==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 11-FEB-13 3ZMN . COMPND 2 MOLECULE: VP17; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS PHAGE P23-77; . AUTHOR I.RISSANEN,J.M.GRIMES,A.PAWLOWSKI,S.MANTYNEN,K.HARLOS,J.K.H. . 468 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22274.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 55.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 170 36.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 36 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 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 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 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 5 3 4 6 2 9 3 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 . 1 0 4 4 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 41 A A 0 0 147 0, 0.0 2,-0.4 0, 0.0 228,-0.0 0.000 360.0 360.0 360.0 152.8 -57.2 66.9 25.6 2 42 A A - 0 0 80 227,-0.2 2,-0.5 2,-0.0 0, 0.0 -0.835 360.0-161.6 -98.1 127.6 -58.0 65.6 22.1 3 43 A V - 0 0 98 -2,-0.4 2,-0.5 224,-0.0 226,-0.2 -0.941 4.1-167.5-115.2 120.7 -55.2 64.0 19.9 4 44 A Q E -A 228 0A 152 224,-3.0 224,-2.6 -2,-0.5 2,-0.4 -0.931 6.6-161.6-106.1 123.9 -55.4 63.5 16.1 5 45 A V E -A 227 0A 73 -2,-0.5 222,-0.2 222,-0.2 2,-0.1 -0.905 7.9-150.3-106.5 129.1 -52.7 61.3 14.4 6 46 A G - 0 0 32 220,-3.1 2,-0.1 -2,-0.4 -1,-0.0 -0.218 33.5 -73.3 -84.4 178.2 -52.1 61.5 10.6 7 47 A G - 0 0 70 1,-0.1 219,-0.4 218,-0.1 2,-0.2 -0.426 51.1-103.7 -73.9 150.1 -50.9 58.8 8.2 8 48 A W - 0 0 89 217,-0.1 2,-0.3 -2,-0.1 217,-0.2 -0.489 40.0-178.1 -72.9 139.9 -47.3 57.5 8.1 9 49 A G E -B 224 0B 36 215,-2.2 215,-2.8 -2,-0.2 2,-0.1 -0.972 34.1 -95.9-136.8 151.8 -45.0 58.7 5.4 10 50 A F E +B 223 0B 116 -2,-0.3 2,-0.3 213,-0.2 213,-0.2 -0.382 47.5 176.1 -63.7 142.6 -41.4 58.0 4.4 11 51 A A E -B 222 0B 24 211,-2.3 211,-1.8 -2,-0.1 2,-0.5 -0.976 27.6-140.1-150.7 136.6 -38.9 60.5 5.8 12 52 A W E -B 221 0B 97 -2,-0.3 2,-0.7 209,-0.2 209,-0.2 -0.866 13.7-148.1 -91.9 129.5 -35.1 60.9 5.8 13 53 A I E +B 220 0B 3 207,-2.9 207,-2.6 -2,-0.5 2,-0.2 -0.926 38.9 171.2 -92.0 114.1 -33.8 62.1 9.1 14 54 A D E > -B 219 0B 44 -2,-0.7 3,-1.6 205,-0.2 4,-0.4 -0.728 50.8 -91.9-124.7 176.4 -30.7 64.1 7.7 15 55 A N G > S+ 0 0 36 203,-1.4 3,-1.4 1,-0.3 204,-0.1 0.803 120.0 63.0 -57.8 -31.3 -28.0 66.5 8.7 16 56 A E G 3 S+ 0 0 167 1,-0.3 -1,-0.3 202,-0.2 -3,-0.0 0.698 95.8 60.2 -67.8 -19.5 -30.2 69.5 7.7 17 57 A D G < S+ 0 0 73 -3,-1.6 20,-0.4 19,-0.1 2,-0.3 0.615 94.6 82.9 -80.7 -14.5 -32.7 68.4 10.5 18 58 A F < - 0 0 9 -3,-1.4 18,-0.2 -4,-0.4 180,-0.1 -0.710 63.6-160.7 -94.4 144.5 -29.9 68.9 13.1 19 59 A S E -F 35 0C 74 16,-2.5 16,-2.2 -2,-0.3 192,-0.0 -0.936 28.8-104.2-117.8 143.4 -29.0 72.2 14.6 20 60 A P E -F 34 0C 73 0, 0.0 14,-0.3 0, 0.0 13,-0.1 -0.364 16.5-150.1 -66.3 145.7 -25.6 73.0 16.3 21 61 A T - 0 0 27 12,-1.8 13,-0.1 2,-0.1 342,-0.1 0.666 33.0-127.2 -83.3 -22.2 -25.8 73.1 20.2 22 62 A G + 0 0 45 11,-0.5 2,-0.1 1,-0.3 11,-0.1 0.442 57.3 149.0 86.7 1.0 -22.9 75.7 20.2 23 63 A L - 0 0 32 9,-0.4 -1,-0.3 10,-0.2 2,-0.2 -0.436 46.5-123.1 -67.4 139.2 -20.9 73.6 22.7 24 64 A A - 0 0 31 339,-0.5 268,-0.1 266,-0.2 -1,-0.1 -0.572 30.1 -98.6 -80.6 151.6 -17.1 73.9 22.2 25 65 A W - 0 0 28 -2,-0.2 265,-0.4 183,-0.1 2,-0.3 -0.370 40.5-177.9 -67.7 147.4 -15.0 70.8 21.6 26 66 A R > - 0 0 16 3,-0.3 3,-0.5 263,-0.1 177,-0.4 -0.965 28.8-104.1-144.8 147.7 -13.1 69.2 24.4 27 67 A S T 3 S- 0 0 7 -2,-0.3 177,-0.3 404,-0.3 178,-0.1 -0.583 87.9 -0.4 -78.5 143.0 -10.7 66.3 24.4 28 68 A G T 3 S+ 0 0 35 175,-2.6 2,-0.3 -2,-0.2 -1,-0.2 0.761 105.9 91.2 54.4 42.0 -11.6 62.7 25.6 29 69 A E S < S- 0 0 59 -3,-0.5 174,-0.4 174,-0.5 -3,-0.3 -0.942 76.6-107.9-162.9 137.0 -15.2 63.3 26.7 30 70 A Y + 0 0 44 -2,-0.3 2,-0.3 172,-0.2 172,-0.2 -0.408 41.2 170.5 -64.6 137.7 -18.6 63.0 25.1 31 71 A F E - G 0 201C 6 170,-1.3 170,-2.1 -2,-0.1 2,-0.5 -0.982 41.7-101.3-150.1 146.3 -20.4 66.4 24.4 32 72 A A E + G 0 200C 18 -2,-0.3 -9,-0.4 168,-0.2 168,-0.3 -0.572 40.7 171.0 -70.5 114.7 -23.6 67.3 22.5 33 73 A L E - 0 0 4 166,-3.0 -12,-1.8 -2,-0.5 -11,-0.5 0.806 64.5 -2.3 -91.3 -45.3 -22.4 68.6 19.1 34 74 A A E -FG 20 199C 0 165,-1.2 165,-3.0 -14,-0.3 -1,-0.4 -0.946 63.6-154.8-148.0 164.0 -25.8 68.9 17.3 35 75 A Q E -FG 19 198C 47 -16,-2.2 -16,-2.5 -2,-0.3 2,-0.7 -0.998 14.0-148.1-150.1 141.6 -29.4 68.1 18.0 36 76 A M E - G 0 197C 7 161,-3.1 161,-2.9 -2,-0.3 2,-0.6 -0.928 21.1-158.0-109.6 106.7 -32.6 67.3 16.2 37 77 A K E - G 0 196C 97 -2,-0.7 159,-0.2 -20,-0.4 -2,-0.0 -0.795 20.5-124.6 -88.6 121.5 -35.6 68.7 18.1 38 78 A T - 0 0 0 157,-2.6 156,-0.8 -2,-0.6 157,-0.1 -0.494 30.4-113.3 -64.2 125.5 -38.8 66.9 17.2 39 79 A P > - 0 0 64 0, 0.0 3,-1.9 0, 0.0 156,-0.1 -0.227 21.7-115.5 -58.9 150.1 -41.4 69.4 16.0 40 80 A E T 3 S+ 0 0 137 1,-0.3 -2,-0.1 153,-0.1 152,-0.0 0.709 116.9 44.7 -57.0 -25.3 -44.5 69.8 18.3 41 81 A T T 3 S+ 0 0 62 151,-0.1 186,-1.6 187,-0.1 2,-0.4 0.060 103.2 86.5-109.3 23.3 -46.7 68.4 15.5 42 82 A A E < -C 226 0B 12 -3,-1.9 2,-0.4 184,-0.2 184,-0.2 -0.953 46.7-171.3-131.1 149.5 -44.5 65.5 14.5 43 83 A H E -C 225 0B 7 182,-2.0 182,-1.9 -2,-0.4 2,-0.3 -0.993 15.7-169.6-131.8 121.3 -43.8 61.9 15.4 44 84 A F E -CD 224 191B 41 147,-2.9 147,-3.3 -2,-0.4 2,-0.4 -0.867 2.1-165.2-111.1 146.7 -40.8 60.1 13.8 45 85 A R E -CD 223 190B 68 178,-2.5 178,-2.0 -2,-0.3 2,-0.5 -0.990 7.3-163.9-136.1 127.5 -40.0 56.4 14.0 46 86 A I E - D 0 189B 0 143,-2.2 143,-2.5 -2,-0.4 176,-0.1 -0.950 29.7-123.8-108.9 125.5 -36.7 54.6 13.2 47 87 A A > - 0 0 42 -2,-0.5 3,-1.4 174,-0.3 138,-0.1 -0.307 23.0-101.0 -70.5 152.1 -37.1 50.8 12.7 48 88 A A T 3 S+ 0 0 51 1,-0.2 139,-0.2 -2,-0.1 -1,-0.1 -0.456 110.7 15.4 -67.3 137.8 -35.3 48.1 14.6 49 89 A Q T 3 S+ 0 0 100 136,-2.2 -1,-0.2 1,-0.2 2,-0.1 0.601 85.9 173.2 68.2 17.1 -32.4 46.7 12.3 50 90 A E < + 0 0 17 -3,-1.4 135,-3.0 135,-0.4 -1,-0.2 -0.356 12.5 175.0 -57.1 125.4 -32.6 49.7 9.9 51 91 A R + 0 0 116 133,-0.2 2,-1.9 -2,-0.1 132,-0.2 0.492 54.4 95.4-113.0 -12.5 -29.7 49.5 7.4 52 92 A R + 0 0 138 169,-0.1 169,-2.6 133,-0.0 2,-0.3 -0.614 64.4 126.5 -80.9 79.2 -30.6 52.5 5.1 53 93 A L E +E 220 0B 20 -2,-1.9 2,-0.4 167,-0.2 167,-0.2 -0.987 37.0 179.0-147.1 126.4 -28.2 54.6 7.2 54 94 A R E +E 219 0B 64 165,-2.5 165,-2.1 -2,-0.3 2,-0.4 -0.985 3.8 174.8-137.4 123.2 -25.2 56.8 6.2 55 95 A I E +E 218 0B 4 -2,-0.4 2,-0.4 116,-0.3 163,-0.2 -0.948 7.6 164.9-133.0 116.7 -23.1 58.8 8.6 56 96 A Y E -E 217 0B 7 161,-2.9 161,-2.5 -2,-0.4 2,-0.3 -0.917 16.4-172.8-133.8 99.9 -19.9 60.8 7.7 57 97 A L - 0 0 0 -2,-0.4 87,-0.8 159,-0.2 2,-0.4 -0.720 13.2-134.0 -99.1 145.0 -18.8 63.2 10.3 58 98 A R E -J 143 0D 19 -2,-0.3 151,-0.4 85,-0.2 85,-0.2 -0.814 6.1-150.8-110.2 141.6 -16.0 65.8 9.9 59 99 A G E -J 142 0D 0 83,-3.6 83,-2.1 -2,-0.4 2,-0.4 -0.516 23.4-130.1 -93.3 166.5 -13.1 66.9 12.0 60 100 A Q E +J 141 0D 30 147,-2.7 2,-0.4 81,-0.2 81,-0.2 -0.972 22.1 179.7-128.8 139.3 -11.7 70.4 11.7 61 101 A K E -J 140 0D 9 79,-2.3 79,-3.1 -2,-0.4 2,-0.5 -0.997 13.4-160.5-132.0 129.2 -8.2 71.9 11.2 62 102 A V E +J 139 0D 12 191,-0.4 190,-0.3 -2,-0.4 2,-0.2 -0.971 14.5 176.3-116.9 119.9 -7.8 75.8 11.1 63 103 A V E -J 138 0D 5 75,-2.6 75,-1.9 -2,-0.5 2,-0.2 -0.747 29.6 -99.5-120.5 163.9 -4.6 77.3 9.6 64 104 A N - 0 0 50 -2,-0.2 71,-0.2 72,-0.2 2,-0.2 -0.525 31.0-117.7 -83.2 151.1 -3.4 80.8 8.8 65 105 A G - 0 0 10 69,-2.4 -1,-0.1 -2,-0.2 73,-0.1 -0.528 10.5-146.2 -80.9 151.2 -3.5 82.6 5.5 66 106 A R - 0 0 99 -2,-0.2 67,-0.2 2,-0.0 -1,-0.1 0.339 32.3-125.1-100.3 5.7 -0.1 83.6 3.9 67 107 A N - 0 0 103 65,-2.5 66,-0.1 1,-0.1 63,-0.1 0.919 41.0-166.3 47.7 51.2 -1.6 86.8 2.3 68 108 A L - 0 0 33 61,-0.4 63,-2.5 64,-0.1 -1,-0.1 -0.295 28.1-144.0 -65.1 150.4 -0.3 85.6 -1.2 69 109 A S S S+ 0 0 108 1,-0.2 61,-0.1 61,-0.2 -1,-0.1 0.729 90.8 19.1 -84.1 -26.6 -0.2 88.1 -4.1 70 110 A D S S- 0 0 112 59,-0.1 -1,-0.2 58,-0.0 61,-0.1 -0.967 101.6 -82.9-137.9 152.5 -1.2 85.1 -6.5 71 111 A P + 0 0 85 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.213 54.9 173.2 -57.7 144.9 -2.9 81.7 -5.8 72 112 A D E -M 128 0E 87 56,-1.8 56,-3.0 -4,-0.0 54,-0.1 -0.986 35.9 -88.6-153.2 153.3 -0.4 79.0 -4.7 73 113 A S E -M 127 0E 60 -2,-0.3 2,-0.4 54,-0.3 54,-0.2 -0.305 37.4-167.6 -61.1 140.5 -0.4 75.4 -3.4 74 114 A R E -M 126 0E 32 52,-2.6 52,-2.4 2,-0.0 2,-0.5 -0.994 6.4-156.0-134.7 127.9 -0.6 74.9 0.3 75 115 A T E +M 125 0E 80 -2,-0.4 2,-0.4 50,-0.2 50,-0.2 -0.937 15.4 176.3-107.9 121.9 0.1 71.5 2.1 76 116 A V E -M 124 0E 9 48,-2.6 48,-2.5 -2,-0.5 2,-0.4 -0.987 26.3-130.7-124.2 137.0 -1.6 70.9 5.5 77 117 A N E -M 123 0E 53 -2,-0.4 46,-0.3 46,-0.2 45,-0.1 -0.748 17.8-156.6 -88.1 131.7 -1.3 67.6 7.5 78 118 A L > - 0 0 1 44,-2.9 3,-1.8 -2,-0.4 128,-0.0 -0.887 15.0-134.1-112.5 98.8 -4.8 66.3 8.8 79 119 A P T 3 S+ 0 0 25 0, 0.0 67,-0.2 0, 0.0 43,-0.1 -0.288 86.6 3.5 -57.9 131.5 -4.5 64.0 11.9 80 120 A F T 3 S+ 0 0 93 1,-0.2 65,-2.1 64,-0.1 66,-0.1 0.534 85.0 171.6 70.4 14.5 -6.6 60.8 11.6 81 121 A L B < -P 144 0F 17 -3,-1.8 2,-0.3 63,-0.2 63,-0.3 -0.258 12.8-165.6 -51.9 137.9 -7.8 61.6 8.0 82 122 A M - 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