==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 05-MAY-96 1KXA . COMPND 2 MOLECULE: SINDBIS VIRUS CAPSID PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SINDBIS VIRUS; . AUTHOR H.-K.CHOI,M.G.ROSSMANN . 158 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8752.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 106 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 39.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 2.5 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 . 21 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 2 5 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 1 0 0 1 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 1 107 A A 0 0 155 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 120.0 47.2 26.3 -12.4 2 108 A L - 0 0 154 2,-0.1 2,-1.8 0, 0.0 0, 0.0 -0.953 360.0-125.3-115.6 138.3 48.7 23.5 -10.3 3 109 A K + 0 0 172 -2,-0.4 2,-0.9 2,-0.0 0, 0.0 -0.440 45.1 161.1 -85.7 64.0 48.4 23.6 -6.5 4 110 A L + 0 0 160 -2,-1.8 2,-0.3 0, 0.0 -2,-0.1 -0.792 14.1 159.3 -87.1 103.7 52.0 23.3 -5.7 5 111 A E - 0 0 105 -2,-0.9 3,-0.1 1,-0.1 65,-0.0 -0.928 38.7-102.3-126.3 154.6 52.4 24.6 -2.1 6 112 A A - 0 0 46 -2,-0.3 2,-0.9 1,-0.1 3,-0.3 0.169 48.3 -85.0 -60.1-179.5 55.0 24.2 0.7 7 113 A D S S+ 0 0 118 1,-0.2 -1,-0.1 60,-0.1 3,-0.1 -0.853 75.3 127.2 -96.3 103.4 54.6 21.9 3.7 8 114 A R + 0 0 68 -2,-0.9 17,-2.0 1,-0.3 2,-0.5 0.598 54.6 62.8-125.3 -35.9 52.7 24.0 6.2 9 115 A L E -A 24 0A 67 -3,-0.3 2,-0.3 15,-0.2 -1,-0.3 -0.908 64.6-175.7-102.0 126.9 49.7 22.0 7.4 10 116 A F E -A 23 0A 17 13,-3.1 13,-2.7 -2,-0.5 2,-0.2 -0.884 23.1-114.8-123.4 151.0 50.4 18.8 9.2 11 117 A D E -A 22 0A 59 30,-0.4 30,-2.8 -2,-0.3 2,-0.5 -0.510 15.2-152.6 -83.9 152.5 48.2 16.0 10.5 12 118 A V E -AB 21 40A 0 9,-1.7 8,-2.2 28,-0.3 9,-1.0 -0.997 21.5-164.4-123.8 115.9 47.9 15.1 14.2 13 119 A K E -AB 19 39A 66 26,-2.7 26,-2.5 -2,-0.5 6,-0.2 -0.731 11.7-126.7-105.7 159.0 47.1 11.5 14.7 14 120 A N > - 0 0 29 4,-2.3 3,-1.2 -2,-0.3 24,-0.1 -0.363 45.9 -78.5 -93.3 178.4 45.7 9.5 17.7 15 121 A E T 3 S+ 0 0 213 1,-0.3 23,-0.1 2,-0.1 -2,-0.0 0.831 134.8 36.0 -45.9 -45.5 47.1 6.3 19.3 16 122 A D T 3 S- 0 0 123 2,-0.0 -1,-0.3 0, 0.0 -3,-0.0 0.648 127.0 -99.8 -84.9 -13.6 45.8 4.0 16.6 17 123 A G < + 0 0 32 -3,-1.2 -2,-0.1 1,-0.3 2,-0.1 0.550 67.0 150.0 112.1 5.8 46.5 6.7 14.0 18 124 A D - 0 0 67 1,-0.1 -4,-2.3 -5,-0.1 2,-0.8 -0.461 54.2-114.4 -65.7 147.4 43.2 8.4 13.2 19 125 A V E +A 13 0A 53 -6,-0.2 -6,-0.3 1,-0.2 -1,-0.1 -0.772 43.6 168.2 -85.8 115.4 43.7 12.1 12.1 20 126 A I E - 0 0 19 -8,-2.2 87,-0.9 -2,-0.8 89,-0.3 0.376 58.5 -18.5-109.0 -0.9 42.0 14.0 15.0 21 127 A G E -A 12 0A 0 -9,-1.0 -9,-1.7 85,-0.2 2,-0.3 -0.979 64.3 -99.7-178.8-171.5 43.3 17.5 14.2 22 128 A H E -A 11 0A 10 87,-2.6 2,-0.4 -2,-0.3 -11,-0.2 -0.959 14.9-155.7-137.6 151.3 45.8 19.7 12.3 23 129 A A E -A 10 0A 0 -13,-2.7 -13,-3.1 -2,-0.3 2,-0.4 -0.955 17.2-155.8-124.8 143.3 49.0 21.6 13.1 24 130 A L E -AC 9 31A 0 7,-2.4 7,-1.8 -2,-0.4 2,-0.5 -0.960 20.1-136.6-134.6 144.5 50.3 24.6 11.2 25 131 A A E + C 0 30A 0 -17,-2.0 47,-2.0 -2,-0.4 2,-0.3 -0.804 46.3 149.6 -85.9 123.0 53.5 26.5 10.5 26 132 A M E > -dC 72 29A 4 3,-2.4 3,-2.0 -2,-0.5 47,-0.2 -0.918 60.0 -6.7-162.0 135.0 52.8 30.2 10.8 27 133 A E T 3 S- 0 0 115 45,-1.8 46,-0.1 -2,-0.3 3,-0.1 0.849 129.6 -50.9 45.2 43.2 54.7 33.3 11.8 28 134 A G T 3 S+ 0 0 22 40,-0.2 35,-2.6 44,-0.2 2,-0.3 0.545 119.5 94.6 78.2 7.8 57.7 31.1 12.8 29 135 A K E < -CE 26 62A 96 -3,-2.0 -3,-2.4 33,-0.3 2,-0.5 -0.921 66.6-134.5-131.5 156.0 55.9 28.7 15.0 30 136 A V E -CE 25 61A 0 31,-2.3 31,-1.8 -2,-0.3 2,-0.4 -0.930 38.0-177.2-103.5 129.2 54.2 25.2 14.7 31 137 A M E +CE 24 60A 12 -7,-1.8 -7,-2.4 -2,-0.5 29,-0.2 -0.994 15.1 168.8-138.9 140.8 50.9 25.4 16.5 32 138 A K E - E 0 59A 11 27,-1.8 27,-1.7 -2,-0.4 -9,-0.1 -0.986 46.0 -85.3-144.9 152.1 48.1 23.0 17.3 33 139 A P E > - E 0 58A 0 0, 0.0 3,-1.3 0, 0.0 25,-0.3 -0.398 33.6-139.7 -60.7 128.4 44.9 23.0 19.5 34 140 A L T 3 S+ 0 0 13 23,-2.0 24,-0.1 1,-0.3 20,-0.1 0.839 101.0 60.4 -57.3 -37.3 45.9 22.0 23.0 35 141 A H T 3 S+ 0 0 40 22,-0.3 2,-1.0 1,-0.1 -1,-0.3 0.705 82.8 95.2 -64.9 -20.2 42.7 19.9 23.4 36 142 A V < - 0 0 7 -3,-1.3 2,-0.9 -14,-0.1 -15,-0.1 -0.638 62.9-165.2 -77.7 103.9 43.9 17.8 20.4 37 143 A K + 0 0 139 -2,-1.0 2,-0.3 -17,-0.1 -2,-0.1 -0.796 45.7 79.7 -98.6 104.0 45.7 14.8 22.0 38 144 A G S S- 0 0 36 -2,-0.9 2,-0.3 -24,-0.1 -24,-0.2 -0.872 77.4 -77.5-172.4-164.2 47.8 13.0 19.5 39 145 A T E -B 13 0A 92 -26,-2.5 -26,-2.7 -2,-0.3 2,-0.7 -0.873 38.6-111.3-119.0 151.1 51.1 13.2 17.7 40 146 A I E -B 12 0A 9 -2,-0.3 2,-2.1 -28,-0.2 -28,-0.3 -0.747 29.2-129.0 -82.6 115.3 52.2 15.5 14.8 41 147 A D S S+ 0 0 94 -30,-2.8 -30,-0.4 -2,-0.7 -1,-0.1 -0.471 74.6 103.4 -66.5 81.7 52.7 13.2 11.8 42 148 A H > - 0 0 37 -2,-2.1 4,-2.7 -32,-0.1 5,-0.2 -0.698 67.4-140.2-168.5 118.1 56.2 14.7 11.0 43 149 A P T 4 S+ 0 0 108 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 0.671 105.0 30.3 -51.9 -27.8 59.7 13.2 11.7 44 150 A V T >4 S+ 0 0 69 2,-0.1 3,-1.3 3,-0.0 4,-0.1 0.835 120.3 47.9-101.3 -45.9 61.1 16.6 12.8 45 151 A L G >4 S+ 0 0 0 1,-0.3 3,-1.4 2,-0.2 -4,-0.1 0.766 101.4 64.4 -69.6 -25.9 58.2 18.4 14.3 46 152 A S G 3< S+ 0 0 54 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.1 0.450 101.1 54.5 -78.4 1.5 57.0 15.5 16.5 47 153 A K G < S+ 0 0 177 -3,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.340 85.3 109.4-114.1 4.7 60.3 15.9 18.3 48 154 A L S < S- 0 0 54 -3,-1.4 2,-0.9 1,-0.1 15,-0.0 -0.425 76.3-107.8 -83.2 157.8 60.1 19.6 19.2 49 155 A K - 0 0 188 -2,-0.1 2,-0.5 13,-0.1 13,-0.3 -0.732 38.1-153.1 -85.5 104.9 59.5 21.0 22.7 50 156 A F - 0 0 53 -2,-0.9 2,-0.4 11,-0.1 11,-0.2 -0.682 2.0-149.0 -88.0 128.2 55.9 22.3 22.7 51 157 A T E -F 60 0A 78 9,-3.4 9,-2.3 -2,-0.5 2,-0.2 -0.786 18.7-133.5 -93.6 139.0 54.9 25.1 25.1 52 158 A K E -F 59 0A 125 -2,-0.4 7,-0.2 7,-0.2 2,-0.2 -0.564 21.7-175.8 -97.1 150.9 51.3 25.2 26.3 53 159 A S E >>> +F 58 0A 31 5,-1.7 5,-1.9 -2,-0.2 3,-1.2 -0.708 5.1 176.8-145.1 85.4 48.8 28.0 26.5 54 160 A S G >45S+ 0 0 84 1,-0.3 3,-0.6 2,-0.2 -1,-0.1 0.797 75.4 67.5 -61.1 -35.3 45.6 26.7 28.2 55 161 A A G 345S+ 0 0 71 1,-0.2 -1,-0.3 2,-0.1 94,-0.1 0.776 116.0 25.7 -59.0 -27.0 43.9 30.1 28.1 56 162 A Y G <45S- 0 0 77 -3,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.318 104.4-114.9-122.5 5.5 43.7 29.9 24.3 57 163 A D T <<5S+ 0 0 15 -3,-0.6 -23,-2.0 -4,-0.5 2,-0.4 0.800 73.1 136.6 65.8 28.1 43.7 26.2 23.6 58 164 A M E < -EF 33 53A 9 -5,-1.9 -5,-1.7 -25,-0.3 2,-0.3 -0.901 35.6-177.1-115.7 142.4 47.1 26.7 21.8 59 165 A E E +EF 32 52A 38 -27,-1.7 -27,-1.8 -2,-0.4 2,-0.3 -0.944 18.9 173.4-129.4 143.2 50.2 24.7 21.9 60 166 A F E -EF 31 51A 63 -9,-2.3 -9,-3.4 -2,-0.3 2,-0.3 -0.988 22.0-172.4-159.8 154.0 53.4 25.8 20.1 61 167 A A E -E 30 0A 5 -31,-1.8 -31,-2.3 -2,-0.3 2,-0.3 -0.859 41.5 -92.9-136.8 162.6 57.0 25.3 19.3 62 168 A Q E -E 29 0A 134 -13,-0.3 -33,-0.3 -2,-0.3 -13,-0.1 -0.633 44.3-112.3 -82.9 141.0 59.5 27.3 17.4 63 169 A L - 0 0 1 -35,-2.6 2,-0.1 -2,-0.3 -1,-0.1 -0.434 35.9-100.9 -72.3 139.7 59.9 26.4 13.7 64 170 A P > - 0 0 29 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 -0.438 36.0-111.8 -61.7 134.6 63.3 24.9 12.7 65 171 A V T 4 S+ 0 0 112 1,-0.2 4,-0.1 2,-0.2 -2,-0.1 0.732 117.9 50.7 -36.3 -32.5 65.4 27.7 11.0 66 172 A N T >4 S+ 0 0 113 1,-0.2 3,-1.4 2,-0.1 4,-0.3 0.989 110.4 43.2 -72.3 -65.2 65.0 25.8 7.8 67 173 A M G >4 S+ 0 0 23 1,-0.3 3,-1.8 2,-0.2 -2,-0.2 0.705 86.9 95.4 -54.5 -24.7 61.2 25.3 7.7 68 174 A R G 3< S+ 0 0 99 -4,-2.1 -1,-0.3 1,-0.3 -40,-0.2 0.685 85.2 50.6 -46.8 -18.5 60.7 28.9 8.8 69 175 A S G < S+ 0 0 92 -3,-1.4 2,-1.9 1,-0.2 -1,-0.3 0.811 96.2 70.0 -89.4 -32.4 60.3 29.9 5.2 70 176 A E S < S+ 0 0 75 -3,-1.8 2,-0.3 -4,-0.3 -1,-0.2 -0.528 86.9 107.7 -82.7 72.6 57.7 27.1 4.5 71 177 A A - 0 0 12 -2,-1.9 -45,-0.2 -3,-0.2 2,-0.2 -0.927 67.9-103.0-147.9 168.1 54.9 28.9 6.5 72 178 A F B -d 26 0A 18 -47,-2.0 -45,-1.8 -2,-0.3 2,-0.4 -0.518 28.5-132.5 -89.1 162.2 51.7 30.8 6.5 73 179 A T - 0 0 79 45,-0.4 47,-2.7 -47,-0.2 2,-0.1 -0.951 19.3-140.0-117.3 129.4 51.4 34.6 7.1 74 180 A Y B -g 120 0B 27 -2,-0.4 2,-0.3 45,-0.2 47,-0.2 -0.415 13.3-166.3 -86.0 167.2 48.8 35.9 9.5 75 181 A T - 0 0 18 45,-1.3 66,-0.2 -2,-0.1 68,-0.1 -0.960 15.8-160.5-154.0 132.4 46.6 39.0 9.1 76 182 A S + 0 0 31 -2,-0.3 2,-0.7 64,-0.1 67,-0.2 0.290 69.5 91.4 -96.6 5.3 44.5 40.7 11.8 77 183 A E + 0 0 117 65,-0.1 65,-0.0 66,-0.0 -1,-0.0 -0.914 44.0 163.8-110.3 112.6 42.3 42.5 9.3 78 184 A H - 0 0 37 -2,-0.7 3,-0.1 43,-0.0 43,-0.0 -0.740 15.5-167.5-127.7 87.4 39.1 40.7 8.4 79 185 A P - 0 0 99 0, 0.0 13,-0.1 0, 0.0 -2,-0.0 -0.241 41.4 -88.7 -66.8 161.9 36.4 42.8 6.8 80 186 A E S S+ 0 0 129 11,-0.1 2,-0.3 1,-0.0 13,-0.2 -0.325 86.7 72.1 -69.6 157.9 33.1 41.0 6.6 81 187 A G E S-H 92 0B 29 11,-2.2 11,-2.6 -3,-0.1 2,-0.4 -0.990 85.2 -20.1 141.3-142.4 32.3 38.8 3.6 82 188 A F E -H 91 0B 130 -2,-0.3 2,-0.2 9,-0.2 9,-0.2 -0.859 48.1-177.1-116.1 143.9 33.5 35.4 2.5 83 189 A Y E -H 90 0B 14 7,-3.3 7,-2.2 -2,-0.4 2,-0.3 -0.693 21.5-116.7-126.4 168.6 36.6 33.5 3.4 84 190 A N E +HI 89 114B 67 30,-3.3 30,-3.2 5,-0.2 2,-0.3 -0.859 34.0 151.6-113.6 154.1 38.2 30.2 2.3 85 191 A W E > -H 88 0B 20 3,-1.5 3,-1.5 -2,-0.3 28,-0.1 -0.908 59.6 -72.7-163.1 174.4 38.9 26.9 4.1 86 192 A H T 3 S+ 0 0 126 26,-0.4 3,-0.1 -2,-0.3 27,-0.1 0.805 127.4 38.8 -47.5 -40.2 39.2 23.2 3.4 87 193 A H T 3 S- 0 0 84 1,-0.2 2,-0.4 2,-0.0 -1,-0.3 0.394 121.2 -90.8 -96.5 1.5 35.5 22.6 2.9 88 194 A G E < S+H 85 0B 36 -3,-1.5 -3,-1.5 11,-0.0 2,-0.2 -0.983 78.3 12.1 137.2-140.8 34.6 25.7 1.1 89 195 A A E -H 84 0B 54 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.527 48.9-161.7 -80.5 149.5 33.4 29.2 2.0 90 196 A V E -H 83 0B 0 -7,-2.2 -7,-3.3 -2,-0.2 2,-0.6 -1.000 14.1-142.6-130.2 126.5 33.4 30.6 5.5 91 197 A Q E -HJ 82 98B 59 7,-2.5 7,-2.4 -2,-0.4 2,-0.7 -0.828 7.7-160.0 -98.1 124.6 31.2 33.6 6.2 92 198 A Y E +HJ 81 97B 40 -11,-2.6 -11,-2.2 -2,-0.6 2,-0.3 -0.905 33.6 136.2-103.7 118.5 32.5 36.3 8.5 93 199 A S E > + J 0 96B 41 3,-2.2 3,-1.5 -2,-0.7 -2,-0.1 -0.953 60.7 14.7-161.0 138.4 29.6 38.5 9.8 94 200 A G T 3 S- 0 0 59 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.869 127.9 -63.6 63.7 37.5 28.7 39.9 13.2 95 201 A G T 3 S+ 0 0 41 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.535 116.4 113.2 63.2 9.8 32.2 39.2 14.5 96 202 A R E < -J 93 0B 83 -3,-1.5 -3,-2.2 41,-0.0 2,-0.6 -0.905 61.7-141.6-120.5 139.5 31.4 35.5 13.9 97 203 A F E -J 92 0B 8 39,-0.4 39,-3.1 -2,-0.4 2,-0.4 -0.856 30.6-178.1 -96.9 118.7 32.8 32.8 11.5 98 204 A T E -JK 91 135B 12 -7,-2.4 -7,-2.5 -2,-0.6 37,-0.2 -0.934 15.9-179.6-125.3 147.0 30.0 30.5 10.3 99 205 A I E - 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