==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 12-DEC-05 2FCA . COMPND 2 MOLECULE: TRNA (GUANINE-N(7)-)-METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR I.ZEGERS,F.VAN VLIET,J.BUJNICKI,J.KOSINSKI,D.GIGOT, . 408 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19924.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 268 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 6.9 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 . 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 . 26 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 23.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 2 1 0 0 2 0 2 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 4 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 . 0 0 0 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 9 A W > 0 0 205 0, 0.0 4,-0.9 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 156.5 -49.4 93.9 -0.3 2 10 A D H > + 0 0 98 2,-0.2 4,-1.0 1,-0.2 5,-0.1 0.688 360.0 59.4 -84.2 -21.7 -49.4 95.1 3.3 3 11 A D H > S+ 0 0 118 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.826 102.4 52.4 -74.5 -35.2 -53.1 94.1 3.7 4 12 A F H > S+ 0 0 53 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.885 108.9 48.8 -68.6 -42.4 -52.3 90.4 2.8 5 13 A L H < S+ 0 0 24 -4,-0.9 7,-0.2 1,-0.2 -1,-0.2 0.780 111.3 49.7 -69.7 -28.9 -49.6 90.2 5.5 6 14 A A H >< S+ 0 0 77 -4,-1.0 3,-0.6 1,-0.2 -1,-0.2 0.777 111.4 49.8 -78.9 -28.2 -51.9 91.7 8.2 7 15 A E H 3< S+ 0 0 161 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.771 116.8 41.7 -78.0 -32.0 -54.6 89.2 7.1 8 16 A N T >X S+ 0 0 8 -4,-1.5 4,-2.5 1,-0.1 3,-1.5 -0.263 70.9 137.1-113.3 46.9 -52.2 86.3 7.4 9 17 A A T <4 + 0 0 41 -3,-0.6 5,-0.3 1,-0.3 -1,-0.1 0.499 61.1 72.0 -71.1 -7.1 -50.4 87.4 10.6 10 18 A D T 34 S+ 0 0 96 -3,-0.2 -1,-0.3 3,-0.1 3,-0.2 0.690 114.4 24.7 -79.1 -23.0 -50.5 83.8 11.9 11 19 A I T <4 S+ 0 0 13 -3,-1.5 73,-2.7 1,-0.2 2,-1.3 0.774 123.9 52.6-103.1 -54.0 -47.8 82.9 9.3 12 20 A A B < S-a 84 0A 12 -4,-2.5 2,-0.4 -7,-0.2 -1,-0.2 -0.692 85.5-150.7 -89.6 85.6 -46.2 86.3 8.8 13 21 A I - 0 0 14 -2,-1.3 73,-0.4 71,-0.8 -3,-0.1 -0.431 12.0-168.9 -63.3 112.6 -45.4 87.3 12.4 14 22 A S S S+ 0 0 103 -2,-0.4 -1,-0.2 -5,-0.3 -4,-0.1 0.740 82.8 41.0 -75.0 -24.2 -45.6 91.1 12.7 15 23 A N > + 0 0 57 1,-0.1 3,-1.3 2,-0.0 4,-0.4 -0.468 64.2 156.3-124.5 60.9 -44.0 91.3 16.2 16 24 A P G > + 0 0 14 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.800 68.3 66.0 -59.5 -29.7 -41.2 88.7 16.2 17 25 A A G > S+ 0 0 55 1,-0.3 3,-1.5 2,-0.2 -2,-0.0 0.799 90.3 66.4 -61.8 -29.8 -39.3 90.4 19.1 18 26 A D G < S+ 0 0 103 -3,-1.3 -1,-0.3 1,-0.3 77,-0.1 0.743 98.4 53.2 -64.3 -24.5 -42.1 89.6 21.5 19 27 A Y G X S+ 0 0 70 -3,-1.4 3,-2.4 -4,-0.4 4,-0.4 0.263 72.5 140.9 -98.5 14.3 -41.4 85.9 21.2 20 28 A K T < S+ 0 0 87 -3,-1.5 76,-0.2 1,-0.3 75,-0.1 -0.377 84.0 3.6 -60.7 116.7 -37.7 86.0 22.1 21 29 A G T 3 S+ 0 0 29 74,-0.3 -1,-0.3 -2,-0.2 3,-0.1 0.320 124.5 75.6 87.3 -5.0 -37.0 83.0 24.2 22 30 A K X> + 0 0 109 -3,-2.4 3,-1.2 1,-0.1 4,-0.6 0.110 50.6 117.7-122.9 18.4 -40.6 81.8 23.8 23 31 A W H 3> + 0 0 0 -4,-0.4 4,-1.4 1,-0.3 3,-0.4 0.732 69.8 64.6 -62.4 -22.1 -40.5 80.4 20.2 24 32 A N H 3>>S+ 0 0 64 1,-0.2 4,-1.5 2,-0.2 5,-1.1 0.847 98.5 55.4 -68.3 -30.5 -41.4 76.9 21.3 25 33 A T H <45S+ 0 0 94 -3,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.715 103.4 55.5 -74.3 -21.9 -44.8 78.3 22.5 26 34 A V H <5S+ 0 0 38 -4,-0.6 -1,-0.2 -3,-0.4 -2,-0.2 0.898 116.7 35.0 -75.0 -43.5 -45.5 79.7 19.0 27 35 A F H <5S- 0 0 22 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.658 104.7-131.2 -83.7 -19.7 -45.0 76.2 17.4 28 36 A G T <5S+ 0 0 66 -4,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.631 76.4 72.1 76.6 16.3 -46.5 74.4 20.4 29 37 A N S + 0 0 5 21,-2.0 3,-1.6 -3,-0.4 5,-0.3 0.780 12.4 179.9 -62.2 -33.9 -36.3 83.1 1.9 40 48 A G T 3 - 0 0 19 1,-0.3 30,-0.3 20,-0.2 -1,-0.2 -0.436 69.5 -8.9 66.5-133.8 -37.3 84.7 -1.4 41 49 A K T 3 S- 0 0 104 -2,-0.1 -1,-0.3 28,-0.1 32,-0.2 0.539 98.3-120.9 -72.7 -12.0 -40.4 83.2 -3.0 42 50 A G S <> S+ 0 0 0 -3,-1.6 4,-1.7 30,-0.1 5,-0.2 0.629 71.6 129.7 83.4 19.2 -40.3 80.4 -0.4 43 51 A Q H > S+ 0 0 49 -4,-0.2 4,-2.2 2,-0.2 5,-0.2 0.903 76.7 50.3 -70.0 -40.6 -40.0 77.1 -2.3 44 52 A F H > S+ 0 0 9 -5,-0.3 4,-2.2 2,-0.2 5,-0.2 0.944 113.5 43.2 -61.5 -52.9 -37.0 76.0 -0.3 45 53 A I H > S+ 0 0 1 -6,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.863 115.2 47.8 -65.7 -36.8 -38.6 76.5 3.1 46 54 A S H X S+ 0 0 21 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.898 113.9 49.1 -69.4 -39.8 -42.0 75.1 2.2 47 55 A G H X S+ 0 0 20 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.872 112.3 46.9 -66.7 -39.2 -40.3 72.0 0.7 48 56 A M H X S+ 0 0 14 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.825 111.7 51.9 -70.5 -35.1 -38.1 71.5 3.8 49 57 A A H < S+ 0 0 1 -4,-1.8 -2,-0.2 2,-0.2 6,-0.2 0.845 111.3 46.8 -69.0 -36.5 -41.2 71.9 6.0 50 58 A K H < S+ 0 0 176 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.922 115.7 45.3 -70.7 -45.5 -43.1 69.3 4.1 51 59 A Q H < S+ 0 0 82 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.836 121.3 38.5 -67.9 -37.6 -40.1 66.9 4.1 52 60 A N >< + 0 0 44 -4,-2.2 3,-1.4 1,-0.1 -1,-0.3 -0.724 59.0 165.1-121.2 83.3 -39.4 67.5 7.8 53 61 A P T 3 S+ 0 0 85 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.785 77.5 61.9 -66.6 -25.0 -42.6 67.8 9.9 54 62 A D T 3 S+ 0 0 115 2,-0.1 2,-0.4 -23,-0.0 -5,-0.1 0.216 94.5 74.9 -85.5 10.0 -40.6 67.2 13.1 55 63 A I S < S- 0 0 35 -3,-1.4 2,-0.5 -6,-0.2 -22,-0.2 -0.984 76.0-135.0-125.0 138.2 -38.5 70.4 12.6 56 64 A N E -b 33 0A 2 -24,-2.8 -22,-3.0 -2,-0.4 2,-0.4 -0.818 22.6-157.9 -93.2 129.1 -39.7 74.0 13.1 57 65 A Y E -bd 34 82A 4 24,-3.0 26,-2.0 -2,-0.5 2,-0.4 -0.884 14.7-176.7-116.0 137.6 -38.8 76.5 10.3 58 66 A I E -bd 35 83A 0 -24,-1.9 -22,-1.8 -2,-0.4 2,-0.4 -0.979 9.8-164.7-130.6 118.5 -38.5 80.3 10.3 59 67 A G E -bd 36 84A 0 24,-2.4 26,-3.0 -2,-0.4 2,-0.4 -0.878 2.2-159.6-107.4 132.9 -37.7 82.1 7.2 60 68 A I E +bd 37 85A 2 -24,-2.8 -21,-2.0 -2,-0.4 -22,-2.0 -0.906 16.1 167.0-109.9 140.6 -36.6 85.7 7.1 61 69 A E - 0 0 29 24,-2.3 27,-0.1 -2,-0.4 6,-0.1 -0.877 24.2-161.5-155.4 123.0 -36.9 87.9 4.0 62 70 A L S S+ 0 0 108 -2,-0.3 2,-0.7 24,-0.2 -1,-0.1 0.902 72.4 86.7 -70.8 -44.6 -36.5 91.7 3.8 63 71 A F >> - 0 0 131 1,-0.2 4,-1.7 24,-0.1 3,-0.7 -0.468 60.1-166.5 -65.2 102.1 -38.3 92.2 0.4 64 72 A K H 3> S+ 0 0 87 -2,-0.7 4,-1.2 1,-0.2 -1,-0.2 0.827 84.0 61.7 -59.8 -32.4 -42.0 92.5 1.4 65 73 A S H 34 S+ 0 0 66 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.825 111.7 36.6 -64.9 -33.5 -43.0 92.1 -2.3 66 74 A V H <> S+ 0 0 20 -3,-0.7 4,-1.1 2,-0.2 3,-0.4 0.720 107.1 63.6 -94.4 -22.3 -41.5 88.6 -2.4 67 75 A I H X S+ 0 0 1 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.781 93.2 66.4 -71.0 -24.6 -42.4 87.4 1.2 68 76 A V H X S+ 0 0 27 -4,-1.2 4,-1.5 1,-0.2 -1,-0.2 0.883 101.6 48.0 -60.8 -38.5 -46.1 87.7 0.2 69 77 A T H > S+ 0 0 52 -3,-0.4 4,-1.4 -4,-0.4 -1,-0.2 0.841 108.9 53.5 -71.8 -34.9 -45.5 84.8 -2.3 70 78 A A H X S+ 0 0 0 -4,-1.1 4,-1.0 -30,-0.3 -2,-0.2 0.897 107.8 50.3 -67.0 -40.1 -43.7 82.8 0.5 71 79 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 3,-0.3 0.853 105.7 57.1 -65.9 -35.6 -46.7 83.3 2.8 72 80 A Q H X S+ 0 0 68 -4,-1.5 4,-2.2 1,-0.2 5,-0.2 0.857 103.3 53.4 -65.8 -34.9 -49.1 82.1 0.0 73 81 A K H X S+ 0 0 70 -4,-1.4 4,-1.8 -32,-0.2 -1,-0.2 0.812 112.7 43.3 -69.4 -31.0 -47.2 78.8 -0.3 74 82 A V H < S+ 0 0 4 -4,-1.0 -2,-0.2 -3,-0.3 -1,-0.2 0.824 112.3 53.9 -82.3 -33.5 -47.6 78.2 3.5 75 83 A K H < S+ 0 0 91 -4,-2.3 -2,-0.2 -5,-0.1 3,-0.2 0.881 117.8 35.9 -66.8 -40.4 -51.3 79.3 3.3 76 84 A D H < S+ 0 0 103 -4,-2.2 2,-1.5 1,-0.2 -2,-0.2 0.966 115.0 52.9 -77.2 -60.7 -52.0 76.8 0.6 77 85 A S S < S- 0 0 75 -4,-1.8 2,-2.3 -5,-0.2 -1,-0.2 -0.696 94.5-140.1 -83.1 87.9 -49.8 73.9 1.6 78 86 A E + 0 0 141 -2,-1.5 -1,-0.1 -3,-0.2 -4,-0.1 0.124 42.2 155.5 -40.8 16.7 -51.2 73.8 5.2 79 87 A A - 0 0 33 -2,-2.3 3,-0.3 1,-0.1 -29,-0.1 -0.154 29.3-164.4 -54.6 131.0 -47.9 73.2 7.0 80 88 A Q S S+ 0 0 140 1,-0.2 -1,-0.1 -31,-0.1 -2,-0.1 0.410 77.0 74.7 -98.2 2.0 -48.0 74.3 10.7 81 89 A N S S+ 0 0 17 -32,-0.1 -24,-3.0 -25,-0.1 2,-0.4 -0.044 80.6 81.1-105.9 28.0 -44.2 74.2 11.1 82 90 A V E + d 0 57A 2 -3,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.983 46.3 174.5-138.3 126.7 -43.3 77.4 9.1 83 91 A K E - d 0 58A 23 -26,-2.0 -24,-2.4 -2,-0.4 2,-0.4 -0.908 17.9-146.9-125.3 149.6 -43.4 81.0 10.2 84 92 A L E -ad 12 59A 1 -73,-2.7 -71,-0.8 -2,-0.3 2,-0.4 -0.979 7.5-161.4-124.3 134.4 -42.1 84.0 8.0 85 93 A L E - d 0 60A 0 -26,-3.0 -24,-2.3 -2,-0.4 2,-1.4 -0.970 17.0-146.5-120.0 132.6 -40.5 87.2 9.2 86 94 A N + 0 0 71 -2,-0.4 2,-0.3 -73,-0.4 -24,-0.2 -0.502 65.5 104.7 -92.5 64.3 -40.1 90.5 7.3 87 95 A I - 0 0 24 -2,-1.4 2,-0.2 -24,-0.1 -2,-0.1 -0.841 66.3-107.5-136.0 171.7 -36.8 91.5 8.9 88 96 A D > - 0 0 58 -2,-0.3 3,-0.9 -27,-0.1 4,-0.3 -0.489 37.4-101.1 -97.3 173.7 -33.0 91.6 8.1 89 97 A A G > S+ 0 0 9 1,-0.2 3,-1.2 2,-0.2 4,-0.3 0.805 118.3 62.6 -64.2 -28.7 -30.2 89.4 9.4 90 98 A D G > S+ 0 0 62 1,-0.2 3,-0.7 2,-0.1 -1,-0.2 0.779 96.6 58.6 -67.9 -26.2 -29.1 92.1 11.9 91 99 A T G X> S+ 0 0 44 -3,-0.9 3,-1.7 1,-0.2 4,-0.9 0.517 77.5 93.5 -83.3 -3.5 -32.5 91.8 13.8 92 100 A L H X> S+ 0 0 0 -3,-1.2 4,-2.2 1,-0.3 3,-0.5 0.838 79.9 58.3 -58.8 -32.3 -32.0 88.1 14.5 93 101 A T H <4 S+ 0 0 22 -3,-0.7 -1,-0.3 -4,-0.3 -2,-0.1 0.621 104.6 50.3 -73.8 -15.4 -30.5 88.9 17.9 94 102 A D H <4 S+ 0 0 92 -3,-1.7 -74,-0.2 -4,-0.1 -1,-0.2 0.620 116.0 43.0 -93.0 -17.9 -33.7 90.8 18.9 95 103 A V H << S+ 0 0 0 -4,-0.9 2,-0.3 -3,-0.5 -74,-0.3 0.757 114.4 43.1 -98.3 -33.8 -35.9 87.8 17.9 96 104 A F < - 0 0 2 -4,-2.2 -1,-0.1 -76,-0.2 -76,-0.1 -0.922 66.4-137.7-124.0 147.9 -33.9 84.8 19.2 97 105 A E > - 0 0 97 -2,-0.3 3,-2.2 1,-0.1 4,-0.4 -0.517 51.0 -75.8 -91.6 158.6 -32.1 83.9 22.5 98 106 A P T 3 S+ 0 0 100 0, 0.0 37,-0.2 0, 0.0 36,-0.2 -0.446 122.6 15.5 -60.6 121.6 -28.6 82.1 22.4 99 107 A G T 3 S+ 0 0 25 35,-0.4 36,-0.2 -2,-0.2 35,-0.1 0.357 93.4 107.9 96.7 -2.6 -29.3 78.5 21.6 100 108 A E S < S+ 0 0 31 -3,-2.2 2,-0.4 34,-0.5 -67,-0.4 0.765 74.6 57.2 -76.9 -26.9 -32.9 79.0 20.4 101 109 A V - 0 0 0 33,-2.1 -2,-0.2 -4,-0.4 -67,-0.2 -0.870 59.2-174.8-106.0 137.9 -31.9 78.3 16.7 102 110 A K + 0 0 98 -69,-3.3 38,-0.8 -2,-0.4 2,-0.3 0.616 68.2 19.4-105.4 -16.8 -30.2 75.1 15.8 103 111 A R E -ce 34 140A 69 -70,-0.9 -68,-2.9 36,-0.2 2,-0.5 -0.995 55.7-151.2-157.4 145.4 -29.3 75.7 12.1 104 112 A V E -ce 35 141A 0 36,-2.4 38,-2.5 -2,-0.3 2,-0.4 -0.989 15.3-157.2-119.9 126.1 -28.9 78.6 9.6 105 113 A Y E -ce 36 142A 11 -70,-2.6 -68,-2.2 -2,-0.5 2,-0.5 -0.897 8.3-174.5-105.5 132.6 -29.7 78.0 5.9 106 114 A L E -ce 37 143A 0 36,-2.5 38,-2.2 -2,-0.4 2,-0.5 -0.988 5.5-176.2-128.7 115.9 -28.1 80.2 3.3 107 115 A N E - 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