==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 14-APR-08 2JJL . COMPND 2 MOLECULE: SIGMA-C CAPSID PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: AVIAN REOVIRUS; . AUTHOR P.GUARDADO-CALVO,G.C.FOX,A.L.LLAMAS-SAIZ,J.BENAVENTE, . 207 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12920.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 152 73.4 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 . 82 39.6 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 16 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 35 16.9 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 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 1 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 1 2 3 1 0 2 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 0 0 1 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 1 120 A T > 0 0 148 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -41.5 44.6 24.3 119.0 2 121 A V H > + 0 0 121 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.896 360.0 44.3 -62.3 -42.2 41.0 25.4 118.5 3 122 A D H > S+ 0 0 122 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.867 113.2 50.3 -69.1 -40.6 42.6 28.7 117.3 4 123 A G H > S+ 0 0 41 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.923 111.4 48.2 -60.1 -49.7 45.2 26.7 115.3 5 124 A N H X S+ 0 0 110 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.872 110.0 53.4 -57.6 -39.1 42.5 24.6 113.6 6 125 A S H X S+ 0 0 61 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.896 108.5 48.4 -68.3 -36.8 40.6 27.8 112.9 7 126 A T H X S+ 0 0 73 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.906 111.8 49.7 -65.3 -44.2 43.6 29.3 111.2 8 127 A A H X S+ 0 0 46 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.914 110.0 51.9 -57.7 -44.9 44.0 26.1 109.1 9 128 A I H X S+ 0 0 96 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.870 107.7 51.3 -60.0 -41.8 40.3 26.2 108.2 10 129 A S H X S+ 0 0 62 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.903 110.4 49.8 -63.9 -43.8 40.7 29.8 107.0 11 130 A N H X S+ 0 0 98 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.903 110.8 48.7 -56.5 -44.7 43.7 28.8 104.8 12 131 A L H X S+ 0 0 104 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.915 108.3 54.5 -62.6 -43.0 41.7 25.8 103.3 13 132 A K H X S+ 0 0 135 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.881 107.2 50.7 -57.3 -43.5 38.8 28.2 102.6 14 133 A S H X S+ 0 0 72 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.913 112.4 46.4 -60.3 -48.2 41.1 30.5 100.7 15 134 A D H X S+ 0 0 96 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.840 110.9 51.8 -60.5 -41.2 42.5 27.5 98.6 16 135 A I H X S+ 0 0 119 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.916 109.4 51.2 -63.7 -42.4 39.0 26.2 97.9 17 136 A S H X S+ 0 0 76 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.858 109.6 49.1 -62.9 -42.5 38.0 29.7 96.7 18 137 A S H X S+ 0 0 68 -4,-1.9 4,-2.4 2,-0.2 3,-0.3 0.930 111.1 49.7 -59.2 -54.0 41.0 29.8 94.3 19 138 A N H X S+ 0 0 106 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.870 108.7 54.4 -48.7 -41.7 40.2 26.4 92.9 20 139 A G H X S+ 0 0 32 -4,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.837 110.5 44.8 -63.9 -36.7 36.6 27.6 92.5 21 140 A L H X S+ 0 0 125 -4,-1.4 4,-2.1 -3,-0.3 -1,-0.2 0.817 110.3 53.6 -78.3 -36.6 37.8 30.6 90.4 22 141 A A H X S+ 0 0 52 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.834 109.9 49.9 -62.6 -34.5 40.2 28.5 88.4 23 142 A I H X S+ 0 0 89 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.789 108.4 51.3 -75.3 -33.0 37.2 26.2 87.6 24 143 A T H X S+ 0 0 68 -4,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.892 110.7 49.2 -69.5 -42.2 35.0 29.1 86.5 25 144 A D H X S+ 0 0 75 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.927 112.3 48.1 -58.5 -47.2 37.8 30.3 84.2 26 145 A L H X S+ 0 0 93 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.836 108.5 55.0 -64.7 -33.2 38.1 26.8 82.7 27 146 A Q H X S+ 0 0 120 -4,-1.6 4,-1.1 2,-0.2 -1,-0.2 0.907 111.2 43.3 -65.9 -44.5 34.3 26.6 82.3 28 147 A D H X S+ 0 0 100 -4,-1.9 4,-1.8 2,-0.2 3,-0.4 0.942 114.7 49.9 -62.6 -51.9 34.2 29.8 80.2 29 148 A R H X S+ 0 0 150 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.836 111.6 48.4 -57.2 -38.4 37.4 28.8 78.2 30 149 A V H X S+ 0 0 70 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.749 105.1 60.4 -73.8 -24.9 35.8 25.3 77.5 31 150 A K H X S+ 0 0 148 -4,-1.1 4,-0.9 -3,-0.4 -2,-0.2 0.927 105.8 47.3 -67.2 -46.3 32.6 27.0 76.4 32 151 A S H >X S+ 0 0 78 -4,-1.8 3,-1.9 1,-0.2 4,-0.7 0.980 111.6 49.4 -50.3 -64.9 34.4 28.9 73.6 33 152 A L H 3< S+ 0 0 114 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.684 105.9 58.0 -52.5 -25.4 36.2 25.8 72.4 34 153 A E H 3< S+ 0 0 151 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.780 112.6 39.7 -77.5 -25.6 32.9 23.8 72.3 35 154 A S H << S+ 0 0 94 -3,-1.9 -2,-0.2 -4,-0.9 -1,-0.2 0.418 78.7 141.5-103.4 -1.6 31.4 26.4 69.9 36 155 A T >< - 0 0 60 -4,-0.7 3,-1.8 -3,-0.1 -3,-0.0 -0.174 53.1-133.2 -50.4 127.8 34.4 27.0 67.6 37 156 A A T 3 S+ 0 0 94 1,-0.3 -1,-0.1 3,-0.0 0, 0.0 0.844 100.0 63.9 -53.9 -43.0 33.2 27.4 64.0 38 157 A S T > S+ 0 0 78 2,-0.1 3,-0.9 3,-0.0 -1,-0.3 0.606 81.2 97.3 -61.3 -14.2 35.8 25.1 62.4 39 158 A H T < S+ 0 0 114 -3,-1.8 -5,-0.0 1,-0.2 0, 0.0 -0.598 91.4 17.6 -73.1 138.2 34.4 22.1 64.4 40 159 A G T 3 S+ 0 0 85 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.867 81.5 164.0 60.6 37.0 32.0 20.1 62.2 41 160 A L < - 0 0 118 -3,-0.9 2,-0.3 2,-0.0 -1,-0.2 -0.694 17.5-166.6 -69.7 134.0 33.2 21.5 58.9 42 161 A S - 0 0 111 -2,-0.4 2,-0.5 6,-0.0 6,-0.0 -0.866 12.8-135.0-123.6 169.6 32.0 19.3 56.0 43 162 A F - 0 0 78 -2,-0.3 6,-0.2 4,-0.1 -2,-0.0 -0.977 10.8-153.7-133.3 116.1 32.9 19.0 52.4 44 163 A S > - 0 0 89 -2,-0.5 3,-2.0 1,-0.1 4,-0.0 -0.631 45.3 -49.0 -88.6 146.8 30.5 18.7 49.5 45 164 A P T 3 S+ 0 0 119 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.186 125.0 34.1 -52.5 142.0 31.4 17.1 46.1 46 165 A P T 3 S+ 0 0 78 0, 0.0 11,-3.4 0, 0.0 2,-0.3 -0.953 118.6 68.4 -80.8 9.3 33.8 17.4 44.2 47 166 A L E < +A 56 0A 72 -3,-2.0 2,-0.3 9,-0.2 9,-0.2 -0.712 67.8 172.6 -85.6 142.1 35.6 17.9 47.6 48 167 A S E -A 55 0A 36 7,-2.3 7,-3.0 -2,-0.3 2,-0.4 -0.987 25.1-139.4-148.6 159.3 35.8 14.9 49.9 49 168 A V E +A 54 0A 75 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.966 19.0 169.8-119.8 135.7 37.3 13.7 53.2 50 169 A A E > S-A 53 0A 61 3,-2.0 3,-2.0 -2,-0.4 -2,-0.0 -0.935 76.3 -16.7-145.1 121.9 38.9 10.3 54.0 51 170 A D T 3 S- 0 0 168 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.892 129.0 -50.6 50.8 49.3 40.8 9.6 57.2 52 171 A G T 3 S+ 0 0 72 1,-0.2 2,-0.5 0, 0.0 -1,-0.3 0.278 112.2 120.6 75.9 -10.9 41.2 13.3 57.9 53 172 A V E < -A 50 0A 93 -3,-2.0 -3,-2.0 2,-0.0 2,-0.5 -0.757 52.4-150.2 -90.2 123.0 42.6 14.1 54.4 54 173 A V E -A 49 0A 68 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.2 -0.849 23.8-179.1 -91.1 128.8 40.6 16.6 52.3 55 174 A S E -A 48 0A 56 -7,-3.0 -7,-2.3 -2,-0.5 2,-0.7 -0.907 32.7-129.0-124.4 149.3 40.9 15.9 48.5 56 175 A L E -A 47 0A 70 -2,-0.3 2,-0.5 -9,-0.2 -9,-0.2 -0.931 31.3-137.8 -89.1 116.2 39.6 17.3 45.3 57 176 A D - 0 0 93 -11,-3.4 2,-0.5 -2,-0.7 -2,-0.0 -0.690 25.0-161.1 -75.8 124.3 38.1 14.4 43.4 58 177 A M - 0 0 69 -2,-0.5 7,-0.1 5,-0.0 3,-0.0 -0.915 21.9-136.0-118.2 124.3 39.2 14.8 39.7 59 178 A D >> - 0 0 61 -2,-0.5 4,-2.9 1,-0.2 3,-1.8 -0.690 20.8-147.8 -67.2 116.0 37.8 13.2 36.5 60 179 A P T 34 S+ 0 0 59 0, 0.0 14,-2.3 0, 0.0 13,-2.0 0.742 94.7 63.8 -69.7 -15.7 41.0 12.1 34.8 61 180 A Y T 34 S+ 0 0 60 11,-0.2 45,-0.4 12,-0.2 11,-0.3 0.621 119.1 24.2 -73.0 -13.9 39.3 12.8 31.4 62 181 A F T <4 S+ 0 0 139 -3,-1.8 10,-0.6 1,-0.4 2,-0.3 0.701 127.7 0.7-119.3 -39.6 39.0 16.4 32.3 63 182 A C E < +B 71 0B 15 -4,-2.9 10,-0.5 8,-0.3 -1,-0.4 -0.924 47.6 174.9-151.0 169.9 41.6 17.4 34.9 64 183 A S E -B 70 0B 17 6,-1.6 6,-2.8 -2,-0.3 2,-0.4 -0.903 31.5-103.7-159.5 178.4 44.6 16.2 37.0 65 184 A Q E +B 69 0B 117 -2,-0.3 4,-0.2 4,-0.2 2,-0.1 -0.981 28.7 168.4-122.4 138.0 47.1 17.7 39.5 66 185 A R S S- 0 0 203 2,-2.2 2,-2.0 -2,-0.4 3,-0.1 -0.655 94.3 -62.2-130.8 72.4 50.7 18.5 39.0 67 186 A V S S+ 0 0 145 -2,-0.1 2,-0.2 3,-0.0 3,-0.0 -0.555 137.1 54.2 68.9 -65.3 50.8 20.5 42.2 68 187 A S S S- 0 0 79 -2,-2.0 -2,-2.2 1,-0.1 2,-0.5 -0.564 105.8 -92.4 -92.2 156.7 48.2 22.8 40.6 69 188 A L E +B 65 0B 110 -4,-0.2 -4,-0.2 -2,-0.2 2,-0.2 -0.570 62.4 157.3 -68.3 117.0 44.9 21.8 39.0 70 189 A T E -B 64 0B 62 -6,-2.8 -6,-1.6 -2,-0.5 3,-0.1 -0.555 37.8 -58.4-131.4-165.6 45.6 21.3 35.3 71 190 A S E S-B 63 0B 75 -8,-0.3 -8,-0.3 -2,-0.2 -1,-0.2 -0.002 74.4 -42.6 -83.2-172.6 44.1 19.4 32.3 72 191 A Y - 0 0 93 -10,-0.6 -11,-0.2 -11,-0.3 -8,-0.2 0.044 32.7-172.4 -57.5 149.3 43.4 15.7 31.6 73 192 A S + 0 0 74 -13,-2.0 -12,-0.2 -10,-0.5 -1,-0.1 0.613 52.8 109.6-109.7 -21.2 45.7 12.8 32.5 74 193 A A S S- 0 0 18 -14,-2.3 31,-0.3 -11,-0.2 2,-0.2 -0.231 78.8-100.7 -59.2 147.9 43.8 10.0 30.8 75 194 A E - 0 0 176 1,-0.1 -1,-0.1 29,-0.1 2,-0.1 -0.472 33.4-122.2 -72.0 134.3 45.4 8.6 27.7 76 195 A A - 0 0 52 -2,-0.2 2,-0.3 -3,-0.1 28,-0.2 -0.397 29.1-154.8 -68.0 151.4 44.1 9.8 24.3 77 196 A Q E -C 103 0C 66 26,-2.3 26,-3.2 -2,-0.1 2,-0.6 -0.983 18.1-154.7-128.7 146.9 42.7 7.1 22.0 78 197 A L E -C 102 0C 99 -2,-0.3 2,-0.3 24,-0.2 24,-0.2 -0.921 25.9-165.6-113.5 100.1 42.4 6.8 18.3 79 198 A M E -C 101 0C 13 22,-2.8 22,-2.6 -2,-0.6 2,-0.4 -0.656 7.2-164.5 -87.3 145.9 39.5 4.3 17.8 80 199 A Q E +C 100 0C 146 -2,-0.3 2,-0.3 20,-0.2 20,-0.2 -0.991 26.6 136.0-131.3 122.8 38.8 2.7 14.4 81 200 A F E -C 99 0C 20 18,-2.1 18,-3.1 -2,-0.4 2,-0.4 -0.921 50.1-103.3-154.6 172.0 35.5 0.9 13.7 82 201 A R E -CD 98 135C 113 53,-1.0 53,-3.1 -2,-0.3 2,-0.5 -0.914 29.2-168.2-106.7 134.4 32.8 0.5 11.2 83 202 A W E -CD 97 134C 2 14,-2.8 14,-2.7 -2,-0.4 2,-0.7 -0.982 14.3-145.2-123.9 118.7 29.5 2.3 11.7 84 203 A M E -C 96 0C 47 49,-2.4 46,-0.4 -2,-0.5 2,-0.3 -0.758 21.4-155.9 -82.1 115.8 26.5 1.4 9.6 85 204 A A E -C 95 0C 0 10,-3.0 10,-2.1 -2,-0.7 2,-0.5 -0.652 4.4-140.0 -91.1 148.9 24.6 4.7 9.0 86 205 A R E -CE 94 128C 102 42,-2.3 42,-3.0 -2,-0.3 2,-0.3 -0.925 9.3-132.3-117.0 128.3 20.8 4.7 8.2 87 206 A G E + E 0 127C 11 6,-3.3 40,-0.2 -2,-0.5 3,-0.1 -0.597 30.7 172.3 -68.4 129.0 18.9 6.9 5.8 88 207 A T E + 0 0 75 38,-2.7 2,-0.2 1,-0.5 39,-0.1 0.389 65.3 13.6-126.5 -0.5 15.9 8.1 7.9 89 208 A N E S+ E 0 126C 109 37,-0.8 37,-2.5 2,-0.2 -1,-0.5 -0.819 130.6 18.6-170.4 139.2 14.3 10.7 5.5 90 209 A G S S+ 0 0 13 -2,-0.2 31,-2.3 35,-0.2 32,-0.8 0.551 127.5 47.1 68.7 7.8 15.1 11.2 1.8 91 210 A S - 0 0 10 29,-0.2 -2,-0.2 30,-0.2 29,-0.1 -0.869 52.4-167.8-169.7 142.7 16.6 7.7 1.8 92 211 A S + 0 0 124 27,-0.3 28,-0.1 -2,-0.3 2,-0.1 0.186 66.8 101.0-113.4 12.5 15.6 4.2 3.0 93 212 A D - 0 0 47 26,-0.6 -6,-3.3 -7,-0.1 2,-0.3 -0.229 61.3-138.0 -90.6 174.9 19.1 2.9 2.4 94 213 A T E -C 86 0C 50 -8,-0.2 2,-0.3 23,-0.2 -8,-0.2 -0.908 11.7-162.6-128.0 163.4 22.1 2.2 4.7 95 214 A I E -C 85 0C 6 -10,-2.1 -10,-3.0 -2,-0.3 2,-0.4 -0.969 19.2-125.8-150.7 133.7 25.8 2.8 4.2 96 215 A D E -CF 84 115C 55 19,-0.7 19,-2.2 -2,-0.3 2,-0.5 -0.637 25.9-162.6 -77.3 128.1 28.9 1.5 6.0 97 216 A M E -CF 83 114C 0 -14,-2.7 -14,-2.8 -2,-0.4 2,-0.6 -0.946 15.1-142.4-113.8 129.5 31.2 4.2 7.4 98 217 A T E -CF 82 113C 63 15,-3.4 15,-2.4 -2,-0.5 2,-0.4 -0.857 32.3-160.8 -86.2 122.2 34.8 3.6 8.3 99 218 A V E -CF 81 112C 0 -18,-3.1 -18,-2.1 -2,-0.6 2,-0.5 -0.919 24.5-170.8-117.7 128.2 35.3 5.7 11.4 100 219 A N E -CF 80 111C 43 11,-2.6 11,-3.0 -2,-0.4 2,-0.6 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