==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS 06-AUG-97 1MVB . COMPND 2 MOLECULE: BACTERIOPHAGE MS2 CAPSID; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIO PHAGE MS2; . AUTHOR S.VANDENWORM,K.VALEGARD,N.J.STONEHOUSE,L.LILJAS . 387 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24864.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 271 70.0 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 . 125 32.3 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 . 2 0.5 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-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 . 48 12.4 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 . 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 3 0 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 4 5 0 0 1 2 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 . 1 0 0 1 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 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 0 154 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.2 2.0 128.9 31.8 2 2 A S - 0 0 62 151,-0.0 260,-0.0 150,-0.0 151,-0.0 -0.552 360.0-151.4 178.3 123.4 3.0 125.8 29.8 3 3 A N S S+ 0 0 150 -2,-0.3 2,-2.1 1,-0.1 0, 0.0 0.501 70.6 105.1 -91.6 1.5 6.3 124.6 31.1 4 4 A F + 0 0 25 257,-0.1 2,-0.3 17,-0.0 -1,-0.1 -0.517 55.8 132.5 -81.4 79.0 7.0 123.2 27.6 5 5 A T - 0 0 67 -2,-2.1 2,-0.1 16,-0.1 15,-0.1 -0.832 60.7 -93.9-127.8 167.3 9.4 125.9 26.6 6 6 A Q + 0 0 127 -2,-0.3 2,-0.3 15,-0.1 15,-0.2 -0.460 44.2 175.4 -79.1 150.9 12.8 126.3 25.0 7 7 A F E -A 20 0A 77 13,-2.0 13,-2.7 -2,-0.1 2,-0.7 -0.968 37.7 -96.5-151.2 163.0 15.9 126.7 27.3 8 8 A V E -A 19 0A 74 -2,-0.3 11,-0.3 11,-0.2 3,-0.2 -0.786 32.0-177.8 -92.6 114.3 19.6 126.9 27.1 9 9 A L E S+ 0 0 52 9,-1.6 2,-0.5 -2,-0.7 10,-0.2 0.882 76.8 30.9 -74.2 -44.4 21.2 123.5 27.6 10 10 A V E S-A 18 0A 45 8,-2.0 8,-2.2 2,-0.0 2,-1.0 -0.973 74.8-154.9-121.3 113.5 24.8 124.6 27.4 11 11 A D + 0 0 116 -2,-0.5 6,-0.1 6,-0.2 8,-0.0 -0.775 19.0 171.8 -92.7 101.2 25.5 128.1 28.5 12 12 A N > - 0 0 91 -2,-1.0 3,-1.0 1,-0.0 -1,-0.1 -0.146 67.4 -88.6 -97.2 33.7 28.7 129.2 26.7 13 13 A G T 3 S- 0 0 57 1,-0.3 2,-1.3 3,-0.1 -2,-0.1 0.972 81.5 -50.8 60.5 62.1 28.2 132.7 28.1 14 14 A G T 3 S+ 0 0 62 1,-0.1 2,-0.7 2,-0.0 3,-0.4 0.004 126.0 86.8 70.6 -31.2 26.0 134.2 25.3 15 15 A T S < S- 0 0 121 -2,-1.3 -1,-0.1 -3,-1.0 -4,-0.0 -0.790 106.7 -4.7-110.0 101.5 28.4 133.0 22.5 16 16 A G S S+ 0 0 56 -2,-0.7 2,-0.2 1,-0.2 -1,-0.2 0.787 85.0 169.1 91.7 26.1 27.8 129.5 21.2 17 17 A D - 0 0 46 -3,-0.4 2,-0.7 -6,-0.1 -1,-0.2 -0.576 33.5-132.5 -69.1 136.5 25.2 128.7 23.7 18 18 A V E -A 10 0A 22 -8,-2.2 -8,-2.0 -2,-0.2 -9,-1.6 -0.877 28.9-174.5 -94.8 116.4 23.4 125.5 22.9 19 19 A T E -A 8 0A 58 -2,-0.7 16,-0.6 -11,-0.3 2,-0.3 -0.928 8.5-155.2-115.1 143.7 19.7 126.1 23.2 20 20 A V E -AB 7 34A 0 -13,-2.7 -13,-2.0 -2,-0.4 14,-0.2 -0.901 7.5-158.4-120.9 140.7 17.1 123.4 22.9 21 21 A A E - B 0 33A 34 12,-2.2 12,-2.0 -2,-0.3 -15,-0.1 -0.931 32.0 -88.0-127.0 150.9 13.4 123.9 21.8 22 22 A P E + B 0 32A 38 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.285 51.1 160.3 -52.2 129.9 10.2 121.9 22.2 23 23 A S E + 0 0 41 8,-2.8 2,-0.3 1,-0.4 9,-0.2 0.508 53.0 2.7-134.1 -10.7 9.9 119.4 19.3 24 24 A N E + B 0 31A 53 7,-1.0 7,-2.5 1,-0.1 -1,-0.4 -0.945 30.8 179.2-172.8 151.6 7.5 116.6 20.0 25 25 A F > + 0 0 43 -2,-0.3 3,-1.7 5,-0.2 132,-0.6 0.069 37.4 146.3-142.6 17.9 5.1 115.3 22.6 26 26 A A G > S+ 0 0 17 1,-0.3 3,-1.2 2,-0.2 260,-0.1 -0.352 73.8 9.2 -63.5 137.1 3.9 112.2 20.8 27 27 A N G 3 S- 0 0 93 258,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.688 129.6 -69.1 66.4 21.5 3.1 109.3 23.2 28 28 A G G < S+ 0 0 9 -3,-1.7 2,-0.6 1,-0.2 20,-0.3 0.724 101.6 126.3 73.4 19.0 3.5 111.5 26.2 29 29 A V < - 0 0 54 -3,-1.2 2,-0.3 18,-0.1 -1,-0.2 -0.954 52.9-145.4-113.0 110.5 7.3 112.0 25.8 30 30 A A E - C 0 46A 10 16,-2.3 16,-1.8 -2,-0.6 2,-0.4 -0.604 22.2-169.1 -74.2 131.4 8.2 115.6 25.8 31 31 A E E -BC 24 45A 17 -7,-2.5 -8,-2.8 -2,-0.3 -7,-1.0 -0.948 16.5-175.8-127.0 148.4 11.2 116.2 23.4 32 32 A W E -BC 22 44A 32 12,-2.1 12,-2.6 -2,-0.4 2,-0.3 -0.989 9.7-178.2-138.0 129.2 13.4 119.2 22.8 33 33 A I E -BC 21 43A 26 -12,-2.0 -12,-2.2 -2,-0.4 10,-0.2 -0.930 27.3-111.7-128.8 155.9 16.1 119.2 20.1 34 34 A S E -B 20 0A 6 8,-1.7 2,-2.3 -2,-0.3 -14,-0.2 -0.382 46.2 -88.6 -77.5 167.5 18.7 121.8 19.2 35 35 A S S S+ 0 0 93 -16,-0.6 2,-0.2 -2,-0.1 323,-0.1 -0.404 91.3 97.0 -78.8 68.9 18.5 123.7 15.9 36 36 A N S S- 0 0 59 -2,-2.3 2,-0.1 6,-0.1 5,-0.1 -0.762 86.3 -66.3-137.8-174.7 20.4 121.2 13.7 37 37 A S >> - 0 0 1 -2,-0.2 3,-1.6 1,-0.1 4,-0.6 -0.460 55.5-109.6 -73.1 151.8 19.8 118.4 11.4 38 38 A R T 34 S+ 0 0 64 318,-0.7 3,-0.2 1,-0.3 317,-0.2 0.731 118.9 61.4 -57.6 -23.8 18.3 115.5 13.3 39 39 A S T 34 S+ 0 0 14 315,-1.8 -1,-0.3 1,-0.2 316,-0.1 0.737 114.0 31.7 -75.9 -24.4 21.7 113.7 12.8 40 40 A Q T <4 S+ 0 0 32 -3,-1.6 -2,-0.2 314,-0.3 -1,-0.2 0.242 94.0 123.6-117.1 12.3 23.7 116.3 14.7 41 41 A A < - 0 0 4 -4,-0.6 2,-0.3 -3,-0.2 -6,-0.1 -0.398 59.6-127.6 -85.8 149.8 21.2 117.5 17.3 42 42 A Y - 0 0 48 -23,-0.1 -8,-1.7 -2,-0.1 2,-0.4 -0.683 35.8-162.4 -78.2 146.8 21.3 117.7 21.0 43 43 A K E -CD 33 63A 67 20,-1.4 20,-2.0 -2,-0.3 2,-0.4 -0.997 17.2-174.6-141.4 138.2 18.2 116.0 22.3 44 44 A V E -CD 32 62A 11 -12,-2.6 -12,-2.1 -2,-0.4 2,-0.3 -0.991 7.9-176.7-130.6 133.3 16.4 116.1 25.7 45 45 A T E -CD 31 61A 24 16,-2.2 16,-2.0 -2,-0.4 2,-0.3 -0.962 2.3-178.9-130.1 151.6 13.4 113.9 26.6 46 46 A C E +CD 30 60A 34 -16,-1.8 -16,-2.3 -2,-0.3 2,-0.3 -0.980 6.4 164.5-150.6 137.1 11.2 113.8 29.7 47 47 A S E - D 0 59A 41 12,-1.0 12,-2.7 -2,-0.3 2,-0.4 -0.974 17.5-154.1-150.9 147.5 8.2 111.7 30.7 48 48 A V E + D 0 58A 41 -20,-0.3 2,-0.3 -2,-0.3 10,-0.2 -0.989 15.5 175.3-124.4 137.5 6.5 111.0 34.1 49 49 A R E - D 0 57A 139 8,-2.2 8,-3.0 -2,-0.4 2,-1.4 -0.973 40.9-114.6-139.6 150.0 4.5 107.9 34.9 50 50 A Q - 0 0 96 -2,-0.3 6,-0.3 6,-0.2 -2,-0.0 -0.750 41.3-178.9 -84.6 93.7 2.9 106.7 38.1 51 51 A S + 0 0 48 -2,-1.4 2,-0.2 2,-0.0 -1,-0.2 0.893 62.8 12.0 -63.6 -52.7 5.2 103.7 38.5 52 52 A S S S- 0 0 55 3,-0.8 3,-0.2 -3,-0.2 5,-0.1 -0.554 91.8 -97.5-112.3-173.8 3.8 102.1 41.6 53 53 A A S S+ 0 0 81 -2,-0.2 -2,-0.0 1,-0.2 -1,-0.0 0.791 127.9 34.4 -73.7 -25.6 0.5 103.0 43.3 54 54 A Q S S+ 0 0 76 39,-0.0 40,-2.2 40,-0.0 41,-0.3 0.290 113.4 64.1-114.1 13.7 2.6 105.2 45.6 55 55 A N E - E 0 93A 48 38,-0.2 -3,-0.8 -3,-0.2 2,-0.4 -0.943 53.5-158.7-135.2 159.7 5.3 106.5 43.3 56 56 A R E - E 0 92A 28 36,-1.9 36,-2.5 -2,-0.3 2,-0.4 -0.948 17.5-155.8-131.3 145.2 5.7 108.6 40.3 57 57 A K E -DE 49 91A 30 -8,-3.0 -8,-2.2 -2,-0.4 2,-0.4 -0.991 5.8-156.9-135.4 125.6 8.8 108.3 38.2 58 58 A Y E -DE 48 90A 66 32,-2.4 32,-2.3 -2,-0.4 2,-0.5 -0.845 6.2-161.3 -96.3 136.1 10.4 110.8 35.9 59 59 A S E +DE 47 89A 17 -12,-2.7 -12,-1.0 -2,-0.4 2,-0.4 -0.958 13.6 178.6-121.4 112.6 12.7 109.6 33.1 60 60 A I E -DE 46 88A 45 28,-2.6 28,-2.9 -2,-0.5 2,-0.4 -0.923 2.6-177.3-116.9 136.2 14.9 112.2 31.7 61 61 A K E -DE 45 87A 94 -16,-2.0 -16,-2.2 -2,-0.4 2,-0.4 -0.999 6.8-171.6-137.1 139.4 17.5 111.7 28.9 62 62 A V E -DE 44 86A 21 24,-1.8 24,-2.7 -2,-0.4 2,-0.5 -0.957 5.9-161.8-128.4 137.7 20.1 113.9 27.3 63 63 A E E -DE 43 85A 45 -20,-2.0 -20,-1.4 -2,-0.4 22,-0.2 -0.994 3.6-167.1-121.9 120.8 22.2 113.2 24.2 64 64 A V E - E 0 84A 56 20,-2.5 20,-2.7 -2,-0.5 2,-0.2 -0.949 14.6-154.2-108.7 114.1 25.3 115.3 23.6 65 65 A P E - E 0 83A 10 0, 0.0 2,-0.7 0, 0.0 18,-0.2 -0.605 16.2-143.4 -92.5 152.4 26.7 114.8 20.1 66 66 A K E - E 0 82A 114 16,-2.6 15,-3.3 -2,-0.2 16,-0.7 -0.955 35.6-139.8-106.9 101.3 30.3 115.2 18.8 67 67 A V E + E 0 80A 79 -2,-0.7 2,-0.3 13,-0.3 13,-0.3 -0.388 31.9 158.4 -71.2 145.2 29.6 116.7 15.4 68 68 A A E - E 0 79A 35 11,-2.4 11,-2.8 -2,-0.1 2,-0.5 -0.911 38.3-121.8-152.5 171.5 31.6 115.7 12.3 69 69 A T E - E 0 78A 95 -2,-0.3 2,-0.4 9,-0.2 7,-0.0 -0.992 32.7-165.2-124.0 115.8 31.3 115.7 8.5 70 70 A Q E - E 0 77A 106 7,-2.4 7,-3.0 -2,-0.5 2,-0.8 -0.895 18.2-134.7-112.5 139.3 31.7 112.3 7.0 71 71 A T E + E 0 76A 86 -2,-0.4 2,-0.5 5,-0.2 5,-0.3 -0.786 28.4 175.9 -89.8 110.6 32.3 111.3 3.4 72 72 A V E > S- E 0 75A 73 3,-3.3 3,-2.0 -2,-0.8 -2,-0.0 -0.980 72.6 -11.6-117.1 124.6 30.0 108.5 2.5 73 73 A G T 3 S- 0 0 82 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.807 129.8 -55.1 57.2 31.1 30.1 107.3 -1.1 74 74 A G T 3 S+ 0 0 71 1,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.567 120.2 107.5 80.4 7.6 32.2 110.3 -2.1 75 75 A V E < -E 72 0A 86 -3,-2.0 -3,-3.3 -5,-0.0 2,-0.5 -0.947 68.0-128.3-120.6 138.5 29.5 112.6 -0.7 76 76 A E E -E 71 0A 143 -2,-0.4 -5,-0.2 -5,-0.3 -7,-0.0 -0.764 27.5-175.9 -90.6 128.1 29.8 114.7 2.6 77 77 A L E -E 70 0A 43 -7,-3.0 -7,-2.4 -2,-0.5 2,-0.4 -0.900 31.7-112.2-124.3 144.4 27.0 114.3 5.2 78 78 A P E +E 69 0A 33 0, 0.0 2,-0.2 0, 0.0 -9,-0.2 -0.642 55.2 159.0 -73.1 129.6 26.5 116.1 8.5 79 79 A V E -E 68 0A 26 -11,-2.8 -11,-2.4 -2,-0.4 2,-0.5 -0.794 45.3-113.9-146.5 173.4 26.9 113.5 11.1 80 80 A A E -E 67 0A 27 -13,-0.3 -13,-0.3 -2,-0.2 3,-0.1 -0.998 15.4-153.9-119.0 120.1 27.7 112.9 14.8 81 81 A A E S- 0 0 59 -15,-3.3 2,-0.3 -2,-0.5 -14,-0.1 0.811 78.0 -26.7 -59.4 -35.7 31.1 111.1 15.4 82 82 A W E -E 66 0A 153 -16,-0.7 -16,-2.6 -3,-0.1 2,-0.4 -0.950 62.1-132.1-168.4 168.4 29.7 109.9 18.7 83 83 A R E -E 65 0A 46 -2,-0.3 2,-0.4 -18,-0.2 -20,-0.0 -0.981 8.5-143.5-134.8 146.1 27.1 110.7 21.3 84 84 A S E -E 64 0A 65 -20,-2.7 -20,-2.5 -2,-0.4 2,-0.5 -0.881 21.2-146.4-106.6 142.2 27.3 110.9 25.1 85 85 A Y E -E 63 0A 135 -2,-0.4 2,-0.4 -22,-0.2 -22,-0.2 -0.946 13.7-168.4-122.1 121.7 24.1 109.8 26.9 86 86 A L E -E 62 0A 80 -24,-2.7 -24,-1.8 -2,-0.5 2,-0.4 -0.859 14.1-178.5 -99.1 139.7 22.8 111.0 30.2 87 87 A N E +E 61 0A 98 -2,-0.4 2,-0.4 -26,-0.2 -26,-0.2 -0.879 3.5 175.9-145.4 102.6 20.1 108.8 31.5 88 88 A M E -E 60 0A 65 -28,-2.9 -28,-2.6 -2,-0.4 2,-0.4 -0.913 14.5-170.4-122.6 142.8 18.3 109.7 34.8 89 89 A E E -E 59 0A 115 -2,-0.4 2,-0.5 -30,-0.2 -30,-0.2 -0.981 5.8-169.3-127.6 123.6 15.4 108.2 36.7 90 90 A L E -E 58 0A 45 -32,-2.3 -32,-2.4 -2,-0.4 2,-0.6 -0.936 3.2-164.6-117.7 118.5 13.8 109.9 39.6 91 91 A T E -E 57 0A 76 -2,-0.5 -34,-0.2 -34,-0.2 -2,-0.0 -0.919 11.2-178.5-105.5 117.4 11.3 108.1 41.9 92 92 A I E -E 56 0A 13 -36,-2.5 -36,-1.9 -2,-0.6 -2,-0.0 -0.939 26.3-122.1-117.5 129.2 9.2 110.4 44.1 93 93 A P E > -E 55 0A 66 0, 0.0 3,-1.5 0, 0.0 -38,-0.2 -0.354 22.9-121.3 -66.5 151.7 6.7 109.1 46.7 94 94 A I T 3 S+ 0 0 11 -40,-2.2 75,-1.9 1,-0.3 74,-0.4 0.695 109.6 68.2 -67.1 -13.6 3.1 110.4 46.2 95 95 A F T 3 S+ 0 0 20 -41,-0.3 2,-0.3 73,-0.2 -1,-0.3 0.506 72.5 117.5 -83.7 -4.3 3.3 111.8 49.8 96 96 A A < - 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