==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-JUN-05 2CX8 . COMPND 2 MOLECULE: METHYL TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR K.MURAYAMA,M.SHIROUZU,S.YOKOYAMA,RIKEN STRUCTURAL . 400 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18359.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 256 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 58 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 4.5 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 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 . 22 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 23.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 3.0 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 1 0 0 0 0 1 2 2 2 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 3 2 4 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 . 1 0 0 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 1 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 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 4 A H 0 0 117 0, 0.0 32,-2.5 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 143.8 -0.3 -16.0 4.9 2 5 A R E -a 33 0A 109 30,-0.2 2,-0.4 38,-0.0 32,-0.2 -0.906 360.0-166.6-104.7 127.8 0.6 -12.3 4.5 3 6 A A E -a 34 0A 3 30,-2.9 32,-1.8 -2,-0.5 2,-0.4 -0.954 20.9-121.7-122.0 134.7 1.3 -11.2 0.9 4 7 A F E +a 35 0A 14 -2,-0.4 12,-0.2 30,-0.2 32,-0.2 -0.550 36.5 164.4 -73.7 120.8 2.9 -8.0 -0.4 5 8 A S > - 0 0 1 30,-3.2 3,-1.3 -2,-0.4 2,-1.1 -0.877 34.6-133.3-142.9 103.5 0.7 -6.1 -2.9 6 9 A P T 3 S- 0 0 58 0, 0.0 3,-0.1 0, 0.0 30,-0.1 -0.413 91.7 -1.0 -60.3 91.4 1.6 -2.5 -3.6 7 10 A G T 3 S- 0 0 30 -2,-1.1 29,-0.1 1,-0.1 0, 0.0 0.227 97.7-105.5 113.0 -14.7 -1.6 -0.5 -3.4 8 11 A L < + 0 0 12 -3,-1.3 -1,-0.1 27,-0.2 48,-0.1 0.931 67.4 154.6 57.8 43.4 -4.0 -3.3 -2.5 9 12 A T - 0 0 102 2,-0.3 -1,-0.1 -3,-0.1 3,-0.1 0.611 66.0-102.9 -79.4 -15.3 -5.3 -3.0 -6.1 10 13 A G S S+ 0 0 8 1,-0.3 44,-2.1 45,-0.1 2,-0.4 0.433 95.4 98.2 104.1 2.4 -6.5 -6.6 -6.4 11 14 A V B -B 53 0A 47 42,-0.2 -2,-0.3 -5,-0.1 -1,-0.3 -0.990 63.9-142.8-125.6 127.9 -3.5 -7.7 -8.4 12 15 A L - 0 0 3 40,-2.5 -7,-0.1 -2,-0.4 -8,-0.0 -0.627 25.8-103.4 -92.3 147.4 -0.5 -9.4 -7.0 13 16 A P > - 0 0 29 0, 0.0 4,-3.0 0, 0.0 5,-0.3 -0.361 37.4-110.4 -63.0 145.2 3.1 -8.9 -8.0 14 17 A L H > S+ 0 0 126 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.811 118.4 53.7 -47.8 -31.7 4.4 -11.8 -10.2 15 18 A R H > S+ 0 0 123 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.985 112.1 39.2 -68.0 -59.3 6.6 -12.8 -7.3 16 19 A E H > S+ 0 0 38 1,-0.2 4,-2.1 -12,-0.2 5,-0.2 0.820 115.2 57.6 -58.7 -32.3 3.9 -13.0 -4.6 17 20 A T H X S+ 0 0 3 -4,-3.0 4,-1.8 2,-0.2 5,-0.3 0.939 108.6 42.6 -65.6 -48.4 1.7 -14.5 -7.2 18 21 A R H X>S+ 0 0 139 -4,-2.1 4,-4.5 -5,-0.3 5,-0.7 0.952 113.9 52.5 -63.5 -48.4 4.0 -17.4 -8.0 19 22 A H H X>S+ 0 0 54 -4,-2.5 5,-1.9 1,-0.2 4,-1.5 0.885 112.1 43.7 -53.8 -47.2 4.8 -18.0 -4.3 20 23 A L H <5S+ 0 0 10 -4,-2.1 6,-0.9 3,-0.2 -1,-0.2 0.849 125.5 33.6 -69.4 -35.4 1.2 -18.3 -3.2 21 24 A V H <5S+ 0 0 32 -4,-1.8 -2,-0.2 4,-0.2 -3,-0.2 0.864 126.2 37.9 -88.7 -41.9 0.2 -20.5 -6.2 22 25 A E H <5S+ 0 0 140 -4,-4.5 -3,-0.2 -5,-0.3 -2,-0.2 0.874 132.1 20.7 -79.5 -40.5 3.4 -22.5 -6.7 23 26 A V T < - 0 0 130 -2,-0.1 3,-3.0 20,-0.0 18,-0.3 -0.991 38.6 -83.4-147.8 146.6 -7.1 -21.8 -5.1 28 31 A V T 3 S+ 0 0 90 -2,-0.3 18,-0.2 1,-0.3 3,-0.1 -0.237 120.7 34.3 -49.9 132.1 -9.9 -19.4 -5.9 29 32 A G T 3 S+ 0 0 40 16,-1.8 -1,-0.3 1,-0.4 2,-0.2 0.111 84.5 134.2 104.6 -22.2 -11.8 -18.9 -2.7 30 33 A D < - 0 0 67 -3,-3.0 15,-2.5 14,-0.1 2,-0.4 -0.429 49.0-141.6 -64.6 128.1 -8.7 -19.1 -0.5 31 34 A R E + C 0 44A 167 13,-0.2 2,-0.3 -2,-0.2 13,-0.2 -0.784 34.3 149.7 -94.4 136.3 -8.7 -16.3 2.0 32 35 A F E - C 0 43A 11 11,-2.7 11,-4.2 -2,-0.4 2,-0.4 -0.897 41.1-101.0-151.0 175.8 -5.3 -14.6 2.8 33 36 A T E -aC 2 42A 27 -32,-2.5 -30,-2.9 -2,-0.3 2,-0.3 -0.877 26.9-162.0-112.9 144.2 -4.0 -11.2 3.9 34 37 A V E +aC 3 41A 0 7,-2.6 7,-2.2 -2,-0.4 2,-0.3 -0.849 13.4 166.1-119.4 157.0 -2.4 -8.5 1.8 35 38 A F E -aC 4 40A 23 -32,-1.8 -30,-3.2 -2,-0.3 5,-0.2 -0.958 23.9-172.7-158.2 171.7 -0.3 -5.4 2.8 36 39 A D - 0 0 25 3,-1.3 4,-0.1 -2,-0.3 295,-0.1 0.281 67.6 -80.3-155.5 7.4 2.0 -2.8 1.3 37 40 A G S S+ 0 0 16 2,-0.7 3,-0.1 294,-0.1 342,-0.1 0.344 127.3 47.5 103.9 -9.2 3.6 -0.8 4.2 38 41 A E S S+ 0 0 107 1,-0.4 2,-0.3 365,-0.1 341,-0.0 0.559 114.3 23.1-130.2 -38.0 0.5 1.4 4.7 39 42 A R - 0 0 89 22,-0.1 -3,-1.3 2,-0.0 -2,-0.7 -0.776 52.9-164.2-129.9 173.5 -2.4 -0.9 4.8 40 43 A E E +CD 35 60A 26 20,-0.8 20,-4.2 -2,-0.3 2,-0.3 -0.964 17.1 168.1-155.0 143.8 -3.4 -4.5 5.4 41 44 A A E -CD 34 59A 0 -7,-2.2 -7,-2.6 -2,-0.3 2,-0.6 -0.988 39.4-102.3-157.5 163.1 -6.5 -6.4 4.5 42 45 A L E -CD 33 58A 19 16,-2.4 15,-3.4 -2,-0.3 16,-1.0 -0.823 45.6-170.6 -90.5 121.3 -8.2 -9.8 4.3 43 46 A A E -CD 32 56A 0 -11,-4.2 -11,-2.7 -2,-0.6 2,-0.4 -0.757 18.0-148.7-114.5 161.2 -8.3 -10.9 0.7 44 47 A E E -CD 31 55A 38 11,-1.8 11,-2.1 -2,-0.3 -13,-0.2 -0.994 30.6-112.3-127.0 130.8 -10.0 -13.7 -1.2 45 48 A V E + D 0 54A 1 -15,-2.5 -16,-1.8 -2,-0.4 9,-0.3 -0.435 34.8 175.8 -64.8 134.7 -8.4 -15.2 -4.3 46 49 A V E - 0 0 67 7,-4.0 2,-0.3 1,-0.5 8,-0.2 0.761 66.8 -3.5-107.1 -42.9 -10.4 -14.4 -7.4 47 50 A D E - D 0 53A 85 6,-1.7 6,-3.1 -20,-0.1 -1,-0.5 -0.985 53.1-140.8-151.5 143.2 -8.3 -15.8 -10.2 48 51 A L + 0 0 49 -2,-0.3 4,-0.2 1,-0.2 -27,-0.1 0.628 52.9 147.8 -81.5 -12.1 -4.9 -17.5 -10.2 49 52 A G - 0 0 41 1,-0.2 -1,-0.2 2,-0.1 3,-0.1 -0.416 68.3 -87.1 60.7-116.3 -3.9 -15.7 -13.4 50 53 A P S S+ 0 0 106 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.502 132.9 47.7 -77.4 155.6 -1.0 -15.2 -13.4 51 54 A P S S- 0 0 47 0, 0.0 -2,-0.1 0, 0.0 -37,-0.1 0.497 106.0-126.7 -77.5 147.7 -0.8 -12.6 -12.0 52 55 A L - 0 0 0 -4,-0.2 -40,-2.5 -39,-0.2 2,-0.3 -0.304 23.9-151.4 -60.6 140.4 -3.2 -13.8 -9.2 53 56 A R E +BD 11 47A 133 -6,-3.1 -7,-4.0 -42,-0.2 -6,-1.7 -0.902 16.1 177.7-117.5 146.5 -6.2 -11.5 -8.6 54 57 A Y E - D 0 45A 9 -44,-2.1 2,-0.4 -2,-0.3 -9,-0.2 -0.949 23.4-132.5-144.3 161.7 -8.1 -11.0 -5.3 55 58 A R E - D 0 44A 126 -11,-2.1 -11,-1.8 -2,-0.3 2,-0.6 -0.939 31.6-113.9-117.5 140.2 -10.9 -9.0 -3.8 56 59 A V E - D 0 43A 58 -2,-0.4 -13,-0.3 -13,-0.2 3,-0.2 -0.620 29.5-179.3 -77.6 115.3 -10.6 -7.2 -0.5 57 60 A L E - 0 0 44 -15,-3.4 2,-0.3 -2,-0.6 -14,-0.2 0.965 69.2 -4.0 -76.0 -57.5 -12.8 -8.7 2.2 58 61 A E E - D 0 42A 98 -16,-1.0 -16,-2.4 0, 0.0 -1,-0.3 -0.968 69.8-120.6-146.7 126.6 -12.1 -6.4 5.2 59 62 A E E - D 0 41A 101 -2,-0.3 -18,-0.3 -18,-0.2 2,-0.2 -0.384 38.0-159.3 -62.3 135.9 -9.6 -3.6 5.6 60 63 A R E - D 0 40A 81 -20,-4.2 -20,-0.8 -2,-0.1 -1,-0.1 -0.679 20.6-107.5-117.0 172.3 -7.1 -4.3 8.4 61 64 A R - 0 0 185 -2,-0.2 -22,-0.1 -22,-0.1 3,-0.1 -0.883 38.9-122.7-102.6 112.5 -4.8 -2.4 10.7 62 65 A P - 0 0 23 0, 0.0 2,-0.6 0, 0.0 -22,-0.1 -0.179 26.4-110.3 -53.3 141.1 -1.1 -3.0 9.9 63 66 A E + 0 0 121 1,-0.2 68,-0.0 68,-0.0 0, 0.0 -0.666 50.4 160.5 -75.4 119.3 1.0 -4.3 12.7 64 67 A R + 0 0 27 -2,-0.6 -1,-0.2 -3,-0.1 313,-0.1 0.729 38.5 89.2-110.6 -35.7 3.3 -1.4 13.6 65 68 A E S S- 0 0 49 1,-0.1 312,-0.1 2,-0.1 29,-0.1 -0.211 75.5-125.6 -71.0 156.4 4.6 -2.1 17.1 66 69 A V - 0 0 5 27,-0.3 -1,-0.1 2,-0.2 3,-0.1 0.853 46.4-119.1 -66.4 -36.9 7.7 -4.0 18.0 67 70 A G S S+ 0 0 65 1,-0.3 2,-0.3 3,-0.0 -2,-0.1 0.290 86.3 55.0 114.8 -11.4 5.7 -6.4 20.1 68 71 A V S S- 0 0 28 103,-0.1 -1,-0.3 105,-0.0 -2,-0.2 -0.954 98.0 -83.2-145.9 158.8 7.4 -5.7 23.5 69 72 A E - 0 0 111 -2,-0.3 104,-3.3 -3,-0.1 2,-0.5 -0.436 39.9-163.5 -66.1 136.4 8.0 -2.5 25.4 70 73 A V E -e 173 0B 0 102,-0.2 25,-3.8 23,-0.2 26,-1.7 -0.934 5.7-171.4-127.4 107.0 11.2 -0.7 24.2 71 74 A V E -ef 174 96B 15 102,-3.0 104,-2.9 -2,-0.5 2,-0.6 -0.881 8.2-156.6-104.3 114.0 12.5 1.9 26.7 72 75 A L E -ef 175 97B 1 24,-2.8 26,-4.2 -2,-0.6 2,-0.8 -0.793 2.4-164.8 -92.0 122.2 15.3 4.2 25.6 73 76 A Y E +ef 176 98B 22 102,-3.1 104,-2.0 -2,-0.6 2,-0.5 -0.898 20.6 177.3-104.4 101.4 17.4 5.7 28.5 74 77 A V E -ef 177 99B 0 24,-1.5 26,-2.1 -2,-0.8 104,-0.2 -0.913 29.3-121.0-116.2 132.3 19.2 8.5 26.8 75 78 A A E - 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