==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS/RNA 04-DEC-98 1ZDK . COMPND 2 MOLECULE: PROTEIN (MS2 PROTEIN CAPSID); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIO PHAGE MS2; . AUTHOR E.GRAHN,N.J.STONEHOUSE,K.VALEGARD,S.VANDENWORM,L.LILJAS . 387 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24824.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 278 71.8 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 . 127 32.8 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 . 5 1.3 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 . 52 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 2 0 0 0 0 0 0 2 1 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 4 0 0 0 3 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 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 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 0 162 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-160.1 2.0 128.8 32.0 2 2 A S - 0 0 58 150,-0.1 260,-0.1 151,-0.0 151,-0.0 -0.179 360.0-150.6 142.5 120.8 3.1 125.7 30.1 3 3 A N S S+ 0 0 146 -2,-0.2 2,-2.5 1,-0.1 0, 0.0 0.459 72.9 103.4 -92.2 -0.6 6.5 124.5 31.1 4 4 A F + 0 0 19 257,-0.1 2,-0.2 18,-0.0 -1,-0.1 -0.416 56.4 124.7 -80.7 69.3 7.1 123.2 27.6 5 5 A T - 0 0 71 -2,-2.5 2,-0.2 1,-0.1 -2,-0.0 -0.627 63.4 -92.0-118.2 177.3 9.3 126.0 26.6 6 6 A Q + 0 0 116 -2,-0.2 2,-0.3 15,-0.1 15,-0.2 -0.517 41.6 174.8 -91.5 163.0 12.8 126.3 25.3 7 7 A F E -A 20 0A 81 13,-1.9 13,-2.9 -2,-0.2 2,-0.7 -0.970 38.7 -94.0-159.2 161.7 16.0 126.8 27.3 8 8 A V E -A 19 0A 68 -2,-0.3 11,-0.3 11,-0.3 3,-0.2 -0.807 32.3-177.8 -89.0 115.3 19.7 126.9 27.0 9 9 A L E S+ 0 0 52 9,-2.1 2,-0.6 -2,-0.7 -1,-0.2 0.902 79.3 32.1 -76.7 -49.1 21.1 123.4 27.6 10 10 A V E S-A 18 0A 47 8,-1.8 8,-2.5 2,-0.0 2,-1.1 -0.943 77.1-158.2-113.2 110.6 24.8 124.5 27.3 11 11 A D + 0 0 106 -2,-0.6 6,-0.1 6,-0.2 2,-0.1 -0.778 16.8 173.6 -90.7 101.7 25.4 128.0 28.5 12 12 A N > - 0 0 95 -2,-1.1 3,-1.1 1,-0.0 5,-0.1 -0.207 67.6 -85.7 -98.7 41.5 28.6 129.2 26.8 13 13 A G T 3 S- 0 0 54 1,-0.2 2,-0.6 3,-0.1 -2,-0.1 0.978 82.9 -49.7 54.0 71.3 28.0 132.6 28.3 14 14 A G T 3 S+ 0 0 59 2,-0.1 2,-0.4 1,-0.1 -1,-0.2 0.244 128.0 74.4 60.2 -11.6 25.8 134.2 25.6 15 15 A T S < S+ 0 0 124 -3,-1.1 3,-0.1 -2,-0.6 -1,-0.1 -0.790 107.3 7.9-140.2 101.4 27.9 133.2 22.6 16 16 A G S S+ 0 0 57 -2,-0.4 2,-0.2 1,-0.3 -1,-0.1 0.561 87.4 160.2 103.5 16.5 27.9 129.6 21.4 17 17 A D - 0 0 46 -5,-0.1 2,-0.7 -6,-0.1 -1,-0.3 -0.506 37.9-135.8 -68.7 139.7 25.1 128.8 23.8 18 18 A V E -A 10 0A 24 -8,-2.5 -9,-2.1 -2,-0.2 -8,-1.8 -0.907 24.5-171.8-100.6 108.7 23.3 125.6 22.8 19 19 A T E -A 8 0A 57 -2,-0.7 16,-0.5 -11,-0.3 2,-0.4 -0.858 8.5-152.4-103.6 147.1 19.6 126.2 23.2 20 20 A V E -A 7 0A 0 -13,-2.9 -13,-1.9 -2,-0.4 14,-0.2 -0.945 9.8-158.4-119.7 130.7 17.1 123.4 22.9 21 21 A A E -B 33 0B 35 12,-2.7 12,-2.4 -2,-0.4 -15,-0.1 -0.873 29.6 -91.5-115.2 150.8 13.5 123.9 21.7 22 22 A P E +B 32 0B 41 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.321 48.4 162.7 -55.8 131.3 10.3 121.8 22.2 23 23 A S E + 0 0 43 8,-2.8 2,-0.3 1,-0.4 9,-0.2 0.563 51.7 2.8-132.4 -8.9 9.8 119.4 19.3 24 24 A N E -B 31 0B 48 7,-1.0 7,-2.5 1,-0.1 -1,-0.4 -0.945 30.6-175.6-174.4 148.8 7.3 116.6 20.0 25 25 A F > + 0 0 40 -2,-0.3 3,-1.5 5,-0.2 132,-0.6 0.055 38.8 146.0-139.6 23.1 5.0 115.4 22.6 26 26 A A G > S+ 0 0 16 1,-0.3 3,-1.0 2,-0.2 260,-0.1 -0.423 72.7 7.4 -68.1 130.4 3.9 112.2 20.9 27 27 A N G 3 S- 0 0 93 258,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.690 126.7 -69.2 71.8 24.5 3.3 109.4 23.4 28 28 A G G < S+ 0 0 8 -3,-1.5 2,-0.7 1,-0.2 20,-0.3 0.706 102.8 125.8 70.2 16.6 3.6 111.5 26.4 29 29 A V < - 0 0 55 -3,-1.0 2,-0.4 18,-0.1 18,-0.2 -0.944 53.6-146.7-111.4 107.8 7.3 112.0 25.9 30 30 A A E - C 0 46B 9 16,-2.4 16,-2.1 -2,-0.7 2,-0.4 -0.600 21.4-167.3 -71.9 125.2 8.2 115.6 25.9 31 31 A E E -BC 24 45B 19 -7,-2.5 -8,-2.8 -2,-0.4 -7,-1.0 -0.925 14.9-177.6-119.4 148.6 11.1 116.1 23.4 32 32 A W E +BC 22 44B 28 12,-2.2 12,-2.5 -2,-0.4 2,-0.3 -0.995 8.9 176.2-139.1 131.9 13.4 119.1 22.9 33 33 A I E -BC 21 43B 26 -12,-2.4 -12,-2.7 -2,-0.3 10,-0.2 -0.920 27.5-113.3-136.3 161.8 16.1 119.2 20.2 34 34 A S - 0 0 6 8,-1.3 2,-1.2 -2,-0.3 -14,-0.2 -0.536 46.0 -85.5 -88.9 163.0 18.6 121.9 19.1 35 35 A S S S+ 0 0 95 -16,-0.5 2,-0.3 -2,-0.2 -1,-0.1 -0.567 89.1 97.4 -70.4 98.4 18.5 123.6 15.6 36 36 A N S S- 0 0 55 -2,-1.2 5,-0.1 320,-0.1 2,-0.1 -0.937 87.2 -65.9-164.5 177.8 20.5 121.1 13.6 37 37 A S > - 0 0 1 -2,-0.3 3,-1.4 1,-0.1 4,-0.4 -0.442 56.6-112.8 -69.5 150.5 20.0 118.2 11.3 38 38 A R T 3 S+ 0 0 67 318,-0.6 3,-0.3 316,-0.3 317,-0.2 0.693 118.2 63.8 -62.5 -14.3 18.4 115.5 13.4 39 39 A S T 3 S+ 0 0 13 315,-1.3 -1,-0.2 1,-0.2 316,-0.1 0.751 113.0 32.4 -80.2 -22.5 21.7 113.6 12.9 40 40 A Q S < S+ 0 0 28 -3,-1.4 -2,-0.2 314,-0.2 -1,-0.2 0.158 94.6 121.1-117.8 13.8 23.7 116.3 14.7 41 41 A A - 0 0 5 -4,-0.4 2,-0.4 -3,-0.3 -6,-0.1 -0.475 61.4-125.1 -90.1 153.1 21.2 117.6 17.3 42 42 A Y - 0 0 47 -2,-0.2 -8,-1.3 -23,-0.1 2,-0.4 -0.761 35.5-160.3 -81.7 136.1 21.3 117.7 21.1 43 43 A K E -CD 33 63B 64 20,-1.3 20,-2.3 -2,-0.4 2,-0.4 -0.966 16.4-175.8-127.3 139.4 18.2 115.9 22.3 44 44 A V E -CD 32 62B 11 -12,-2.5 -12,-2.2 -2,-0.4 2,-0.3 -0.999 8.6-175.9-131.3 128.2 16.4 116.1 25.7 45 45 A T E -CD 31 61B 22 16,-2.6 16,-2.2 -2,-0.4 2,-0.3 -0.960 3.1-177.8-127.5 146.6 13.4 113.9 26.5 46 46 A C E +CD 30 60B 35 -16,-2.1 -16,-2.4 -2,-0.3 2,-0.3 -0.968 6.7 165.9-146.3 130.1 11.2 113.8 29.6 47 47 A S E - D 0 59B 35 12,-1.2 12,-3.1 -2,-0.3 2,-0.4 -0.990 17.5-154.6-143.4 144.8 8.3 111.7 30.7 48 48 A V E + D 0 58B 42 -20,-0.3 2,-0.3 -2,-0.3 10,-0.2 -0.991 16.5 176.7-119.8 133.3 6.5 111.1 34.1 49 49 A R E - D 0 57B 138 8,-2.1 8,-3.3 -2,-0.4 2,-2.1 -0.976 40.6-117.6-137.7 142.0 4.6 107.9 34.9 50 50 A Q E - 0 0 91 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.612 39.7-175.5 -78.1 81.9 2.9 106.8 38.0 51 51 A S E + 0 0 47 -2,-2.1 2,-0.3 3,-0.1 5,-0.2 0.610 60.1 5.4 -58.0 -21.4 5.3 103.9 38.4 52 52 A S E > S- D 0 55B 55 3,-1.3 3,-0.6 -3,-0.1 5,-0.1 -0.891 89.5 -89.1-150.5 178.6 3.6 102.3 41.4 53 53 A A T 3 S+ 0 0 85 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.903 129.6 27.5 -63.0 -33.3 0.5 102.9 43.5 54 54 A Q T 3 S+ 0 0 80 -3,-0.1 40,-2.2 39,-0.0 41,-0.3 0.150 114.7 65.4-117.8 21.9 2.6 105.3 45.6 55 55 A N E < -DE 52 93B 45 -3,-0.6 -3,-1.3 38,-0.3 2,-0.4 -0.957 53.1-155.2-139.8 163.5 5.3 106.6 43.4 56 56 A R E - E 0 92B 26 36,-2.2 36,-2.6 -2,-0.3 2,-0.5 -0.969 16.6-154.8-136.7 138.5 5.8 108.7 40.4 57 57 A K E -DE 49 91B 34 -8,-3.3 -8,-2.1 -2,-0.4 2,-0.4 -0.976 3.7-159.5-127.5 121.0 8.8 108.2 38.2 58 58 A Y E -DE 48 90B 61 32,-2.3 32,-2.2 -2,-0.5 2,-0.6 -0.801 6.7-160.3 -93.1 133.9 10.4 110.9 35.9 59 59 A T E -DE 47 89B 38 -12,-3.1 -12,-1.2 -2,-0.4 2,-0.4 -0.930 11.8-178.2-120.5 105.9 12.6 109.6 33.1 60 60 A I E -DE 46 88B 43 28,-2.3 28,-3.1 -2,-0.6 2,-0.4 -0.888 1.3-177.2-107.8 133.2 15.0 112.2 31.8 61 61 A K E -DE 45 87B 67 -16,-2.2 -16,-2.6 -2,-0.4 2,-0.3 -0.994 2.3-174.6-132.4 131.9 17.3 111.5 28.9 62 62 A V E -DE 44 86B 20 24,-1.9 24,-2.7 -2,-0.4 2,-0.4 -0.981 6.4-162.4-129.0 140.2 19.9 113.9 27.4 63 63 A E E -DE 43 85B 25 -20,-2.3 -20,-1.3 -2,-0.3 22,-0.2 -0.990 2.2-170.4-125.8 124.0 22.2 113.3 24.3 64 64 A V E - E 0 84B 56 20,-2.2 20,-2.4 -2,-0.4 2,-0.2 -0.958 16.7-153.3-113.8 110.9 25.3 115.4 23.6 65 65 A P E - E 0 83B 11 0, 0.0 2,-0.7 0, 0.0 18,-0.2 -0.514 17.1-140.4 -86.4 158.7 26.8 114.8 20.1 66 66 A K E - E 0 82B 109 16,-2.4 15,-2.9 -2,-0.2 16,-0.8 -0.954 38.3-141.2-110.3 100.0 30.3 115.2 18.9 67 67 A V E + E 0 80B 79 -2,-0.7 2,-0.3 13,-0.3 13,-0.3 -0.376 31.5 156.8 -71.6 149.5 29.6 116.7 15.5 68 68 A A E - E 0 79B 32 11,-2.6 11,-3.1 -2,-0.1 2,-0.5 -0.946 40.0-119.1-159.0 168.8 31.4 115.9 12.3 69 69 A T E - E 0 78B 94 -2,-0.3 2,-0.5 9,-0.2 7,-0.0 -0.982 33.4-165.4-119.5 114.3 31.2 115.8 8.5 70 70 A Q E - E 0 77B 103 7,-2.4 7,-2.6 -2,-0.5 2,-1.1 -0.887 18.3-137.7-111.2 138.0 31.6 112.4 7.1 71 71 A T E + E 0 76B 88 -2,-0.5 2,-0.4 5,-0.2 3,-0.4 -0.707 29.9 175.1 -92.2 92.3 32.3 111.4 3.5 72 72 A V E > S- E 0 75B 74 3,-1.8 3,-3.3 -2,-1.1 -2,-0.0 -0.800 70.1 -8.6 -98.1 138.5 30.1 108.4 2.7 73 73 A G T 3 S- 0 0 79 -2,-0.4 -1,-0.2 1,-0.3 3,-0.1 0.800 130.4 -56.9 47.1 32.4 30.1 107.1 -0.9 74 74 A G T 3 S+ 0 0 71 -3,-0.4 2,-0.3 1,-0.3 -1,-0.3 0.388 119.6 104.7 83.9 -6.2 32.1 110.1 -2.0 75 75 A V E < S-E 72 0B 92 -3,-3.3 -3,-1.8 -5,-0.0 2,-0.5 -0.839 70.5-119.7-110.5 151.8 29.6 112.5 -0.7 76 76 A E E +E 71 0B 138 -2,-0.3 -5,-0.2 -5,-0.3 -3,-0.0 -0.787 30.9 178.1 -94.3 123.6 29.7 114.7 2.4 77 77 A L E -E 70 0B 48 -7,-2.6 -7,-2.4 -2,-0.5 2,-0.5 -0.905 33.5-115.8-124.0 141.9 27.0 114.3 5.1 78 78 A P E +E 69 0B 32 0, 0.0 -9,-0.2 0, 0.0 2,-0.2 -0.667 53.7 157.3 -75.2 127.3 26.5 116.1 8.5 79 79 A V E -E 68 0B 31 -11,-3.1 -11,-2.6 -2,-0.5 2,-0.5 -0.752 45.8-106.7-143.5 178.2 26.9 113.5 11.1 80 80 A A E -E 67 0B 25 -13,-0.3 -13,-0.3 -2,-0.2 3,-0.1 -0.987 15.5-154.6-117.4 117.5 27.8 112.8 14.8 81 81 A A E S- 0 0 60 -15,-2.9 2,-0.3 -2,-0.5 -14,-0.1 0.887 78.0 -29.1 -53.8 -41.5 31.2 111.3 15.4 82 82 A W E -E 66 0B 155 -16,-0.8 -16,-2.4 -3,-0.1 2,-0.3 -0.944 61.7-128.2-164.5 172.4 29.7 109.9 18.7 83 83 A R E -E 65 0B 49 -2,-0.3 2,-0.4 -18,-0.2 -20,-0.0 -0.997 6.3-145.4-137.6 142.3 27.2 110.6 21.4 84 84 A S E -E 64 0B 69 -20,-2.4 -20,-2.2 -2,-0.3 2,-0.5 -0.885 22.3-149.9-104.1 134.3 27.3 110.8 25.1 85 85 A Y E -E 63 0B 136 -2,-0.4 2,-0.4 -22,-0.2 -22,-0.2 -0.942 11.5-167.7-114.5 120.1 24.1 109.6 26.9 86 86 A L E -E 62 0B 81 -24,-2.7 -24,-1.9 -2,-0.5 2,-0.4 -0.863 10.2-176.4-100.9 135.7 22.7 110.8 30.2 87 87 A N E +E 61 0B 100 -2,-0.4 2,-0.4 -26,-0.2 -26,-0.2 -0.932 5.4 173.1-133.8 109.8 20.0 108.7 31.7 88 88 A M E -E 60 0B 66 -28,-3.1 -28,-2.3 -2,-0.4 2,-0.4 -0.945 12.8-174.1-124.2 140.3 18.2 109.7 34.9 89 89 A E E -E 59 0B 119 -2,-0.4 2,-0.5 -30,-0.2 -30,-0.2 -0.993 6.5-168.3-127.1 129.3 15.2 108.3 36.7 90 90 A L E -E 58 0B 43 -32,-2.2 -32,-2.3 -2,-0.4 2,-0.6 -0.957 3.6-162.0-119.7 122.7 13.9 110.0 39.7 91 91 A T E -E 57 0B 74 -2,-0.5 -34,-0.2 -34,-0.2 -2,-0.0 -0.930 10.6-177.5-108.9 120.0 11.3 108.2 41.9 92 92 A I E -E 56 0B 7 -36,-2.6 -36,-2.2 -2,-0.6 2,-0.1 -0.908 26.4-120.3-118.3 135.0 9.2 110.4 44.2 93 93 A P E > -E 55 0B 63 0, 0.0 3,-1.8 0, 0.0 -38,-0.3 -0.423 24.1-121.1 -68.4 148.3 6.6 109.1 46.7 94 94 A I T 3 S+ 0 0 12 -40,-2.2 75,-2.0 1,-0.3 74,-0.5 0.704 110.6 68.6 -64.4 -12.2 3.1 110.4 46.2 95 95 A F T 3 S+ 0 0 20 -41,-0.3 2,-0.4 73,-0.2 -1,-0.3 0.463 71.3 117.4 -85.3 -4.2 3.4 111.8 49.8 96 96 A A < - 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