==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS/RNA 08-JUN-05 2BU1 . COMPND 2 MOLECULE: MS2 COAT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTERIOPHAGE MS2; . AUTHOR E.GRAHN,T.MOSS,C.HELGSTRAND,K.FRIDBORG,M.SUNDARAM,K.TARS, . 387 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20626.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 280 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 133 34.4 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.6 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 . 50 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 57 14.7 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 0 0 0 3 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 5 3 0 1 3 1 0 0 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 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 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 0 142 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 176.1 -115.0 -64.7 -16.4 2 2 A S - 0 0 34 260,-0.0 256,-0.1 3,-0.0 260,-0.0 -0.534 360.0-152.2 167.5 124.1 -112.7 -61.7 -16.9 3 3 A N S S+ 0 0 18 -2,-0.2 2,-1.9 1,-0.1 248,-0.1 0.445 70.7 101.7 -94.0 2.2 -113.7 -58.3 -15.5 4 4 A F + 0 0 15 257,-0.1 2,-0.2 243,-0.1 -1,-0.1 -0.531 57.3 130.5 -84.7 73.9 -111.8 -56.4 -18.1 5 5 A T - 0 0 56 -2,-1.9 2,-0.1 16,-0.1 -2,-0.0 -0.726 62.4 -92.2-121.7 170.7 -114.8 -55.5 -20.2 6 6 A Q + 0 0 120 -2,-0.2 2,-0.3 15,-0.1 15,-0.2 -0.447 46.2 177.4 -79.6 157.7 -116.3 -52.4 -21.7 7 7 A F E -A 20 0A 9 13,-2.0 13,-2.7 -2,-0.1 2,-0.8 -0.975 38.0 -92.2-155.1 164.5 -118.9 -50.4 -19.7 8 8 A V E +A 19 0A 49 -2,-0.3 11,-0.3 11,-0.2 3,-0.2 -0.752 35.0 177.6 -85.1 111.3 -121.0 -47.3 -19.9 9 9 A L E S+ 0 0 0 9,-2.1 2,-0.6 -2,-0.8 231,-0.5 0.909 76.9 32.1 -78.4 -45.3 -119.0 -44.4 -18.2 10 10 A V E S-A 18 0A 0 8,-1.8 8,-2.3 230,-0.1 2,-1.0 -0.951 74.1-157.2-119.2 113.8 -121.7 -41.8 -18.9 11 11 A D + 0 0 76 -2,-0.6 6,-0.1 225,-0.2 228,-0.0 -0.783 22.3 165.1 -92.1 99.5 -125.3 -42.9 -18.9 12 12 A N S > S- 0 0 66 -2,-1.0 3,-0.9 224,-0.0 -1,-0.1 -0.156 71.0 -88.5-102.4 34.6 -127.3 -40.4 -20.9 13 13 A G T 3 S- 0 0 50 1,-0.2 2,-1.9 3,-0.1 -2,-0.1 0.984 78.0 -51.1 56.7 79.2 -130.1 -42.9 -21.1 14 14 A G T 3 S+ 0 0 65 1,-0.1 2,-0.5 2,-0.1 -1,-0.2 0.156 125.3 79.5 51.8 -19.7 -129.4 -45.0 -24.2 15 15 A T S < S+ 0 0 121 -2,-1.9 -1,-0.1 -3,-0.9 -4,-0.0 -0.845 107.3 4.4-124.5 98.8 -129.0 -42.0 -26.6 16 16 A G S S+ 0 0 56 -2,-0.5 -1,-0.1 1,-0.2 -3,-0.1 0.567 87.7 165.4 105.5 16.3 -125.6 -40.2 -26.4 17 17 A D - 0 0 54 -5,-0.1 2,-0.8 -3,-0.1 -1,-0.2 -0.322 34.8-135.7 -63.7 145.5 -124.1 -42.7 -23.9 18 18 A V E -A 10 0A 22 -8,-2.3 -9,-2.1 16,-0.0 -8,-1.8 -0.904 26.3-175.4-106.7 104.0 -120.4 -42.6 -23.5 19 19 A T E -A 8 0A 54 -2,-0.8 16,-0.4 -11,-0.3 2,-0.4 -0.722 8.7-154.7 -96.9 152.9 -119.1 -46.2 -23.4 20 20 A V E -A 7 0A 0 -13,-2.7 -13,-2.0 -2,-0.3 14,-0.2 -0.984 8.0-158.8-130.3 135.9 -115.5 -47.0 -22.7 21 21 A A E -B 33 0B 32 12,-2.5 12,-2.1 -2,-0.4 -15,-0.1 -0.885 31.0 -88.6-121.6 152.2 -113.7 -50.1 -23.9 22 22 A P E +B 32 0B 43 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.239 49.5 160.8 -52.1 134.7 -110.5 -52.0 -22.8 23 23 A S E + 0 0 43 8,-2.5 2,-0.3 1,-0.4 9,-0.2 0.508 53.8 1.3-137.5 -12.0 -107.5 -50.6 -24.7 24 24 A N E -B 31 0B 52 7,-1.1 7,-2.6 1,-0.1 -1,-0.4 -0.916 30.4-178.0-176.4 149.5 -104.3 -51.5 -22.9 25 25 A F > + 0 0 68 -2,-0.3 3,-1.4 5,-0.2 5,-0.1 0.093 38.2 145.5-139.7 18.0 -102.8 -53.4 -20.0 26 26 A A G > S+ 0 0 15 1,-0.2 3,-1.5 2,-0.2 260,-0.1 -0.327 72.3 7.9 -62.1 141.6 -99.1 -52.7 -20.5 27 27 A N G 3 S- 0 0 116 1,-0.3 -1,-0.2 258,-0.3 3,-0.1 0.711 128.4 -67.3 60.0 25.0 -97.1 -52.3 -17.2 28 28 A G G < S+ 0 0 45 -3,-1.4 2,-0.7 1,-0.2 20,-0.4 0.626 103.5 123.7 75.1 11.2 -100.0 -53.5 -15.0 29 29 A V < - 0 0 58 -3,-1.5 2,-0.3 18,-0.1 18,-0.2 -0.919 53.8-146.4-108.9 111.1 -102.1 -50.4 -15.7 30 30 A A E - C 0 46B 0 16,-2.7 16,-2.1 -2,-0.7 2,-0.4 -0.598 21.3-165.2 -75.3 133.5 -105.5 -51.4 -17.1 31 31 A E E -BC 24 45B 17 -7,-2.6 -8,-2.5 -2,-0.3 -7,-1.1 -0.938 15.7-176.3-125.7 148.0 -106.8 -48.8 -19.6 32 32 A W E +BC 22 44B 0 12,-2.2 12,-2.3 -2,-0.4 2,-0.3 -0.988 8.1 177.0-137.3 141.5 -110.1 -48.0 -21.1 33 33 A I E -BC 21 43B 25 -12,-2.1 -12,-2.5 -2,-0.3 10,-0.2 -0.979 27.5-114.4-144.1 155.0 -110.9 -45.3 -23.8 34 34 A S - 0 0 7 8,-1.3 2,-2.2 -2,-0.3 -14,-0.2 -0.397 47.6 -85.9 -84.2 166.9 -114.0 -44.3 -25.8 35 35 A S S S+ 0 0 89 -16,-0.4 2,-0.3 -2,-0.1 -1,-0.1 -0.501 92.0 103.2 -74.1 78.2 -114.3 -44.6 -29.6 36 36 A N S S- 0 0 56 -2,-2.2 5,-0.1 6,-0.1 2,-0.1 -0.875 84.4 -73.1-146.2 175.7 -112.6 -41.4 -30.4 37 37 A S >> - 0 0 0 -2,-0.3 3,-1.6 1,-0.1 4,-0.8 -0.435 54.4-110.3 -68.8 155.9 -109.3 -40.1 -31.6 38 38 A R T 34 S+ 0 0 51 318,-0.6 317,-0.2 316,-0.4 -1,-0.1 0.729 118.3 60.4 -62.7 -20.1 -106.8 -40.4 -28.8 39 39 A S T 34 S+ 0 0 12 315,-1.6 -1,-0.3 1,-0.2 316,-0.1 0.676 114.9 31.8 -82.0 -16.6 -106.8 -36.6 -28.5 40 40 A Q T <4 S+ 0 0 30 -3,-1.6 -2,-0.2 314,-0.3 -1,-0.2 0.312 93.2 122.9-120.2 5.7 -110.5 -36.4 -27.7 41 41 A A < - 0 0 4 -4,-0.8 2,-0.2 -5,-0.1 -6,-0.1 -0.360 61.0-125.4 -78.2 149.6 -111.1 -39.7 -25.9 42 42 A Y - 0 0 26 22,-0.1 -8,-1.3 -2,-0.1 2,-0.4 -0.599 36.9-158.1 -78.6 151.7 -112.5 -40.2 -22.4 43 43 A K E -CD 33 63B 53 20,-1.7 20,-2.8 -2,-0.2 2,-0.4 -0.998 20.3-178.2-143.8 137.7 -109.9 -42.3 -20.5 44 44 A V E -CD 32 62B 0 -12,-2.3 -12,-2.2 -2,-0.4 2,-0.3 -1.000 8.4-178.1-133.3 132.1 -110.1 -44.5 -17.4 45 45 A T E -CD 31 61B 19 16,-2.5 16,-2.3 -2,-0.4 2,-0.3 -0.961 1.5-177.8-130.9 152.3 -107.1 -46.3 -15.9 46 46 A C E +CD 30 60B 2 -16,-2.1 -16,-2.7 -2,-0.3 2,-0.3 -0.987 5.7 167.9-151.4 137.0 -106.8 -48.7 -12.9 47 47 A S E - D 0 59B 32 12,-1.7 12,-2.5 -2,-0.3 2,-0.4 -0.983 16.1-152.6-146.4 154.0 -103.9 -50.4 -11.1 48 48 A V E + D 0 58B 44 -20,-0.4 2,-0.3 -2,-0.3 10,-0.2 -0.990 15.8 175.1-130.1 140.0 -103.6 -52.4 -7.9 49 49 A R E - D 0 57B 119 8,-1.7 8,-3.0 -2,-0.4 2,-1.6 -0.989 40.4-121.2-144.1 148.2 -100.4 -52.8 -5.8 50 50 A Q - 0 0 112 -2,-0.3 6,-0.2 6,-0.2 -2,-0.0 -0.729 38.4-178.0 -89.0 85.5 -99.6 -54.3 -2.5 51 51 A S + 0 0 44 -2,-1.6 2,-0.3 3,-0.0 5,-0.2 0.484 61.0 6.1 -65.2 -10.3 -98.3 -51.0 -1.2 52 52 A S S S- 0 0 57 3,-1.1 3,-0.3 1,-0.1 5,-0.1 -0.920 89.5 -87.9-158.6 178.5 -97.2 -52.3 2.2 53 53 A A S S+ 0 0 78 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.913 128.5 24.2 -63.9 -36.6 -96.9 -55.6 4.0 54 54 A Q S S+ 0 0 94 -3,-0.1 40,-1.9 39,-0.0 41,-0.3 0.182 113.5 67.9-118.6 20.5 -100.6 -55.2 5.2 55 55 A N E - E 0 93B 33 -3,-0.3 -3,-1.1 38,-0.3 2,-0.4 -0.932 52.2-157.2-136.3 158.4 -102.3 -52.9 2.6 56 56 A R E - E 0 92B 35 36,-1.6 36,-2.5 -2,-0.3 2,-0.4 -0.974 16.6-155.1-132.0 142.8 -103.4 -53.0 -1.0 57 57 A K E -DE 49 91B 40 -8,-3.0 -8,-1.7 -2,-0.4 2,-0.4 -0.979 6.2-157.7-131.3 125.6 -103.9 -49.8 -2.9 58 58 A Y E -DE 48 90B 2 32,-2.5 32,-2.3 -2,-0.4 2,-0.5 -0.834 7.0-163.4 -97.1 133.0 -106.0 -49.1 -5.9 59 59 A T E +DE 47 89B 43 -12,-2.5 -12,-1.7 -2,-0.4 2,-0.4 -0.977 13.7 179.0-119.2 116.7 -105.1 -46.2 -8.1 60 60 A I E -DE 46 88B 3 28,-2.7 28,-2.7 -2,-0.5 2,-0.4 -0.950 6.0-174.3-122.0 138.4 -107.9 -45.1 -10.4 61 61 A K E -DE 45 87B 61 -16,-2.3 -16,-2.5 -2,-0.4 2,-0.4 -0.994 4.4-172.7-134.9 139.7 -107.9 -42.2 -12.9 62 62 A V E -DE 44 86B 5 24,-2.0 24,-2.4 -2,-0.4 2,-0.5 -0.998 5.8-162.4-132.4 134.4 -110.6 -40.8 -15.1 63 63 A E E -DE 43 85B 22 -20,-2.8 -20,-1.7 -2,-0.4 22,-0.2 -0.975 3.5-171.0-119.2 120.3 -110.2 -38.1 -17.8 64 64 A V E - E 0 84B 10 20,-2.4 20,-2.6 -2,-0.5 2,-0.2 -0.939 15.6-156.7-112.3 113.0 -113.3 -36.2 -19.1 65 65 A P E - E 0 83B 10 0, 0.0 2,-0.8 0, 0.0 18,-0.2 -0.543 19.9-138.9 -93.1 156.5 -112.6 -34.0 -22.1 66 66 A K E - E 0 82B 80 16,-2.5 15,-2.5 -2,-0.2 16,-0.7 -0.923 36.0-142.2-107.7 98.9 -114.3 -31.0 -23.6 67 67 A V E + E 0 80B 82 -2,-0.8 2,-0.3 13,-0.2 13,-0.2 -0.305 31.3 157.5 -67.0 148.1 -114.1 -31.8 -27.3 68 68 A A E - E 0 79B 37 11,-2.2 11,-2.8 9,-0.0 2,-0.6 -0.974 40.4-117.2-162.5 163.2 -113.5 -29.1 -29.8 69 69 A T E - E 0 78B 96 -2,-0.3 2,-0.4 9,-0.2 7,-0.0 -0.957 33.6-165.8-112.8 117.0 -112.2 -28.5 -33.4 70 70 A Q E - E 0 77B 104 7,-2.4 7,-2.9 -2,-0.6 2,-0.8 -0.870 18.0-138.3-111.6 138.5 -109.1 -26.4 -33.5 71 71 A T E + E 0 76B 86 -2,-0.4 2,-0.6 5,-0.2 5,-0.2 -0.803 26.6 177.5 -92.7 105.3 -107.4 -24.7 -36.5 72 72 A V E > S- E 0 75B 75 3,-2.4 3,-1.4 -2,-0.8 -2,-0.0 -0.941 72.7 -14.8-112.0 116.9 -103.6 -25.1 -36.3 73 73 A G T 3 S- 0 0 84 -2,-0.6 -1,-0.2 1,-0.3 3,-0.1 0.843 130.5 -52.7 62.2 32.5 -101.6 -23.7 -39.2 74 74 A G T 3 S+ 0 0 68 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.344 117.7 105.4 86.7 -6.9 -104.7 -23.3 -41.3 75 75 A V E < -E 72 0B 92 -3,-1.4 -3,-2.4 -5,-0.0 2,-0.6 -0.870 69.1-121.4-112.1 143.2 -105.9 -27.0 -40.9 76 76 A E E -E 71 0B 138 -2,-0.4 -5,-0.2 -5,-0.2 -7,-0.0 -0.693 31.5-179.2 -86.9 121.8 -108.7 -28.4 -38.7 77 77 A L E -E 70 0B 47 -7,-2.9 -7,-2.4 -2,-0.6 2,-0.6 -0.921 32.0-118.9-120.8 140.8 -107.8 -30.9 -36.0 78 78 A P E +E 69 0B 33 0, 0.0 2,-0.2 0, 0.0 -9,-0.2 -0.671 54.2 153.7 -77.4 121.9 -110.0 -32.8 -33.5 79 79 A V E -E 68 0B 34 -11,-2.8 -11,-2.2 -2,-0.6 2,-0.5 -0.755 47.1-103.8-138.7-177.7 -108.7 -31.7 -30.1 80 80 A A E -E 67 0B 22 -13,-0.2 -13,-0.2 -2,-0.2 3,-0.1 -0.966 14.8-155.5-118.1 117.4 -109.7 -31.3 -26.5 81 81 A A E S- 0 0 62 -15,-2.5 2,-0.3 -2,-0.5 -1,-0.2 0.905 77.9 -32.8 -54.0 -42.9 -110.3 -27.7 -25.3 82 82 A W E -E 66 0B 43 -16,-0.7 -16,-2.5 -3,-0.1 2,-0.3 -0.963 61.5-128.4-167.5 169.6 -109.5 -28.9 -21.8 83 83 A R E -E 65 0B 38 -2,-0.3 2,-0.4 -18,-0.2 -20,-0.0 -0.975 6.0-144.0-134.1 148.0 -109.9 -31.9 -19.6 84 84 A S E -E 64 0B 2 -20,-2.6 -20,-2.4 -2,-0.3 2,-0.4 -0.880 24.1-151.9-106.2 139.8 -111.2 -32.6 -16.1 85 85 A Y E -EF 63 221B 88 136,-2.0 136,-3.0 -2,-0.4 2,-0.5 -0.950 14.2-166.9-122.8 137.8 -109.3 -35.2 -14.0 86 86 A L E -EF 62 220B 7 -24,-2.4 -24,-2.0 -2,-0.4 2,-0.5 -0.978 10.6-178.6-118.7 118.6 -110.4 -37.5 -11.2 87 87 A N E +EF 61 219B 67 132,-2.8 132,-2.6 -2,-0.5 2,-0.4 -0.976 7.1 174.6-118.1 122.9 -107.6 -39.2 -9.2 88 88 A M E -EF 60 218B 5 -28,-2.7 -28,-2.7 -2,-0.5 2,-0.4 -0.989 14.7-169.1-133.2 141.0 -108.5 -41.6 -6.5 89 89 A E E -EF 59 217B 75 128,-2.3 128,-2.6 -2,-0.4 2,-0.5 -0.994 5.5-167.4-126.0 130.5 -106.5 -43.9 -4.3 90 90 A L E -EF 58 216B 4 -32,-2.3 -32,-2.5 -2,-0.4 2,-0.6 -0.972 2.5-164.2-123.0 117.9 -108.1 -46.5 -2.1 91 91 A T E +EF 57 215B 28 124,-2.8 124,-2.1 -2,-0.5 -34,-0.2 -0.905 11.9 179.9-104.5 118.4 -106.1 -48.2 0.6 92 92 A I E -E 56 0B 0 -36,-2.5 -36,-1.6 -2,-0.6 122,-0.1 -0.966 27.4-120.6-121.2 129.7 -107.7 -51.4 1.9 93 93 A P E > -E 55 0B 1 0, 0.0 3,-2.0 0, 0.0 -38,-0.3 -0.362 22.1-121.6 -67.5 147.0 -106.2 -53.6 4.7 94 94 A I T 3 S+ 0 0 70 -40,-1.9 -39,-0.1 1,-0.3 117,-0.1 0.679 109.2 69.0 -61.4 -14.3 -105.4 -57.2 3.7 95 95 A F T 3 S+ 0 0 90 -41,-0.3 2,-0.4 116,-0.1 -1,-0.3 0.505 71.3 110.8 -83.7 -4.0 -107.7 -58.2 6.6 96 96 A A < - 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