==== 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 18-DEC-97 1ZDJ . COMPND 2 MOLECULE: PROTEIN (MS2 PROTEIN CAPSID); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIO PHAGE MS2; . AUTHOR E.GRAHN,N.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) . 24883.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 274 70.8 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 . 123 31.8 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 . 0 0.0 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 . 36 9.3 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 2 1 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 3 0 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 0 163 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-171.0 1.8 128.7 32.0 2 2 A S - 0 0 57 150,-0.0 260,-0.0 151,-0.0 151,-0.0 -0.504 360.0-154.3 166.7 121.8 3.1 125.7 30.0 3 3 A N S S+ 0 0 148 -2,-0.2 2,-2.1 1,-0.1 0, 0.0 0.422 70.1 104.1 -94.0 4.0 6.5 124.5 31.1 4 4 A F + 0 0 21 257,-0.1 2,-0.3 17,-0.0 -1,-0.1 -0.544 55.5 127.6 -84.3 77.5 7.1 123.1 27.7 5 5 A T - 0 0 67 -2,-2.1 2,-0.1 16,-0.1 15,-0.0 -0.784 62.3 -93.7-127.2 170.8 9.4 125.9 26.6 6 6 A Q + 0 0 119 -2,-0.3 2,-0.3 15,-0.1 15,-0.2 -0.476 43.0 174.8 -82.8 159.9 12.8 126.2 25.1 7 7 A F E -A 20 0A 78 13,-2.3 13,-3.1 -2,-0.1 2,-0.7 -0.958 38.7 -93.8-157.2 165.0 15.9 126.7 27.3 8 8 A V E -A 19 0A 69 -2,-0.3 11,-0.3 11,-0.3 3,-0.2 -0.825 32.0-176.7 -92.2 115.2 19.6 126.9 27.0 9 9 A L E S+ 0 0 51 9,-2.6 2,-0.6 -2,-0.7 10,-0.2 0.893 78.5 30.8 -75.3 -45.5 21.1 123.5 27.6 10 10 A V E S-A 18 0A 44 8,-1.8 8,-2.9 2,-0.0 2,-1.1 -0.952 74.1-156.1-119.1 109.8 24.8 124.6 27.4 11 11 A D + 0 0 115 -2,-0.6 6,-0.1 6,-0.2 8,-0.0 -0.754 16.2 175.4 -86.8 99.8 25.4 128.1 28.5 12 12 A N > - 0 0 96 -2,-1.1 3,-0.7 1,-0.0 -1,-0.1 -0.029 65.2 -86.0 -93.6 29.7 28.6 129.0 26.6 13 13 A G T 3 S- 0 0 53 1,-0.2 2,-2.7 3,-0.1 -2,-0.1 0.999 81.1 -49.4 64.5 74.6 28.4 132.5 28.0 14 14 A G T 3 S+ 0 0 62 1,-0.1 2,-0.6 2,-0.1 3,-0.4 0.012 127.1 76.7 61.7 -33.7 26.1 134.3 25.5 15 15 A T S < S+ 0 0 122 -2,-2.7 -1,-0.1 -3,-0.7 3,-0.1 -0.844 107.8 1.8-120.0 110.5 28.0 133.1 22.4 16 16 A G S S+ 0 0 55 -2,-0.6 -1,-0.2 1,-0.2 2,-0.2 0.781 84.0 165.6 90.3 29.4 27.6 129.6 21.1 17 17 A D - 0 0 49 -3,-0.4 2,-0.7 -6,-0.1 -6,-0.2 -0.519 36.7-130.2 -72.9 148.7 25.1 128.8 23.8 18 18 A V E -A 10 0A 22 -8,-2.9 -9,-2.6 -2,-0.2 -8,-1.8 -0.938 27.8-173.6-104.9 103.7 23.2 125.6 22.9 19 19 A T E -A 8 0A 62 -2,-0.7 16,-0.6 -11,-0.3 2,-0.4 -0.841 7.6-156.6 -98.0 141.4 19.5 126.3 23.3 20 20 A V E -AB 7 34A 0 -13,-3.1 -13,-2.3 -2,-0.4 14,-0.2 -0.932 10.4-161.3-117.5 137.1 17.1 123.3 22.9 21 21 A A E - B 0 33A 31 12,-2.0 12,-1.9 -2,-0.4 -15,-0.1 -0.905 29.5 -84.4-125.5 154.8 13.5 123.9 21.9 22 22 A P E + B 0 32A 41 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.226 49.7 157.8 -53.7 135.8 10.2 121.9 22.1 23 23 A S E + 0 0 45 8,-2.7 2,-0.3 1,-0.4 9,-0.2 0.544 54.6 3.5-140.0 -7.8 9.8 119.4 19.2 24 24 A N E - B 0 31A 48 7,-1.0 7,-2.6 1,-0.1 -1,-0.4 -0.939 30.4-178.9-175.9 148.0 7.4 116.6 20.0 25 25 A F > + 0 0 41 -2,-0.3 3,-1.4 5,-0.2 132,-0.6 -0.004 38.5 146.9-142.3 24.6 5.1 115.3 22.7 26 26 A A G > S+ 0 0 15 1,-0.3 3,-1.3 2,-0.2 260,-0.1 -0.418 72.6 8.0 -68.4 139.0 3.9 112.2 20.9 27 27 A N G 3 S- 0 0 95 258,-0.3 -1,-0.3 1,-0.2 3,-0.1 0.733 127.3 -72.1 62.2 23.8 3.2 109.3 23.3 28 28 A G G < S+ 0 0 9 -3,-1.4 2,-0.6 1,-0.2 20,-0.3 0.745 101.3 125.4 67.4 20.2 3.6 111.5 26.3 29 29 A V < - 0 0 59 -3,-1.3 2,-0.4 18,-0.1 18,-0.2 -0.971 55.3-143.3-111.1 109.2 7.4 111.8 25.9 30 30 A A E - C 0 46A 10 16,-2.6 16,-2.0 -2,-0.6 2,-0.3 -0.636 22.6-165.9 -74.3 130.8 8.2 115.5 25.9 31 31 A E E -BC 24 45A 19 -7,-2.6 -8,-2.7 -2,-0.4 -7,-1.0 -0.924 18.6-179.1-124.2 149.1 11.1 116.2 23.4 32 32 A W E -BC 22 44A 30 12,-2.2 12,-2.4 -2,-0.3 2,-0.3 -0.994 9.6-176.7-140.8 130.8 13.4 119.1 22.8 33 33 A I E -BC 21 43A 28 -12,-1.9 -12,-2.0 -2,-0.3 10,-0.2 -0.940 28.5-109.4-130.5 154.7 16.1 119.1 20.1 34 34 A S E -B 20 0A 3 8,-2.0 2,-2.3 -2,-0.3 -14,-0.2 -0.422 46.5 -91.6 -75.3 162.3 18.7 121.7 19.2 35 35 A S S S+ 0 0 91 -16,-0.6 2,-0.2 -2,-0.1 323,-0.1 -0.458 90.6 100.2 -75.2 71.6 18.4 123.6 16.0 36 36 A N S S- 0 0 58 -2,-2.3 5,-0.1 6,-0.1 2,-0.1 -0.790 86.1 -66.5-141.0-177.3 20.4 121.2 13.8 37 37 A S >> - 0 0 1 -2,-0.2 3,-1.4 1,-0.1 4,-0.8 -0.459 56.7-111.0 -71.2 149.8 19.9 118.4 11.4 38 38 A R T 34 S+ 0 0 66 318,-0.7 317,-0.2 1,-0.3 -1,-0.1 0.688 118.1 60.6 -60.3 -16.2 18.4 115.5 13.3 39 39 A S T 34 S+ 0 0 15 315,-1.5 -1,-0.3 1,-0.2 316,-0.1 0.741 115.8 30.9 -82.1 -22.8 21.7 113.6 12.9 40 40 A Q T <4 S+ 0 0 28 -3,-1.4 -2,-0.2 314,-0.3 -1,-0.2 0.277 94.4 122.0-116.4 6.6 23.7 116.3 14.7 41 41 A A < - 0 0 5 -4,-0.8 2,-0.3 -5,-0.1 -6,-0.1 -0.381 60.6-126.5 -78.7 152.2 21.1 117.6 17.2 42 42 A Y - 0 0 50 22,-0.1 -8,-2.0 -2,-0.1 2,-0.4 -0.685 34.6-160.3 -84.0 148.5 21.2 117.6 20.9 43 43 A K E -CD 33 63A 67 20,-1.5 20,-2.2 -2,-0.3 2,-0.4 -0.991 19.2-176.4-141.4 141.2 18.2 116.0 22.3 44 44 A V E -CD 32 62A 10 -12,-2.4 -12,-2.2 -2,-0.4 2,-0.3 -0.996 8.6-177.0-135.0 131.6 16.4 116.0 25.7 45 45 A T E -CD 31 61A 23 16,-2.2 16,-1.9 -2,-0.4 2,-0.3 -0.975 0.7-176.3-128.5 148.4 13.4 113.9 26.5 46 46 A C E +CD 30 60A 34 -16,-2.0 -16,-2.6 -2,-0.3 2,-0.3 -0.996 6.5 167.5-147.0 135.7 11.2 113.7 29.7 47 47 A S E - D 0 59A 38 12,-1.1 12,-2.7 -2,-0.3 2,-0.4 -0.975 15.1-157.5-148.9 144.1 8.3 111.6 30.8 48 48 A V E + D 0 58A 44 -20,-0.3 2,-0.3 -2,-0.3 10,-0.2 -0.981 15.9 172.6-121.3 139.2 6.5 111.0 34.1 49 49 A R E - D 0 57A 135 8,-1.9 8,-2.9 -2,-0.4 2,-1.9 -0.968 45.2-109.3-144.9 154.5 4.5 108.0 35.1 50 50 A Q - 0 0 95 -2,-0.3 6,-0.3 6,-0.2 8,-0.0 -0.672 38.9-171.8 -81.7 84.1 2.8 106.7 38.2 51 51 A S - 0 0 38 -2,-1.9 2,-0.3 3,-0.1 5,-0.2 0.558 65.0 -6.5 -56.9 -10.6 5.4 103.9 38.4 52 52 A S S S- 0 0 51 3,-1.4 3,-0.4 1,-0.1 5,-0.0 -0.966 88.4 -80.8-168.7 177.3 3.4 102.3 41.2 53 53 A A S S+ 0 0 82 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.889 131.4 26.5 -59.7 -35.7 0.4 102.9 43.4 54 54 A Q S S+ 0 0 80 -3,-0.1 40,-2.1 39,-0.0 41,-0.3 0.335 114.7 63.9-114.4 10.9 2.6 105.1 45.6 55 55 A N E - E 0 93A 50 -3,-0.4 -3,-1.4 38,-0.2 2,-0.4 -0.937 52.5-156.6-133.5 161.8 5.4 106.5 43.3 56 56 A R E - E 0 92A 23 36,-2.3 36,-2.5 -2,-0.3 2,-0.4 -0.943 17.5-156.3-132.2 141.9 5.8 108.7 40.4 57 57 A K E -DE 49 91A 32 -8,-2.9 -8,-1.9 -2,-0.4 2,-0.4 -0.985 5.7-158.7-131.9 124.3 8.8 108.3 38.2 58 58 A Y E -DE 48 90A 64 32,-2.4 32,-2.1 -2,-0.4 2,-0.5 -0.825 6.6-162.1 -98.3 137.8 10.4 110.8 35.9 59 59 A T E +DE 47 89A 20 -12,-2.7 -12,-1.1 -2,-0.4 2,-0.4 -0.978 11.8 179.7-124.3 115.3 12.7 109.6 33.1 60 60 A I E -DE 46 88A 44 28,-2.5 28,-3.0 -2,-0.5 2,-0.4 -0.963 3.2-177.3-120.3 128.9 15.0 112.2 31.6 61 61 A K E -DE 45 87A 101 -16,-1.9 -16,-2.2 -2,-0.4 2,-0.4 -0.979 3.5-173.2-127.5 139.7 17.5 111.5 28.8 62 62 A V E -DE 44 86A 22 24,-1.9 24,-2.8 -2,-0.4 2,-0.5 -0.991 6.5-161.6-131.9 135.8 20.0 113.9 27.2 63 63 A E E -DE 43 85A 48 -20,-2.2 -20,-1.5 -2,-0.4 22,-0.2 -0.993 2.8-166.6-121.4 121.0 22.2 113.1 24.2 64 64 A V E - E 0 84A 56 20,-2.6 20,-2.5 -2,-0.5 2,-0.2 -0.945 15.6-152.3-108.7 112.1 25.2 115.3 23.6 65 65 A P E - E 0 83A 11 0, 0.0 2,-0.8 0, 0.0 18,-0.2 -0.601 15.5-145.7 -90.0 151.9 26.7 114.8 20.1 66 66 A K E - E 0 82A 110 16,-2.4 15,-3.2 -2,-0.2 16,-0.8 -0.931 35.5-140.9-109.4 100.1 30.2 115.3 18.9 67 67 A V E + E 0 80A 79 -2,-0.8 13,-0.3 13,-0.3 2,-0.3 -0.331 31.2 158.4 -73.3 147.0 29.6 116.6 15.4 68 68 A A E - E 0 79A 35 11,-3.0 11,-3.0 -2,-0.1 2,-0.5 -0.879 39.2-120.0-149.4 177.3 31.6 115.7 12.3 69 69 A T E - E 0 78A 89 -2,-0.3 2,-0.4 9,-0.2 7,-0.0 -0.962 32.0-163.7-130.0 104.3 31.2 115.6 8.5 70 70 A Q E - E 0 77A 111 7,-1.8 7,-2.8 -2,-0.5 2,-0.9 -0.794 15.8-135.6 -96.8 140.6 31.6 112.2 7.2 71 71 A T E + E 0 76A 87 -2,-0.4 2,-0.5 5,-0.2 5,-0.3 -0.804 27.6 179.5 -94.1 102.2 32.3 111.4 3.5 72 72 A V E > S- E 0 75A 73 3,-2.6 3,-2.1 -2,-0.9 -2,-0.0 -0.910 70.7 -12.8-106.0 128.9 30.0 108.6 2.5 73 73 A G T 3 S- 0 0 81 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.820 130.0 -53.2 53.2 33.3 30.2 107.4 -1.1 74 74 A G T 3 S+ 0 0 72 1,-0.2 2,-0.4 -3,-0.2 -1,-0.3 0.595 119.5 106.5 80.6 9.7 32.2 110.5 -2.1 75 75 A V E < -E 72 0A 89 -3,-2.1 -3,-2.6 -5,-0.0 2,-0.5 -0.960 69.1-124.8-124.8 139.8 29.6 112.8 -0.6 76 76 A E E -E 71 0A 148 -2,-0.4 -5,-0.2 -5,-0.3 -7,-0.0 -0.746 29.2-177.3 -86.3 126.6 29.8 114.9 2.6 77 77 A L E -E 70 0A 42 -7,-2.8 -7,-1.8 -2,-0.5 2,-0.4 -0.914 32.8-112.5-123.3 141.6 27.0 114.4 5.1 78 78 A P E +E 69 0A 31 0, 0.0 2,-0.3 0, 0.0 -9,-0.2 -0.620 54.8 162.7 -71.9 129.6 26.5 116.2 8.5 79 79 A V E -E 68 0A 25 -11,-3.0 -11,-3.0 -2,-0.4 2,-0.5 -0.831 43.8-117.0-144.8 169.4 27.1 113.5 11.1 80 80 A A E -E 67 0A 27 -13,-0.3 -13,-0.3 -2,-0.3 3,-0.1 -0.989 15.4-154.1-114.7 119.6 27.8 113.0 14.8 81 81 A A E S- 0 0 59 -15,-3.2 2,-0.3 -2,-0.5 -14,-0.2 0.797 76.5 -23.7 -59.7 -32.9 31.2 111.3 15.4 82 82 A W E -E 66 0A 155 -16,-0.8 -16,-2.4 -3,-0.1 2,-0.4 -0.964 62.6-127.2-168.3 167.9 29.8 109.9 18.7 83 83 A R E -E 65 0A 48 -2,-0.3 2,-0.5 -18,-0.2 -20,-0.0 -0.995 4.9-148.5-134.4 140.2 27.2 110.6 21.3 84 84 A S E -E 64 0A 67 -20,-2.5 -20,-2.6 -2,-0.4 2,-0.5 -0.905 22.7-154.9-102.6 128.4 27.3 110.9 25.1 85 85 A Y E -E 63 0A 144 -2,-0.5 2,-0.5 -22,-0.2 -22,-0.2 -0.940 11.0-167.8-112.6 128.7 24.1 109.7 26.8 86 86 A L E -E 62 0A 81 -24,-2.8 -24,-1.9 -2,-0.5 2,-0.5 -0.957 8.7-176.3-112.4 127.9 22.7 110.8 30.2 87 87 A N E +E 61 0A 102 -2,-0.5 2,-0.4 -26,-0.2 -26,-0.2 -0.971 4.8 176.0-126.6 116.2 19.9 108.7 31.6 88 88 A M E -E 60 0A 63 -28,-3.0 -28,-2.5 -2,-0.5 2,-0.4 -0.964 12.2-171.8-126.6 140.3 18.2 109.7 34.8 89 89 A E E -E 59 0A 118 -2,-0.4 2,-0.5 -30,-0.2 -30,-0.2 -0.982 4.7-169.9-127.4 124.3 15.3 108.2 36.7 90 90 A L E -E 58 0A 46 -32,-2.1 -32,-2.4 -2,-0.4 2,-0.6 -0.947 3.7-163.9-117.4 119.0 13.9 110.0 39.7 91 91 A T E -E 57 0A 74 -2,-0.5 -34,-0.2 -34,-0.2 -2,-0.0 -0.931 11.2-178.4-105.3 119.7 11.3 108.1 41.8 92 92 A I E -E 56 0A 8 -36,-2.5 -36,-2.3 -2,-0.6 -2,-0.0 -0.924 26.2-121.4-119.0 132.1 9.3 110.4 44.2 93 93 A P E > -E 55 0A 62 0, 0.0 3,-1.1 0, 0.0 -38,-0.2 -0.323 22.7-120.6 -67.2 157.4 6.6 109.1 46.6 94 94 A I T 3 S+ 0 0 12 -40,-2.1 75,-1.7 1,-0.2 74,-0.3 0.678 108.7 70.6 -72.5 -12.4 3.1 110.5 46.2 95 95 A F T 3 S+ 0 0 21 -41,-0.3 2,-0.4 73,-0.2 -1,-0.2 0.430 72.0 117.6 -83.9 0.9 3.4 111.8 49.8 96 96 A A < - 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