==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/VIRAL PROTEIN 18-NOV-10 2XYQ . COMPND 2 MOLECULE: PUTATIVE 2'-O-METHYL TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SARS CORONAVIRUS; . AUTHOR E.DECROLY,C.DEBARNOT,F.FERRON,M.BOUVET,B.COUTARD,I.IMBERT,L. . 410 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19461.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 231 56.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 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 . 25 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 18.5 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+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 3 0 1 2 1 1 1 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 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 0 PARALLEL BRIDGES PER LADDER . 3 1 1 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 1 0 0 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 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 A A > 0 0 93 0, 0.0 4,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.8 14.0 69.4 3.4 2 2 A S H >> + 0 0 99 2,-0.2 3,-0.7 1,-0.2 4,-0.6 0.895 360.0 50.3 -67.5 -41.6 14.6 71.1 0.0 3 3 A Q H >4 S+ 0 0 82 1,-0.2 3,-1.0 2,-0.2 -1,-0.2 0.865 101.7 63.1 -62.0 -37.9 18.3 71.5 0.8 4 4 A A H 34 S+ 0 0 17 1,-0.2 236,-0.5 236,-0.1 237,-0.4 0.746 99.0 55.3 -60.7 -26.5 18.4 67.8 1.8 5 5 A W H << S+ 0 0 167 -3,-0.7 -1,-0.2 -4,-0.7 -2,-0.2 0.738 91.0 91.1 -76.5 -26.6 17.5 66.8 -1.8 6 6 A Q S << S- 0 0 83 -3,-1.0 235,-0.4 -4,-0.6 234,-0.1 -0.265 87.6-119.4 -67.2 154.5 20.5 68.8 -3.3 7 7 A P S S- 0 0 21 0, 0.0 187,-2.4 0, 0.0 188,-0.4 0.675 85.1 -46.5 -68.8 -12.2 23.8 67.1 -3.9 8 8 A G E -A 193 0A 1 185,-0.3 2,-0.4 186,-0.2 185,-0.2 -0.980 67.5 -72.6 170.6-166.7 25.2 69.7 -1.4 9 9 A V E -A 192 0A 13 183,-2.7 183,-2.7 -2,-0.3 2,-0.3 -0.965 29.5-150.0-125.7 127.0 25.3 73.4 -0.4 10 10 A A E -A 191 0A 27 -2,-0.4 181,-0.2 181,-0.2 179,-0.0 -0.727 36.4 -98.1 -91.5 143.1 27.1 76.3 -2.2 11 11 A M - 0 0 3 179,-2.3 179,-0.1 -2,-0.3 5,-0.1 -0.450 46.6-119.9 -59.4 116.5 28.4 79.3 -0.2 12 12 A P >> - 0 0 52 0, 0.0 4,-1.5 0, 0.0 3,-1.2 -0.277 13.5-120.1 -63.5 145.4 25.7 82.0 -0.5 13 13 A N H 3> S+ 0 0 102 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.838 111.6 67.2 -51.3 -38.4 26.7 85.3 -2.1 14 14 A L H 34 S+ 0 0 110 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.892 105.4 42.1 -47.5 -46.0 25.7 87.1 1.2 15 15 A Y H X4 S+ 0 0 41 -3,-1.2 3,-0.9 1,-0.2 -1,-0.2 0.806 109.2 57.3 -76.0 -32.3 28.6 85.3 2.9 16 16 A K H 3< S+ 0 0 18 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.839 102.2 57.5 -62.9 -33.9 31.1 85.9 -0.1 17 17 A M T 3< S+ 0 0 120 -4,-2.0 -1,-0.2 208,-0.1 -2,-0.2 0.510 89.3 100.8 -78.0 -7.8 30.5 89.7 0.2 18 18 A Q < - 0 0 67 -3,-0.9 207,-0.1 -4,-0.2 206,-0.0 -0.127 64.1-145.4 -73.4 172.3 31.6 89.8 3.9 19 19 A R + 0 0 214 205,-0.1 203,-0.1 206,-0.1 -1,-0.1 -0.355 37.0 174.2-132.6 53.8 35.0 91.0 5.3 20 20 A M - 0 0 53 201,-0.2 2,-0.2 1,-0.1 205,-0.2 -0.126 32.9-118.0 -66.8 151.2 35.2 88.6 8.2 21 21 A L - 0 0 152 203,-0.1 2,-0.4 1,-0.1 -1,-0.1 -0.609 43.8 -95.8 -78.9 151.2 38.1 88.1 10.6 22 22 A L + 0 0 66 -2,-0.2 2,-0.2 205,-0.1 202,-0.1 -0.605 51.5 175.9 -75.1 123.0 39.6 84.7 10.6 23 23 A E - 0 0 101 -2,-0.4 2,-0.2 201,-0.2 204,-0.1 -0.730 36.9 -90.3-115.0 168.6 38.2 82.4 13.3 24 24 A K - 0 0 175 -2,-0.2 2,-0.4 1,-0.1 -1,-0.0 -0.503 46.0-113.7 -70.4 148.6 38.7 78.8 14.2 25 25 A C - 0 0 14 -2,-0.2 203,-0.1 2,-0.1 175,-0.1 -0.757 12.3-147.7 -89.9 134.5 36.3 76.4 12.6 26 26 A D + 0 0 120 -2,-0.4 2,-0.3 201,-0.2 -1,-0.1 0.159 68.0 95.8 -85.0 18.0 33.8 74.6 15.0 27 27 A L - 0 0 41 2,-0.0 2,-0.4 173,-0.0 173,-0.1 -0.866 62.9-141.8-116.8 145.3 33.7 71.4 12.8 28 28 A Q - 0 0 145 170,-0.4 -2,-0.0 -2,-0.3 0, 0.0 -0.838 7.3-150.0-100.7 141.5 35.6 68.1 12.8 29 29 A N S S+ 0 0 62 -2,-0.4 2,-0.4 170,-0.2 170,-0.2 0.620 77.5 60.9 -87.5 -16.3 36.6 66.4 9.5 30 30 A Y + 0 0 92 168,-0.1 2,-0.3 2,-0.0 -2,-0.1 -0.924 61.2 129.9-116.2 140.4 36.4 62.8 10.7 31 31 A G - 0 0 64 -2,-0.4 2,-0.7 168,-0.0 168,-0.0 -0.942 63.3 -80.4-176.1 157.9 33.3 61.0 11.9 32 32 A E - 0 0 192 -2,-0.3 2,-0.8 1,-0.1 -2,-0.0 -0.613 51.5-140.9 -70.8 109.7 31.2 57.8 11.6 33 33 A N > - 0 0 41 -2,-0.7 3,-0.6 1,-0.2 -1,-0.1 -0.657 23.2-177.7 -87.9 109.1 29.1 58.6 8.5 34 34 A A T 3 S+ 0 0 99 -2,-0.8 -1,-0.2 1,-0.2 -2,-0.0 0.568 76.2 60.2 -78.8 -11.1 25.5 57.4 8.8 35 35 A V T 3 S+ 0 0 30 160,-0.2 -1,-0.2 203,-0.1 161,-0.1 0.596 73.3 103.7 -96.2 -10.4 24.4 58.6 5.3 36 36 A I S < S- 0 0 29 -3,-0.6 3,-0.1 159,-0.1 6,-0.1 -0.614 76.0-121.5 -75.7 120.3 26.8 56.6 3.1 37 37 A P > - 0 0 32 0, 0.0 3,-1.8 0, 0.0 8,-0.1 -0.161 42.9 -75.9 -60.7 157.3 24.9 53.7 1.6 38 38 A K T 3 S+ 0 0 187 1,-0.3 3,-0.1 3,-0.0 0, 0.0 -0.241 115.2 8.3 -62.7 136.4 26.1 50.1 2.3 39 39 A G T 3 S+ 0 0 53 1,-0.2 284,-0.4 -3,-0.1 2,-0.4 0.449 100.5 121.2 75.7 1.2 29.2 49.0 0.4 40 40 A I < - 0 0 19 -3,-1.8 -1,-0.2 282,-0.1 2,-0.2 -0.820 61.2-128.2 -99.5 134.3 29.7 52.5 -1.0 41 41 A M >> - 0 0 24 -2,-0.4 4,-2.3 282,-0.4 3,-0.6 -0.560 18.4-122.2 -76.9 143.6 33.0 54.4 -0.4 42 42 A M H 3> S+ 0 0 51 1,-0.2 4,-3.0 -2,-0.2 5,-0.1 0.897 113.6 52.2 -47.0 -45.8 32.8 57.9 1.0 43 43 A N H 3> S+ 0 0 27 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.790 105.6 52.1 -71.1 -28.0 34.8 59.2 -2.0 44 44 A V H <> S+ 0 0 0 -3,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.945 114.6 44.3 -65.6 -48.2 32.4 57.6 -4.5 45 45 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.911 115.7 48.1 -58.9 -46.2 29.5 59.3 -2.7 46 46 A K H X S+ 0 0 12 -4,-3.0 4,-2.0 -5,-0.2 -2,-0.2 0.929 114.2 43.5 -63.5 -50.5 31.4 62.6 -2.4 47 47 A Y H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.829 110.4 57.7 -66.5 -34.1 32.6 62.7 -6.1 48 48 A T H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.956 109.6 43.8 -60.0 -48.8 29.1 61.7 -7.2 49 49 A Q H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.849 111.6 54.9 -65.4 -34.2 27.5 64.7 -5.4 50 50 A L H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.955 110.9 44.5 -59.8 -49.8 30.3 66.9 -6.8 51 51 A C H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.883 110.1 55.2 -64.7 -39.0 29.5 65.8 -10.4 52 52 A Q H < S+ 0 0 27 -4,-2.4 4,-0.3 2,-0.2 -1,-0.2 0.903 111.3 45.5 -57.0 -43.7 25.8 66.2 -9.7 53 53 A Y H >< S+ 0 0 28 -4,-2.2 3,-1.7 1,-0.2 4,-0.3 0.902 108.8 54.5 -65.6 -43.4 26.5 69.8 -8.7 54 54 A L H >< S+ 0 0 1 -4,-2.6 3,-1.4 1,-0.3 5,-0.4 0.803 97.5 67.1 -61.1 -28.7 28.8 70.4 -11.7 55 55 A N T 3< S+ 0 0 50 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.667 95.5 56.7 -60.6 -21.2 25.8 69.3 -13.9 56 56 A T T < S+ 0 0 97 -3,-1.7 -1,-0.2 -4,-0.3 2,-0.2 0.514 98.4 78.3 -89.2 -7.7 23.9 72.5 -12.7 57 57 A L S < S- 0 0 20 -3,-1.4 2,-1.8 -4,-0.3 -3,-0.0 -0.584 93.4-102.5-103.7 165.3 26.7 74.8 -14.0 58 58 A T + 0 0 68 -2,-0.2 2,-0.2 216,-0.1 -3,-0.1 -0.380 52.9 172.2 -86.2 59.9 27.6 76.0 -17.5 59 59 A L - 0 0 2 -2,-1.8 2,-0.4 -5,-0.4 104,-0.1 -0.477 34.5-122.8 -67.9 134.7 30.6 73.7 -18.0 60 60 A A - 0 0 3 102,-0.6 104,-0.1 65,-0.2 217,-0.1 -0.668 27.4-170.7 -74.0 131.7 32.1 73.7 -21.5 61 61 A V - 0 0 2 -2,-0.4 194,-2.2 215,-0.3 193,-0.9 -0.770 4.8-167.8-129.7 85.3 32.0 70.2 -22.9 62 62 A P > - 0 0 6 0, 0.0 3,-0.6 0, 0.0 192,-0.2 -0.246 35.3-109.9 -66.8 162.7 34.1 69.9 -26.1 63 63 A Y T 3 S+ 0 0 195 192,-0.4 2,-0.4 1,-0.3 193,-0.1 0.800 119.5 36.7 -61.8 -32.4 33.8 66.8 -28.4 64 64 A N T 3 S- 0 0 129 29,-0.1 -1,-0.3 2,-0.0 29,-0.1 -0.664 91.5-170.8-121.4 73.6 37.4 65.8 -27.3 65 65 A M < - 0 0 2 -3,-0.6 29,-2.4 -2,-0.4 2,-0.5 -0.344 12.3-150.2 -74.0 145.3 37.4 66.8 -23.7 66 66 A R E +b 94 0A 17 27,-0.2 59,-2.3 -2,-0.1 60,-1.3 -0.970 18.0 176.6-120.7 120.5 40.6 66.9 -21.6 67 67 A V E -bc 95 126A 0 27,-2.8 29,-2.4 -2,-0.5 2,-0.4 -0.982 10.6-167.0-128.9 132.4 40.3 66.3 -17.9 68 68 A I E -bc 96 127A 0 58,-2.2 60,-2.5 -2,-0.4 2,-0.5 -0.978 5.0-161.2-121.9 134.7 43.1 66.0 -15.3 69 69 A H E -bc 97 128A 0 27,-2.9 29,-2.1 -2,-0.4 3,-0.4 -0.938 5.4-163.8-122.0 108.4 42.6 64.7 -11.8 70 70 A F E S+bc 98 129A 0 58,-3.0 60,-2.6 -2,-0.5 61,-0.3 -0.689 73.0 21.4 -92.0 146.3 45.2 65.5 -9.0 71 71 A G S S+ 0 0 1 27,-0.7 28,-0.2 -2,-0.3 -1,-0.2 0.900 76.3 149.6 66.6 45.0 45.3 63.5 -5.7 72 72 A A + 0 0 0 26,-2.9 10,-0.4 -3,-0.4 9,-0.3 0.580 38.6 87.9 -86.7 -15.1 43.5 60.6 -7.2 73 73 A G - 0 0 0 25,-0.3 2,-0.2 6,-0.1 6,-0.2 -0.555 57.7-158.8 -87.9 150.2 45.0 57.8 -5.1 74 74 A S > - 0 0 18 4,-1.1 3,-1.3 339,-0.3 -2,-0.0 -0.715 36.8-106.9-114.8 173.0 43.8 56.5 -1.8 75 75 A D T 3 S+ 0 0 159 1,-0.2 -1,-0.0 -2,-0.2 -2,-0.0 0.637 120.7 68.0 -70.3 -12.9 45.5 54.6 1.1 76 76 A K T 3 S- 0 0 85 2,-0.2 -1,-0.2 214,-0.0 3,-0.1 0.616 113.0-121.9 -76.2 -17.0 43.4 51.8 -0.3 77 77 A G S < S+ 0 0 22 -3,-1.3 27,-3.0 1,-0.3 2,-0.2 0.519 79.0 95.6 85.2 6.9 45.5 51.8 -3.4 78 78 A V B S-h 104 0B 1 25,-0.2 -4,-1.1 243,-0.0 -1,-0.3 -0.650 73.6-121.7-120.3 177.6 42.5 52.4 -5.8 79 79 A A > + 0 0 4 25,-0.5 4,-2.1 -2,-0.2 27,-0.3 -0.701 33.1 163.6-127.5 79.7 40.9 55.5 -7.4 80 80 A P H > S+ 0 0 2 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.896 81.1 50.4 -62.6 -43.9 37.2 55.9 -6.4 81 81 A G H > S+ 0 0 0 332,-2.0 4,-2.4 -9,-0.3 5,-0.1 0.890 109.8 50.0 -60.4 -45.1 37.0 59.5 -7.5 82 82 A T H > S+ 0 0 0 -10,-0.4 4,-2.8 1,-0.2 -1,-0.2 0.899 107.2 55.0 -61.0 -42.7 38.6 58.7 -10.9 83 83 A A H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.875 109.9 47.0 -58.4 -39.2 36.0 55.9 -11.3 84 84 A V H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.926 110.9 51.0 -68.0 -45.1 33.2 58.4 -10.7 85 85 A L H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.912 109.7 50.7 -56.9 -43.8 34.8 60.9 -13.2 86 86 A R H < S+ 0 0 19 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.855 112.0 47.8 -62.3 -37.4 35.0 58.1 -15.8 87 87 A Q H < S+ 0 0 16 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.873 117.7 42.5 -66.7 -39.7 31.3 57.3 -15.2 88 88 A W H < S+ 0 0 0 -4,-2.5 162,-2.6 161,-0.1 -2,-0.2 0.905 100.4 76.0 -76.8 -46.9 30.3 61.0 -15.4 89 89 A L S < S- 0 0 5 -4,-3.1 3,-0.1 160,-0.2 163,-0.1 -0.241 94.3 -87.0 -72.7 154.8 32.4 62.3 -18.4 90 90 A P > - 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