==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS 27-OCT-09 2WWS . COMPND 2 MOLECULE: COAT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSALIS MOTTLE VIRUS; . AUTHOR S.R.SAGURTHI,V.RAJARAM,H.S.SAVITHRI,M.R.N.MURTHY . 531 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24756.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 333 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 170 32.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 5 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 60 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 0 0 PARALLEL BRIDGES PER LADDER . 7 3 3 3 4 1 0 0 0 0 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 2 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 28 A Q 0 0 261 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 57.4 24.1 -78.8 71.2 2 29 A S - 0 0 87 0, 0.0 2,-0.4 0, 0.0 0, 0.0 -0.719 360.0 -45.6-138.3-176.0 24.1 -82.1 69.3 3 30 A P S S+ 0 0 114 0, 0.0 152,-0.5 0, 0.0 2,-0.3 -0.478 75.8 165.9 -61.9 118.4 21.8 -85.1 69.2 4 31 A A E -A 154 0A 55 -2,-0.4 2,-0.4 150,-0.1 150,-0.2 -0.962 25.3-156.7-134.8 152.5 21.0 -85.6 72.9 5 32 A I E -A 153 0A 82 148,-1.8 148,-2.9 -2,-0.3 2,-0.6 -0.988 9.2-145.2-132.5 138.9 18.4 -87.6 74.7 6 33 A V E +A 152 0A 49 -2,-0.4 146,-0.2 146,-0.2 -2,-0.0 -0.907 24.2 169.6-107.3 121.7 17.1 -87.0 78.2 7 34 A L E -A 151 0A 43 144,-2.0 144,-2.5 -2,-0.6 2,-0.1 -0.955 26.4-117.2-131.9 153.1 16.2 -90.0 80.4 8 35 A P E -A 150 0A 94 0, 0.0 2,-0.3 0, 0.0 142,-0.2 -0.371 24.1-177.4 -83.8 163.9 15.2 -90.4 84.1 9 36 A F E +A 149 0A 20 140,-1.9 140,-1.7 -2,-0.1 2,-0.3 -0.968 6.5 177.9-154.8 156.5 16.9 -92.3 86.9 10 37 A Q E +A 148 0A 126 -2,-0.3 2,-0.3 138,-0.2 138,-0.2 -0.817 10.2 160.1-167.1 122.5 16.2 -93.1 90.6 11 38 A F E -A 147 0A 26 136,-2.1 136,-2.9 -2,-0.3 2,-0.5 -0.956 41.2-106.7-142.0 158.1 18.2 -95.2 93.0 12 39 A E E -A 146 0A 127 -2,-0.3 134,-0.3 134,-0.3 3,-0.1 -0.772 30.2-177.8 -92.7 132.4 18.3 -95.4 96.8 13 40 A A E + 0 0 28 132,-2.5 2,-0.3 -2,-0.5 133,-0.2 0.854 56.9 14.9 -96.3 -42.9 21.5 -93.9 98.3 14 41 A T E -A 145 0A 16 131,-1.3 131,-1.6 9,-0.1 2,-0.4 -0.902 52.7-152.3-136.7 166.7 21.3 -94.4 102.0 15 42 A T E -A 144 0A 50 -2,-0.3 2,-0.3 129,-0.2 129,-0.2 -1.000 14.3-155.1-139.3 136.9 19.5 -96.3 104.8 16 43 A F E +A 143 0A 0 127,-3.0 126,-2.6 -2,-0.4 127,-0.9 -0.760 61.1 43.4-115.9 160.8 18.9 -95.3 108.4 17 44 A G S S+ 0 0 8 2,-0.6 121,-0.4 -2,-0.3 -1,-0.1 -0.036 84.3 90.8 104.5 -30.2 18.3 -97.1 111.7 18 45 A T S S- 0 0 72 1,-0.2 2,-0.3 119,-0.2 120,-0.1 0.794 108.2 -41.6 -68.3 -27.7 20.8 -99.8 111.4 19 46 A A S S- 0 0 50 118,-0.1 -2,-0.6 113,-0.1 2,-0.3 -0.956 91.7 -40.7 178.1 176.0 23.4 -97.6 113.1 20 47 A E - 0 0 112 -2,-0.3 2,-0.5 114,-0.1 113,-0.2 -0.428 64.3-161.5 -58.1 117.2 24.8 -94.1 113.3 21 48 A T B +E 131 0B 22 110,-1.2 110,-1.2 -2,-0.3 -1,-0.1 -0.929 28.5 158.6-111.2 127.1 24.7 -93.2 109.6 22 49 A A + 0 0 48 -2,-0.5 108,-0.2 108,-0.2 2,-0.2 -0.540 23.8 156.8-142.2 66.3 26.8 -90.3 108.3 23 50 A A - 0 0 36 106,-0.4 106,-2.3 55,-0.1 2,-0.3 -0.542 28.9-158.3 -95.3 162.3 27.2 -91.0 104.6 24 51 A Q E -F 128 0C 92 104,-0.2 2,-0.3 -2,-0.2 104,-0.2 -0.907 11.5-158.9-142.5 107.1 27.9 -88.7 101.8 25 52 A V E -F 127 0C 29 102,-1.5 102,-2.8 -2,-0.3 2,-0.5 -0.683 3.7-153.0 -90.7 140.6 27.0 -89.8 98.2 26 53 A S E >> -F 126 0C 25 -2,-0.3 4,-1.7 100,-0.3 3,-1.4 -0.952 7.8-151.7-112.4 124.9 28.5 -88.3 95.1 27 54 A L T 34 S+ 0 0 0 98,-1.8 -1,-0.1 -2,-0.5 99,-0.1 0.894 92.5 67.8 -61.3 -36.1 26.4 -88.4 92.0 28 55 A Q T 34 S+ 0 0 65 97,-0.6 -1,-0.3 1,-0.2 98,-0.1 0.663 114.8 24.0 -58.0 -19.7 29.5 -88.5 89.9 29 56 A T T <4 S+ 0 0 93 -3,-1.4 -1,-0.2 5,-0.0 -2,-0.2 0.561 83.7 125.2-122.9 -15.1 30.4 -92.0 91.1 30 57 A A X - 0 0 17 -4,-1.7 4,-1.1 1,-0.1 3,-0.3 -0.259 62.1-131.3 -50.5 123.5 27.2 -93.6 92.2 31 58 A D H >> S+ 0 0 103 1,-0.2 4,-2.3 2,-0.2 3,-1.1 0.866 100.7 55.4 -46.8 -53.4 26.9 -96.9 90.3 32 59 A P H 3> S+ 0 0 57 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.939 109.9 47.5 -48.6 -50.9 23.3 -96.5 89.1 33 60 A I H 3> S+ 0 0 5 -3,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.737 113.1 53.9 -62.8 -20.8 24.2 -93.2 87.5 34 61 A T H XX S+ 0 0 54 -4,-1.1 4,-2.0 -3,-1.1 3,-0.8 0.987 105.1 45.9 -74.3 -70.3 27.2 -95.0 86.1 35 62 A K H 3< S+ 0 0 170 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.733 115.1 56.6 -45.3 -21.7 25.6 -98.0 84.4 36 63 A L H 3< S+ 0 0 41 -4,-1.3 -1,-0.3 -5,-0.4 -2,-0.2 0.934 114.7 30.8 -78.0 -48.3 23.3 -95.3 83.1 37 64 A T H X< S+ 0 0 8 -4,-1.7 3,-1.8 -3,-0.8 -2,-0.2 0.450 88.6 101.6 -92.0 -2.4 25.8 -93.0 81.5 38 65 A A T 3< S+ 0 0 29 -4,-2.0 -1,-0.2 1,-0.3 -3,-0.1 0.832 79.1 54.1 -50.9 -40.2 28.4 -95.6 80.4 39 66 A P T 3 S+ 0 0 50 0, 0.0 118,-3.4 0, 0.0 2,-0.3 0.514 107.7 59.4 -73.6 -7.9 27.2 -95.6 76.7 40 67 A Y E < -B 156 0A 66 -3,-1.8 115,-0.2 116,-0.3 3,-0.1 -0.834 65.5-150.8-121.7 160.7 27.7 -91.9 76.4 41 68 A R E S+ 0 0 0 114,-1.8 2,-0.3 113,-1.2 114,-0.2 0.241 84.3 56.5-111.8 9.9 30.6 -89.6 76.8 42 69 A H E +B 154 0A 27 112,-0.9 112,-1.1 -5,-0.2 2,-0.4 -0.831 59.3 173.6-148.4 107.6 28.6 -86.6 77.9 43 70 A A E +BC 153 116A 0 73,-2.0 72,-1.7 -2,-0.3 73,-0.8 -0.925 0.8 175.2-116.5 137.4 26.3 -86.5 80.9 44 71 A Q E -BC 152 114A 41 108,-1.1 108,-2.9 -2,-0.4 70,-0.2 -0.987 28.8-124.9-142.7 128.7 24.5 -83.4 82.2 45 72 A I E +B 151 0A 0 68,-2.9 106,-0.2 -2,-0.4 3,-0.1 -0.520 25.8 175.5 -73.4 137.0 21.9 -83.3 85.0 46 73 A V E S+ 0 0 32 104,-3.6 2,-0.3 1,-0.5 105,-0.2 0.729 71.1 2.2-108.0 -39.3 18.7 -81.6 84.1 47 74 A E E +B 150 0A 71 103,-1.5 103,-2.0 2,-0.0 -1,-0.5 -0.995 65.5 177.4-148.9 146.2 16.8 -82.2 87.2 48 75 A C E +B 149 0A 5 -2,-0.3 58,-2.7 58,-0.3 101,-0.3 -0.923 3.0 169.8-159.8 131.5 17.6 -83.8 90.6 49 76 A K E -BD 148 105A 57 99,-3.1 99,-1.2 -2,-0.3 2,-0.4 -0.747 25.0-140.4-128.6 176.6 15.9 -84.4 94.0 50 77 A A E -BD 147 104A 0 54,-0.7 54,-2.2 -2,-0.2 2,-0.4 -0.897 21.6-161.9-141.9 103.5 16.5 -86.4 97.2 51 78 A I E -BD 146 103A 27 95,-2.4 95,-2.6 -2,-0.4 2,-0.6 -0.769 6.5-149.2 -94.9 136.5 13.4 -87.9 98.6 52 79 A L E -BD 145 102A 1 50,-1.5 50,-0.7 -2,-0.4 93,-0.2 -0.921 16.6-174.6-105.1 119.9 13.4 -89.1 102.2 53 80 A T E -B 144 0A 34 91,-3.8 91,-2.8 -2,-0.6 2,-0.1 -0.926 3.5-167.8-125.1 112.2 11.1 -92.1 102.9 54 81 A P E -B 143 0A 25 0, 0.0 89,-0.3 0, 0.0 2,-0.2 -0.426 13.3-136.9 -89.3 164.9 10.4 -93.5 106.4 55 82 A T > - 0 0 53 87,-2.7 3,-2.9 -2,-0.1 4,-0.5 -0.711 32.6 -92.9-119.6 172.5 8.7 -96.8 107.2 56 83 A D G > S+ 0 0 126 1,-0.3 3,-1.1 -2,-0.2 4,-0.4 0.809 121.1 68.5 -51.4 -30.8 6.1 -98.1 109.6 57 84 A L G >> S+ 0 0 51 1,-0.3 4,-1.8 84,-0.2 3,-1.0 0.743 85.4 71.1 -61.9 -23.2 9.0 -98.9 111.9 58 85 A A G <4 S+ 0 0 0 -3,-2.9 -1,-0.3 84,-0.4 -2,-0.2 0.870 86.0 62.7 -63.0 -37.5 9.6 -95.2 112.3 59 86 A V G <4 S+ 0 0 78 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.2 0.744 110.8 40.5 -59.5 -23.7 6.5 -94.8 114.5 60 87 A S T <4 S+ 0 0 91 -3,-1.0 -1,-0.2 -4,-0.4 -2,-0.2 0.806 129.0 26.6 -92.3 -38.6 8.1 -97.1 117.0 61 88 A N S < S- 0 0 43 -4,-1.8 -1,-0.2 81,-0.1 -2,-0.1 -0.630 83.3-158.3-127.5 73.7 11.6 -95.9 116.9 62 89 A P + 0 0 80 0, 0.0 2,-0.3 0, 0.0 31,-0.2 -0.082 14.8 178.3 -51.3 150.9 11.6 -92.2 115.8 63 90 A L E -G 92 0C 23 29,-2.2 29,-1.0 71,-0.1 2,-0.4 -0.930 24.2-130.0-147.6 164.4 14.8 -90.8 114.3 64 91 A T E -G 91 0C 25 -2,-0.3 2,-0.4 27,-0.2 27,-0.2 -0.979 21.1-160.0-122.4 136.1 15.9 -87.5 112.8 65 92 A V E -G 90 0C 0 25,-1.4 25,-2.0 -2,-0.4 2,-0.5 -0.916 4.2-149.6-118.5 144.4 17.6 -87.3 109.5 66 93 A Y E -GH 89 130C 43 64,-2.8 64,-1.6 -2,-0.4 2,-0.3 -0.960 15.7-178.1-117.9 124.4 19.8 -84.5 108.1 67 94 A L E +GH 88 129C 0 21,-1.6 21,-2.6 -2,-0.5 2,-0.2 -0.772 9.8 155.4-115.7 161.7 20.0 -83.7 104.4 68 95 A A E - H 0 128C 0 60,-0.7 60,-3.2 -2,-0.3 2,-0.4 -0.756 31.7-131.8 178.0 133.6 22.1 -81.1 102.4 69 96 A W E + H 0 127C 17 17,-0.4 58,-0.2 -2,-0.2 275,-0.1 -0.818 31.0 178.4 -98.8 134.8 23.4 -80.8 98.9 70 97 A V E - H 0 126C 0 56,-2.6 56,-1.4 -2,-0.4 41,-0.1 -0.965 41.6-114.9-139.5 153.1 27.0 -79.8 98.3 71 98 A P - 0 0 0 0, 0.0 53,-0.6 0, 0.0 41,-0.1 0.509 47.9-122.8 -57.4 -11.3 29.6 -79.2 95.6 72 99 A A S S+ 0 0 29 54,-0.2 51,-0.1 51,-0.2 55,-0.0 0.507 108.2 72.9 76.6 0.5 31.7 -82.2 96.7 73 100 A N S S+ 0 0 54 53,-0.1 -1,-0.1 51,-0.1 50,-0.1 0.574 72.5 110.6-109.5 -29.6 34.6 -79.7 97.0 74 101 A S - 0 0 4 1,-0.2 271,-0.1 271,-0.0 -2,-0.1 -0.182 69.5-141.2 -54.6 129.8 32.9 -78.3 100.1 75 102 A P + 0 0 93 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.382 65.6 125.5 -70.2 3.0 34.8 -79.0 103.4 76 103 A A - 0 0 2 268,-0.3 -4,-0.1 2,-0.0 5,-0.0 -0.503 45.4-163.2 -69.3 129.6 31.3 -79.5 104.8 77 104 A T > - 0 0 51 -2,-0.3 3,-2.1 51,-0.0 4,-0.2 -0.686 34.9 -93.3-111.8 166.9 30.9 -82.9 106.5 78 105 A P G > S+ 0 0 12 0, 0.0 3,-0.8 0, 0.0 -55,-0.1 0.746 121.2 56.0 -49.2 -33.0 27.9 -84.9 107.6 79 106 A T G 3 S+ 0 0 93 1,-0.2 3,-0.3 2,-0.1 51,-0.1 0.665 103.6 55.0 -78.6 -13.3 27.8 -83.5 111.1 80 107 A Q G X + 0 0 45 -3,-2.1 3,-3.0 1,-0.2 4,-0.4 0.260 66.5 120.5-102.5 11.6 27.7 -79.9 109.9 81 108 A I G X S+ 0 0 0 -3,-0.8 3,-1.4 1,-0.3 -1,-0.2 0.854 75.5 52.5 -42.2 -45.8 24.6 -80.3 107.7 82 109 A L G 3 S+ 0 0 102 -3,-0.3 -1,-0.3 1,-0.3 5,-0.1 0.586 105.5 53.3 -71.9 -10.9 22.7 -77.7 109.8 83 110 A R G < S+ 0 0 126 -3,-3.0 264,-2.6 2,-0.1 2,-0.5 0.252 93.7 88.7-104.8 11.5 25.5 -75.1 109.4 84 111 A V B X S-I 346 0D 4 -3,-1.4 3,-1.0 -4,-0.4 262,-0.2 -0.941 93.6-100.7-112.3 124.1 25.4 -75.5 105.6 85 112 A Y T 3 S+ 0 0 190 260,-0.7 -16,-0.2 -2,-0.5 3,-0.1 -0.086 106.8 13.8 -43.0 128.6 23.1 -73.3 103.7 86 113 A G T 3 S+ 0 0 44 1,-0.3 -17,-0.4 -4,-0.1 2,-0.3 0.812 89.4 141.8 73.9 29.9 20.0 -75.2 102.7 87 114 A G < - 0 0 20 -3,-1.0 2,-0.3 -19,-0.2 -1,-0.3 -0.733 33.7-155.0 -97.7 152.9 20.6 -78.1 105.0 88 115 A Q E -G 67 0C 84 -21,-2.6 -21,-1.6 -2,-0.3 2,-0.4 -0.953 19.0-148.3-139.1 158.9 17.5 -79.6 106.7 89 116 A S E -G 66 0C 59 -2,-0.3 2,-0.3 -23,-0.2 -23,-0.2 -0.975 17.9-176.7-121.8 127.9 16.3 -81.6 109.7 90 117 A F E -G 65 0C 46 -25,-2.0 -25,-1.4 -2,-0.4 2,-0.7 -0.920 20.4-143.4-122.6 149.8 13.3 -83.9 109.6 91 118 A V E -G 64 0C 106 -2,-0.3 2,-0.6 -27,-0.2 -27,-0.2 -0.770 15.9-168.7-115.4 88.0 11.6 -85.8 112.3 92 119 A L E +G 63 0C 8 -29,-1.0 -29,-2.2 -2,-0.7 2,-0.2 -0.647 41.3 110.5 -75.2 116.8 10.6 -89.2 110.9 93 120 A G S S+ 0 0 27 -2,-0.6 -34,-0.2 -31,-0.2 -37,-0.1 -0.527 81.5 9.4 170.7 119.3 8.3 -90.7 113.6 94 121 A G S S+ 0 0 32 -2,-0.2 -35,-0.1 -38,-0.2 -38,-0.1 0.701 89.4 179.6 69.8 15.3 4.6 -91.4 113.8 95 122 A A > + 0 0 34 1,-0.2 2,-1.6 -40,-0.2 3,-0.5 0.636 19.8 167.1 -15.9 -65.3 5.5 -90.4 110.3 96 123 A I T 3 - 0 0 153 1,-0.2 3,-0.4 2,-0.1 -1,-0.2 0.151 47.5-127.4 63.1 -26.0 1.9 -90.7 108.9 97 124 A S T 3 - 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