==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-APR-08 2VS1 . COMPND 2 MOLECULE: UNCHARACTERIZED RNA METHYLTRANSFERASE PYRAB10780; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS ABYSSI; . AUTHOR H.WALBOTT,N.LEULLIOT,H.GROSJEAN,B.GOLINELLI-PIMPANEAU . 399 4 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18910.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 279 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 20.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 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-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 36 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 78 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 1 0 0 2 0 0 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 0 3 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 PARALLEL BRIDGES PER LADDER . 5 0 4 0 3 2 1 0 1 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 0 0 0 1 0 1 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 -2 A G > 0 0 99 0, 0.0 3,-1.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -82.0 13.1 -16.2 -22.4 2 -1 A S G > + 0 0 73 1,-0.3 3,-1.3 2,-0.2 0, 0.0 0.652 360.0 70.3 -71.2 -19.7 10.7 -17.3 -19.6 3 0 A H G 3 S+ 0 0 143 1,-0.2 -1,-0.3 3,-0.0 16,-0.0 0.664 103.6 47.5 -61.5 -16.7 13.4 -18.5 -17.1 4 1 A M G < S+ 0 0 54 -3,-1.5 31,-3.1 31,-0.0 2,-0.3 0.099 109.2 69.8-113.0 14.8 14.3 -14.8 -16.7 5 2 A R E < +A 34 0A 104 -3,-1.3 2,-0.3 29,-0.2 29,-0.2 -0.995 59.1 87.6-141.9 144.8 10.7 -13.8 -16.2 6 3 A G E -A 33 0A 13 27,-1.9 27,-2.9 -2,-0.3 2,-0.4 -0.980 65.2 -63.9 160.4-177.9 8.0 -14.3 -13.6 7 4 A V E -A 32 0A 31 -2,-0.3 2,-0.3 25,-0.2 25,-0.2 -0.878 46.7-117.0-103.1 140.0 6.3 -13.1 -10.4 8 5 A I + 0 0 0 23,-2.2 22,-3.4 -2,-0.4 23,-0.2 -0.610 31.5 177.4 -72.9 129.9 8.2 -12.9 -7.1 9 6 A R + 0 0 182 9,-0.8 2,-0.3 -2,-0.3 -1,-0.2 0.707 60.8 11.2-105.8 -27.1 6.6 -15.2 -4.6 10 7 A K - 0 0 121 8,-0.5 8,-1.5 18,-0.1 2,-0.4 -0.936 57.5-133.0-148.9 161.6 8.9 -14.8 -1.6 11 8 A L B -B 17 0A 10 -2,-0.3 6,-0.3 6,-0.2 12,-0.0 -0.963 31.3-130.0-112.9 141.6 11.8 -12.7 -0.0 12 9 A N > - 0 0 41 4,-3.1 3,-2.3 -2,-0.4 71,-0.1 -0.129 40.9 -80.9 -80.0-174.2 14.7 -14.6 1.5 13 10 A D T 3 S+ 0 0 53 1,-0.3 -1,-0.1 2,-0.1 70,-0.0 0.780 131.0 52.5 -67.3 -25.6 16.0 -13.9 4.9 14 11 A D T 3 S- 0 0 97 2,-0.1 -1,-0.3 376,-0.0 378,-0.1 0.314 122.0-104.5 -86.9 7.0 18.1 -10.9 3.8 15 12 A G S < S+ 0 0 0 -3,-2.3 2,-0.4 1,-0.3 11,-0.4 0.632 74.8 137.1 83.0 13.7 15.0 -9.4 2.1 16 13 A F - 0 0 57 9,-0.1 -4,-3.1 10,-0.1 -1,-0.3 -0.802 53.3-121.6 -95.7 137.7 15.8 -10.2 -1.5 17 14 A G E -BC 11 24A 0 7,-1.7 7,-3.8 -2,-0.4 2,-0.5 -0.406 20.7-139.5 -67.1 151.6 13.1 -11.4 -3.8 18 15 A V E - C 0 23A 16 -8,-1.5 -9,-0.8 5,-0.2 2,-0.6 -0.960 16.3-173.9-120.7 122.9 13.6 -14.7 -5.5 19 16 A L E > S- C 0 22A 2 3,-2.7 3,-2.9 -2,-0.5 -11,-0.1 -0.923 76.3 -39.3-117.6 102.1 12.6 -15.3 -9.1 20 17 A K T 3 S- 0 0 128 -2,-0.6 3,-0.1 1,-0.3 -1,-0.1 0.835 126.8 -41.0 51.3 37.8 13.0 -18.9 -10.3 21 18 A G T 3 S+ 0 0 29 1,-0.3 24,-0.3 23,-0.0 -1,-0.3 0.194 114.2 118.7 101.1 -15.7 16.2 -19.1 -8.3 22 19 A I E < -C 19 0A 7 -3,-2.9 -3,-2.7 22,-0.1 2,-0.4 -0.645 62.7-130.8 -90.3 140.2 17.6 -15.6 -9.2 23 20 A L E -Cd 18 46A 21 22,-3.1 24,-3.1 -2,-0.3 -5,-0.2 -0.785 24.5-171.9 -85.7 133.8 18.1 -13.2 -6.2 24 21 A V E > -C 17 0A 0 -7,-3.8 -7,-1.7 -2,-0.4 3,-0.8 -0.874 11.1-148.0-132.3 100.0 16.5 -9.9 -7.0 25 22 A P T 3 S+ 0 0 30 0, 0.0 -9,-0.1 0, 0.0 3,-0.1 -0.390 79.2 22.4 -70.1 152.2 17.2 -7.0 -4.6 26 23 A F T 3 S+ 0 0 102 -11,-0.4 2,-0.2 41,-0.4 -10,-0.1 0.810 94.5 126.6 68.7 35.3 14.5 -4.4 -4.0 27 24 A S < - 0 0 0 -3,-0.8 -1,-0.3 -12,-0.3 43,-0.1 -0.672 45.8-143.8-119.5 169.8 11.6 -6.5 -5.2 28 25 A A > - 0 0 0 -2,-0.2 3,-2.5 -3,-0.1 -20,-0.4 -0.986 29.8 -94.0-133.5 142.9 8.4 -7.5 -3.6 29 26 A P T 3 S+ 0 0 15 0, 0.0 29,-0.4 0, 0.0 -20,-0.2 -0.405 116.9 30.3 -57.9 134.5 6.1 -10.6 -3.5 30 27 A G T 3 S+ 0 0 19 -22,-3.4 2,-0.2 1,-0.4 -21,-0.1 0.271 88.2 130.5 94.4 -8.8 3.6 -10.1 -6.4 31 28 A D < - 0 0 0 -3,-2.5 -23,-2.2 -23,-0.2 2,-0.5 -0.581 50.4-146.5 -67.2 141.8 6.0 -8.0 -8.6 32 29 A E E +AE 7 54A 44 22,-2.6 21,-2.9 -2,-0.2 22,-1.8 -0.951 31.8 170.6-111.6 131.0 6.1 -9.3 -12.1 33 30 A I E -AE 6 52A 0 -27,-2.9 -27,-1.9 -2,-0.5 2,-0.4 -0.913 36.6-142.2-139.5 161.2 9.6 -8.8 -13.5 34 31 A I E -AE 5 51A 44 17,-2.2 17,-2.9 -2,-0.3 2,-0.6 -0.992 22.9-140.9-124.4 122.9 12.1 -9.5 -16.3 35 32 A V E - E 0 50A 5 -31,-3.1 15,-0.3 -2,-0.4 3,-0.1 -0.721 18.3-177.4 -82.6 116.1 15.8 -10.1 -15.3 36 33 A E E + 0 0 90 13,-2.1 2,-0.3 -2,-0.6 14,-0.2 0.834 68.0 2.6 -88.5 -33.4 17.9 -8.4 -17.9 37 34 A R E - E 0 49A 165 12,-2.1 11,-2.8 -33,-0.0 12,-1.9 -0.974 62.3-162.0-152.8 142.3 21.3 -9.6 -16.5 38 35 A V E - E 0 47A 39 -2,-0.3 2,-0.3 9,-0.3 9,-0.2 -0.890 3.7-161.5-113.2 148.3 22.6 -11.7 -13.7 39 36 A E E - E 0 46A 104 7,-2.5 7,-2.2 -2,-0.3 2,-0.5 -0.729 27.3-109.6-109.7 172.1 25.9 -12.0 -11.9 40 37 A R E + E 0 45A 229 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.925 39.1 173.7 -97.9 127.2 27.4 -14.8 -9.8 41 38 A V E > S- E 0 44A 74 3,-3.8 3,-2.3 -2,-0.5 -2,-0.0 -0.945 73.0 -16.0-137.0 120.8 27.7 -13.8 -6.1 42 39 A K T 3 S- 0 0 210 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.914 127.6 -60.9 51.4 39.9 28.7 -16.2 -3.3 43 40 A K T 3 S+ 0 0 208 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.569 118.7 112.3 62.3 10.3 27.9 -18.8 -6.1 44 41 A R E < S- E 0 41A 122 -3,-2.3 -3,-3.8 -22,-0.0 2,-0.5 -0.876 73.1-114.0-106.1 148.1 24.2 -17.6 -6.2 45 42 A R E - E 0 40A 150 -2,-0.4 -22,-3.1 -24,-0.3 2,-0.4 -0.710 33.7-168.9 -83.4 121.5 22.8 -15.8 -9.2 46 43 A V E -dE 23 39A 27 -7,-2.2 -7,-2.5 -2,-0.5 2,-0.4 -0.914 24.4-122.7-116.1 131.9 21.9 -12.2 -8.6 47 44 A A E + E 0 38A 5 -24,-3.1 -9,-0.3 -2,-0.4 3,-0.1 -0.629 29.6 175.1 -68.5 126.1 19.9 -9.9 -10.9 48 45 A S E S+ 0 0 59 -11,-2.8 2,-0.4 -2,-0.4 -10,-0.2 0.715 75.6 25.4-102.0 -30.0 22.1 -6.8 -11.5 49 46 A Q E S+ E 0 37A 109 -12,-1.9 -13,-2.1 -3,-0.1 -12,-2.1 -0.996 75.6 151.8-133.2 133.8 19.7 -5.4 -14.1 50 47 A W E - E 0 35A 64 -2,-0.4 2,-0.4 -15,-0.3 -15,-0.2 -0.970 32.8-132.1-153.9 158.0 15.9 -6.1 -14.1 51 48 A K E - E 0 34A 103 -17,-2.9 -17,-2.2 -2,-0.3 2,-0.7 -0.962 17.3-131.9-120.1 134.8 12.7 -4.4 -15.2 52 49 A L E + E 0 33A 61 -2,-0.4 -19,-0.2 -19,-0.2 3,-0.1 -0.809 27.7 173.5 -82.2 115.0 9.5 -4.1 -13.1 53 50 A V E + 0 0 57 -21,-2.9 2,-0.4 -2,-0.7 -20,-0.2 0.743 69.5 14.6 -94.4 -32.1 6.6 -5.2 -15.4 54 51 A R E S- E 0 32A 123 -22,-1.8 -22,-2.6 0, 0.0 2,-0.4 -0.974 82.2-120.7-148.3 129.5 3.8 -5.2 -12.8 55 52 A S - 0 0 80 -2,-0.4 -24,-0.1 -24,-0.2 -22,-0.0 -0.568 20.2-124.8 -76.8 128.7 3.9 -3.6 -9.3 56 53 A S > - 0 0 5 -2,-0.4 3,-1.4 1,-0.1 -26,-0.1 -0.428 15.3-131.9 -57.6 139.8 3.3 -5.6 -6.2 57 54 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -27,-0.1 0.487 105.5 70.0 -72.2 -1.4 0.5 -4.2 -4.0 58 55 A L T 3 S+ 0 0 44 -29,-0.4 14,-3.0 13,-0.0 17,-0.2 0.427 80.6 104.1 -91.8 -9.7 3.0 -4.6 -1.0 59 56 A R B < F 71 0B 60 -3,-1.4 12,-0.2 12,-0.3 11,-0.1 -0.396 360.0 360.0 -72.5 149.3 5.1 -1.7 -2.5 60 57 A V 0 0 137 10,-2.2 -1,-0.2 -2,-0.1 11,-0.1 0.812 360.0 360.0 -91.6 360.0 5.1 1.7 -1.1 61 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 62 66 A K 0 0 141 0, 0.0 2,-0.3 0, 0.0 72,-0.2 0.000 360.0 360.0 360.0 139.6 16.7 6.1 0.8 63 67 A a > - 0 0 11 3,-0.2 3,-1.2 326,-0.1 2,-0.4 -0.978 360.0 -91.1-145.1 160.4 19.2 5.0 3.4 64 68 A G T 3 S+ 0 0 51 -2,-0.3 56,-0.1 1,-0.2 3,-0.1 -0.557 112.8 12.3 -75.4 124.2 22.2 2.7 3.7 65 69 A G T 3 S+ 0 0 51 -2,-0.4 2,-1.9 1,-0.1 -1,-0.2 0.295 90.7 125.7 96.5 -9.2 21.3 -0.8 4.8 66 70 A a X + 0 0 13 -3,-1.2 3,-1.1 1,-0.2 -3,-0.2 -0.477 18.7 152.7 -86.7 68.5 17.6 -0.1 4.1 67 71 A T T 3 + 0 0 29 -2,-1.9 -41,-0.4 1,-0.2 323,-0.2 0.554 69.7 50.7 -80.3 -7.7 16.9 -2.9 1.8 68 72 A L T > S+ 0 0 0 321,-2.8 3,-2.1 -3,-0.1 -1,-0.2 0.266 76.1 109.1-106.9 5.5 13.1 -3.2 2.7 69 73 A Q T < S+ 0 0 41 -3,-1.1 -1,-0.1 320,-0.6 -2,-0.1 0.690 70.4 58.9 -66.4 -22.1 12.4 0.6 2.2 70 74 A H T 3 S+ 0 0 27 -3,-0.2 -10,-2.2 -4,-0.2 2,-0.4 0.424 95.9 86.1 -79.9 -1.9 10.3 0.1 -1.0 71 75 A L B < S-F 59 0B 3 -3,-2.1 -12,-0.3 -12,-0.2 2,-0.1 -0.789 89.1-108.0 -99.0 138.5 8.0 -2.2 1.1 72 76 A N >> - 0 0 48 -14,-3.0 4,-2.2 -2,-0.4 3,-1.0 -0.430 30.3-115.9 -68.7 159.2 5.1 -0.8 3.0 73 77 A Y H 3> S+ 0 0 31 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.842 110.9 54.9 -69.7 -38.9 5.7 -0.9 6.7 74 78 A D H 3> S+ 0 0 117 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.820 109.7 48.2 -61.4 -33.7 2.9 -3.4 7.5 75 79 A Y H <> S+ 0 0 19 -3,-1.0 4,-3.3 2,-0.2 5,-0.3 0.901 105.6 57.1 -77.1 -38.7 4.3 -5.8 5.1 76 80 A Q H X S+ 0 0 1 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.941 109.6 48.9 -46.6 -48.6 7.9 -5.3 6.6 77 81 A L H X S+ 0 0 6 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.862 110.6 48.9 -63.4 -36.2 6.3 -6.4 9.9 78 82 A E H X S+ 0 0 62 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.916 109.3 51.4 -66.6 -43.5 4.7 -9.3 8.3 79 83 A F H X S+ 0 0 3 -4,-3.3 4,-2.5 1,-0.2 -2,-0.2 0.928 111.8 49.6 -58.8 -41.4 7.9 -10.5 6.7 80 84 A K H X S+ 0 0 1 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 0.884 109.1 50.3 -64.4 -39.0 9.6 -10.2 10.1 81 85 A R H X S+ 0 0 106 -4,-1.9 4,-2.1 1,-0.2 11,-0.3 0.856 114.7 44.3 -64.1 -38.8 6.9 -12.2 11.9 82 86 A K H X S+ 0 0 95 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.843 111.1 52.9 -77.7 -40.8 7.2 -14.9 9.4 83 87 A K H X S+ 0 0 19 -4,-2.5 4,-1.8 -5,-0.2 -2,-0.2 0.975 113.5 45.0 -55.6 -52.5 11.0 -14.8 9.4 84 88 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 6,-0.5 0.839 111.4 52.2 -59.6 -43.4 10.9 -15.3 13.2 85 89 A K H X S+ 0 0 105 -4,-2.1 4,-0.8 -5,-0.2 -1,-0.2 0.892 112.0 46.2 -60.4 -39.5 8.3 -18.0 13.0 86 90 A R H >< S+ 0 0 130 -4,-2.3 3,-1.4 2,-0.2 -2,-0.2 0.978 119.8 39.8 -64.8 -73.9 10.4 -20.0 10.4 87 91 A I H 3< S+ 0 0 42 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.808 126.2 32.8 -32.0 -62.2 13.6 -19.6 12.5 88 92 A L H 3< S- 0 0 21 -4,-2.9 -1,-0.2 2,-0.2 -3,-0.2 0.482 101.1-129.4 -82.3 -7.7 12.2 -20.0 16.1 89 93 A G S << S+ 0 0 62 -3,-1.4 2,-0.3 -4,-0.8 -4,-0.2 0.594 79.1 68.7 67.8 8.5 9.5 -22.5 14.9 90 94 A F S S- 0 0 68 -6,-0.5 -2,-0.2 2,-0.0 2,-0.2 -0.951 88.7 -83.4-148.8 177.7 6.8 -20.6 16.7 91 95 A E + 0 0 140 -2,-0.3 2,-0.4 -3,-0.1 -9,-0.1 -0.548 37.8 179.3 -92.5 142.7 4.9 -17.3 16.5 92 96 A V - 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