==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 25-APR-13 4KDM . COMPND 2 MOLECULE: HEMAGGLUTININ; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR X.LU,Y.SHI,W.ZHANG,Y.ZHANG,J.QI,G.F.GAO . 1491 6 18 15 3 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 61227.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 934 62.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 78 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 284 19.0 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 . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 21 1.4 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 . 6 0.4 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 . 142 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 299 20.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 0.8 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 3 0 3 3 3 0 1 0 0 1 1 0 0 0 0 3 0 0 0 0 0 0 0 0 0 3 RESIDUES PER ALPHA HELIX . 6 9 9 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 . 16 14 16 6 0 12 0 0 3 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 . 12 9 3 3 0 3 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 4 A Q 0 0 132 0, 0.0 2,-0.2 0, 0.0 463,-0.1 0.000 360.0 360.0 360.0 138.6 25.4 -33.0 0.4 2 5 A D - 0 0 16 463,-0.4 461,-2.7 461,-0.3 2,-0.3 -0.474 360.0-168.6 -84.9 147.6 27.5 -29.9 0.9 3 6 A Q E -AB 350 462A 44 347,-2.1 347,-2.1 459,-0.2 2,-0.4 -0.979 20.5-167.1-142.2 147.2 26.6 -26.5 -0.5 4 7 A I E -AB 349 461A 0 457,-2.4 457,-5.0 -2,-0.3 2,-0.4 -1.000 16.0-174.4-130.7 132.0 27.8 -22.9 -1.1 5 8 A a E -AB 348 460A 11 343,-2.1 343,-2.0 -2,-0.4 2,-0.5 -0.977 17.6-140.5-128.6 141.1 25.5 -20.1 -2.0 6 9 A I E +A 347 0A 2 453,-2.8 2,-0.3 -2,-0.4 341,-0.2 -0.870 37.6 150.1-101.5 130.4 26.2 -16.5 -3.0 7 10 A G E -A 346 0A 0 339,-2.8 339,-2.8 -2,-0.5 2,-0.3 -0.887 32.0-119.6-151.2 179.7 23.9 -13.8 -1.5 8 11 A Y E -A 345 0A 7 327,-0.4 329,-4.2 -2,-0.3 337,-0.2 -0.812 34.5 -80.2-131.2 165.9 23.5 -10.2 -0.4 9 12 A H B +e 337 0B 21 335,-2.6 2,-0.3 -2,-0.3 329,-0.2 -0.166 38.8 175.0 -64.7 150.5 22.7 -8.1 2.7 10 13 A A + 0 0 5 327,-1.2 2,-0.3 330,-0.7 310,-0.1 -0.966 3.7 168.0-146.3 158.9 19.2 -7.4 4.1 11 14 A N - 0 0 35 -2,-0.3 327,-0.1 2,-0.1 325,-0.1 -0.884 50.6 -81.8-155.8-171.5 17.9 -5.6 7.2 12 15 A N S S+ 0 0 146 -2,-0.3 16,-0.0 326,-0.1 308,-0.0 0.207 74.6 139.2 -85.3 17.0 15.0 -4.1 9.0 13 16 A S - 0 0 16 1,-0.1 -2,-0.1 15,-0.1 16,-0.1 -0.276 35.9-175.5 -71.4 148.5 15.2 -0.9 7.0 14 17 A T + 0 0 124 14,-0.1 -1,-0.1 12,-0.1 14,-0.1 0.342 40.2 134.2-119.6 -4.2 12.0 0.9 5.8 15 18 A E - 0 0 73 12,-0.3 12,-3.2 13,-0.1 2,-0.3 -0.254 40.1-158.2 -51.0 125.3 14.0 3.5 3.9 16 19 A Q E -F 26 0C 77 10,-0.3 2,-0.3 12,-0.0 10,-0.2 -0.832 11.6-175.2-111.8 153.4 12.6 4.0 0.4 17 20 A V E -F 25 0C 3 8,-1.4 8,-2.8 -2,-0.3 2,-0.3 -0.948 18.0-130.1-139.2 152.2 14.2 5.5 -2.7 18 21 A D - 0 0 47 295,-0.4 2,-0.3 -2,-0.3 5,-0.2 -0.781 18.6-166.1-107.5 160.9 12.9 6.3 -6.2 19 22 A T - 0 0 6 3,-3.5 406,-0.2 -2,-0.3 405,-0.1 -0.886 39.0-102.1-138.5 157.3 14.4 5.3 -9.6 20 23 A I S S+ 0 0 0 404,-0.9 1355,-0.3 -2,-0.3 1356,-0.1 0.868 125.4 23.7 -48.1 -38.3 13.9 6.4 -13.2 21 24 A M S S+ 0 0 24 403,-0.2 2,-0.3 1,-0.1 1350,-0.2 0.540 125.8 46.2-110.2 -10.6 11.8 3.2 -13.7 22 25 A E - 0 0 84 1349,-0.1 -3,-3.5 402,-0.1 2,-0.3 -0.980 59.8-156.5-137.1 149.8 10.6 2.4 -10.2 23 26 A K S S+ 0 0 101 -2,-0.3 -5,-0.2 -5,-0.2 -3,-0.0 -0.881 71.9 16.7-121.6 154.9 9.1 4.2 -7.2 24 27 A N S S+ 0 0 99 -2,-0.3 2,-1.0 1,-0.2 -6,-0.2 0.904 70.7 175.5 52.6 49.5 9.1 3.4 -3.5 25 28 A V E -F 17 0C 8 -8,-2.8 -8,-1.4 -3,-0.2 -1,-0.2 -0.778 27.3-135.9 -87.3 102.9 11.9 0.9 -3.7 26 29 A T E -F 16 0C 42 -2,-1.0 294,-1.5 -10,-0.2 2,-0.3 -0.325 33.3-171.3 -57.7 142.0 12.6 -0.1 -0.1 27 30 A V B -G 319 0D 0 -12,-3.2 -12,-0.3 292,-0.2 292,-0.2 -0.921 37.3-119.6-146.5 161.2 16.4 -0.1 0.5 28 31 A T S S- 0 0 8 290,-1.7 2,-0.3 -2,-0.3 -13,-0.1 0.888 95.3 -3.8 -70.5 -43.1 19.2 -1.0 2.9 29 32 A H + 0 0 87 -16,-0.1 288,-2.9 -14,-0.1 287,-2.7 -0.982 65.1 179.3-156.4 140.7 20.7 2.5 3.4 30 33 A A E -H 315 0E 11 -2,-0.3 2,-0.3 285,-0.2 285,-0.2 -0.894 13.0-151.9-140.1 165.8 19.9 5.9 1.9 31 34 A Q E -H 314 0E 72 283,-2.0 283,-2.8 -2,-0.3 2,-0.3 -0.940 16.7-133.5-146.7 120.3 21.2 9.5 2.2 32 35 A D E -H 313 0E 52 -2,-0.3 281,-0.2 281,-0.3 258,-0.0 -0.551 10.5-167.5 -77.2 136.0 19.3 12.7 1.7 33 36 A I + 0 0 1 279,-3.2 259,-1.0 -2,-0.3 2,-0.5 0.567 63.4 91.8 -95.7 -12.9 21.1 15.3 -0.5 34 37 A L E -i 292 0F 7 278,-0.3 2,-0.4 257,-0.1 259,-0.2 -0.740 68.2-142.9 -95.8 121.9 18.6 18.1 0.5 35 38 A E E +i 293 0F 36 257,-2.8 259,-1.3 -2,-0.5 260,-0.3 -0.669 28.9 161.2 -82.1 130.1 19.2 20.4 3.5 36 39 A K + 0 0 85 -2,-0.4 2,-0.4 257,-0.2 -1,-0.1 0.407 42.8 95.5-125.5 -3.6 16.0 21.3 5.4 37 40 A K + 0 0 165 250,-0.1 2,-0.3 2,-0.0 250,-0.3 -0.795 38.2 167.5-105.5 135.2 17.4 22.5 8.8 38 41 A H - 0 0 66 -2,-0.4 248,-0.2 248,-0.1 246,-0.0 -0.879 38.8-123.4-130.3 167.3 18.2 26.0 10.0 39 42 A N - 0 0 76 246,-1.7 245,-0.1 -2,-0.3 247,-0.1 0.443 37.3-126.6 -95.1 -0.2 18.9 27.4 13.5 40 43 A G S S+ 0 0 29 245,-0.3 2,-0.3 1,-0.2 244,-0.2 0.577 73.6 102.3 70.3 10.6 16.1 30.0 13.6 41 44 A K S S- 0 0 121 244,-0.1 244,-0.9 229,-0.1 2,-0.4 -0.926 74.2-114.4-130.5 151.5 18.5 32.8 14.4 42 45 A L E -k 272 0G 0 229,-1.4 231,-2.2 -2,-0.3 2,-0.3 -0.693 45.8-177.4 -79.7 130.1 20.4 35.8 12.8 43 46 A b E - 0 0 0 -2,-0.4 233,-0.2 229,-0.2 231,-0.1 -0.789 31.1 -86.0-128.7 165.6 24.1 35.2 12.8 44 47 A D E -k 276 0G 28 231,-3.2 233,-2.2 -2,-0.3 2,-0.6 -0.322 38.8-131.6 -61.3 152.6 27.5 36.7 11.9 45 48 A L E S-k 277 0G 1 3,-2.6 3,-0.4 1,-0.2 233,-0.2 -0.951 85.6 -20.2-113.9 110.5 28.6 36.2 8.3 46 49 A D S S- 0 0 76 231,-2.0 -1,-0.2 -2,-0.6 232,-0.1 0.942 131.1 -49.4 51.5 51.2 32.2 34.9 8.3 47 50 A G S S+ 0 0 49 230,-0.2 2,-0.5 1,-0.2 -1,-0.2 0.727 115.3 118.1 63.3 25.6 32.6 36.3 11.8 48 51 A V - 0 0 36 -3,-0.4 -3,-2.6 -5,-0.0 30,-0.2 -0.972 61.1-132.3-125.8 119.0 31.2 39.7 10.9 49 52 A K - 0 0 84 -2,-0.5 29,-0.9 -5,-0.2 30,-0.2 -0.296 19.9-124.6 -68.7 145.7 28.1 40.9 12.7 50 53 A P - 0 0 1 0, 0.0 2,-0.7 0, 0.0 30,-0.2 -0.450 24.1-108.0 -80.6 165.1 25.2 42.3 10.7 51 54 A L E -l 80 0H 10 28,-2.8 30,-2.9 56,-0.2 2,-0.7 -0.870 35.6-164.2 -95.1 114.5 23.7 45.7 11.3 52 55 A I E -l 81 0H 18 -2,-0.7 2,-0.6 28,-0.2 30,-0.1 -0.877 6.2-166.9-108.6 106.0 20.3 45.1 12.8 53 56 A L - 0 0 13 28,-2.0 30,-0.2 -2,-0.7 5,-0.1 -0.820 8.7-159.3 -92.0 120.1 18.0 48.1 12.8 54 57 A R S S- 0 0 105 -2,-0.6 29,-0.2 1,-0.1 -1,-0.2 0.995 75.8 -16.2 -70.9 -78.6 15.1 47.3 15.1 55 58 A D S S+ 0 0 64 31,-0.1 33,-2.9 27,-0.1 2,-0.4 0.183 116.6 97.0-112.2 15.7 12.2 49.6 14.2 56 59 A c B -n 88 0I 13 31,-0.2 27,-0.2 30,-0.1 33,-0.2 -0.826 65.0-136.1-106.0 145.2 14.2 52.1 12.1 57 60 A S > - 0 0 5 31,-2.2 4,-1.9 -2,-0.4 5,-0.2 -0.434 34.3-105.0 -82.1 167.4 14.7 52.2 8.4 58 61 A V H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.894 124.3 51.7 -60.3 -39.1 18.1 52.9 6.9 59 62 A A H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.918 109.9 47.0 -63.6 -45.0 16.9 56.4 6.1 60 63 A G H 4>S+ 0 0 0 28,-0.3 5,-2.2 1,-0.2 -1,-0.2 0.803 115.3 47.8 -66.6 -31.1 15.7 57.0 9.7 61 64 A W H <5S+ 0 0 31 -4,-1.9 -2,-0.2 3,-0.2 -1,-0.2 0.876 110.7 48.6 -77.4 -41.6 19.0 55.7 11.1 62 65 A L H <5S+ 0 0 0 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.965 114.7 47.6 -64.7 -55.0 21.3 57.6 8.8 63 66 A L T <5S- 0 0 1 -4,-2.1 2,-1.3 -5,-0.2 82,-0.0 -0.373 112.4-101.3 -70.9 166.2 19.6 60.9 9.5 64 67 A G T 5 - 0 0 10 -2,-0.1 82,-1.5 84,-0.0 -3,-0.2 -0.499 42.3-173.4 -97.2 69.7 19.1 61.2 13.2 65 68 A N > < - 0 0 7 -5,-2.2 3,-1.6 -2,-1.3 80,-0.1 -0.507 17.9-147.0 -60.9 115.1 15.4 60.2 13.5 66 69 A P T 3 S+ 0 0 10 0, 0.0 -1,-0.2 0, 0.0 72,-0.1 0.829 95.1 55.8 -57.0 -37.8 14.8 61.0 17.2 67 70 A M T 3 S+ 0 0 90 2,-0.0 2,-0.2 -3,-0.0 3,-0.1 0.585 90.5 88.8 -75.5 -12.7 12.3 58.1 17.6 68 71 A c S < S- 0 0 12 -3,-1.6 3,-0.1 -8,-0.2 21,-0.0 -0.539 100.1 -87.6 -74.0 153.7 15.0 55.7 16.3 69 72 A D - 0 0 121 -2,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.132 61.0 -74.6 -57.7 161.6 17.1 54.3 19.2 70 73 A E - 0 0 113 1,-0.1 2,-0.4 -3,-0.1 -1,-0.1 -0.231 59.9 -95.6 -59.0 150.1 20.2 56.3 20.1 71 74 A F - 0 0 59 -3,-0.1 2,-0.4 2,-0.0 -1,-0.1 -0.534 42.0-173.5 -75.8 126.5 23.0 56.0 17.7 72 75 A I - 0 0 118 -2,-0.4 2,-0.8 -3,-0.1 -3,-0.0 -0.969 29.5-114.7-117.4 135.6 25.6 53.4 18.6 73 76 A N + 0 0 80 -2,-0.4 40,-0.0 2,-0.0 -2,-0.0 -0.582 32.8 176.5 -77.4 106.8 28.8 53.1 16.5 74 77 A V - 0 0 31 -2,-0.8 3,-0.1 1,-0.1 -1,-0.0 -0.926 10.3-168.4-103.8 104.7 29.0 49.8 14.6 75 78 A P + 0 0 64 0, 0.0 37,-1.0 0, 0.0 2,-0.3 0.527 66.0 20.9 -76.4 -5.3 32.2 50.3 12.7 76 79 A E + 0 0 86 35,-0.2 2,-0.3 -26,-0.1 34,-0.2 -0.966 59.9 170.0-164.1 138.9 31.7 47.3 10.4 77 80 A W B -O 109 0J 2 32,-2.1 32,-1.1 -2,-0.3 -28,-0.1 -0.979 26.7-149.4-150.2 164.7 28.9 45.0 9.2 78 81 A S S S- 0 0 2 -29,-0.9 2,-0.3 1,-0.4 186,-0.2 0.751 82.1 -6.1-105.8 -35.6 28.4 42.2 6.6 79 82 A Y - 0 0 0 -30,-0.2 -28,-2.8 184,-0.1 2,-0.4 -0.954 68.1-114.3-152.1 170.7 24.7 42.8 5.8 80 83 A I E -lm 51 265H 0 184,-1.5 186,-3.4 -2,-0.3 2,-0.5 -0.915 17.5-157.0-115.5 137.9 21.8 44.9 7.0 81 84 A V E +lm 52 266H 2 -30,-2.9 -28,-2.0 -2,-0.4 2,-0.3 -0.964 17.9 169.7-116.0 116.9 18.6 43.6 8.6 82 85 A E E - m 0 267H 2 184,-2.5 186,-2.7 -2,-0.5 2,-0.2 -0.752 34.1-113.5-110.8 164.2 15.4 45.6 8.4 83 86 A K - 0 0 46 -2,-0.3 186,-0.1 -27,-0.2 -28,-0.0 -0.605 37.4-102.1 -89.4 163.5 11.9 44.7 9.4 84 87 A A S S+ 0 0 48 1,-0.3 -1,-0.1 -2,-0.2 185,-0.0 0.888 114.1 9.1 -53.3 -46.1 9.3 44.4 6.6 85 88 A N S S- 0 0 143 -28,-0.0 -1,-0.3 -3,-0.0 2,-0.1 -0.731 80.9-154.0-138.7 85.9 7.8 47.7 7.6 86 89 A P - 0 0 27 0, 0.0 -31,-0.1 0, 0.0 -30,-0.1 -0.398 10.4-143.5 -59.6 135.8 9.9 49.6 10.1 87 90 A V S S+ 0 0 106 1,-0.2 2,-0.8 2,-0.1 -31,-0.2 0.844 86.7 62.7 -74.0 -32.4 7.7 52.0 12.1 88 91 A N B +n 56 0I 42 -33,-2.9 -31,-2.2 1,-0.1 -28,-0.3 -0.825 62.6 121.7-102.0 105.3 10.3 54.7 12.2 89 92 A D S S- 0 0 67 -2,-0.8 2,-0.8 -33,-0.2 3,-0.1 0.419 79.2 -0.7-120.8 -98.7 11.3 56.0 8.8 90 93 A L - 0 0 16 1,-0.2 4,-0.1 4,-0.1 -1,-0.1 -0.895 58.5-168.1-101.3 105.9 11.0 59.7 8.0 91 94 A d S S+ 0 0 8 -2,-0.8 -1,-0.2 1,-0.1 -31,-0.0 0.956 87.8 47.0 -57.8 -51.3 9.5 61.4 11.1 92 95 A Y S S- 0 0 9 -3,-0.1 135,-0.1 44,-0.1 -1,-0.1 -0.838 110.8-112.9 -86.6 128.3 8.9 64.5 9.1 93 96 A P + 0 0 9 0, 0.0 134,-2.0 0, 0.0 2,-0.3 -0.216 67.3 85.2 -67.1 150.2 7.2 63.1 5.9 94 97 A G E -p 227 0K 22 132,-0.3 2,-0.3 -4,-0.1 134,-0.2 -0.960 65.1 -63.0 162.4-137.1 9.0 63.3 2.5 95 98 A D E -p 228 0K 93 132,-2.4 134,-2.6 -2,-0.3 2,-0.5 -0.939 19.1-135.9-148.7 161.7 11.4 61.4 0.3 96 99 A F E > -p 229 0K 18 -2,-0.3 3,-1.2 132,-0.2 4,-0.2 -0.979 30.0-129.2-127.3 117.8 15.0 60.1 0.0 97 100 A N T 3 S- 0 0 56 132,-3.0 5,-0.1 -2,-0.5 134,-0.1 -0.442 87.3 -5.6 -72.7 134.8 16.7 60.5 -3.3 98 101 A D T 3> S+ 0 0 72 -2,-0.2 4,-1.7 1,-0.1 -1,-0.3 0.873 86.5 159.3 49.1 43.2 18.3 57.5 -4.8 99 102 A Y H <> + 0 0 26 -3,-1.2 4,-2.6 1,-0.2 5,-0.2 0.903 63.8 51.7 -64.9 -44.3 17.4 55.7 -1.6 100 103 A E H > S+ 0 0 48 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.893 109.5 49.2 -64.5 -39.5 17.6 52.2 -2.9 101 104 A E H > S+ 0 0 10 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.872 111.3 51.1 -67.2 -34.3 21.1 52.6 -4.4 102 105 A L 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