==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 27-DEC-07 3BT6 . COMPND 2 MOLECULE: INFLUENZA B HEMAGGLUTININ (HA); . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA B VIRUS; . AUTHOR Q.WANG,F.CHENG,M.LU,X.TIAN,J.MA . 511 2 7 6 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24049.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 302 59.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 18.0 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 0.2 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 . 42 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 17.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 1 2 1 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 5 2 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 6 4 1 3 0 0 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 . 3 2 2 0 0 1 1 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 1 A D 0 0 41 0, 0.0 482,-3.0 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 143.3 64.8 35.1 86.1 2 2 A R E -AB 370 482A 101 368,-1.3 368,-3.0 480,-0.2 2,-0.4 -0.972 360.0-168.0-122.0 127.6 63.2 35.1 82.7 3 3 A I E +AB 369 481A 0 478,-1.8 478,-2.1 -2,-0.5 2,-0.3 -0.948 19.9 176.2-112.5 137.1 63.8 32.6 80.1 4 4 A a E -AB 368 480A 11 364,-2.8 364,-1.9 -2,-0.4 2,-0.3 -0.852 31.9-111.6-137.4 164.8 62.5 33.4 76.6 5 5 A T E +A 367 0A 13 474,-1.4 2,-0.3 -2,-0.3 362,-0.3 -0.770 42.0 168.8 -94.8 148.3 62.4 32.2 73.1 6 6 A G E -A 366 0A 4 360,-3.1 360,-2.4 -2,-0.3 2,-0.3 -0.956 25.7-134.0-149.5 166.7 64.2 34.3 70.5 7 7 A I E -Ac 365 356A 0 348,-0.7 350,-1.0 -2,-0.3 358,-0.2 -0.779 34.5 -92.1-117.8 171.5 65.3 34.3 66.9 8 8 A T - 0 0 10 356,-1.9 2,-0.4 -2,-0.3 350,-0.2 -0.321 19.7-153.1 -80.6 159.4 68.7 35.2 65.4 9 9 A S + 0 0 6 348,-0.4 2,-0.3 347,-0.2 325,-0.1 -0.994 38.6 130.4-122.9 134.0 70.0 38.5 63.9 10 10 A S - 0 0 48 -2,-0.4 325,-0.2 325,-0.1 2,-0.1 -0.970 60.8 -36.5-165.9-179.3 72.7 38.2 61.3 11 11 A N + 0 0 124 -2,-0.3 3,-0.1 1,-0.1 -2,-0.0 -0.295 54.9 171.5 -51.8 114.8 73.9 39.1 57.9 12 12 A S + 0 0 11 -2,-0.1 15,-0.2 1,-0.1 16,-0.1 -0.569 20.2 140.8-132.2 70.9 70.8 39.3 55.7 13 13 A P + 0 0 76 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.628 50.3 91.4 -85.9 -16.4 71.7 40.8 52.3 14 14 A H E -G 26 0B 65 12,-0.9 12,-3.2 13,-0.2 2,-0.3 -0.648 63.8-154.4 -85.7 136.3 69.4 38.5 50.4 15 15 A V E -G 25 0B 46 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.857 8.2-162.2-112.8 146.2 65.9 39.7 49.7 16 16 A V E -G 24 0B 0 8,-2.9 8,-2.4 -2,-0.3 2,-0.5 -0.946 19.3-118.5-134.1 152.5 62.8 37.6 49.1 17 17 A K E +G 23 0B 50 -2,-0.3 2,-0.3 310,-0.3 431,-0.3 -0.746 35.5 170.6 -90.3 120.2 59.2 37.9 47.6 18 18 A T - 0 0 8 4,-1.5 4,-0.3 -2,-0.5 427,-0.1 -0.926 33.2-139.2-126.9 157.4 56.3 37.3 49.9 19 19 A A S S+ 0 0 71 -2,-0.3 3,-0.2 425,-0.3 -1,-0.1 0.925 99.7 31.9 -77.4 -49.4 52.5 37.8 49.6 20 20 A T S S+ 0 0 102 1,-0.2 -1,-0.1 2,-0.1 3,-0.1 0.765 126.1 35.9 -84.9 -29.4 51.7 39.1 53.0 21 21 A Q S S- 0 0 51 1,-0.4 -1,-0.2 3,-0.0 2,-0.1 0.268 96.5-130.4-113.1 14.1 54.8 41.0 54.1 22 22 A G - 0 0 42 -4,-0.3 -4,-1.5 -3,-0.2 2,-0.5 -0.476 66.9 -19.0 67.3-144.1 55.9 42.5 50.8 23 23 A E E S-G 17 0B 141 -6,-0.2 2,-0.3 -2,-0.1 -6,-0.2 -0.842 75.9-170.7-101.1 127.5 59.6 41.9 50.0 24 24 A V E -G 16 0B 9 -8,-2.4 -8,-2.9 -2,-0.5 2,-0.3 -0.876 24.4-115.1-125.6 151.3 61.8 41.0 53.0 25 25 A N E -G 15 0B 70 -2,-0.3 309,-2.5 -10,-0.2 2,-0.3 -0.601 37.1-163.3 -81.4 143.7 65.5 40.6 53.9 26 26 A V E -GH 14 333B 0 -12,-3.2 -12,-0.9 307,-0.3 307,-0.2 -0.946 30.2-121.9-136.1 147.1 66.6 37.0 54.8 27 27 A T S S- 0 0 30 305,-2.3 2,-0.3 -2,-0.3 -13,-0.2 0.939 89.5 -21.6 -45.9 -61.9 69.4 35.2 56.6 28 28 A G - 0 0 15 -16,-0.1 302,-2.7 -15,-0.1 2,-0.3 -0.952 61.2-150.9-151.1 166.6 70.3 33.0 53.6 29 29 A V E -I 329 0C 29 -2,-0.3 300,-0.2 300,-0.3 -13,-0.0 -0.984 18.2-134.6-144.6 152.4 68.8 31.6 50.4 30 30 A I E -I 328 0C 34 298,-2.5 298,-3.1 -2,-0.3 2,-0.2 -0.954 34.9-138.9 -98.3 118.1 69.0 28.7 48.0 31 31 A P E -I 327 0C 56 0, 0.0 296,-0.2 0, 0.0 -2,-0.0 -0.579 19.6-172.4 -78.4 146.1 69.0 30.2 44.5 32 32 A L + 0 0 0 294,-2.3 274,-2.0 -2,-0.2 2,-0.2 0.306 62.1 79.5-114.7 3.8 66.9 28.5 41.8 33 33 A T + 0 0 23 293,-0.6 2,-0.3 272,-0.1 274,-0.2 -0.702 45.0 169.0-117.6 156.1 68.3 30.6 39.0 34 34 A T - 0 0 57 -2,-0.2 274,-3.1 270,-0.1 -2,-0.0 -0.934 28.9-134.9-152.5 150.7 71.3 30.7 36.7 35 35 A T - 0 0 84 -2,-0.3 274,-0.1 272,-0.2 272,-0.0 -0.977 29.5-144.6-100.8 121.9 72.1 32.6 33.6 36 36 A P - 0 0 13 0, 0.0 2,-0.4 0, 0.0 264,-0.1 -0.304 11.1-129.0 -73.7 171.6 73.7 30.2 31.2 37 37 A T - 0 0 116 260,-0.1 259,-0.0 -2,-0.0 -2,-0.0 -0.980 27.5 -93.3-127.8 138.4 76.5 31.4 28.9 38 38 A K + 0 0 160 -2,-0.4 2,-0.3 260,-0.1 259,-0.2 -0.156 58.6 152.7 -45.0 127.0 76.8 31.0 25.1 39 39 A S B -j 298 0D 47 258,-1.3 260,-0.6 257,-0.3 -1,-0.0 -0.970 45.6 -70.7-152.8 173.1 78.8 27.9 24.2 40 40 A H - 0 0 94 -2,-0.3 259,-0.9 258,-0.2 244,-0.1 -0.162 53.9-107.5 -62.4 155.0 79.3 25.2 21.5 41 41 A F - 0 0 6 242,-0.5 246,-2.6 257,-0.2 2,-0.3 -0.186 34.9-165.2 -81.6 175.8 76.6 22.6 20.9 42 42 A A - 0 0 3 244,-0.2 2,-0.4 258,-0.1 247,-0.2 -0.973 34.3 -75.8-155.9 162.5 76.9 18.9 21.8 43 43 A N E -m 289 0E 61 245,-2.9 247,-0.9 -2,-0.3 2,-0.5 -0.549 58.9-111.8 -66.3 120.2 75.3 15.5 21.3 44 44 A L E > -m 290 0E 7 -2,-0.4 3,-1.9 245,-0.2 247,-0.2 -0.427 29.5-122.0 -65.9 112.6 72.1 15.4 23.3 45 45 A K T 3 S+ 0 0 109 245,-2.0 2,-0.9 -2,-0.5 246,-0.1 0.649 99.8 30.5 -12.3 -92.7 72.5 13.0 26.2 46 46 A G T 3 S+ 0 0 79 245,-0.2 -1,-0.3 2,-0.0 2,-0.2 -0.001 125.5 36.9 -76.9 33.0 69.7 10.3 26.0 47 47 A T S < S- 0 0 38 -3,-1.9 2,-0.4 -2,-0.9 32,-0.0 -0.813 83.6 -94.4-155.3-162.9 69.6 10.5 22.2 48 48 A Q - 0 0 110 -2,-0.2 33,-1.2 -5,-0.0 32,-0.6 -0.972 33.6-137.3-132.6 142.7 71.6 10.9 18.9 49 49 A T B -n 81 0F 17 -2,-0.4 33,-0.2 30,-0.1 -6,-0.0 -0.904 11.1-127.6-119.2 121.5 72.0 14.2 17.2 50 50 A R + 0 0 10 31,-2.0 33,-0.5 -2,-0.5 28,-0.0 -0.292 30.7 168.1 -61.7 139.7 71.8 15.0 13.5 51 51 A G S S- 0 0 28 31,-0.1 34,-0.2 234,-0.0 -1,-0.1 0.421 72.2 -3.9-113.8-105.1 74.6 16.8 11.8 52 52 A K S S- 0 0 110 1,-0.1 2,-1.5 33,-0.0 -2,-0.1 0.037 93.6-109.6 -86.6 28.1 74.9 17.1 8.0 53 53 A L S S+ 0 0 2 12,-0.0 -1,-0.1 59,-0.0 8,-0.0 0.027 110.8 43.8 69.7 -32.6 71.9 14.9 7.5 54 54 A b - 0 0 4 -2,-1.5 3,-0.5 22,-0.1 2,-0.2 -0.795 67.6-178.4-144.6 97.3 74.4 12.4 6.3 55 55 A P S S+ 0 0 70 0, 0.0 20,-0.1 0, 0.0 -5,-0.0 -0.553 83.3 34.8 -75.8 160.2 77.7 11.8 8.1 56 56 A N S S+ 0 0 136 -2,-0.2 2,-0.1 1,-0.1 19,-0.1 0.291 98.1 89.1 73.5 -12.6 79.9 9.2 6.3 57 57 A b S S- 0 0 10 -3,-0.5 -1,-0.1 17,-0.1 17,-0.1 -0.409 85.1-161.5-105.1 50.4 78.3 10.8 3.1 58 58 A L + 0 0 141 -2,-0.1 3,-0.1 1,-0.1 16,-0.1 0.334 45.7 12.7 -51.7 158.0 81.3 13.2 3.3 59 59 A N S S+ 0 0 142 1,-0.2 2,-0.3 13,-0.0 -1,-0.1 0.904 96.5 107.1 45.1 61.9 82.0 16.6 1.8 60 60 A c - 0 0 9 -6,-0.1 2,-0.2 11,-0.1 -1,-0.2 -0.977 67.9-108.0-156.2 155.4 78.5 17.4 0.6 61 61 A T > - 0 0 8 -2,-0.3 4,-3.4 1,-0.1 5,-0.1 -0.532 26.0-122.9 -80.5 158.3 75.6 19.6 1.5 62 62 A D H > S+ 0 0 0 2,-0.2 4,-3.7 1,-0.2 5,-0.1 0.889 122.0 50.4 -60.9 -41.2 72.4 18.3 3.0 63 63 A L H > S+ 0 0 0 27,-0.5 4,-3.1 2,-0.2 -1,-0.2 0.933 109.9 49.8 -60.6 -46.4 70.8 19.9 0.0 64 64 A D H >>S+ 0 0 0 26,-0.5 5,-1.7 2,-0.2 4,-0.7 0.972 115.1 43.1 -51.4 -59.6 73.3 18.1 -2.2 65 65 A V H ><5S+ 0 0 6 -4,-3.4 3,-1.2 1,-0.2 -2,-0.2 0.894 113.2 52.8 -52.8 -48.8 72.5 14.9 -0.4 66 66 A A H 3<5S+ 0 0 0 -4,-3.7 -1,-0.2 1,-0.3 -2,-0.2 0.918 107.9 50.4 -54.0 -50.0 68.8 15.6 -0.5 67 67 A L H 3<5S- 0 0 2 -4,-3.1 88,-0.9 -5,-0.1 -1,-0.3 0.571 116.3-116.5 -67.2 -12.6 68.9 16.2 -4.3 68 68 A G T <<5 - 0 0 8 -3,-1.2 86,-2.2 -4,-0.7 -3,-0.2 0.887 37.8-166.2 75.2 40.3 70.8 12.9 -4.7 69 69 A R < - 0 0 27 -5,-1.7 -1,-0.2 84,-0.2 83,-0.1 -0.426 32.8-105.3 -58.2 132.2 74.0 14.3 -6.1 70 70 A P S S+ 0 0 28 0, 0.0 3,-0.4 0, 0.0 76,-0.1 0.701 114.1 26.1 -28.2 -64.9 76.1 11.4 -7.6 71 71 A K S S+ 0 0 121 73,-0.3 2,-2.3 1,-0.2 -11,-0.1 0.933 111.1 70.1 -70.2 -49.6 78.8 11.0 -4.9 72 72 A c + 0 0 2 1,-0.2 -1,-0.2 -13,-0.1 -3,-0.2 0.074 65.5 114.6 -60.9 28.4 76.7 12.3 -2.0 73 73 A M + 0 0 74 -2,-2.3 -1,-0.2 -3,-0.4 -2,-0.1 -0.092 41.4 135.6 -98.2 37.0 74.5 9.2 -2.2 74 74 A G - 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