==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 21-MAY-10 3N44 . COMPND 2 MOLECULE: E3 ENVELOPE GLYCOPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CHIKUNGUNYA VIRUS; . AUTHOR J.VOSS,M.C.VANEY,S.DUQUERROY,F.A.REY . 783 3 17 17 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37332.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 474 60.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 271 34.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 96 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 2 0 0 0 2 1 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 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 0 0 0 PARALLEL BRIDGES PER LADDER . 6 8 9 10 7 4 3 4 1 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 . 9 4 2 3 2 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 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 5 A P 0 0 177 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -9.4 56.6 1.0 42.1 2 6 A V - 0 0 44 10,-0.1 11,-0.9 39,-0.0 2,-0.3 -0.416 360.0-157.6 -66.7 129.9 54.4 -2.1 41.2 3 7 A M E -A 12 0A 77 9,-0.2 39,-0.3 -2,-0.1 2,-0.2 -0.896 7.1-159.2-116.8 144.0 56.0 -5.4 42.4 4 8 A a E -A 11 0A 0 7,-3.7 7,-2.3 -2,-0.3 2,-0.3 -0.688 17.0-122.1-113.1 165.7 55.4 -9.1 41.2 5 9 A L E -A 10 0A 63 -2,-0.2 2,-0.3 5,-0.2 5,-0.2 -0.892 20.4-179.6-120.4 147.8 56.1 -12.5 42.9 6 10 A L E > -A 9 0A 42 3,-1.9 3,-3.0 -2,-0.3 2,-1.5 -0.894 69.1 -64.6-143.3 103.5 58.1 -15.7 42.2 7 11 A A T 3 S- 0 0 93 -2,-0.3 3,-0.0 1,-0.3 -2,-0.0 -0.321 121.1 -17.2 53.5 -78.6 57.8 -18.4 44.9 8 12 A N T 3 S+ 0 0 152 -2,-1.5 2,-0.4 2,-0.0 -1,-0.3 0.319 120.5 88.1-133.6 0.6 59.5 -16.5 47.8 9 13 A T E < -A 6 0A 75 -3,-3.0 -3,-1.9 2,-0.0 2,-0.4 -0.893 62.6-145.2-110.4 134.8 61.3 -13.6 46.0 10 14 A T E +A 5 0A 96 -2,-0.4 -5,-0.2 -5,-0.2 -2,-0.0 -0.800 25.0 165.4 -99.3 138.3 59.8 -10.2 45.1 11 15 A F E -A 4 0A 18 -7,-2.3 -7,-3.7 -2,-0.4 2,-0.2 -0.981 44.2 -86.8-146.5 154.2 60.7 -8.4 41.8 12 16 A P E > -A 3 0A 48 0, 0.0 3,-1.2 0, 0.0 -9,-0.2 -0.467 36.8-129.1 -69.4 133.3 59.3 -5.4 39.8 13 17 A a T 3 S+ 0 0 0 -11,-0.9 36,-0.2 1,-0.3 -10,-0.1 0.810 107.1 49.6 -47.1 -44.7 56.6 -6.6 37.2 14 18 A S T 3 S+ 0 0 62 -12,-0.3 -1,-0.3 1,-0.2 -11,-0.1 0.731 113.1 50.6 -70.0 -25.3 58.3 -4.9 34.2 15 19 A Q S < S- 0 0 138 -3,-1.2 -1,-0.2 3,-0.0 31,-0.1 -0.785 75.1-178.8-117.2 84.2 61.7 -6.4 35.1 16 20 A P - 0 0 7 0, 0.0 3,-0.5 0, 0.0 -3,-0.1 -0.457 34.5-125.1 -80.6 157.8 61.4 -10.2 35.6 17 21 A P S S+ 0 0 90 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.747 107.8 59.6 -72.3 -20.8 64.5 -12.4 36.6 18 22 A b S S+ 0 0 28 8,-0.0 7,-0.1 12,-0.0 12,-0.0 0.730 84.4 150.0 -74.6 -30.1 63.9 -14.7 33.6 19 23 A T + 0 0 69 -3,-0.5 2,-0.1 2,-0.0 31,-0.1 -0.197 39.3 56.9 -53.9 136.2 64.3 -12.0 30.9 20 24 A P S S- 0 0 86 0, 0.0 33,-0.2 0, 0.0 5,-0.1 0.522 131.4 -11.6 -82.1 157.9 65.3 -12.2 28.0 21 25 A c > + 0 0 23 31,-1.3 4,-1.5 28,-0.2 5,-0.2 0.973 68.8 177.4 51.2 75.1 63.0 -14.9 26.5 22 26 A b H > S+ 0 0 1 28,-0.8 4,-1.9 30,-0.4 8,-0.2 0.904 80.4 43.0 -69.0 -46.4 61.2 -16.3 29.6 23 27 A Y H 4 S+ 0 0 20 27,-1.1 -1,-0.2 2,-0.2 7,-0.1 0.811 112.6 53.8 -70.3 -35.4 58.9 -18.7 27.7 24 28 A E H 4 S+ 0 0 94 2,-0.1 -2,-0.2 1,-0.1 -1,-0.2 0.905 114.7 39.6 -66.5 -44.6 61.7 -19.9 25.4 25 29 A K H < S+ 0 0 124 -4,-1.5 -2,-0.2 1,-0.3 -3,-0.1 0.968 138.6 5.6 -68.4 -59.8 64.1 -20.8 28.3 26 30 A E X + 0 0 106 -4,-1.9 4,-1.0 -5,-0.2 -1,-0.3 -0.891 63.4 176.9-130.7 96.4 61.5 -22.4 30.7 27 31 A P H > S+ 0 0 30 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.829 80.3 49.9 -72.1 -29.6 57.9 -22.7 29.3 28 32 A E H > S+ 0 0 84 2,-0.2 4,-1.7 1,-0.2 3,-0.1 0.950 112.5 41.7 -72.9 -54.5 56.4 -24.4 32.4 29 33 A E H > S+ 0 0 102 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.692 109.0 61.0 -69.4 -20.6 57.6 -22.1 35.2 30 34 A T H X S+ 0 0 3 -4,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.930 109.0 41.5 -69.6 -47.3 56.9 -18.9 33.2 31 35 A L H X S+ 0 0 0 -4,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.861 114.7 52.8 -66.5 -37.8 53.1 -19.8 33.0 32 36 A R H X S+ 0 0 90 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.869 109.3 49.1 -63.7 -40.7 53.2 -20.9 36.6 33 37 A M H < S+ 0 0 11 -4,-1.9 4,-0.5 2,-0.2 3,-0.4 0.908 112.7 47.5 -64.2 -45.7 54.8 -17.5 37.6 34 38 A L H >< S+ 0 0 0 -4,-2.1 3,-0.8 1,-0.2 -2,-0.2 0.842 107.6 56.3 -64.9 -36.9 52.0 -15.7 35.6 35 39 A E H >< S+ 0 0 11 -4,-2.2 3,-0.5 1,-0.2 269,-0.4 0.775 106.1 51.1 -65.0 -31.2 49.3 -17.8 37.2 36 40 A D T 3< S+ 0 0 89 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.561 110.1 50.4 -82.4 -12.6 50.5 -16.7 40.7 37 41 A N T < S+ 0 0 0 -3,-0.8 3,-0.3 -4,-0.5 -1,-0.2 0.200 75.5 105.1-111.6 13.8 50.4 -13.0 39.7 38 42 A V S < S+ 0 0 17 -3,-0.5 5,-0.1 266,-0.3 -1,-0.1 0.812 81.5 48.1 -64.4 -36.7 46.8 -12.8 38.2 39 43 A M S S+ 0 0 178 -4,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.733 95.5 96.6 -75.0 -25.3 45.2 -10.9 41.2 40 44 A R S > S- 0 0 90 -3,-0.3 3,-1.1 1,-0.1 -36,-0.1 -0.320 78.1-130.6 -67.4 143.8 48.1 -8.4 41.2 41 45 A P T 3 S+ 0 0 121 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.799 103.6 56.7 -68.3 -29.2 47.7 -5.0 39.4 42 46 A G T >> S+ 0 0 0 -39,-0.3 4,-1.4 1,-0.2 3,-0.5 0.079 70.8 114.3 -89.8 22.9 51.0 -5.3 37.5 43 47 A Y H <> S+ 0 0 1 -3,-1.1 4,-2.4 1,-0.2 3,-0.2 0.889 75.1 50.2 -58.5 -48.0 50.1 -8.6 35.8 44 48 A Y H 3> S+ 0 0 52 -3,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.692 106.8 55.8 -67.5 -19.9 50.0 -7.2 32.2 45 49 A Q H <> S+ 0 0 90 -3,-0.5 4,-1.6 2,-0.2 -1,-0.2 0.842 112.5 43.0 -76.1 -36.3 53.4 -5.6 32.8 46 50 A L H X S+ 0 0 0 -4,-1.4 4,-2.3 -3,-0.2 -2,-0.2 0.843 112.1 53.4 -75.0 -38.7 54.7 -9.1 33.7 47 51 A L H X S+ 0 0 5 -4,-2.4 4,-1.2 2,-0.2 -2,-0.2 0.855 111.2 46.7 -64.6 -38.3 52.8 -10.7 30.7 48 52 A Q H < S+ 0 0 120 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.915 115.7 44.4 -69.5 -46.5 54.4 -8.2 28.2 49 53 A A H >< S+ 0 0 16 -4,-1.6 3,-0.8 1,-0.2 -27,-0.3 0.827 113.1 50.0 -68.6 -38.3 58.0 -8.7 29.6 50 54 A S H 3< S+ 0 0 0 -4,-2.3 -27,-1.1 1,-0.2 -28,-0.8 0.801 110.8 48.9 -72.0 -33.5 57.8 -12.6 29.9 51 55 A L T 3< S+ 0 0 0 -4,-1.2 8,-2.3 -5,-0.2 2,-0.4 0.067 89.8 101.2 -97.9 25.0 56.5 -13.1 26.3 52 56 A T B < +B 58 0B 44 -3,-0.8 -31,-1.3 6,-0.2 -30,-0.4 -0.931 33.2 134.8-110.8 128.1 59.1 -10.8 24.6 53 57 A c 0 0 37 4,-1.1 -1,-0.1 -2,-0.4 5,-0.1 0.468 360.0 360.0-132.9 -80.4 62.2 -12.4 22.9 54 58 A S 0 0 127 3,-0.3 4,-0.1 -34,-0.0 -2,-0.1 0.433 360.0 360.0-139.1 360.0 63.4 -11.2 19.4 55 !* 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 56 4 B D 0 0 201 0, 0.0 -4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 2.1 57.1 -4.6 19.7 57 5 B N + 0 0 79 -4,-0.1 -4,-1.1 2,-0.0 2,-0.3 0.327 360.0 120.1 -90.3 4.5 58.9 -8.0 20.1 58 6 B F B +B 52 0B 74 -6,-0.2 2,-0.4 -5,-0.1 -6,-0.2 -0.588 37.3 178.6 -77.9 127.5 55.9 -9.3 22.3 59 7 B N > - 0 0 25 -8,-2.3 3,-0.6 -2,-0.3 4,-0.3 -0.957 13.8-179.5-134.1 108.9 54.0 -12.4 21.1 60 8 B V G >> S+ 0 0 20 -2,-0.4 4,-1.0 1,-0.2 3,-0.9 0.737 77.1 72.6 -77.3 -25.3 51.1 -13.7 23.3 61 9 B Y G 34 S+ 0 0 26 1,-0.2 -1,-0.2 2,-0.2 51,-0.1 0.570 82.7 68.5 -69.6 -11.9 50.3 -16.5 20.9 62 10 B K G <4 S+ 0 0 7 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.834 103.3 44.1 -76.2 -30.6 53.5 -18.5 21.8 63 11 B A T <4 S+ 0 0 0 -3,-0.9 224,-2.8 -4,-0.3 -2,-0.2 0.828 113.0 60.7 -78.2 -37.2 52.1 -19.2 25.3 64 12 B T B < -c 287 0C 3 -4,-1.0 224,-0.2 222,-0.2 157,-0.0 -0.359 66.5-164.5 -88.8 168.4 48.6 -20.1 24.0 65 13 B R - 0 0 32 222,-1.0 224,-0.3 -2,-0.1 57,-0.1 -0.992 26.1-103.6-150.8 150.5 47.5 -22.9 21.5 66 14 B P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 38,-0.2 -0.390 47.0-162.4 -71.5 156.4 44.5 -23.8 19.3 67 15 B Y - 0 0 2 36,-1.9 2,-0.5 16,-0.2 55,-0.4 -0.864 24.1-112.8-139.6 171.5 42.3 -26.7 20.7 68 16 B L + 0 0 34 -2,-0.3 2,-0.3 56,-0.1 415,-0.1 -0.930 42.3 167.0-105.7 125.0 39.6 -29.4 20.2 69 17 B A E -D 82 0D 2 13,-1.8 13,-1.8 -2,-0.5 225,-0.1 -0.910 39.8 -79.3-136.0 163.0 36.3 -28.8 21.9 70 18 B H E -D 81 0D 26 223,-1.0 11,-0.2 553,-0.4 16,-0.1 -0.339 39.8-176.2 -64.2 141.0 32.7 -30.1 21.8 71 19 B d E -D 80 0D 0 9,-1.4 9,-1.4 14,-0.1 3,-0.2 -0.994 22.8-146.8-137.7 128.9 30.3 -29.0 19.0 72 20 B P S S+ 0 0 57 0, 0.0 2,-0.3 0, 0.0 107,-0.1 0.782 91.7 27.1 -69.6 -25.8 26.6 -30.1 18.9 73 21 B D B +E 178 0E 44 105,-0.6 105,-3.1 1,-0.1 6,-0.2 -0.873 52.8 163.4-142.5 104.6 26.6 -30.1 15.0 74 22 B e S S- 0 0 27 4,-2.6 102,-0.6 1,-0.4 2,-0.1 0.379 78.1 -53.8 -95.3 -0.7 29.7 -30.7 12.9 75 23 B G S > S+ 0 0 20 3,-0.3 3,-1.2 103,-0.1 -1,-0.4 -0.327 122.1 35.8 130.7 145.9 27.6 -31.4 9.8 76 24 B E T 3 S- 0 0 193 1,-0.2 -3,-0.0 -2,-0.1 0, 0.0 0.190 126.2 -68.4 70.5 -13.1 24.6 -33.8 8.9 77 25 B G T 3 S+ 0 0 51 1,-0.3 2,-0.3 101,-0.0 -1,-0.2 0.681 100.1 123.4 104.2 29.6 23.3 -33.3 12.5 78 26 B H < - 0 0 129 -3,-1.2 -4,-2.6 0, 0.0 -3,-0.3 -0.950 56.9-119.7-125.7 143.6 25.9 -35.1 14.5 79 27 B S + 0 0 64 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.1 -0.441 37.0 164.1 -77.9 149.2 28.2 -34.1 17.4 80 28 B e E -D 71 0D 47 -9,-1.4 -9,-1.4 -2,-0.1 2,-1.3 -0.962 50.6 -93.0-156.4 168.3 32.1 -34.2 17.2 81 29 B H E -D 70 0D 69 -2,-0.3 -11,-0.2 -11,-0.2 401,-0.0 -0.773 58.7-157.6 -89.0 88.1 35.4 -32.9 18.8 82 30 B S E > -D 69 0D 1 -13,-1.8 -13,-1.8 -2,-1.3 3,-1.0 -0.585 31.4-159.6 -79.2 132.8 35.7 -29.9 16.5 83 31 B P T 3 S+ 0 0 9 0, 0.0 39,-0.3 0, 0.0 -16,-0.2 0.598 104.9 44.3 -80.4 -9.1 38.9 -28.0 15.7 84 32 B V T 3 S+ 0 0 0 19,-0.1 81,-0.2 92,-0.1 93,-0.1 -0.185 87.1 160.5-122.2 32.8 36.5 -25.1 14.7 85 33 B A < - 0 0 0 -3,-1.0 18,-1.6 -18,-0.3 2,-0.4 -0.312 40.2-119.6 -63.3 136.6 34.2 -25.4 17.8 86 34 B L E +I 102 0F 0 16,-0.2 16,-0.2 1,-0.2 3,-0.1 -0.662 34.2 171.1 -83.3 130.6 32.1 -22.4 18.7 87 35 B E E - 0 0 28 14,-3.1 2,-0.4 -2,-0.4 -1,-0.2 0.868 62.2 -7.5-100.2 -71.5 32.6 -20.8 22.2 88 36 B R E - 0 0 62 13,-0.3 13,-1.8 2,-0.0 2,-0.6 -0.995 52.1-158.9-139.3 126.9 30.7 -17.5 22.6 89 37 B I E -I 100 0F 29 -2,-0.4 2,-0.5 11,-0.2 11,-0.2 -0.943 15.9-158.4-106.7 115.6 28.8 -15.4 20.0 90 38 B R E +I 99 0F 5 9,-3.0 9,-2.6 -2,-0.6 3,-0.1 -0.874 21.3 171.6-102.2 125.7 28.4 -11.8 21.0 91 39 B N + 0 0 50 -2,-0.5 7,-0.1 7,-0.2 -1,-0.1 -0.264 40.7 119.1-124.0 42.0 25.6 -9.6 19.5 92 40 B E + 0 0 7 7,-0.1 2,-0.3 352,-0.0 -1,-0.1 0.707 47.6 99.4 -79.8 -25.3 26.0 -6.5 21.7 93 41 B A > - 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