==== 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 22-JAN-10 3LHD . COMPND 2 MOLECULE: SAM-DEPENDENT METHYLTRANSFERASE, PUTATIVE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS ABYSSI; . AUTHOR A.GUELORGET,B.GOLINELLI-PIMPANEAU,J.WOUTERS,C.BARBEY . 1016 8 4 0 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40943.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 742 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 95 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 165 16.2 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 . 8 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 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 . 1 0.1 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 . 116 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 95 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 209 20.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 7 0 0 4 4 0 7 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 5 11 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 . 4 2 16 3 4 4 0 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 . 5 0 4 0 0 0 0 0 0 0 0 0 0 0 2 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 C M 0 0 87 0, 0.0 2,-0.4 0, 0.0 42,-0.2 0.000 360.0 360.0 360.0 -29.6 10.0 -41.2 2.1 2 2 C I - 0 0 3 40,-2.2 39,-3.5 37,-0.3 2,-0.3 -0.670 360.0-168.9 -82.3 130.3 8.9 -42.3 -1.3 3 3 C R > - 0 0 162 -2,-0.4 3,-1.9 37,-0.2 19,-0.2 -0.767 34.1 -73.4-118.5 162.2 6.2 -45.0 -1.3 4 4 C E T 3 S+ 0 0 129 -2,-0.3 19,-0.2 1,-0.2 -1,-0.1 -0.264 118.4 26.0 -52.6 133.2 4.7 -47.4 -3.8 5 5 C G T 3 S+ 0 0 39 17,-2.4 -1,-0.2 1,-0.4 18,-0.1 0.022 91.2 121.3 99.6 -27.2 2.3 -45.5 -6.2 6 6 C D < - 0 0 68 -3,-1.9 16,-2.6 15,-0.1 -1,-0.4 -0.240 62.9-117.0 -64.3 158.5 4.0 -42.1 -5.8 7 7 C K E -A 21 0A 53 14,-0.2 2,-0.3 -3,-0.1 14,-0.2 -0.782 32.3-176.7-104.7 149.2 5.4 -40.4 -8.9 8 8 C V E -A 20 0A 0 12,-2.8 12,-3.6 -2,-0.3 2,-0.7 -0.990 25.6-133.6-147.9 141.8 9.0 -39.6 -9.5 9 9 C V E -AB 19 59A 1 50,-3.0 50,-3.4 -2,-0.3 2,-0.5 -0.915 22.2-160.2 -99.0 115.9 11.2 -37.9 -12.0 10 10 C L E -AB 18 58A 0 8,-2.8 8,-2.0 -2,-0.7 2,-0.6 -0.866 4.5-159.8 -93.3 126.8 14.3 -40.0 -12.9 11 11 C V E -AB 17 57A 9 46,-2.6 46,-2.8 -2,-0.5 6,-0.2 -0.941 5.0-152.7-111.0 119.4 17.1 -38.0 -14.4 12 12 C D > - 0 0 6 4,-2.5 3,-1.8 -2,-0.6 44,-0.1 -0.226 37.1 -93.4 -78.5 172.7 19.8 -39.8 -16.4 13 13 C P T 3 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 43,-0.1 0.805 125.4 56.3 -58.8 -30.2 23.4 -38.6 -16.9 14 14 C R T 3 S- 0 0 164 2,-0.1 -3,-0.0 1,-0.0 -2,-0.0 0.484 121.7-105.5 -78.5 -3.6 22.5 -36.8 -20.1 15 15 C G S < S+ 0 0 25 -3,-1.8 2,-0.3 1,-0.3 -1,-0.0 0.537 70.7 146.9 88.4 7.4 19.8 -34.8 -18.4 16 16 C K - 0 0 95 1,-0.0 -4,-2.5 2,-0.0 2,-0.3 -0.603 36.6-143.7 -79.1 138.7 16.9 -36.8 -19.9 17 17 C R E -A 11 0A 42 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.814 15.5-167.6-109.0 143.0 13.9 -37.1 -17.6 18 18 C Y E -A 10 0A 29 -8,-2.0 -8,-2.8 -2,-0.3 2,-0.9 -0.979 13.6-150.3-126.9 117.4 11.4 -39.9 -17.0 19 19 C L E +A 9 0A 26 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.803 35.9 178.5 -87.8 110.1 8.2 -39.2 -15.0 20 20 C I E -A 8 0A 8 -12,-3.6 -12,-2.8 -2,-0.9 2,-0.5 -0.823 34.5-132.5-123.2 145.8 7.6 -42.6 -13.5 21 21 C T E -A 7 0A 44 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.896 35.3-120.0 -95.2 127.2 5.2 -44.3 -11.1 22 22 C V + 0 0 1 -16,-2.6 -17,-2.4 -2,-0.5 2,-0.3 -0.507 56.5 129.2 -70.2 126.7 7.0 -46.3 -8.5 23 23 C S - 0 0 26 -2,-0.3 2,-2.2 2,-0.2 16,-0.1 -0.973 68.7 -76.4-172.6 162.2 6.0 -50.0 -8.6 24 24 C K S S+ 0 0 85 -2,-0.3 2,-0.3 12,-0.1 -2,-0.1 -0.444 90.2 97.3 -77.0 74.6 7.4 -53.6 -8.8 25 25 C R S S- 0 0 121 -2,-2.2 11,-1.5 9,-0.0 2,-0.7 -0.971 73.8-112.8-152.5 158.5 8.5 -53.6 -12.4 26 26 C D E -D 35 0B 81 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.884 27.0-145.8-107.9 115.1 11.7 -53.1 -14.3 27 27 C F E -D 34 0B 49 7,-1.4 7,-2.5 -2,-0.7 2,-0.3 -0.546 13.0-137.4 -78.5 132.4 11.8 -50.0 -16.4 28 28 C H E +D 33 0B 128 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.721 27.9 174.4 -94.3 144.4 13.9 -50.2 -19.6 29 29 C T E > -D 32 0B 26 3,-0.6 3,-1.3 -2,-0.3 0, 0.0 -0.913 50.1-103.6-140.5 160.0 16.2 -47.4 -20.8 30 30 C D T 3 S+ 0 0 111 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.910 125.5 41.0 -35.3 -48.6 18.8 -46.3 -23.3 31 31 C L T 3 S- 0 0 21 1,-0.3 23,-0.4 -3,-0.1 21,-0.4 -0.204 124.1 -70.9-113.9 36.8 21.2 -47.0 -20.5 32 32 C G E < -D 29 0B 2 -3,-1.3 -3,-0.6 18,-0.1 2,-0.5 -0.392 64.4 -44.9 108.7 179.8 20.0 -50.2 -18.8 33 33 C I E -D 28 0B 52 -5,-0.2 18,-0.9 -2,-0.1 2,-0.4 -0.787 41.7-159.0 -98.8 121.7 17.3 -51.7 -16.6 34 34 C L E -D 27 0B 0 -7,-2.5 -7,-1.4 -2,-0.5 2,-0.9 -0.806 12.6-144.1 -92.1 136.4 16.1 -49.8 -13.5 35 35 C K E > -D 26 0B 106 -2,-0.4 3,-2.2 14,-0.3 4,-0.2 -0.881 12.2-161.9 -97.0 98.9 14.3 -51.8 -10.9 36 36 C L G > S+ 0 0 0 -11,-1.5 3,-1.2 -2,-0.9 4,-0.4 0.653 82.0 73.9 -59.6 -16.4 11.7 -49.2 -9.8 37 37 C E G > S+ 0 0 38 -12,-0.3 3,-1.2 1,-0.2 -1,-0.3 0.801 82.8 68.6 -65.2 -29.2 11.2 -51.1 -6.6 38 38 C E G < S+ 0 0 83 -3,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.616 88.1 68.1 -65.0 -12.6 14.5 -49.9 -5.3 39 39 C I G X S+ 0 0 0 -3,-1.2 3,-2.2 -4,-0.2 -37,-0.3 0.772 72.4 105.2 -81.0 -28.5 13.0 -46.3 -5.1 40 40 C I T < S+ 0 0 74 -3,-1.2 -37,-0.2 -4,-0.4 3,-0.1 -0.342 89.8 14.8 -54.6 123.5 10.6 -47.2 -2.3 41 41 C G T 3 S+ 0 0 54 -39,-3.5 -1,-0.3 1,-0.3 -38,-0.1 0.348 102.3 115.8 90.5 -4.8 11.9 -45.6 1.0 42 42 C R < - 0 0 71 -3,-2.2 -40,-2.2 -40,-0.2 -1,-0.3 -0.302 58.9-124.0 -85.0 174.8 14.4 -43.3 -0.8 43 43 C N > - 0 0 76 -42,-0.2 3,-1.9 -3,-0.1 15,-0.2 -0.867 31.4 -89.4-117.2 156.9 14.4 -39.5 -0.8 44 44 C F T 3 S+ 0 0 40 -2,-0.3 15,-0.2 1,-0.2 3,-0.1 -0.458 116.5 35.6 -61.1 127.3 14.3 -36.9 -3.6 45 45 C G T 3 S+ 0 0 25 13,-2.9 -1,-0.2 1,-0.5 14,-0.1 0.078 94.5 106.1 108.9 -21.8 17.9 -36.1 -4.4 46 46 C E < - 0 0 73 -3,-1.9 12,-2.3 12,-0.2 -1,-0.5 -0.278 63.7-129.0 -75.4 173.0 19.1 -39.7 -3.9 47 47 C A E -C 57 0A 42 10,-0.2 2,-0.3 -3,-0.1 10,-0.2 -0.872 13.8-157.0-127.3 158.3 20.0 -41.9 -6.8 48 48 C I E -C 56 0A 4 8,-2.6 8,-3.6 -2,-0.3 2,-0.4 -0.949 19.2-138.9-126.1 151.2 19.3 -45.4 -8.3 49 49 C K E -C 55 0A 48 -2,-0.3 -14,-0.3 6,-0.2 6,-0.2 -0.909 10.8-129.9-115.8 139.4 21.6 -47.2 -10.7 50 50 C S > - 0 0 8 4,-2.7 3,-1.3 -2,-0.4 -16,-0.2 -0.105 40.9 -92.1 -72.3-179.9 20.6 -49.3 -13.7 51 51 C H T 3 S+ 0 0 123 -18,-0.9 -19,-0.1 1,-0.3 -1,-0.1 0.765 128.2 53.5 -70.5 -21.9 21.9 -52.8 -14.3 52 52 C K T 3 S- 0 0 122 -21,-0.4 -1,-0.3 2,-0.1 -20,-0.1 0.387 122.9-104.3 -90.5 0.8 24.8 -51.4 -16.4 53 53 C G S < S+ 0 0 56 -3,-1.3 2,-0.3 1,-0.3 -2,-0.1 0.527 70.3 144.3 92.6 7.4 25.8 -49.0 -13.5 54 54 C H - 0 0 72 -23,-0.4 -4,-2.7 1,-0.0 2,-0.5 -0.639 47.0-125.7 -81.6 138.6 24.5 -45.7 -14.9 55 55 C E E - C 0 49A 53 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.732 21.7-168.6 -94.8 126.2 23.1 -43.4 -12.2 56 56 C F E - C 0 48A 0 -8,-3.6 -8,-2.6 -2,-0.5 2,-0.3 -0.937 16.6-137.5-111.8 133.4 19.6 -42.0 -12.4 57 57 C K E -BC 11 47A 40 -46,-2.8 -46,-2.6 -2,-0.4 2,-0.7 -0.696 9.2-132.0 -97.9 145.2 18.6 -39.2 -10.0 58 58 C I E +B 10 0A 0 -12,-2.3 -13,-2.9 -2,-0.3 2,-0.3 -0.845 30.1 172.8-101.5 111.0 15.2 -39.0 -8.2 59 59 C L E -B 9 0A 0 -50,-3.4 -50,-3.0 -2,-0.7 890,-0.1 -0.840 38.3-108.6-113.1 152.8 13.4 -35.6 -8.3 60 60 C R - 0 0 117 888,-0.4 -52,-0.1 -2,-0.3 2,-0.0 -0.696 46.3-109.9 -75.5 127.0 9.9 -34.6 -7.2 61 61 C P - 0 0 15 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.334 38.7-166.8 -62.7 134.5 7.8 -34.1 -10.3 62 62 C R > - 0 0 41 1,-0.0 4,-2.2 -2,-0.0 3,-0.4 -0.572 39.6 -93.4-112.3 177.6 6.9 -30.4 -10.9 63 63 C I H > S+ 0 0 6 789,-0.4 4,-3.2 1,-0.2 5,-0.2 0.908 126.3 56.3 -59.2 -38.2 4.3 -28.8 -13.2 64 64 C V H > S+ 0 0 12 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.849 107.8 48.9 -60.1 -36.3 7.1 -28.4 -15.9 65 65 C D H > S+ 0 0 2 -3,-0.4 4,-1.3 2,-0.2 -2,-0.2 0.945 113.4 44.6 -69.0 -50.4 7.7 -32.2 -15.7 66 66 C Y H X S+ 0 0 32 -4,-2.2 4,-0.7 1,-0.2 3,-0.5 0.929 117.2 46.4 -57.8 -48.2 4.0 -33.1 -16.0 67 67 C L H >< S+ 0 0 30 -4,-3.2 3,-0.6 1,-0.2 -2,-0.2 0.909 111.9 50.9 -62.7 -42.4 3.6 -30.6 -18.8 68 68 C D H 3< S+ 0 0 92 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.733 119.8 32.8 -67.4 -22.3 6.7 -31.7 -20.6 69 69 C K H 3< S+ 0 0 82 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.223 83.5 119.5-130.5 16.8 5.8 -35.4 -20.7 70 70 C M S << S- 0 0 22 -4,-0.7 2,-0.6 -3,-0.6 35,-0.0 -0.389 76.2 -91.2 -75.5 159.1 2.0 -35.9 -20.9 71 71 C K - 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