==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 06-SEP-12 4GZO . COMPND 2 MOLECULE: NEURAMINIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR X.ZHU,I.A.WILSON . 388 1 9 9 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15116.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 228 58.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 136 35.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 2.1 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 . 37 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 1.5 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+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 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 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 1 1 2 5 6 2 0 2 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 4 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 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 82 A A 0 0 117 0, 0.0 2,-0.2 0, 0.0 105,-0.1 0.000 360.0 360.0 360.0 137.6 2.7 43.3 44.9 2 83 A E - 0 0 155 103,-0.2 2,-0.2 1,-0.0 151,-0.0 -0.717 360.0 -92.6-111.5 165.2 2.9 39.6 45.9 3 84 A Y - 0 0 60 -2,-0.2 2,-0.5 150,-0.1 102,-0.3 -0.538 38.7-114.3 -73.3 141.3 4.0 36.5 44.1 4 85 A R + 0 0 17 100,-2.5 149,-1.2 -2,-0.2 150,-0.7 -0.676 38.1 168.2 -73.8 122.4 1.4 34.4 42.2 5 86 A N - 0 0 54 -2,-0.5 -1,-0.2 147,-0.3 3,-0.1 0.640 30.8-147.5 -97.9 -29.2 1.0 31.0 43.9 6 87 A W + 0 0 10 1,-0.2 2,-2.1 195,-0.1 197,-0.6 0.797 36.8 160.9 57.7 33.0 -2.1 29.9 42.0 7 88 A S + 0 0 66 195,-0.1 -1,-0.2 197,-0.1 145,-0.0 -0.368 37.0 102.8 -83.9 59.3 -3.1 28.0 45.1 8 89 A K S S- 0 0 71 -2,-2.1 195,-0.2 -3,-0.1 328,-0.2 -0.942 78.2 -93.8-137.2 153.6 -6.8 27.9 44.0 9 90 A P - 0 0 94 0, 0.0 328,-3.1 0, 0.0 2,-0.2 -0.351 45.6-100.4 -66.8 149.8 -9.0 25.2 42.5 10 91 A Q B -a 337 0A 44 326,-0.2 328,-0.2 1,-0.1 3,-0.1 -0.489 50.3-104.8 -65.3 138.0 -9.4 25.0 38.7 11 92 A a - 0 0 17 326,-2.4 2,-0.2 -2,-0.2 -1,-0.1 -0.253 36.7 -89.9 -66.2 152.6 -12.7 26.6 37.7 12 93 A D - 0 0 129 -3,-0.1 2,-0.5 355,-0.1 -1,-0.1 -0.449 47.8-160.1 -54.0 125.4 -15.9 24.7 36.6 13 94 A I + 0 0 10 -2,-0.2 356,-0.2 1,-0.1 3,-0.1 -0.936 32.5 160.3-124.9 115.7 -15.7 24.2 32.9 14 95 A T S S- 0 0 57 354,-2.9 2,-0.3 -2,-0.5 355,-0.1 0.332 75.6 -58.4-108.4 6.3 -18.7 23.4 30.7 15 96 A G E S-B 368 0A 0 353,-0.6 353,-2.1 281,-0.1 -1,-0.4 -0.909 71.0 -61.8 140.9-167.2 -16.9 24.6 27.5 16 97 A F E -B 367 0A 1 -2,-0.3 351,-0.2 351,-0.2 324,-0.1 -0.894 33.3-151.5-122.9 145.4 -15.3 27.8 26.3 17 98 A A E -B 366 0A 30 349,-3.4 349,-2.6 -2,-0.4 355,-0.1 -0.857 35.5 -91.8-112.6 145.9 -16.7 31.3 25.6 18 99 A P E +B 365 0A 85 0, 0.0 347,-0.2 0, 0.0 3,-0.1 -0.225 49.3 160.5 -53.1 142.4 -15.4 33.9 23.1 19 100 A F E - 0 0 111 345,-2.0 2,-0.3 1,-0.3 346,-0.2 0.594 51.9 -5.1-137.9 -49.2 -12.8 36.3 24.5 20 101 A S E +B 364 0A 20 344,-2.0 344,-3.0 63,-0.0 -1,-0.3 -0.996 40.7 178.8-151.6 157.6 -10.6 38.1 21.8 21 102 A K E -B 363 0A 52 -2,-0.3 342,-0.2 342,-0.2 358,-0.0 -0.965 8.8-166.5-147.0 139.9 -9.9 38.4 18.1 22 103 A D - 0 0 7 340,-1.7 5,-0.1 -2,-0.3 341,-0.1 0.636 16.7-150.6-106.9 -11.0 -7.4 40.7 16.4 23 104 A N > + 0 0 59 339,-0.6 4,-2.3 1,-0.1 3,-0.4 0.796 35.6 162.2 53.9 28.4 -8.2 40.5 12.7 24 105 A S H > + 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.817 65.1 47.4 -53.3 -40.6 -4.6 41.3 12.1 25 106 A I H 4 S+ 0 0 0 2,-0.2 -1,-0.2 1,-0.2 4,-0.1 0.871 112.2 48.7 -75.6 -35.1 -4.5 40.1 8.5 26 107 A R H >4 S+ 0 0 139 -3,-0.4 3,-0.9 353,-0.3 -2,-0.2 0.843 112.8 49.4 -69.7 -34.0 -7.6 42.0 7.5 27 108 A L H >< S+ 0 0 79 -4,-2.3 3,-2.2 1,-0.2 -2,-0.2 0.896 99.9 64.4 -71.2 -38.4 -6.2 45.1 9.1 28 109 A S T 3< S+ 0 0 0 -4,-2.0 3,-0.4 1,-0.3 -1,-0.2 0.510 87.4 74.0 -65.0 -2.7 -2.9 44.7 7.4 29 110 A A T < S+ 0 0 50 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.541 117.1 13.9 -84.5 -10.4 -4.8 45.3 4.1 30 111 A G S < S+ 0 0 74 -3,-2.2 2,-0.3 -4,-0.1 -1,-0.2 -0.201 126.6 41.4-161.4 53.7 -5.1 49.0 4.9 31 112 A G S S- 0 0 31 -3,-0.4 2,-1.0 2,-0.1 29,-0.4 -0.927 89.4 -82.8 174.4 167.4 -2.7 49.7 7.7 32 113 A D + 0 0 96 -2,-0.3 56,-0.7 27,-0.1 2,-0.4 -0.787 54.9 163.1 -97.4 98.5 0.8 49.0 9.0 33 114 A I B -E 87 0B 12 -2,-1.0 26,-2.5 54,-0.2 54,-0.2 -0.937 37.9-110.9-118.8 136.9 0.6 45.6 10.9 34 115 A W E -F 58 0C 18 52,-2.8 2,-0.5 -2,-0.4 24,-0.3 -0.266 26.0-119.1 -62.8 147.6 3.6 43.4 11.8 35 116 A V E + 0 0 0 22,-2.5 20,-1.7 324,-0.1 22,-0.3 -0.805 49.4 169.6 -86.6 127.0 4.2 40.1 10.1 36 117 A T E +F 54 0C 2 -2,-0.5 2,-0.3 18,-0.2 18,-0.2 -0.864 25.7 172.6-134.5 164.1 4.0 37.5 12.8 37 118 A R E +F 53 0C 25 16,-1.5 16,-2.8 -2,-0.3 323,-0.1 -0.934 62.9 43.8-152.3 179.2 3.9 33.8 13.7 38 119 A E E S+ 0 0 13 -2,-0.3 -1,-0.1 14,-0.2 61,-0.1 0.920 75.5 176.1 52.8 51.8 4.1 31.7 16.9 39 120 A P E + 0 0 0 0, 0.0 2,-0.3 0, 0.0 13,-0.3 -0.266 10.4 174.2 -82.4 171.7 1.8 33.9 19.0 40 121 A Y E -F 51 0C 0 11,-2.4 11,-3.5 107,-0.1 2,-0.4 -0.967 24.6-125.9-165.2 164.3 0.5 33.5 22.5 41 122 A V E +F 50 0C 0 -2,-0.3 107,-0.5 9,-0.2 2,-0.3 -0.899 28.1 164.9-113.5 144.3 -1.5 35.1 25.2 42 123 A S E -F 49 0C 0 7,-2.3 7,-3.2 -2,-0.4 2,-0.4 -0.951 18.6-147.3-153.3 153.0 -0.3 35.7 28.8 43 124 A b E -F 48 0C 3 -2,-0.3 60,-0.3 5,-0.3 5,-0.3 -0.944 7.9-142.4-129.9 139.7 -1.7 37.9 31.5 44 125 A D - 0 0 13 3,-2.3 62,-0.0 -2,-0.4 5,-0.0 -0.302 56.6 -81.7 -77.4 176.0 -0.4 39.9 34.5 45 126 A P S S+ 0 0 74 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.649 130.1 35.0 -58.3 -10.8 -2.6 40.0 37.6 46 127 A D S S- 0 0 143 1,-0.3 2,-0.3 0, 0.0 -3,-0.0 0.802 123.8 -5.6-106.3 -38.8 -4.7 42.7 36.0 47 128 A K - 0 0 77 -5,-0.0 -3,-2.3 2,-0.0 -1,-0.3 -0.964 65.4 -97.5-163.9 161.4 -4.9 42.1 32.3 48 129 A b E -F 43 0C 16 -2,-0.3 34,-2.6 -5,-0.3 2,-0.4 -0.567 21.1-157.4-100.4 153.4 -3.8 40.1 29.3 49 130 A Y E -FG 42 81C 33 -7,-3.2 -7,-2.3 32,-0.3 2,-0.4 -0.976 11.0-141.9-123.6 138.5 -1.2 40.5 26.7 50 131 A Q E -FG 41 80C 0 30,-1.3 30,-2.5 -2,-0.4 2,-0.3 -0.846 24.5-172.6 -92.9 138.0 -0.9 39.0 23.2 51 132 A F E +FG 40 79C 0 -11,-3.5 -11,-2.4 -2,-0.4 2,-0.3 -0.886 9.0 166.9-122.8 159.1 2.6 38.1 22.2 52 133 A A E - G 0 78C 0 26,-1.5 26,-2.9 -2,-0.3 2,-0.7 -0.968 40.8-104.1-162.4 163.9 4.0 36.9 18.8 53 134 A L E -FG 37 77C 0 -16,-2.8 -16,-1.5 -2,-0.3 24,-0.2 -0.887 42.1-150.2 -94.8 113.0 7.3 36.4 17.0 54 135 A G E -F 36 0C 0 22,-3.6 -18,-0.2 -2,-0.7 22,-0.2 -0.299 16.3-138.4 -77.5 164.8 7.7 39.2 14.6 55 136 A Q E - 0 0 12 -20,-1.7 20,-0.2 2,-0.5 19,-0.1 0.075 50.8-104.9-107.5 22.7 9.6 39.0 11.3 56 137 A G E S+ 0 0 36 -21,-0.2 2,-0.3 1,-0.2 19,-0.1 0.835 94.6 80.3 62.7 30.5 11.1 42.5 11.8 57 138 A T E S- 0 0 9 -22,-0.3 -22,-2.5 7,-0.1 -2,-0.5 -0.970 74.5-121.4-155.7 162.3 8.7 43.8 9.2 58 139 A T E -F 34 0C 15 -24,-0.3 3,-0.3 -2,-0.3 -24,-0.3 -0.582 35.9-112.3 -96.5 173.2 5.1 45.0 8.6 59 140 A L S S+ 0 0 3 -26,-2.5 2,-2.6 1,-0.2 5,-0.3 0.954 109.0 55.8 -77.9 -53.4 3.0 43.2 5.9 60 141 A N S S+ 0 0 97 -29,-0.4 2,-0.3 -27,-0.2 -1,-0.2 -0.379 95.5 103.5 -78.0 65.2 2.5 45.9 3.2 61 142 A N S > S- 0 0 52 -2,-2.6 3,-1.9 -3,-0.3 4,-0.2 -0.991 81.9-125.0-156.0 132.7 6.2 46.0 3.1 62 143 A V G > S+ 0 0 132 -2,-0.3 3,-1.4 1,-0.3 -1,-0.1 0.804 108.2 66.6 -59.0 -28.9 8.8 44.6 0.6 63 144 A H G 3 S+ 0 0 136 1,-0.3 -1,-0.3 -5,-0.1 -4,-0.1 0.563 79.8 79.5 -69.0 -11.0 10.5 42.8 3.6 64 145 A S G X + 0 0 9 -3,-1.9 3,-1.2 -5,-0.3 294,-0.3 0.537 65.7 111.9 -75.4 -6.2 7.5 40.6 4.1 65 146 A N T < S+ 0 0 86 -3,-1.4 292,-0.2 1,-0.2 291,-0.0 -0.531 86.0 10.0 -65.6 130.9 8.7 38.4 1.2 66 147 A N T > S+ 0 0 70 290,-1.4 3,-1.6 -2,-0.2 -1,-0.2 0.740 72.9 146.1 72.5 28.1 9.8 35.0 2.5 67 148 A T T < + 0 0 6 -3,-1.2 290,-0.1 289,-0.3 -2,-0.1 0.450 53.2 92.2 -78.9 5.8 8.5 35.3 6.0 68 149 A V T 3 + 0 0 58 288,-0.3 -1,-0.3 282,-0.0 289,-0.1 0.802 63.5 104.7 -54.9 -35.3 7.9 31.6 5.7 69 150 A R < - 0 0 154 -3,-1.6 3,-0.2 1,-0.1 289,-0.1 -0.170 66.4-147.1 -55.9 142.1 11.4 31.2 7.2 70 151 A D S S+ 0 0 84 1,-0.2 2,-0.4 5,-0.0 -1,-0.1 0.874 76.8 28.9 -85.3 -39.6 11.5 30.1 10.8 71 152 A R + 0 0 80 43,-0.0 -1,-0.2 -16,-0.0 46,-0.1 -0.935 62.2 151.0-132.3 111.9 14.6 31.9 12.2 72 153 A T > - 0 0 23 -2,-0.4 3,-1.0 -3,-0.2 43,-0.1 -0.842 54.7-110.8-119.9 164.5 16.2 35.2 11.0 73 154 A P T 3 S+ 0 0 93 0, 0.0 -17,-0.1 0, 0.0 23,-0.0 0.616 114.2 63.7 -60.5 -15.1 18.2 37.9 12.9 74 155 A Y T 3 S+ 0 0 156 -19,-0.1 2,-0.4 21,-0.1 -18,-0.1 0.488 73.1 112.8 -96.5 -4.1 15.2 40.2 12.6 75 156 A R < + 0 0 1 -3,-1.0 21,-2.4 -20,-0.2 2,-0.3 -0.558 40.7 170.3 -73.6 122.4 12.7 38.2 14.6 76 157 A T E - H 0 95C 15 -2,-0.4 -22,-3.6 19,-0.3 2,-0.7 -0.925 40.0-104.6-126.9 156.0 11.7 39.8 17.9 77 158 A L E -GH 53 94C 0 17,-2.4 16,-3.2 -2,-0.3 17,-0.6 -0.760 36.0-154.2 -79.7 114.0 9.1 39.1 20.5 78 159 A L E -GH 52 92C 0 -26,-2.9 -26,-1.5 -2,-0.7 2,-0.4 -0.750 9.9-168.1 -88.6 136.6 6.2 41.6 20.1 79 160 A M E +GH 51 91C 24 12,-2.2 12,-0.8 -2,-0.4 2,-0.3 -0.965 15.4 156.1-133.4 115.2 4.1 42.4 23.2 80 161 A N E -G 50 0C 16 -30,-2.5 -30,-1.3 -2,-0.4 2,-0.2 -0.831 50.1 -90.3-119.1 168.9 0.8 44.2 23.2 81 162 A E E > -G 49 0C 97 -2,-0.3 3,-2.1 -32,-0.3 -32,-0.3 -0.582 67.8 -80.8 -71.4 143.7 -2.2 44.4 25.5 82 163 A L T 3 S+ 0 0 36 -34,-2.6 -1,-0.1 1,-0.3 -34,-0.1 -0.236 116.8 17.6 -57.9 124.1 -4.6 41.7 24.3 83 164 A G T 3 S+ 0 0 37 1,-0.3 -1,-0.3 -3,-0.1 -62,-0.1 0.464 91.3 113.8 95.5 1.8 -6.8 42.8 21.4 84 165 A V S < S- 0 0 52 -3,-2.1 -1,-0.3 -34,-0.0 -34,-0.2 -0.960 70.7-129.6 -98.6 110.0 -4.5 45.7 20.4 85 166 A P - 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