==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS 23-AUG-94 2MS2 . COMPND 2 MOLECULE: BACTERIOPHAGE MS2 COAT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIO PHAGE MS2; . AUTHOR K.VALEGARD,L.LILJAS . 387 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24860.0 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 . 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 . 51 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 14.2 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 4 5 0 0 1 1 1 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 0 156 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 144.8 2.1 129.0 31.8 2 2 A S - 0 0 62 151,-0.0 260,-0.0 150,-0.0 151,-0.0 -0.486 360.0-149.4-172.1 125.9 2.9 125.8 29.8 3 3 A N S S+ 0 0 151 -2,-0.2 2,-2.1 1,-0.1 150,-0.0 0.473 71.1 104.5 -91.9 5.9 6.2 124.6 31.0 4 4 A F + 0 0 27 257,-0.2 2,-0.3 18,-0.0 -1,-0.1 -0.509 56.1 133.9 -84.5 75.9 7.0 123.2 27.6 5 5 A T - 0 0 70 -2,-2.1 2,-0.1 16,-0.1 15,-0.1 -0.771 60.3 -93.1-119.0 169.8 9.4 125.9 26.6 6 6 A Q + 0 0 124 -2,-0.3 2,-0.3 15,-0.1 15,-0.2 -0.421 45.0 176.3 -75.2 151.8 12.8 126.3 25.0 7 7 A F E -A 20 0A 76 13,-2.2 13,-2.7 -2,-0.1 2,-0.6 -0.969 35.8-100.3-152.1 166.6 15.8 126.6 27.3 8 8 A V E -A 19 0A 73 -2,-0.3 11,-0.3 11,-0.2 3,-0.2 -0.839 30.3-176.7 -99.9 123.6 19.6 126.9 27.0 9 9 A L E S+ 0 0 52 9,-2.0 2,-0.5 -2,-0.6 10,-0.2 0.808 74.6 31.1 -81.4 -41.4 21.2 123.6 27.6 10 10 A V E S-A 18 0A 46 8,-2.2 8,-2.2 2,-0.0 2,-1.1 -0.977 72.8-155.4-124.8 113.8 24.8 124.6 27.4 11 11 A D + 0 0 115 -2,-0.5 2,-0.3 6,-0.2 6,-0.1 -0.762 18.2 172.7 -94.0 101.9 25.6 128.1 28.5 12 12 A N > - 0 0 93 -2,-1.1 3,-1.0 2,-0.0 5,-0.1 -0.261 69.0 -86.6 -97.0 46.1 28.8 129.2 26.7 13 13 A G T 3 S- 0 0 60 -2,-0.3 2,-0.9 1,-0.3 -2,-0.1 0.909 82.5 -50.1 54.2 57.3 28.3 132.7 28.1 14 14 A G T 3 S+ 0 0 58 1,-0.1 2,-0.8 2,-0.0 3,-0.5 -0.135 126.4 85.5 79.0 -39.2 26.1 134.2 25.4 15 15 A T S < S- 0 0 122 -3,-1.0 -1,-0.1 -2,-0.9 -4,-0.0 -0.745 106.1 -2.6-104.8 100.8 28.4 133.0 22.5 16 16 A G S S+ 0 0 56 -2,-0.8 2,-0.2 1,-0.2 -1,-0.2 0.810 84.0 169.7 89.9 27.5 27.8 129.5 21.2 17 17 A D - 0 0 46 -3,-0.5 2,-0.7 -6,-0.1 -1,-0.2 -0.572 32.3-133.9 -64.0 133.8 25.1 128.7 23.7 18 18 A V E -A 10 0A 22 -8,-2.2 -8,-2.2 -2,-0.2 -9,-2.0 -0.883 29.4-176.8 -97.0 123.6 23.4 125.5 22.9 19 19 A T E -A 8 0A 59 -2,-0.7 16,-0.7 -11,-0.3 2,-0.3 -0.938 9.6-156.9-126.1 144.3 19.7 126.1 23.2 20 20 A V E -AB 7 34A 1 -13,-2.7 -13,-2.2 -2,-0.4 14,-0.2 -0.890 6.9-160.3-127.7 142.5 17.1 123.4 22.8 21 21 A A E - B 0 33A 32 12,-2.5 12,-1.9 -2,-0.3 -15,-0.1 -0.919 33.8 -81.5-134.1 152.6 13.4 123.9 21.8 22 22 A P E + B 0 32A 39 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.255 51.9 158.7 -50.5 130.7 10.2 121.9 22.1 23 23 A S E + 0 0 40 8,-3.0 2,-0.3 1,-0.4 9,-0.2 0.526 53.4 1.3-134.2 -13.7 9.9 119.5 19.2 24 24 A N E + B 0 31A 46 7,-1.3 7,-2.5 1,-0.1 -1,-0.4 -0.965 30.6 178.8-168.1 153.4 7.5 116.6 20.0 25 25 A F > + 0 0 45 -2,-0.3 3,-1.5 5,-0.2 132,-0.5 0.073 36.9 145.3-143.4 19.5 5.1 115.2 22.6 26 26 A A G > S+ 0 0 16 1,-0.3 3,-1.2 2,-0.2 260,-0.1 -0.363 73.8 11.5 -64.4 139.2 3.9 112.2 20.8 27 27 A N G 3 S- 0 0 94 258,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.742 129.4 -69.7 64.4 30.0 3.2 109.3 23.1 28 28 A G G < S+ 0 0 8 -3,-1.5 2,-0.6 1,-0.2 20,-0.3 0.729 101.8 125.2 67.2 20.6 3.5 111.5 26.2 29 29 A V < - 0 0 53 -3,-1.2 2,-0.3 -4,-0.1 18,-0.2 -0.944 53.8-145.3-113.9 113.1 7.3 112.0 25.9 30 30 A A E - C 0 46A 9 16,-2.3 16,-1.9 -2,-0.6 2,-0.4 -0.616 22.4-169.9 -76.7 133.0 8.2 115.7 25.8 31 31 A E E -BC 24 45A 17 -7,-2.5 -8,-3.0 -2,-0.3 -7,-1.3 -0.975 14.5-175.0-126.1 141.3 11.2 116.1 23.4 32 32 A W E -BC 22 44A 30 12,-2.5 12,-2.3 -2,-0.4 2,-0.3 -0.991 9.1-178.0-125.9 132.3 13.4 119.2 22.9 33 33 A I E -BC 21 43A 28 -12,-1.9 -12,-2.5 -2,-0.4 10,-0.2 -0.900 26.8-112.4-126.5 164.2 16.1 119.2 20.1 34 34 A S E -B 20 0A 5 8,-1.6 2,-2.2 -2,-0.3 -14,-0.2 -0.426 45.6 -89.0 -81.5 173.0 18.6 121.9 19.2 35 35 A S S S+ 0 0 92 -16,-0.7 2,-0.2 -2,-0.1 323,-0.1 -0.347 91.6 97.4 -84.8 64.2 18.4 123.6 15.9 36 36 A N S S- 0 0 59 -2,-2.2 2,-0.1 6,-0.1 5,-0.1 -0.706 86.6 -67.4-128.9-174.4 20.5 121.2 13.8 37 37 A S >> - 0 0 2 -2,-0.2 3,-1.3 1,-0.1 4,-0.7 -0.439 53.9-108.1 -71.2 156.6 19.8 118.4 11.5 38 38 A R T 34 S+ 0 0 61 318,-0.8 3,-0.4 316,-0.4 317,-0.2 0.790 119.5 61.4 -62.4 -23.5 18.3 115.6 13.3 39 39 A S T 34 S+ 0 0 14 315,-1.8 -1,-0.3 1,-0.2 316,-0.1 0.792 115.0 30.0 -74.8 -26.5 21.7 113.7 12.8 40 40 A Q T <4 S+ 0 0 31 -3,-1.3 -1,-0.2 314,-0.3 -2,-0.2 0.282 94.5 124.0-114.2 11.9 23.7 116.3 14.7 41 41 A A < - 0 0 4 -4,-0.7 2,-0.3 -3,-0.4 -6,-0.1 -0.423 60.2-127.0 -85.3 147.4 21.2 117.6 17.3 42 42 A Y - 0 0 47 -2,-0.2 -8,-1.6 -23,-0.1 2,-0.4 -0.637 35.5-161.2 -71.6 146.6 21.3 117.7 21.0 43 43 A K E -CD 33 63A 70 20,-1.3 20,-2.1 -2,-0.3 2,-0.4 -0.990 16.6-176.0-136.7 142.4 18.2 115.9 22.3 44 44 A V E -CD 32 62A 11 -12,-2.3 -12,-2.5 -2,-0.4 2,-0.3 -0.999 8.2-178.7-133.6 134.0 16.4 116.1 25.7 45 45 A T E -CD 31 61A 25 16,-2.2 16,-2.2 -2,-0.4 2,-0.3 -0.972 2.8-176.5-134.1 154.0 13.3 114.0 26.6 46 46 A C E +CD 30 60A 34 -16,-1.9 -16,-2.3 -2,-0.3 2,-0.3 -0.992 6.3 167.4-149.0 135.1 11.3 113.8 29.7 47 47 A S E - D 0 59A 37 12,-1.3 12,-2.9 -2,-0.3 2,-0.4 -0.983 16.4-155.7-149.5 150.6 8.3 111.7 30.8 48 48 A V E + D 0 58A 41 -2,-0.3 2,-0.3 -20,-0.3 10,-0.2 -0.984 16.1 174.9-121.7 134.9 6.5 111.0 34.2 49 49 A R E - D 0 57A 143 8,-2.0 8,-2.9 -2,-0.4 2,-1.3 -0.964 41.0-115.2-137.7 152.3 4.5 107.9 34.9 50 50 A Q - 0 0 95 -2,-0.3 6,-0.3 6,-0.2 -2,-0.0 -0.783 41.4-178.7 -84.0 95.8 2.9 106.7 38.1 51 51 A S + 0 0 47 -2,-1.3 2,-0.2 2,-0.0 -1,-0.2 0.918 61.9 11.3 -67.0 -55.1 5.2 103.7 38.5 52 52 A S S S- 0 0 57 3,-0.6 3,-0.1 -3,-0.2 5,-0.1 -0.504 91.9 -97.2-102.9-171.1 3.8 102.1 41.6 53 53 A A S S+ 0 0 78 -2,-0.2 -2,-0.0 1,-0.2 -1,-0.0 0.826 127.2 34.4 -72.4 -34.3 0.6 103.0 43.3 54 54 A Q S S+ 0 0 77 39,-0.0 40,-2.3 40,-0.0 41,-0.3 0.291 113.9 64.8-108.1 15.4 2.6 105.1 45.7 55 55 A N E - E 0 93A 43 38,-0.3 -3,-0.6 39,-0.1 2,-0.3 -0.938 53.7-158.4-135.5 158.1 5.3 106.5 43.4 56 56 A R E - E 0 92A 24 36,-2.1 36,-2.6 -2,-0.3 2,-0.5 -0.948 16.5-154.4-128.5 148.6 5.8 108.6 40.3 57 57 A K E -DE 49 91A 28 -8,-2.9 -8,-2.0 -2,-0.3 2,-0.4 -0.987 5.0-158.8-132.6 123.7 8.8 108.2 38.2 58 58 A Y E -DE 48 90A 67 32,-2.7 32,-2.6 -2,-0.5 2,-0.5 -0.861 6.9-163.4 -95.7 137.4 10.4 110.8 36.0 59 59 A T E +DE 47 89A 20 -12,-2.9 -12,-1.3 -2,-0.4 2,-0.4 -0.972 12.3 178.0-124.4 114.1 12.7 109.6 33.2 60 60 A I E -DE 46 88A 42 28,-2.8 28,-2.8 -2,-0.5 2,-0.3 -0.922 3.0-176.1-117.0 138.4 14.9 112.3 31.7 61 61 A K E -DE 45 87A 93 -16,-2.2 -16,-2.2 -2,-0.4 2,-0.4 -0.996 6.1-170.6-137.4 145.1 17.5 111.6 28.9 62 62 A V E -DE 44 86A 21 24,-2.2 24,-2.5 -2,-0.3 2,-0.5 -0.993 5.7-161.3-131.3 137.2 20.1 113.9 27.3 63 63 A E E -DE 43 85A 47 -20,-2.1 -20,-1.3 -2,-0.4 22,-0.2 -0.989 3.6-167.3-119.1 126.9 22.2 113.2 24.1 64 64 A V E - E 0 84A 57 20,-2.4 20,-3.0 -2,-0.5 2,-0.2 -0.971 15.0-153.7-111.9 116.4 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 -0.624 15.4-144.6 -91.0 151.0 26.7 114.8 20.0 66 66 A K E - E 0 82A 116 16,-2.7 15,-3.3 -2,-0.2 16,-0.7 -0.959 35.4-140.1-107.4 105.4 30.3 115.3 18.8 67 67 A V E + E 0 80A 80 -2,-0.7 2,-0.3 13,-0.3 13,-0.2 -0.383 32.4 156.1 -74.3 151.1 29.6 116.6 15.4 68 68 A A E - E 0 79A 35 11,-2.5 11,-2.7 -2,-0.1 2,-0.5 -0.936 38.6-119.2-157.0 173.4 31.6 115.7 12.3 69 69 A T E - E 0 78A 93 -2,-0.3 2,-0.4 9,-0.2 7,-0.0 -0.985 31.5-163.9-129.1 116.2 31.3 115.6 8.5 70 70 A Q E - E 0 77A 102 7,-2.6 7,-3.2 -2,-0.5 2,-0.7 -0.854 17.1-135.3-104.7 142.6 31.6 112.3 7.0 71 71 A T E + E 0 76A 89 -2,-0.4 2,-0.5 5,-0.3 5,-0.3 -0.825 28.3 174.7 -92.9 112.7 32.3 111.3 3.4 72 72 A V E > S- E 0 75A 71 3,-2.9 3,-2.2 -2,-0.7 -2,-0.0 -0.973 73.1 -10.8-117.3 124.6 30.0 108.4 2.5 73 73 A G T 3 S- 0 0 82 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.800 128.6 -57.1 58.6 28.2 30.2 107.4 -1.2 74 74 A G T 3 S+ 0 0 70 1,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.529 119.6 108.3 82.7 5.7 32.2 110.5 -2.1 75 75 A V E < -E 72 0A 87 -3,-2.2 -3,-2.9 -5,-0.0 2,-0.6 -0.912 68.8-127.4-116.2 137.7 29.5 112.7 -0.7 76 76 A E E -E 71 0A 142 -2,-0.4 -5,-0.3 -5,-0.3 -3,-0.0 -0.772 27.3-173.8 -93.2 124.5 29.8 114.7 2.5 77 77 A L E -E 70 0A 41 -7,-3.2 -7,-2.6 -2,-0.6 2,-0.4 -0.917 29.9-114.7-116.7 138.9 27.1 114.2 5.1 78 78 A P E +E 69 0A 32 0, 0.0 2,-0.3 0, 0.0 -9,-0.2 -0.565 53.2 161.5 -69.1 124.7 26.6 116.0 8.5 79 79 A V E -E 68 0A 26 -11,-2.7 -11,-2.5 -2,-0.4 2,-0.5 -0.812 44.4-116.6-142.1 168.8 27.0 113.4 11.1 80 80 A A E -E 67 0A 28 -2,-0.3 -13,-0.3 -13,-0.2 3,-0.1 -0.983 16.9-154.5-113.6 123.6 27.7 112.9 14.8 81 81 A A E S- 0 0 62 -15,-3.3 2,-0.3 -2,-0.5 -14,-0.1 0.751 76.5 -23.5 -64.5 -29.6 31.0 111.1 15.4 82 82 A W E -E 66 0A 152 -16,-0.7 -16,-2.7 -3,-0.1 2,-0.4 -0.933 62.8-138.0-169.3 164.7 29.7 109.9 18.8 83 83 A R E -E 65 0A 49 -2,-0.3 2,-0.4 -18,-0.2 -20,-0.0 -0.978 9.5-140.0-132.0 150.3 27.1 110.8 21.3 84 84 A S E -E 64 0A 64 -20,-3.0 -20,-2.4 -2,-0.4 2,-0.5 -0.865 20.9-146.3-106.9 146.1 27.2 110.9 25.0 85 85 A Y E -E 63 0A 144 -2,-0.4 2,-0.5 -22,-0.2 -22,-0.2 -0.954 13.8-171.1-125.4 120.5 24.1 109.7 26.9 86 86 A L E +E 62 0A 84 -24,-2.5 -24,-2.2 -2,-0.5 2,-0.4 -0.895 13.3 179.4-103.3 138.5 22.8 110.9 30.2 87 87 A N E +E 61 0A 90 -2,-0.5 2,-0.4 -26,-0.2 -26,-0.2 -0.952 1.9 175.2-143.8 112.5 20.0 108.9 31.5 88 88 A M E -E 60 0A 63 -28,-2.8 -28,-2.8 -2,-0.4 2,-0.4 -0.982 15.3-168.0-132.2 139.2 18.3 109.6 34.7 89 89 A E E -E 59 0A 114 -2,-0.4 2,-0.5 -30,-0.2 -30,-0.2 -0.986 6.5-168.6-119.2 129.0 15.4 108.2 36.6 90 90 A L E -E 58 0A 43 -32,-2.6 -32,-2.7 -2,-0.4 2,-0.6 -0.975 2.9-164.7-120.1 118.7 13.9 109.9 39.6 91 91 A T E -E 57 0A 75 -2,-0.5 -34,-0.2 -34,-0.2 -2,-0.0 -0.933 10.9-176.7-105.4 118.9 11.3 108.0 41.8 92 92 A I E -E 56 0A 11 -36,-2.6 -36,-2.1 -2,-0.6 -2,-0.0 -0.923 26.6-119.6-117.2 133.0 9.3 110.3 44.2 93 93 A P E > -E 55 0A 66 0, 0.0 3,-1.4 0, 0.0 -38,-0.3 -0.374 22.3-123.7 -65.3 150.1 6.7 109.1 46.7 94 94 A I T 3 S+ 0 0 12 -40,-2.3 75,-1.7 1,-0.3 74,-0.3 0.751 108.2 69.0 -66.7 -19.3 3.1 110.4 46.2 95 95 A F T 3 S+ 0 0 19 -41,-0.3 2,-0.4 73,-0.2 -1,-0.3 0.500 74.1 117.1 -78.8 -2.7 3.3 111.8 49.8 96 96 A A < - 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