==== 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 1KXF . COMPND 2 MOLECULE: SINDBIS VIRUS CAPSID PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SINDBIS VIRUS; . AUTHOR H.-K.CHOI,M.G.ROSSMANN . 159 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8921.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 103 64.8 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 39.0 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 . 1 0.6 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 . 17 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 11.3 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 1 106 A M 0 0 254 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -57.8 46.8 27.7 -15.9 2 107 A A + 0 0 97 2,-0.0 2,-0.4 0, 0.0 0, 0.0 -0.787 360.0 180.0-111.5 135.3 47.1 26.6 -12.2 3 108 A L - 0 0 149 -2,-0.5 2,-2.0 2,-0.1 0, 0.0 -0.958 33.9-128.5-117.3 128.4 48.7 23.8 -10.3 4 109 A K + 0 0 171 -2,-0.4 2,-0.6 2,-0.0 -2,-0.0 -0.501 44.6 160.0 -80.4 70.1 48.3 24.0 -6.5 5 110 A L + 0 0 163 -2,-2.0 2,-0.3 0, 0.0 -2,-0.1 -0.876 14.0 160.1 -94.9 118.8 52.0 23.4 -5.6 6 111 A E - 0 0 105 -2,-0.6 65,-0.0 1,-0.1 3,-0.0 -0.963 40.2 -94.2-138.5 159.0 52.6 24.7 -2.1 7 112 A A - 0 0 44 -2,-0.3 2,-1.1 1,-0.1 3,-0.3 0.004 50.8 -90.6 -63.7 168.6 55.1 24.4 0.7 8 113 A D S S+ 0 0 125 1,-0.2 -1,-0.1 60,-0.0 3,-0.1 -0.772 74.9 130.5 -87.3 101.2 54.6 21.9 3.6 9 114 A R + 0 0 58 -2,-1.1 17,-2.2 1,-0.2 2,-0.5 0.609 51.7 63.5-122.7 -32.1 52.7 24.0 6.1 10 115 A L E -A 25 0A 69 -3,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.891 64.8-176.3-104.0 133.9 49.7 22.0 7.3 11 116 A F E -A 24 0A 18 13,-2.6 13,-2.4 -2,-0.5 2,-0.2 -0.926 22.9-113.7-131.3 154.9 50.3 18.7 9.1 12 117 A D E -A 23 0A 57 -2,-0.3 30,-3.2 30,-0.3 2,-0.5 -0.583 14.7-156.3 -87.7 150.8 48.2 15.9 10.5 13 118 A V E -AB 22 41A 0 9,-1.7 8,-2.1 28,-0.2 9,-1.0 -0.991 21.3-164.4-122.7 122.9 47.9 15.1 14.2 14 119 A K E -AB 20 40A 69 26,-2.4 26,-2.1 -2,-0.5 6,-0.2 -0.824 13.2-125.1-113.5 156.2 46.9 11.4 14.7 15 120 A N > - 0 0 32 4,-2.1 3,-2.4 -2,-0.3 24,-0.1 -0.305 48.7 -77.0 -87.3 180.0 45.6 9.4 17.7 16 121 A E T 3 S+ 0 0 212 1,-0.3 23,-0.1 2,-0.1 -2,-0.0 0.807 134.1 38.0 -47.8 -42.1 47.0 6.3 19.2 17 122 A D T 3 S- 0 0 123 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.366 126.2 -98.0 -93.5 2.4 45.8 4.0 16.4 18 123 A G < + 0 0 35 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.647 68.3 148.4 98.4 11.5 46.5 6.6 13.7 19 124 A D - 0 0 70 1,-0.1 -4,-2.1 2,-0.0 2,-0.6 -0.672 54.8-113.2 -75.3 141.9 43.2 8.4 13.0 20 125 A V E +A 14 0A 53 -2,-0.3 -6,-0.2 -6,-0.2 3,-0.1 -0.622 43.2 168.0 -78.8 117.4 43.6 12.0 12.0 21 126 A I E - 0 0 20 -8,-2.1 87,-0.8 -2,-0.6 89,-0.3 0.376 59.5 -29.5-111.6 2.1 42.0 13.9 14.8 22 127 A G E -A 13 0A 0 -9,-1.0 -9,-1.7 85,-0.2 2,-0.3 -0.983 63.4 -93.2 171.9-167.9 43.2 17.4 13.9 23 128 A H E -A 12 0A 9 87,-2.5 2,-0.3 -2,-0.3 -11,-0.2 -0.947 13.7-155.5-141.0 154.8 45.8 19.6 12.3 24 129 A A E -A 11 0A 0 -13,-2.4 -13,-2.6 -2,-0.3 2,-0.4 -0.893 19.5-152.0-124.5 154.3 49.0 21.5 13.1 25 130 A L E -AC 10 32A 0 7,-2.7 7,-2.5 -2,-0.3 2,-0.7 -0.987 19.4-134.9-143.3 147.9 50.4 24.5 11.2 26 131 A A E + C 0 31A 1 -17,-2.2 47,-2.8 -2,-0.4 2,-0.3 -0.813 47.8 145.0 -90.6 116.4 53.6 26.4 10.3 27 132 A M E > -dC 73 30A 3 3,-2.6 3,-1.9 -2,-0.7 47,-0.2 -0.945 59.7 -5.4-160.9 135.5 52.9 30.1 10.7 28 133 A E T 3 S- 0 0 118 45,-1.7 3,-0.1 -2,-0.3 46,-0.1 0.785 129.0 -50.6 47.8 40.0 54.8 33.1 11.8 29 134 A G T 3 S+ 0 0 22 1,-0.2 35,-3.1 40,-0.2 2,-0.3 0.427 119.9 93.3 84.6 4.0 57.8 31.0 12.8 30 135 A K E < -CE 27 63A 96 -3,-1.9 -3,-2.6 33,-0.3 2,-0.6 -0.849 67.5-134.1-128.4 157.9 56.0 28.5 14.9 31 136 A V E -CE 26 62A 0 31,-2.3 31,-1.6 -2,-0.3 2,-0.3 -0.970 39.5-177.8-105.8 119.5 54.3 25.1 14.6 32 137 A M E +CE 25 61A 15 -7,-2.5 -7,-2.7 -2,-0.6 29,-0.2 -0.916 14.9 167.1-126.9 148.5 51.0 25.4 16.4 33 138 A K E - E 0 60A 10 27,-2.5 27,-1.7 -2,-0.3 -9,-0.2 -0.990 45.6 -86.2-151.7 151.5 48.1 23.1 17.2 34 139 A P E > - E 0 59A 0 0, 0.0 3,-0.6 0, 0.0 25,-0.3 -0.326 32.4-139.9 -59.4 139.8 45.1 23.1 19.4 35 140 A L T 3 S+ 0 0 13 23,-1.8 24,-0.1 1,-0.2 20,-0.1 0.908 98.3 64.2 -70.5 -38.5 46.0 21.9 22.9 36 141 A H T 3 S+ 0 0 42 22,-0.3 2,-0.9 1,-0.1 -1,-0.2 0.649 82.7 91.4 -59.7 -16.3 42.7 19.8 23.3 37 142 A V < - 0 0 6 -3,-0.6 2,-1.0 -14,-0.1 -1,-0.1 -0.731 64.1-166.0 -86.6 103.8 43.9 17.6 20.4 38 143 A K + 0 0 136 -2,-0.9 2,-0.3 -17,-0.1 -2,-0.1 -0.790 45.4 85.8 -98.9 97.9 45.8 14.8 22.0 39 144 A G S S- 0 0 32 -2,-1.0 2,-0.3 -24,-0.1 -24,-0.2 -0.892 76.4 -79.5-165.4-169.9 47.8 12.9 19.4 40 145 A T E -B 14 0A 92 -26,-2.1 -26,-2.4 -2,-0.3 2,-0.5 -0.849 38.2-110.6-112.7 146.6 51.1 13.2 17.7 41 146 A I E -B 13 0A 9 -2,-0.3 2,-2.6 -28,-0.2 -28,-0.2 -0.628 29.9-129.8 -73.6 121.8 52.2 15.4 14.9 42 147 A D S S+ 0 0 87 -30,-3.2 -30,-0.3 -2,-0.5 -1,-0.1 -0.431 74.9 100.3 -71.6 69.0 52.7 13.2 11.8 43 148 A H > - 0 0 40 -2,-2.6 4,-2.5 -32,-0.1 5,-0.2 -0.878 69.1-138.6-160.0 124.1 56.2 14.6 11.0 44 149 A P T 4 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.689 105.8 30.3 -54.4 -28.2 59.7 13.2 11.8 45 150 A V T >4 S+ 0 0 64 2,-0.1 3,-1.8 3,-0.1 4,-0.3 0.859 118.9 50.0 -98.8 -52.0 61.1 16.5 12.8 46 151 A L G >4 S+ 0 0 0 1,-0.3 3,-1.3 2,-0.2 -5,-0.1 0.815 102.8 61.5 -58.3 -33.8 58.1 18.4 14.2 47 152 A S G 3< S+ 0 0 52 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.1 0.644 101.7 54.1 -71.0 -11.4 57.0 15.5 16.5 48 153 A K G < S+ 0 0 176 -3,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.422 85.0 107.7-102.5 1.9 60.3 15.8 18.4 49 154 A L S < S- 0 0 50 -3,-1.3 2,-0.7 -4,-0.3 15,-0.0 -0.413 78.0-107.9 -80.0 159.2 60.2 19.4 19.2 50 155 A K - 0 0 189 -2,-0.1 2,-0.4 13,-0.1 13,-0.3 -0.770 38.6-149.9 -87.4 113.0 59.6 20.8 22.7 51 156 A F - 0 0 54 -2,-0.7 2,-0.4 11,-0.1 11,-0.2 -0.732 4.5-148.8 -94.2 133.5 56.0 22.2 22.8 52 157 A T E -F 61 0A 77 9,-3.5 9,-2.8 -2,-0.4 2,-0.2 -0.827 19.4-137.5 -95.9 140.6 54.9 25.1 25.0 53 158 A K E -F 60 0A 124 -2,-0.4 7,-0.2 7,-0.2 2,-0.2 -0.531 19.1-172.6-103.2 153.1 51.3 25.1 26.2 54 159 A S E > > +F 59 0A 31 5,-1.8 5,-2.0 -2,-0.2 3,-1.2 -0.668 7.0 175.0-144.3 85.5 48.8 27.9 26.4 55 160 A S G > 5S+ 0 0 78 1,-0.3 3,-1.1 2,-0.2 -1,-0.1 0.865 76.3 65.9 -62.4 -36.0 45.6 26.7 28.2 56 161 A A G 3 5S+ 0 0 78 1,-0.3 -1,-0.3 2,-0.1 94,-0.0 0.768 117.9 26.8 -57.8 -25.4 44.0 30.1 28.2 57 162 A Y G < 5S- 0 0 74 -3,-1.2 -1,-0.3 2,-0.2 -2,-0.2 0.254 104.4-117.4-124.1 8.7 43.8 29.9 24.4 58 163 A D T < 5S+ 0 0 13 -3,-1.1 -23,-1.8 -4,-0.4 2,-0.3 0.799 72.3 132.1 58.6 32.7 43.7 26.2 23.6 59 164 A M E < -EF 34 54A 10 -5,-2.0 -5,-1.8 -25,-0.3 2,-0.4 -0.881 39.1-172.9-119.1 152.9 47.0 26.5 21.8 60 165 A E E +EF 33 53A 39 -27,-1.7 -27,-2.5 -2,-0.3 2,-0.3 -0.997 21.1 171.4-141.9 130.6 50.3 24.5 21.9 61 166 A F E -EF 32 52A 64 -9,-2.8 -9,-3.5 -2,-0.4 2,-0.3 -0.984 21.1-172.8-149.1 160.6 53.3 25.7 20.0 62 167 A A E -E 31 0A 4 -31,-1.6 -31,-2.3 -2,-0.3 2,-0.3 -0.917 40.5 -90.8-144.1 160.0 57.1 25.3 19.3 63 168 A Q E -E 30 0A 133 -13,-0.3 -33,-0.3 -2,-0.3 -13,-0.1 -0.591 45.6-112.6 -78.9 137.8 59.6 27.3 17.3 64 169 A L - 0 0 1 -35,-3.1 5,-0.1 -2,-0.3 -1,-0.1 -0.408 35.9-100.2 -68.0 141.2 60.1 26.3 13.6 65 170 A P > - 0 0 28 0, 0.0 4,-1.7 0, 0.0 3,-0.1 -0.396 39.3-107.6 -61.3 143.0 63.4 24.7 12.7 66 171 A V T 4 S+ 0 0 117 1,-0.2 4,-0.2 2,-0.2 3,-0.1 0.825 119.7 48.9 -37.7 -43.2 65.6 27.4 11.0 67 172 A N T >4 S+ 0 0 108 1,-0.2 3,-1.3 2,-0.1 4,-0.4 0.945 109.0 47.3 -66.0 -56.5 65.0 25.6 7.7 68 173 A M G >4 S+ 0 0 24 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.675 85.8 92.7 -64.1 -16.2 61.2 25.3 7.8 69 174 A R G 3< S+ 0 0 97 -4,-1.7 -1,-0.2 1,-0.3 -40,-0.2 0.724 86.4 50.3 -52.6 -23.1 60.7 28.9 8.8 70 175 A S G < S+ 0 0 92 -3,-1.3 2,-1.9 -4,-0.2 -1,-0.3 0.838 96.8 69.9 -81.9 -38.0 60.4 29.8 5.2 71 176 A E S < S+ 0 0 74 -3,-0.8 2,-0.3 -4,-0.4 -1,-0.2 -0.577 86.3 106.3 -78.9 78.5 57.7 27.1 4.5 72 177 A A - 0 0 14 -2,-1.9 -45,-0.3 -3,-0.1 -63,-0.1 -0.997 68.6-104.3-159.4 153.0 55.0 28.9 6.5 73 178 A F B -d 27 0A 19 -47,-2.8 -45,-1.7 -2,-0.3 2,-0.4 -0.276 28.2-133.4 -73.1 162.9 51.8 30.9 6.5 74 179 A T - 0 0 76 45,-0.4 47,-2.7 -47,-0.2 2,-0.2 -0.917 20.3-139.4-115.6 139.6 51.6 34.6 7.1 75 180 A Y B -g 121 0B 30 -2,-0.4 2,-0.3 45,-0.2 47,-0.2 -0.663 13.2-165.1-100.3 160.1 48.9 35.9 9.4 76 181 A T - 0 0 18 45,-2.2 66,-0.2 -2,-0.2 68,-0.0 -0.993 15.7-159.6-144.9 133.9 46.7 39.0 9.1 77 182 A S + 0 0 31 -2,-0.3 2,-0.6 64,-0.1 67,-0.2 0.368 69.1 94.1 -91.9 1.8 44.6 40.7 11.7 78 183 A E + 0 0 114 65,-0.1 65,-0.0 66,-0.1 -2,-0.0 -0.872 42.6 162.2-101.9 119.3 42.4 42.5 9.2 79 184 A H - 0 0 37 -2,-0.6 3,-0.1 37,-0.0 -1,-0.0 -0.647 16.5-167.5-134.5 80.9 39.2 40.7 8.4 80 185 A P - 0 0 96 0, 0.0 13,-0.1 0, 0.0 -2,-0.0 -0.240 42.3 -86.4 -64.4 160.1 36.5 42.8 6.8 81 186 A E S S+ 0 0 130 11,-0.1 2,-0.3 1,-0.0 13,-0.2 -0.260 87.8 78.0 -61.2 157.7 33.1 41.2 6.7 82 187 A G E S-H 93 0B 32 11,-1.8 11,-2.8 -3,-0.1 2,-0.3 -0.968 83.2 -32.4 140.6-155.6 32.5 39.0 3.7 83 188 A F E -H 92 0B 134 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.770 48.5-176.6-107.8 150.8 33.5 35.5 2.6 84 189 A Y E -H 91 0B 13 7,-2.8 7,-2.9 -2,-0.3 2,-0.3 -0.820 21.8-110.5-133.6 171.9 36.7 33.6 3.3 85 190 A N E +HI 90 115B 67 30,-3.0 30,-3.5 -2,-0.3 2,-0.3 -0.837 34.0 154.6-115.3 147.0 38.2 30.2 2.3 86 191 A W E > -H 89 0B 19 3,-2.1 3,-2.0 -2,-0.3 28,-0.1 -0.920 59.1 -77.3-153.9 173.1 38.9 26.9 4.1 87 192 A H T 3 S+ 0 0 129 26,-0.4 3,-0.1 -2,-0.3 27,-0.1 0.767 127.3 43.2 -45.2 -38.2 39.2 23.3 3.3 88 193 A H T 3 S- 0 0 84 1,-0.2 2,-0.4 2,-0.0 -1,-0.3 0.459 120.2 -95.9 -93.6 -0.6 35.5 22.7 3.0 89 194 A G E < S+H 86 0B 36 -3,-2.0 -3,-2.1 11,-0.0 2,-0.3 -0.989 78.9 17.8 135.2-131.1 34.6 25.8 1.0 90 195 A A E -H 85 0B 54 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.601 48.3-165.0 -88.6 141.8 33.3 29.2 2.0 91 196 A V E -H 84 0B 0 -7,-2.9 -7,-2.8 -2,-0.3 2,-0.4 -0.994 14.5-146.1-123.8 127.2 33.5 30.7 5.5 92 197 A Q E -HJ 83 99B 60 7,-2.3 7,-2.4 -2,-0.4 2,-0.6 -0.776 7.0-160.9 -96.5 137.5 31.3 33.7 6.1 93 198 A Y E +HJ 82 98B 41 -11,-2.8 -11,-1.8 -2,-0.4 2,-0.3 -0.930 33.4 130.6-120.6 109.4 32.4 36.4 8.5 94 199 A S E > + J 0 97B 42 3,-2.5 3,-1.1 -2,-0.6 -2,-0.1 -0.974 60.1 21.0-155.7 142.4 29.7 38.7 9.8 95 200 A G T 3 S- 0 0 61 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.742 128.1 -61.1 73.1 26.3 28.6 39.9 13.2 96 201 A G T 3 S+ 0 0 48 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.366 118.6 106.2 79.8 -3.5 32.0 39.2 14.8 97 202 A R E < -J 94 0B 84 -3,-1.1 -3,-2.5 41,-0.0 2,-0.5 -0.872 62.5-145.8-119.1 145.2 31.4 35.5 13.9 98 203 A F E +J 93 0B 7 -2,-0.3 39,-2.8 39,-0.3 2,-0.3 -0.870 32.0 178.8 -99.7 126.1 32.8 33.1 11.4 99 204 A T E -JK 92 136B 11 -7,-2.4 -7,-2.3 -2,-0.5 37,-0.2 -0.937 16.5-175.7-131.9 158.6 30.1 30.6 10.3 100 205 A I E - 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