==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN/IMMUNE SYSTEM 22-OCT-10 2XV6 . COMPND 2 MOLECULE: CAPSID PROTEIN P24; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR S.IGONET,M.-C.VANEY,V.BARTONOVA,J.HELMA,U.ROTHBAUER,H.LEONHA . 370 5 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18158.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 23.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.1 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 . 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 . 24 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 20.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.4 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 2 0 1 1 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 PARALLEL BRIDGES PER LADDER . 0 0 6 1 1 7 0 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 2 0 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 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 1 146 A S 0 0 144 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 137.8 -5.0 2.1 11.0 2 147 A P + 0 0 96 0, 0.0 2,-0.4 0, 0.0 24,-0.0 0.393 360.0 163.5 -76.7 134.6 -4.8 2.4 7.9 3 148 A T - 0 0 56 23,-0.1 2,-0.3 -2,-0.1 5,-0.1 -0.976 39.3-120.4-121.1 137.8 -7.8 0.1 7.5 4 149 A S > - 0 0 0 -2,-0.4 3,-1.8 1,-0.1 4,-0.3 -0.562 17.9-132.2 -71.1 134.6 -9.8 -0.3 4.3 5 150 A I G > S+ 0 0 0 -2,-0.3 3,-1.4 1,-0.3 -1,-0.1 0.800 107.0 68.9 -52.7 -30.1 -13.5 0.5 4.8 6 151 A L G 3 S+ 0 0 0 1,-0.3 -1,-0.3 169,-0.0 104,-0.1 0.797 97.3 52.3 -60.6 -27.0 -14.1 -2.8 2.9 7 152 A D G < S+ 0 0 44 -3,-1.8 2,-1.0 169,-0.2 -1,-0.3 0.434 77.4 108.7 -90.8 -5.0 -12.7 -4.7 5.9 8 153 A I < + 0 0 8 -3,-1.4 2,-0.4 -4,-0.3 40,-0.1 -0.684 45.6 166.1 -79.6 107.0 -14.9 -3.2 8.7 9 154 A R - 0 0 123 -2,-1.0 40,-0.2 38,-0.0 2,-0.1 -0.973 39.9-109.3-126.5 135.8 -17.2 -6.0 9.7 10 155 A Q - 0 0 14 38,-2.4 6,-0.1 -2,-0.4 43,-0.0 -0.406 35.9-121.3 -63.9 133.5 -19.4 -6.2 12.7 11 156 A G > - 0 0 21 4,-0.1 3,-0.9 -2,-0.1 39,-0.2 -0.287 24.6-109.4 -69.9 156.3 -18.2 -8.8 15.3 12 157 A P T 3 S+ 0 0 115 0, 0.0 40,-0.1 0, 0.0 -1,-0.1 0.823 120.3 24.8 -59.4 -29.0 -20.6 -11.6 16.3 13 158 A K T 3 S+ 0 0 202 2,-0.1 -2,-0.0 37,-0.0 -3,-0.0 0.197 94.9 121.6-116.9 11.0 -21.1 -10.1 19.7 14 159 A E < - 0 0 36 -3,-0.9 36,-0.2 1,-0.1 5,-0.1 -0.661 68.3-116.8 -79.1 126.1 -20.3 -6.5 18.8 15 160 A P >> - 0 0 65 0, 0.0 4,-1.7 0, 0.0 3,-0.7 -0.321 22.1-122.1 -59.6 141.3 -23.2 -4.0 19.5 16 161 A F H 3> S+ 0 0 4 57,-0.6 4,-2.9 59,-0.4 5,-0.2 0.878 112.2 56.0 -53.9 -39.8 -24.5 -2.3 16.3 17 162 A R H 3> S+ 0 0 115 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.831 107.2 49.6 -60.2 -37.4 -23.7 1.2 17.7 18 163 A D H <> S+ 0 0 88 -3,-0.7 4,-2.1 2,-0.2 -1,-0.2 0.858 111.8 47.5 -69.6 -39.6 -20.0 0.1 18.3 19 164 A Y H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.927 110.3 52.9 -67.2 -44.7 -19.7 -1.3 14.7 20 165 A V H X S+ 0 0 8 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.906 109.8 49.6 -53.6 -46.4 -21.3 2.0 13.3 21 166 A D H X S+ 0 0 84 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.927 112.9 44.6 -60.8 -50.1 -18.7 4.0 15.2 22 167 A R H X S+ 0 0 87 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.846 114.0 52.3 -61.7 -39.9 -15.7 1.9 13.9 23 168 A F H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.959 114.1 40.4 -62.0 -54.2 -17.3 2.1 10.4 24 169 A Y H X S+ 0 0 73 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.873 114.3 52.7 -66.5 -36.8 -17.6 5.9 10.3 25 170 A K H X S+ 0 0 118 -4,-2.5 4,-1.7 -5,-0.2 -1,-0.2 0.932 113.9 43.8 -61.9 -45.6 -14.2 6.4 12.0 26 171 A T H X S+ 0 0 23 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.893 114.8 48.7 -65.6 -43.3 -12.5 4.2 9.4 27 172 A L H < S+ 0 0 7 -4,-2.6 3,-0.3 2,-0.2 -2,-0.2 0.889 108.7 53.1 -68.3 -33.6 -14.5 5.9 6.5 28 173 A R H < S+ 0 0 195 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.912 110.6 49.1 -63.9 -38.1 -13.6 9.4 7.8 29 174 A A H < S+ 0 0 60 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.705 89.7 102.7 -73.7 -23.3 -9.9 8.3 7.8 30 175 A E S < S- 0 0 7 -4,-1.2 2,-1.2 -3,-0.3 93,-0.1 -0.371 79.0-124.5 -62.8 137.7 -10.2 6.9 4.1 31 176 A Q B +a 123 0A 104 91,-0.5 93,-2.3 -2,-0.1 2,-0.3 -0.762 68.0 114.0 -85.1 95.8 -8.7 9.2 1.5 32 177 A A - 0 0 21 -2,-1.2 93,-0.1 91,-0.2 2,-0.0 -0.973 69.4 -90.1-157.7 163.0 -11.7 9.6 -0.7 33 178 A S > - 0 0 19 91,-0.3 4,-2.3 -2,-0.3 5,-0.1 -0.311 40.3-111.5 -73.7 163.1 -14.2 12.1 -2.0 34 179 A Q H > S+ 0 0 144 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.887 120.0 57.1 -63.9 -35.9 -17.5 12.7 0.0 35 180 A E H > S+ 0 0 92 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.904 108.6 45.2 -59.4 -47.2 -19.4 11.1 -2.9 36 181 A V H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.919 112.6 51.8 -63.9 -43.0 -17.3 7.9 -2.7 37 182 A K H X S+ 0 0 30 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.916 109.8 48.4 -61.4 -44.1 -17.8 7.9 1.2 38 183 A N H X S+ 0 0 96 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.895 111.1 51.0 -62.9 -37.6 -21.6 8.2 0.9 39 184 A W H X S+ 0 0 20 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.926 108.8 52.0 -63.0 -44.8 -21.7 5.4 -1.7 40 185 A M H X>S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.6 0.876 108.7 50.4 -58.7 -42.8 -19.6 3.2 0.7 41 186 A T H X5S+ 0 0 24 -4,-2.0 4,-1.2 1,-0.2 5,-0.4 0.927 113.1 46.1 -61.9 -42.6 -22.1 3.8 3.5 42 187 A E H <5S+ 0 0 139 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.770 122.6 35.1 -70.9 -30.7 -25.0 2.9 1.2 43 188 A T H <5S+ 0 0 3 -4,-1.9 4,-0.2 -5,-0.1 -2,-0.2 0.706 127.6 28.5 -96.0 -28.7 -23.3 -0.3 -0.1 44 189 A L H X5S+ 0 0 2 -4,-2.8 4,-3.0 -5,-0.2 -3,-0.2 0.740 96.7 75.3-106.3 -34.7 -21.3 -1.6 3.0 45 190 A L T <4 S+ 0 0 23 -5,-0.4 3,-1.6 2,-0.2 -1,-0.2 0.936 120.5 55.4 -72.4 -47.7 -25.8 -3.2 6.1 47 192 A Q T 34 S+ 0 0 46 1,-0.3 -2,-0.2 -4,-0.2 -1,-0.2 0.819 111.2 44.0 -54.1 -37.3 -23.7 -5.7 4.0 48 193 A N T 3< S+ 0 0 16 -4,-3.0 -38,-2.4 -40,-0.1 -1,-0.3 0.399 89.2 111.5 -95.0 5.6 -20.9 -5.8 6.6 49 194 A A S < S- 0 0 9 -3,-1.6 -3,-0.0 -4,-0.2 -33,-0.0 -0.335 79.9 -95.3 -71.9 158.1 -23.3 -6.0 9.6 50 195 A N > - 0 0 11 -39,-0.2 4,-3.3 -36,-0.2 5,-0.2 -0.187 43.2 -95.9 -68.1 165.8 -23.3 -9.4 11.6 51 196 A P H > S+ 0 0 103 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.874 123.9 50.5 -55.2 -38.6 -26.0 -12.1 10.7 52 197 A D H > S+ 0 0 123 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.930 118.0 37.6 -61.7 -52.1 -28.4 -10.9 13.5 53 198 A C H > S+ 0 0 12 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.917 111.9 57.9 -69.2 -40.9 -28.2 -7.3 12.6 54 199 A K H X S+ 0 0 64 -4,-3.3 4,-2.6 1,-0.2 5,-0.2 0.881 106.2 51.6 -55.7 -39.9 -28.1 -7.9 8.8 55 200 A T H X S+ 0 0 100 -4,-1.8 4,-1.6 -5,-0.2 -1,-0.2 0.911 113.0 43.4 -62.7 -48.5 -31.5 -9.8 9.1 56 201 A I H X S+ 0 0 69 -4,-1.4 4,-1.1 2,-0.2 -2,-0.2 0.927 116.4 48.0 -62.5 -48.1 -33.2 -6.9 11.0 57 202 A L H >X S+ 0 0 6 -4,-2.9 4,-0.7 1,-0.2 3,-0.6 0.903 109.5 50.9 -62.6 -44.6 -31.7 -4.2 8.7 58 203 A K H >< S+ 0 0 126 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.885 106.7 56.5 -62.7 -35.8 -32.7 -6.1 5.5 59 204 A A H 3< S+ 0 0 88 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.778 98.1 62.1 -65.8 -29.4 -36.3 -6.4 6.9 60 205 A L H << S- 0 0 80 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.768 102.5-149.7 -65.7 -26.7 -36.4 -2.5 7.3 61 206 A G X< - 0 0 29 -3,-0.9 3,-0.8 -4,-0.7 -1,-0.1 -0.113 32.3 -27.9 82.8-179.0 -36.0 -2.3 3.5 62 207 A P T 3 S+ 0 0 137 0, 0.0 -4,-0.0 0, 0.0 0, 0.0 -0.331 118.1 33.3 -74.2 150.7 -34.3 0.4 1.3 63 208 A G T 3 S+ 0 0 77 1,-0.3 2,-0.1 -2,-0.0 -2,-0.1 0.473 73.1 154.5 88.9 4.0 -34.1 4.0 2.4 64 209 A A < - 0 0 23 -3,-0.8 -1,-0.3 -7,-0.1 2,-0.1 -0.417 40.3-128.8 -64.2 137.7 -33.7 3.4 6.1 65 210 A T > - 0 0 71 1,-0.1 4,-2.3 -2,-0.1 5,-0.1 -0.460 22.1-108.8 -81.4 163.6 -31.9 6.3 7.9 66 211 A L H > S+ 0 0 58 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.882 121.4 54.0 -57.3 -39.3 -28.9 5.6 10.2 67 212 A E H > S+ 0 0 148 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.904 109.7 47.3 -63.0 -42.9 -31.1 6.5 13.2 68 213 A E H > S+ 0 0 100 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.910 112.5 49.4 -62.6 -44.4 -33.7 4.0 12.2 69 214 A M H X S+ 0 0 28 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.925 112.7 46.8 -61.6 -48.1 -31.1 1.3 11.6 70 215 A M H < S+ 0 0 40 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.834 112.9 49.9 -65.7 -35.2 -29.5 2.0 15.1 71 216 A T H >< S+ 0 0 69 -4,-2.1 3,-1.3 -5,-0.2 -2,-0.2 0.925 111.0 48.6 -69.2 -45.5 -32.9 1.9 16.8 72 217 A A H 3< S+ 0 0 40 -4,-2.6 3,-0.3 1,-0.2 -2,-0.2 0.816 115.6 44.5 -64.2 -31.0 -33.9 -1.4 15.1 73 218 A C T 3< S+ 0 0 6 -4,-1.7 -57,-0.6 1,-0.2 -1,-0.2 0.122 76.7 121.9 -99.1 17.7 -30.5 -3.0 16.2 74 219 A Q < 0 0 115 -3,-1.3 -1,-0.2 -58,-0.1 -2,-0.1 0.739 360.0 360.0 -50.0 -36.6 -30.6 -1.6 19.8 75 220 A G 0 0 111 -3,-0.3 -59,-0.4 -4,-0.1 -3,-0.0 0.071 360.0 360.0 -64.3 360.0 -30.4 -5.1 21.4 76 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 77 0 B A 0 0 89 0, 0.0 101,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 65.3 -6.5 -11.8 5.6 78 1 B Q + 0 0 177 1,-0.4 2,-0.5 99,-0.4 100,-0.2 0.055 360.0 37.3-153.6 -72.0 -7.4 -14.7 3.4 79 2 B V S S- 0 0 40 98,-0.2 100,-2.2 26,-0.1 2,-0.6 -0.723 71.8-141.7 -81.8 132.0 -7.3 -14.7 -0.4 80 3 B Q B -n 179 0B 106 -2,-0.5 100,-0.1 98,-0.2 2,-0.1 -0.790 16.4-144.8 -89.9 123.8 -4.2 -12.7 -1.7 81 4 B L - 0 0 0 98,-1.4 2,-0.4 -2,-0.6 101,-0.3 -0.461 6.1-146.3 -83.1 154.9 -5.2 -10.8 -4.8 82 5 B V E -O 100 0C 91 18,-1.8 18,-2.0 99,-0.2 2,-0.3 -0.976 7.4-154.5-129.2 121.0 -2.7 -10.2 -7.6 83 6 B E E +O 99 0C 12 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.665 20.2 163.2 -90.5 147.4 -2.6 -7.1 -9.7 84 7 B S E +O 98 0C 59 14,-2.1 14,-2.2 -2,-0.3 100,-0.1 -0.913 39.9 72.3-149.3 173.4 -1.3 -7.0 -13.3 85 8 B G + 0 0 13 1,-0.3 11,-0.5 -2,-0.3 193,-0.4 0.352 60.3 135.7 97.7 -2.5 -1.4 -4.7 -16.4 86 9 B G + 0 0 13 12,-0.1 188,-0.7 9,-0.1 -1,-0.3 -0.219 24.3 137.6 -67.1 163.4 0.7 -1.8 -15.1 87 10 B G E -bC 186 273A 16 98,-0.7 100,-2.9 186,-0.1 2,-0.5 -0.986 54.1 -71.3 179.6-170.7 3.3 -0.3 -17.4 88 11 B L E +bC 187 272A 79 184,-2.5 184,-2.9 -2,-0.3 2,-0.3 -0.957 54.3 160.0-111.0 118.6 5.1 2.7 -18.8 89 12 B V E -bC 188 271A 2 98,-2.3 100,-2.0 -2,-0.5 182,-0.2 -0.958 38.9-109.4-138.9 151.8 3.0 4.8 -21.2 90 13 B Q E > -b 189 0A 99 180,-1.4 3,-2.0 -2,-0.3 73,-0.2 -0.557 53.9 -78.9 -80.7 153.8 3.1 8.3 -22.6 91 14 B A T 3 S+ 0 0 36 98,-2.3 178,-0.2 1,-0.3 73,-0.2 -0.182 121.1 32.7 -49.2 133.6 0.4 10.9 -21.4 92 15 B G T 3 S+ 0 0 28 71,-3.0 70,-0.6 1,-0.3 -1,-0.3 0.174 98.0 114.9 98.8 -13.9 -2.9 10.4 -23.3 93 16 B G < - 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