==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS/RNA 21-OCT-05 2C4Q . COMPND 2 MOLECULE: COAT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIO PHAGE 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) . 20619.0 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 . 132 34.1 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 . 34 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 14.5 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 0 0 0 3 0 0 0 0 0 0 1 2 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 1 1 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 0 140 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-161.0 -115.0 -64.5 -16.3 2 2 A S - 0 0 28 245,-0.0 256,-0.1 3,-0.0 260,-0.0 -0.214 360.0-152.0 150.9 115.7 -112.6 -61.6 -16.9 3 3 A N S S+ 0 0 18 -2,-0.2 2,-2.1 254,-0.1 248,-0.1 0.480 71.4 103.3 -87.4 -0.3 -113.7 -58.3 -15.4 4 4 A F + 0 0 15 257,-0.1 2,-0.3 243,-0.1 -1,-0.1 -0.505 56.4 129.2 -82.2 75.5 -111.7 -56.4 -18.1 5 5 A T - 0 0 55 -2,-2.1 2,-0.1 16,-0.1 15,-0.0 -0.808 63.0 -93.3-126.2 166.0 -114.8 -55.5 -20.2 6 6 A Q + 0 0 121 -2,-0.3 2,-0.3 15,-0.1 15,-0.2 -0.423 45.5 177.0 -76.7 154.9 -116.3 -52.4 -21.7 7 7 A F E -A 20 0A 9 13,-2.0 13,-2.9 -2,-0.1 2,-0.7 -0.963 37.8 -92.2-152.6 165.7 -118.9 -50.4 -19.7 8 8 A V E +A 19 0A 51 -2,-0.3 11,-0.3 11,-0.2 3,-0.2 -0.766 34.6 178.5 -86.8 113.0 -121.0 -47.3 -19.9 9 9 A L E S+ 0 0 0 9,-2.1 2,-0.5 -2,-0.7 231,-0.5 0.922 76.4 31.2 -78.6 -47.8 -119.1 -44.5 -18.3 10 10 A V E S-A 18 0A 0 8,-1.9 8,-2.4 230,-0.1 2,-0.7 -0.956 76.7-155.2-116.9 117.5 -121.7 -41.8 -18.9 11 11 A D + 0 0 79 -2,-0.5 6,-0.1 225,-0.2 228,-0.0 -0.821 24.6 162.4 -97.1 111.4 -125.3 -42.9 -19.0 12 12 A N S > S- 0 0 65 -2,-0.7 3,-1.3 224,-0.0 5,-0.1 -0.357 73.5 -81.4-118.2 47.4 -127.6 -40.7 -21.0 13 13 A G T 3 S- 0 0 54 1,-0.2 2,-1.0 3,-0.1 -2,-0.1 0.965 84.1 -54.2 49.7 79.6 -130.5 -43.2 -21.3 14 14 A G T 3 S+ 0 0 65 2,-0.1 2,-0.4 1,-0.1 -1,-0.2 0.347 123.7 85.8 41.1 -1.1 -129.2 -45.3 -24.2 15 15 A T S < S+ 0 0 114 -3,-1.3 3,-0.1 -2,-1.0 -1,-0.1 -0.911 101.9 2.8-133.7 111.1 -128.7 -42.3 -26.6 16 16 A G S S+ 0 0 62 -2,-0.4 -1,-0.1 1,-0.3 -3,-0.1 0.606 91.4 161.2 91.5 14.6 -125.5 -40.2 -26.6 17 17 A D - 0 0 47 -5,-0.1 2,-0.7 -6,-0.1 -1,-0.3 -0.363 38.2-134.1 -67.1 147.2 -124.2 -42.6 -24.0 18 18 A V E -A 10 0A 24 -8,-2.4 -9,-2.1 -3,-0.1 -8,-1.9 -0.910 25.9-175.7-108.1 105.9 -120.4 -42.7 -23.5 19 19 A T E -A 8 0A 56 -2,-0.7 16,-0.4 -11,-0.3 2,-0.4 -0.753 9.3-154.0 -99.6 152.2 -119.1 -46.3 -23.4 20 20 A V E -A 7 0A 0 -13,-2.9 -13,-2.0 -2,-0.3 14,-0.2 -0.968 8.9-159.0-127.5 138.2 -115.5 -47.0 -22.7 21 21 A A E -B 33 0B 33 12,-2.8 12,-2.1 -2,-0.4 -15,-0.1 -0.894 31.1 -88.3-123.9 153.2 -113.6 -50.2 -23.8 22 22 A P E +B 32 0B 42 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.277 50.5 159.1 -53.8 130.6 -110.4 -52.1 -22.8 23 23 A S E + 0 0 44 8,-2.7 2,-0.3 1,-0.4 9,-0.2 0.529 54.9 4.9-133.9 -13.0 -107.5 -50.6 -24.7 24 24 A N E +B 31 0B 49 7,-1.1 7,-2.8 1,-0.1 -1,-0.4 -0.934 31.5 178.8-172.3 147.7 -104.3 -51.5 -22.9 25 25 A F > + 0 0 68 -2,-0.3 3,-1.2 5,-0.2 5,-0.1 0.116 38.1 145.0-138.8 18.3 -102.8 -53.4 -20.0 26 26 A A G > S+ 0 0 17 1,-0.2 3,-1.4 2,-0.2 260,-0.1 -0.326 71.7 8.6 -63.6 140.5 -99.1 -52.7 -20.4 27 27 A N G 3 S- 0 0 118 258,-0.3 -1,-0.2 1,-0.3 3,-0.1 0.767 128.6 -67.7 60.3 30.2 -97.1 -52.3 -17.2 28 28 A G G < S+ 0 0 48 -3,-1.2 2,-0.6 1,-0.2 20,-0.4 0.641 104.1 123.6 68.7 14.0 -100.0 -53.6 -15.1 29 29 A V < - 0 0 61 -3,-1.4 2,-0.4 18,-0.1 18,-0.2 -0.932 53.7-146.0-110.2 112.7 -102.1 -50.5 -15.7 30 30 A A E - C 0 46B 0 16,-2.6 16,-2.0 -2,-0.6 2,-0.3 -0.629 20.5-165.7 -78.3 132.9 -105.5 -51.4 -17.1 31 31 A E E -BC 24 45B 18 -7,-2.8 -8,-2.7 -2,-0.4 -7,-1.1 -0.925 15.2-175.6-124.7 147.4 -106.8 -48.8 -19.6 32 32 A W E +BC 22 44B 0 12,-2.2 12,-2.3 -2,-0.3 2,-0.3 -0.992 9.0 178.0-135.9 140.2 -110.2 -48.0 -21.2 33 33 A I E -BC 21 43B 27 -12,-2.1 -12,-2.8 -2,-0.3 10,-0.2 -0.950 27.0-114.1-140.3 161.5 -110.9 -45.4 -23.8 34 34 A S - 0 0 5 8,-1.1 2,-2.2 -2,-0.3 -14,-0.2 -0.497 47.0 -87.7 -89.8 164.4 -114.0 -44.2 -25.8 35 35 A S S S+ 0 0 93 -16,-0.4 2,-0.3 -2,-0.2 -1,-0.1 -0.487 91.7 102.1 -74.2 79.7 -114.3 -44.6 -29.6 36 36 A N S S- 0 0 56 -2,-2.2 2,-0.2 6,-0.1 5,-0.1 -0.841 85.1 -70.8-146.0 178.7 -112.6 -41.3 -30.4 37 37 A S >> - 0 0 1 -2,-0.3 3,-2.2 1,-0.1 4,-0.7 -0.528 54.8-109.2 -73.5 149.1 -109.3 -40.1 -31.6 38 38 A R T 34 S+ 0 0 57 318,-0.7 3,-0.3 1,-0.3 317,-0.2 0.767 120.1 59.5 -51.3 -25.6 -106.8 -40.5 -28.8 39 39 A S T 34 S+ 0 0 11 315,-1.9 -1,-0.3 1,-0.2 316,-0.1 0.704 113.8 33.0 -79.3 -19.8 -106.8 -36.7 -28.5 40 40 A Q T <4 S+ 0 0 32 -3,-2.2 -1,-0.2 314,-0.3 -2,-0.2 0.245 94.0 121.0-118.5 12.3 -110.6 -36.5 -27.8 41 41 A A < - 0 0 5 -4,-0.7 2,-0.2 -3,-0.3 -6,-0.1 -0.478 62.3-123.1 -87.7 149.8 -111.1 -39.7 -25.8 42 42 A Y - 0 0 28 -2,-0.2 -8,-1.1 -23,-0.1 2,-0.4 -0.580 36.4-156.7 -76.4 148.5 -112.5 -40.3 -22.4 43 43 A K E -CD 33 63B 68 20,-1.5 20,-2.5 -2,-0.2 2,-0.4 -0.994 19.2-179.5-138.7 136.1 -109.9 -42.3 -20.4 44 44 A V E -CD 32 62B 0 -12,-2.3 -12,-2.2 -2,-0.4 2,-0.3 -1.000 7.4-179.0-133.0 132.8 -110.1 -44.6 -17.4 45 45 A T E -CD 31 61B 21 16,-2.5 16,-2.3 -2,-0.4 2,-0.3 -0.975 1.3-178.9-132.8 149.4 -107.1 -46.3 -15.8 46 46 A C E +CD 30 60B 1 -16,-2.0 -16,-2.6 -2,-0.3 2,-0.3 -0.998 5.8 165.3-147.9 143.5 -106.9 -48.7 -12.9 47 47 A S E - D 0 59B 32 12,-1.3 12,-2.8 -2,-0.3 2,-0.4 -0.984 17.5-152.2-155.5 152.2 -104.1 -50.5 -11.1 48 48 A V E + D 0 58B 43 -20,-0.4 2,-0.3 -2,-0.3 10,-0.2 -0.991 15.7 175.2-129.2 138.6 -103.6 -52.4 -7.8 49 49 A R E - D 0 57B 119 8,-1.9 8,-3.0 -2,-0.4 2,-1.8 -0.984 40.1-121.8-141.0 148.3 -100.4 -52.8 -5.8 50 50 A Q - 0 0 114 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.619 38.2-178.9 -89.5 77.2 -99.6 -54.3 -2.5 51 51 A S + 0 0 50 -2,-1.8 2,-0.3 3,-0.1 -1,-0.2 0.617 62.3 12.0 -51.1 -22.6 -98.2 -51.0 -1.3 52 52 A S S S- 0 0 57 3,-1.4 3,-0.1 -3,-0.1 5,-0.1 -0.838 89.0 -93.5-144.7-178.0 -97.3 -52.4 2.1 53 53 A A S S+ 0 0 79 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.920 127.6 25.1 -67.6 -38.9 -96.9 -55.7 3.9 54 54 A Q S S+ 0 0 95 -3,-0.1 40,-1.9 39,-0.0 2,-0.3 0.217 113.7 70.3-114.2 18.1 -100.5 -55.2 5.1 55 55 A N E - E 0 93B 36 38,-0.2 -3,-1.4 -3,-0.1 2,-0.4 -0.968 51.9-159.4-135.8 149.4 -102.2 -52.9 2.6 56 56 A R E - E 0 92B 36 36,-2.2 36,-2.8 -2,-0.3 2,-0.5 -0.974 17.2-157.0-123.9 138.3 -103.4 -53.0 -1.0 57 57 A K E -DE 49 91B 36 -8,-3.0 -8,-1.9 -2,-0.4 2,-0.5 -0.971 6.5-157.2-126.1 126.6 -103.9 -49.8 -2.9 58 58 A Y E -DE 48 90B 2 32,-2.7 32,-2.4 -2,-0.5 2,-0.5 -0.848 7.6-162.4 -98.4 133.0 -106.1 -49.2 -5.9 59 59 A T E -DE 47 89B 39 -12,-2.8 -12,-1.3 -2,-0.5 2,-0.4 -0.970 13.1-179.7-118.3 116.8 -105.1 -46.2 -8.1 60 60 A I E -DE 46 88B 3 28,-2.7 28,-2.9 -2,-0.5 2,-0.4 -0.943 6.8-175.0-121.3 138.1 -107.9 -45.0 -10.4 61 61 A K E -DE 45 87B 66 -16,-2.3 -16,-2.5 -2,-0.4 2,-0.4 -0.997 1.9-175.3-134.4 134.8 -107.8 -42.2 -12.9 62 62 A V E -DE 44 86B 5 24,-2.3 24,-2.8 -2,-0.4 2,-0.5 -0.994 6.1-163.2-130.0 136.7 -110.6 -40.8 -15.1 63 63 A E E -DE 43 85B 24 -20,-2.5 -20,-1.5 -2,-0.4 22,-0.2 -0.973 1.4-168.8-123.4 120.3 -110.3 -38.1 -17.7 64 64 A V E - E 0 84B 11 20,-2.3 20,-2.6 -2,-0.5 2,-0.2 -0.920 16.0-153.8-108.4 116.6 -113.4 -36.2 -19.1 65 65 A P E - E 0 83B 11 0, 0.0 2,-0.8 0, 0.0 18,-0.2 -0.574 17.8-142.1 -94.5 155.4 -112.7 -34.1 -22.2 66 66 A K E - E 0 82B 81 16,-2.4 15,-2.8 -2,-0.2 16,-0.7 -0.933 36.0-142.3-107.8 100.7 -114.4 -31.0 -23.6 67 67 A V E + E 0 80B 81 -2,-0.8 2,-0.3 13,-0.2 13,-0.2 -0.376 31.4 155.3 -71.9 145.5 -114.2 -31.8 -27.3 68 68 A A E - E 0 79B 39 11,-2.5 11,-2.8 -2,-0.1 2,-0.5 -0.977 41.2-115.4-159.9 164.8 -113.5 -29.1 -29.9 69 69 A T E - E 0 78B 97 -2,-0.3 2,-0.4 9,-0.2 7,-0.0 -0.950 34.1-165.2-110.8 120.1 -112.2 -28.5 -33.4 70 70 A Q E - E 0 77B 112 7,-2.5 7,-2.9 -2,-0.5 2,-0.7 -0.893 16.2-139.2-114.3 140.0 -109.0 -26.4 -33.6 71 71 A T E + E 0 76B 88 -2,-0.4 2,-0.5 5,-0.2 5,-0.2 -0.825 27.2 172.1 -95.8 111.9 -107.4 -24.7 -36.5 72 72 A V E > S- E 0 75B 76 3,-2.8 3,-1.4 -2,-0.7 -2,-0.0 -0.985 73.1 -6.4-121.7 125.9 -103.6 -25.0 -36.4 73 73 A G T 3 S- 0 0 81 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.880 131.8 -57.1 58.0 36.5 -101.5 -23.8 -39.4 74 74 A G T 3 S+ 0 0 71 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.633 117.6 110.4 70.3 14.7 -104.8 -23.2 -41.2 75 75 A V E < -E 72 0B 87 -3,-1.4 -3,-2.8 -5,-0.0 2,-0.5 -0.958 67.2-122.0-125.4 142.5 -105.9 -26.8 -40.8 76 76 A E E +E 71 0B 143 -2,-0.4 -5,-0.2 -5,-0.2 -7,-0.0 -0.703 30.6 179.0 -87.9 124.1 -108.7 -28.3 -38.7 77 77 A L E -E 70 0B 46 -7,-2.9 -7,-2.5 -2,-0.5 2,-0.4 -0.922 32.1-117.5-123.1 144.7 -107.8 -31.0 -36.1 78 78 A P E +E 69 0B 33 0, 0.0 2,-0.2 0, 0.0 -9,-0.2 -0.686 55.5 146.4 -79.7 128.1 -110.0 -32.9 -33.6 79 79 A V E -E 68 0B 34 -11,-2.8 -11,-2.5 -2,-0.4 2,-0.5 -0.834 49.6 -95.9-149.5-175.4 -108.9 -31.9 -30.1 80 80 A A E -E 67 0B 22 -2,-0.2 -13,-0.2 -13,-0.2 3,-0.1 -0.966 14.5-156.2-116.9 121.7 -109.8 -31.2 -26.5 81 81 A A E S- 0 0 62 -15,-2.8 2,-0.3 -2,-0.5 -1,-0.2 0.918 80.1 -33.0 -57.5 -44.0 -110.4 -27.6 -25.3 82 82 A W E -E 66 0B 42 -16,-0.7 -16,-2.4 -3,-0.1 2,-0.3 -0.947 62.9-128.2-164.8 172.3 -109.6 -28.8 -21.8 83 83 A R E -E 65 0B 34 -2,-0.3 2,-0.4 -18,-0.2 -20,-0.0 -0.971 7.7-139.7-135.1 150.1 -109.9 -31.9 -19.6 84 84 A S E -E 64 0B 2 -20,-2.6 -20,-2.3 -2,-0.3 2,-0.5 -0.894 24.2-150.3-106.7 137.9 -111.3 -32.6 -16.2 85 85 A Y E -EF 63 221B 82 136,-2.0 136,-3.2 -2,-0.4 2,-0.5 -0.946 14.4-170.8-121.1 128.7 -109.2 -35.1 -14.1 86 86 A L E +EF 62 220B 4 -24,-2.8 -24,-2.3 -2,-0.5 2,-0.5 -0.954 9.6 179.4-113.1 121.0 -110.3 -37.5 -11.3 87 87 A N E +EF 61 219B 61 132,-2.8 132,-2.4 -2,-0.5 2,-0.4 -0.979 6.4 175.6-123.1 119.4 -107.6 -39.2 -9.3 88 88 A M E -EF 60 218B 4 -28,-2.9 -28,-2.7 -2,-0.5 2,-0.4 -0.974 15.5-166.6-130.5 142.4 -108.5 -41.6 -6.6 89 89 A E E -EF 59 217B 75 128,-2.5 128,-2.6 -2,-0.4 2,-0.5 -0.989 5.4-167.9-124.5 129.1 -106.5 -43.8 -4.3 90 90 A L E -EF 58 216B 3 -32,-2.4 -32,-2.7 -2,-0.4 2,-0.6 -0.961 2.5-164.7-120.9 116.1 -108.2 -46.5 -2.2 91 91 A T E -EF 57 215B 30 124,-2.9 124,-2.0 -2,-0.5 -34,-0.2 -0.892 10.6-179.3-104.0 118.7 -106.2 -48.2 0.6 92 92 A I E -E 56 0B 0 -36,-2.8 -36,-2.2 -2,-0.6 122,-0.1 -0.953 26.4-123.3-119.4 130.0 -107.7 -51.5 1.9 93 93 A P E > -E 55 0B 1 0, 0.0 3,-2.0 0, 0.0 -38,-0.2 -0.417 22.6-122.1 -69.4 147.2 -106.1 -53.6 4.7 94 94 A I T 3 S+ 0 0 67 -40,-1.9 -39,-0.1 1,-0.3 117,-0.1 0.686 108.7 68.4 -62.0 -16.5 -105.4 -57.2 3.8 95 95 A F T 3 S+ 0 0 93 -41,-0.3 2,-0.3 116,-0.1 -1,-0.3 0.516 73.1 112.0 -81.3 -4.9 -107.7 -58.3 6.6 96 96 A A < - 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