 2.6 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 . 12 2.6 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 . 2 0.4 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 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 2.1 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+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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 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 0 0 PARALLEL BRIDGES PER LADDER . 0 2 6 4 14 1 3 0 2 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 6 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 25 A S 0 0 171 0, 0.0 142,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -38.6 -16.5 -31.9 -33.9 2 26 A I - 0 0 28 180,-0.0 180,-0.1 141,-0.0 179,-0.1 -0.886 360.0-120.0 -96.1 108.5 -13.4 -29.8 -33.1 3 27 A P - 0 0 43 0, 0.0 180,-2.2 0, 0.0 2,-0.4 -0.119 26.0-149.7 -52.9 132.3 -10.5 -31.7 -34.8 4 28 A I E -a 183 0A 63 229,-0.2 229,-3.3 178,-0.2 2,-0.4 -0.844 7.2-152.8-106.0 141.2 -7.8 -32.8 -32.3 5 29 A Y E -aB 184 232A 43 178,-3.3 180,-2.7 -2,-0.4 2,-0.3 -0.941 1.9-153.1-120.0 134.0 -4.1 -33.1 -33.3 6 30 A D E -aB 185 231A 52 225,-3.3 225,-2.3 -2,-0.4 2,-0.2 -0.759 20.7-127.0 -97.6 147.4 -1.4 -35.4 -31.8 7 31 A Y E - B 0 230A 48 178,-0.6 2,-0.4 -2,-0.3 223,-0.2 -0.520 12.5-160.1 -87.0 159.5 2.3 -34.4 -32.0 8 32 A Q E - B 0 229A 76 221,-1.5 221,-2.2 -2,-0.2 2,-0.6 -0.974 25.0-128.2-126.1 134.3 5.2 -36.4 -33.3 9 33 A I E + B 0 228A 59 -2,-0.4 219,-0.3 219,-0.2 3,-0.1 -0.702 28.3 176.1 -81.4 123.0 8.6 -35.3 -32.0 10 34 A V E S- 0 0 60 217,-3.7 2,-0.3 -2,-0.6 218,-0.2 0.879 70.6 -15.3 -89.8 -46.0 10.9 -34.7 -35.0 11 35 A H E - B 0 227A 87 216,-1.2 216,-2.6 2,-0.0 -1,-0.4 -0.949 58.4-148.2-147.4 170.0 13.8 -33.4 -32.8 12 36 A S E - B 0 226A 48 -2,-0.3 214,-0.2 214,-0.2 204,-0.0 -0.958 13.3-165.7-149.7 126.7 14.3 -32.1 -29.4 13 37 A Y E - B 0 225A 17 212,-2.7 212,-3.0 -2,-0.3 37,-0.1 -0.789 31.5 -94.6-117.9 150.6 16.9 -29.5 -28.3 14 38 A P E - B 0 224A 58 0, 0.0 2,-0.3 0, 0.0 210,-0.3 -0.302 39.8-167.3 -62.3 144.4 18.2 -28.4 -24.9 15 39 A H - 0 0 15 208,-2.2 2,-0.4 206,-0.1 37,-0.1 -0.972 34.3 -94.5-132.5 145.9 16.4 -25.5 -23.4 16 40 A D > - 0 0 57 -2,-0.3 3,-1.6 35,-0.3 205,-0.3 -0.449 30.0-155.0 -60.7 115.5 17.6 -23.5 -20.3 17 41 A T T 3 S+ 0 0 46 -2,-0.4 -1,-0.2 1,-0.3 207,-0.0 0.582 91.3 58.4 -78.7 -4.7 15.8 -25.1 -17.4 18 42 A K T 3 S+ 0 0 136 204,-0.1 2,-0.7 205,-0.0 -1,-0.3 0.355 85.8 104.8 -93.7 3.2 16.0 -21.8 -15.4 19 43 A A < - 0 0 1 -3,-1.6 202,-3.1 203,-0.2 2,-1.2 -0.774 59.2-153.4-102.6 115.0 14.1 -19.8 -18.1 20 44 A F E -H 36 0B 73 16,-2.5 16,-2.3 -2,-0.7 2,-0.7 -0.741 26.4-142.2 -77.9 102.1 10.5 -18.8 -17.7 21 45 A T E +H 35 0B 0 -2,-1.2 14,-0.2 14,-0.2 199,-0.2 -0.543 36.0 160.5 -69.4 106.7 9.6 -18.6 -21.4 22 46 A E E + 0 0 7 12,-3.6 2,-0.3 -2,-0.7 13,-0.2 0.519 69.8 10.6-102.1 -7.2 7.3 -15.6 -21.9 23 47 A G E +H 34 0B 0 11,-0.8 11,-3.2 44,-0.2 2,-0.3 -0.921 65.0 179.3-174.2 140.4 7.7 -15.2 -25.8 24 48 A F E +H 33 0B 0 44,-0.4 182,-0.4 129,-0.3 2,-0.3 -0.977 7.7 156.6-160.0 130.9 9.4 -17.4 -28.4 25 49 A F E -H 32 0B 0 7,-2.3 7,-2.8 -2,-0.3 2,-0.5 -0.969 32.3-119.7-153.5 167.3 9.9 -17.1 -32.1 26 50 A Y E +H 31 0B 26 182,-0.5 2,-0.3 -2,-0.3 5,-0.2 -0.924 36.5 153.4-113.4 129.5 12.1 -18.4 -34.9 27 51 A R E > -H 30 0B 52 3,-2.7 3,-2.1 -2,-0.5 182,-0.1 -0.927 59.6 -3.2-153.5 137.5 14.3 -16.3 -37.2 28 52 A N T 3 S- 0 0 35 1,-0.3 3,-0.1 -2,-0.3 181,-0.0 0.822 126.6 -52.6 71.8 32.7 17.4 -16.5 -39.2 29 53 A G T 3 S+ 0 0 22 1,-0.2 19,-0.5 18,-0.0 -1,-0.3 0.434 122.2 101.5 69.5 5.5 18.3 -20.0 -38.1 30 54 A Y E < -H 27 0B 71 -3,-2.1 -3,-2.7 17,-0.1 2,-0.3 -0.782 69.1-125.0-117.2 158.1 17.9 -18.8 -34.4 31 55 A F E -HI 26 46B 5 15,-2.4 15,-2.4 -2,-0.3 2,-0.4 -0.757 19.2-159.4 -90.7 147.7 15.5 -18.9 -31.5 32 56 A Y E -HI 25 45B 3 -7,-2.8 -7,-2.3 -2,-0.3 2,-0.4 -0.999 16.2-176.5-126.1 128.4 14.4 -15.6 -29.9 33 57 A E E -HI 24 44B 4 11,-2.3 11,-1.9 -2,-0.4 2,-0.7 -0.990 28.7-143.9-131.1 134.1 13.0 -15.9 -26.4 34 58 A S E -HI 23 43B 1 -11,-3.2 -12,-3.6 -2,-0.4 -11,-0.8 -0.866 39.9-169.1 -87.8 115.2 11.5 -13.5 -24.0 35 59 A T E -HI 21 42B 0 7,-3.0 7,-3.3 -2,-0.7 2,-0.5 -0.908 30.3-154.8-121.8 136.8 12.8 -14.9 -20.6 36 60 A G E +HI 20 41B 2 -16,-2.3 -16,-2.5 -2,-0.4 5,-0.2 -0.904 18.6 176.0 -94.0 123.9 12.2 -14.4 -16.9 37 61 A L S S- 0 0 48 3,-2.8 3,-0.2 -2,-0.5 -18,-0.1 -0.507 75.5 -27.5-129.8 70.0 15.4 -15.4 -15.0 38 62 A N S S- 0 0 162 -20,-0.1 2,-0.4 -2,-0.1 3,-0.1 0.892 121.4 -49.2 89.3 55.5 14.7 -14.6 -11.3 39 63 A G S S+ 0 0 59 1,-0.2 2,-0.3 25,-0.0 -1,-0.1 0.020 118.1 106.3 74.1 -28.9 12.2 -11.8 -11.5 40 64 A R - 0 0 91 -2,-0.4 -3,-2.8 -3,-0.2 2,-0.5 -0.655 65.1-139.8 -78.0 136.7 14.4 -9.9 -14.1 41 65 A S E +I 36 0B 2 22,-0.4 18,-3.8 -2,-0.3 2,-0.3 -0.837 24.4 175.2 -96.5 130.0 13.2 -10.0 -17.7 42 66 A S E -IJ 35 58B 4 -7,-3.3 -7,-3.0 -2,-0.5 2,-0.4 -0.943 24.5-139.9-126.7 163.5 15.7 -10.5 -20.5 43 67 A I E -IJ 34 57B 2 14,-2.2 14,-2.1 -2,-0.3 2,-0.4 -0.961 32.4-170.6-115.3 139.7 15.3 -10.9 -24.3 44 68 A R E -IJ 33 56B 15 -11,-1.9 -11,-2.3 -2,-0.4 2,-0.6 -0.962 31.3-141.7-148.3 139.6 17.7 -13.4 -25.8 45 69 A K E -IJ 32 55B 44 10,-3.4 9,-3.5 -2,-0.4 10,-1.3 -0.927 33.3-163.7-102.9 117.0 19.1 -14.9 -29.0 46 70 A V E -IJ 31 53B 6 -15,-2.4 -15,-2.4 -2,-0.6 2,-0.3 -0.883 22.2-125.8-110.5 133.9 19.5 -18.7 -28.6 47 71 A D > - 0 0 50 5,-2.6 4,-2.1 -2,-0.4 -17,-0.1 -0.604 25.1-141.5 -65.3 125.6 21.5 -21.2 -30.6 48 72 A I T 4 S+ 0 0 15 -19,-0.5 -1,-0.1 -2,-0.3 177,-0.1 0.957 92.6 44.2 -61.3 -50.7 19.0 -23.8 -31.6 49 73 A E T 4 S+ 0 0 141 1,-0.2 -1,-0.2 -36,-0.1 -37,-0.0 0.907 124.5 30.7 -67.2 -43.6 21.2 -26.9 -31.2 50 74 A S T 4 S- 0 0 42 2,-0.1 -1,-0.2 -37,-0.1 -2,-0.2 0.725 90.9-137.1 -86.6 -21.4 22.9 -26.0 -27.9 51 75 A G < + 0 0 13 -4,-2.1 -35,-0.3 1,-0.3 -3,-0.1 0.384 59.9 138.4 74.2 -2.1 20.1 -24.0 -26.3 52 76 A K - 0 0 148 -5,-0.1 -5,-2.6 1,-0.1 2,-0.5 -0.318 59.2-106.2 -75.1 159.4 22.8 -21.6 -25.3 53 77 A T E +J 46 0B 46 -7,-0.2 -7,-0.2 1,-0.1 3,-0.1 -0.737 29.1 179.5 -88.7 129.8 22.5 -17.9 -25.4 54 78 A L E S- 0 0 89 -9,-3.5 2,-0.3 -2,-0.5 -8,-0.2 0.649 72.6 -4.1-100.6 -20.0 24.4 -16.1 -28.1 55 79 A Q E +J 45 0B 60 -10,-1.3 -10,-3.4 2,-0.0 -1,-0.4 -0.913 64.2 174.0-174.8 142.4 23.2 -12.6 -27.1 56 80 A Q E -J 44 0B 96 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.997 16.9-158.0-151.6 149.6 20.9 -10.9 -24.6 57 81 A I E -J 43 0B 42 -14,-2.1 -14,-2.2 -2,-0.3 2,-0.4 -0.954 24.2-131.5-118.2 156.8 19.8 -7.7 -23.2 58 82 A E E -J 42 0B 117 -2,-0.3 -16,-0.3 -16,-0.2 2,-0.2 -0.808 15.3-130.5-100.2 141.0 18.1 -7.2 -19.8 59 83 A L - 0 0 9 -18,-3.8 -18,-0.3 -2,-0.4 2,-0.1 -0.634 41.0 -88.7 -82.2 150.5 14.9 -5.3 -19.3 60 84 A G > - 0 0 26 -2,-0.2 3,-3.6 1,-0.1 -19,-0.1 -0.343 43.0-102.1 -58.8 138.9 14.9 -2.7 -16.5 61 85 A K T 3 S+ 0 0 138 1,-0.3 -1,-0.1 -21,-0.1 -2,-0.1 0.647 117.7 56.6 -29.9 -37.3 13.9 -3.9 -13.0 62 86 A R T 3 S+ 0 0 200 2,-0.0 2,-0.4 -22,-0.0 -1,-0.3 0.588 93.2 82.7 -85.7 -3.0 10.4 -2.4 -13.2 63 87 A Y < - 0 0 78 -3,-3.6 2,-0.6 -22,-0.1 -22,-0.4 -0.788 58.4-159.0 -99.4 138.4 9.4 -4.3 -16.4 64 88 A F - 0 0 52 -2,-0.4 16,-3.4 -24,-0.1 18,-0.2 -0.916 26.7-139.9-107.1 108.5 8.1 -7.8 -16.6 65 89 A G E +K 79 0C 1 -2,-0.6 14,-0.3 14,-0.3 -23,-0.1 -0.335 30.7 160.4 -64.9 132.7 8.7 -8.9 -20.2 66 90 A E E + 0 0 10 12,-3.2 -44,-0.2 1,-0.3 41,-0.2 -0.017 43.3 16.5-120.6-132.3 6.2 -10.9 -22.1 67 91 A G E - 0 0 0 39,-3.0 11,-2.8 10,-0.2 -1,-0.3 -0.019 57.7-172.2 -52.7 139.9 5.4 -11.7 -25.8 68 92 A I E +K 77 0C 0 40,-0.4 -44,-0.4 9,-0.2 40,-0.3 -0.955 9.4 165.3-128.8 159.1 8.0 -11.1 -28.5 69 93 A S E -K 76 0C 0 7,-1.9 7,-3.0 -2,-0.3 2,-0.1 -0.970 33.1-111.5-162.6 151.5 7.9 -11.2 -32.3 70 94 A D E -K 75 0C 18 -2,-0.3 5,-0.3 5,-0.2 2,-0.2 -0.480 23.3-175.8 -83.7 159.2 9.9 -10.0 -35.1 71 95 A W E > -K 74 0C 35 3,-2.7 3,-1.8 -2,-0.1 2,-0.4 -0.685 62.1 -59.5-154.5 106.3 8.8 -7.3 -37.5 72 96 A K T 3 S- 0 0 120 1,-0.3 -1,-0.1 -2,-0.2 361,-0.0 -0.437 126.1 -9.0 51.5-108.9 11.1 -6.7 -40.5 73 97 A D T 3 S+ 0 0 82 -2,-0.4 17,-2.9 -3,-0.1 18,-0.4 0.235 126.6 83.4-100.9 17.5 14.4 -5.7 -38.9 74 98 A K E < -KL 71 89C 50 -3,-1.8 -3,-2.7 15,-0.2 2,-0.5 -0.805 63.2-142.7-123.8 155.2 12.9 -5.5 -35.4 75 99 A I E -KL 70 88C 0 13,-2.3 13,-3.0 -2,-0.3 2,-0.4 -0.981 21.1-162.4-103.1 126.7 11.9 -7.3 -32.3 76 100 A V E -KL 69 87C 4 -7,-3.0 -7,-1.9 -2,-0.5 2,-0.3 -0.885 12.0-172.4-103.8 140.7 8.7 -6.0 -30.7 77 101 A G E -KL 68 86C 2 9,-2.1 9,-1.9 -2,-0.4 -9,-0.2 -0.987 12.4-145.5-139.1 146.5 8.1 -7.1 -27.0 78 102 A L E - 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