==== 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 VIRUS 08-APR-05 1ZBA . COMPND 2 MOLECULE: COAT PROTEIN VP1; . SOURCE 2 ORGANISM_SCIENTIFIC: FOOT-AND-MOUTH DISEASE VIRUS; . AUTHOR E.E.FRY,J.W.NEWMAN,S.CURRY,S.NAJJAM,T.JACKSON,W.BLAKEMORE,S. . 668 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37411.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 347 51.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 168 25.1 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 . 1 0.1 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-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 . 2 0.3 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 . 49 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 5.5 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 1 1 3 1 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 . 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 . 4 6 3 2 3 4 2 0 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 2 3 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 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 1 T 0 0 59 0, 0.0 2,-0.3 0, 0.0 666,-0.1 0.000 360.0 360.0 360.0 135.8 9.5 17.8 120.6 2 2 1 T + 0 0 107 666,-0.2 666,-0.4 2,-0.0 2,-0.3 -0.839 360.0 162.9-109.2 148.1 9.1 14.9 122.9 3 3 1 T - 0 0 62 -2,-0.3 2,-1.3 664,-0.1 3,-0.1 -0.937 51.1 -83.2-153.2 174.1 11.1 11.7 122.3 4 4 1 T > - 0 0 73 -2,-0.3 3,-1.0 1,-0.2 5,-0.4 -0.754 44.1-174.2 -85.4 95.6 12.3 8.5 124.0 5 5 1 G G > S+ 0 0 41 -2,-1.3 3,-1.8 1,-0.2 -1,-0.2 0.793 71.3 72.4 -65.8 -26.7 15.3 9.9 125.8 6 6 1 E G 3 S+ 0 0 24 1,-0.3 323,-2.3 2,-0.1 -1,-0.2 0.770 88.0 65.0 -61.3 -23.7 16.6 6.6 127.1 7 7 1 S G < S- 0 0 10 -3,-1.0 -1,-0.3 321,-0.2 -2,-0.2 0.705 95.3-141.5 -70.8 -24.1 17.7 5.6 123.6 8 8 1 A < + 0 0 28 -3,-1.8 319,-0.1 -4,-0.3 -3,-0.1 0.654 43.4 156.0 70.1 15.1 20.2 8.4 123.5 9 9 1 D - 0 0 108 -5,-0.4 -1,-0.2 1,-0.1 -2,-0.1 -0.605 52.6-100.5 -71.7 132.2 19.4 9.1 119.8 10 10 1 P - 0 0 44 0, 0.0 654,-2.5 0, 0.0 2,-0.4 -0.237 39.1-169.3 -57.3 138.9 20.4 12.8 119.0 11 11 1 V B -a 664 0A 57 652,-0.3 2,-0.5 654,-0.1 654,-0.2 -0.993 7.6-179.5-131.2 123.2 17.6 15.3 119.0 12 12 1 T - 0 0 77 652,-2.7 2,-0.1 -2,-0.4 0, 0.0 -0.898 8.2-170.4-127.9 100.9 18.0 18.9 117.6 13 13 1 T - 0 0 73 -2,-0.5 2,-0.3 -12,-0.1 653,-0.1 -0.426 8.2-149.8 -83.2 168.2 15.0 21.1 117.7 14 14 1 T > - 0 0 39 651,-0.3 3,-1.9 652,-0.2 4,-0.2 -0.900 30.7-103.4-134.5 164.6 14.8 24.5 116.1 15 15 1 V G > >S+ 0 0 52 -2,-0.3 5,-2.8 1,-0.3 3,-1.4 0.654 107.3 83.4 -65.9 -10.8 13.0 27.8 116.7 16 16 1 E G > 5S+ 0 0 86 3,-0.3 3,-1.6 1,-0.3 -1,-0.3 0.773 72.4 77.6 -62.3 -25.0 10.6 27.0 113.9 17 17 1 N G < 5S+ 0 0 67 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.837 109.3 25.4 -53.4 -36.2 8.7 24.9 116.5 18 18 1 Y G < 5S- 0 0 189 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.052 133.7 -77.6-118.6 24.2 7.3 28.1 117.9 19 19 1 G T < 5S+ 0 0 70 -3,-1.6 -3,-0.3 1,-0.2 -2,-0.1 0.511 85.7 127.9 100.5 5.0 7.5 30.3 114.8 20 20 1 G < - 0 0 28 -5,-2.8 2,-0.5 -6,-0.1 -1,-0.2 -0.242 54.9-119.7 -86.2-177.4 11.1 31.4 114.5 21 21 1 D - 0 0 127 -6,-0.1 2,-0.2 -2,-0.1 -6,-0.0 -0.987 20.9-134.0-126.4 117.7 13.6 31.3 111.6 22 22 1 T - 0 0 71 -2,-0.5 2,-0.1 1,-0.1 -8,-0.0 -0.524 32.4-142.2 -69.8 137.2 16.8 29.2 112.0 23 23 1 Q - 0 0 149 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.311 17.5 -80.1 -98.4-175.7 19.7 31.3 110.7 24 24 1 V - 0 0 111 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.641 40.4-157.7 -84.7 134.4 23.0 30.8 108.8 25 25 1 Q - 0 0 115 -2,-0.3 2,-0.5 2,-0.0 -1,-0.0 -0.873 11.9-165.1-116.4 143.7 26.1 29.5 110.6 26 26 1 R + 0 0 201 -2,-0.3 3,-0.3 1,-0.0 -2,-0.0 -0.975 10.6 179.1-124.9 109.6 29.7 29.9 109.7 27 27 1 R > + 0 0 179 -2,-0.5 3,-1.1 1,-0.2 4,-0.1 0.017 36.2 123.3-106.7 33.7 31.8 27.5 111.8 28 28 1 H G > S+ 0 0 128 1,-0.3 3,-1.5 2,-0.2 7,-0.2 0.866 72.8 55.8 -59.2 -42.6 35.4 28.0 110.6 29 29 1 H G 3 S+ 0 0 139 1,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.658 104.7 52.8 -68.3 -18.3 36.8 28.9 114.0 30 30 1 T G < S+ 0 0 108 -3,-1.1 2,-0.4 4,-0.1 -1,-0.3 0.229 79.6 122.3 -99.5 12.2 35.5 25.6 115.5 31 31 1 D <> - 0 0 76 -3,-1.5 4,-3.1 1,-0.1 5,-0.3 -0.634 62.5-139.0 -74.0 128.8 37.3 23.6 112.8 32 32 1 V H > S+ 0 0 59 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 0.907 98.8 46.7 -55.9 -51.1 39.7 21.2 114.4 33 33 1 G H > S+ 0 0 19 1,-0.2 4,-0.5 2,-0.2 132,-0.3 0.878 116.8 45.7 -62.0 -36.6 42.5 21.5 112.0 34 34 1 F H >4 S+ 0 0 42 590,-0.2 3,-0.9 -6,-0.2 -2,-0.2 0.955 113.1 47.3 -71.2 -51.0 42.3 25.3 112.1 35 35 1 I H 3< S+ 0 0 31 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.843 112.2 48.7 -63.6 -34.0 42.0 25.7 115.9 36 36 1 M H 3< S+ 0 0 0 -4,-2.2 2,-1.7 -5,-0.3 126,-0.8 0.641 90.0 92.7 -81.1 -10.2 44.9 23.4 116.7 37 37 1 D << + 0 0 4 -3,-0.9 2,-0.3 -4,-0.5 -1,-0.2 -0.418 64.9 86.8 -87.2 65.9 47.1 25.2 114.2 38 38 1 R S S- 0 0 73 -2,-1.7 124,-0.5 122,-0.1 2,-0.1 -0.979 82.7 -88.5-155.0 152.4 48.8 27.8 116.3 39 39 1 F - 0 0 57 -2,-0.3 2,-0.3 122,-0.2 122,-0.2 -0.403 39.4-175.7 -68.7 141.2 51.9 27.9 118.5 40 40 1 V E -B 160 0B 25 120,-2.2 120,-2.8 -2,-0.1 2,-0.2 -0.973 22.8-117.8-132.8 145.1 51.6 26.9 122.2 41 41 1 K E -B 159 0B 92 -2,-0.3 2,-0.6 118,-0.2 16,-0.5 -0.597 7.9-147.0 -93.4 150.5 54.4 27.1 124.7 42 42 1 I - 0 0 5 116,-2.4 116,-0.5 -2,-0.2 14,-0.1 -0.976 13.3-166.3-110.0 115.1 56.1 24.3 126.7 43 43 1 N + 0 0 115 -2,-0.6 2,-0.3 12,-0.5 -1,-0.1 0.890 65.5 68.0 -72.6 -46.8 57.1 25.6 130.1 44 44 1 S + 0 0 75 11,-0.3 2,-0.3 114,-0.0 11,-0.0 -0.598 66.2 158.1 -78.9 136.7 59.4 22.9 131.5 45 45 1 L + 0 0 46 -2,-0.3 111,-0.1 4,-0.0 4,-0.1 -0.912 17.3 174.5-147.1 175.3 62.7 22.8 129.6 46 46 1 S - 0 0 57 -2,-0.3 108,-0.1 1,-0.0 106,-0.0 -0.910 54.2 -84.6-176.5 161.0 66.3 21.6 130.0 47 47 1 P S S+ 0 0 74 0, 0.0 105,-1.8 0, 0.0 2,-0.5 0.786 125.0 40.9 -48.1 -31.9 69.4 21.3 127.8 48 48 1 T E S+F 151 0C 45 103,-0.2 2,-0.4 105,-0.1 103,-0.2 -0.982 80.2 176.8-120.0 119.8 68.0 17.9 126.6 49 49 1 H E -F 150 0C 7 101,-2.8 101,-2.8 -2,-0.5 2,-0.6 -0.979 23.7-149.1-135.3 126.6 64.3 17.9 126.0 50 50 1 V E -F 149 0C 68 -2,-0.4 2,-0.5 99,-0.2 99,-0.3 -0.826 30.6-122.4 -91.8 119.3 62.0 15.1 124.7 51 51 1 I + 0 0 3 97,-2.2 96,-2.5 -2,-0.6 2,-0.4 -0.504 43.3 161.5 -68.7 113.1 59.0 16.6 122.7 52 52 1 D > - 0 0 44 -2,-0.5 3,-2.1 94,-0.2 94,-0.1 -0.970 34.1-150.6-137.5 113.9 55.8 15.4 124.3 53 53 1 L G > S+ 0 0 4 -2,-0.4 3,-1.2 1,-0.3 13,-0.1 0.662 93.4 72.2 -59.2 -19.0 52.5 17.4 123.6 54 54 1 M G 3 S+ 0 0 36 1,-0.3 -1,-0.3 12,-0.1 4,-0.1 0.571 81.0 71.9 -74.9 -6.1 51.2 16.4 127.0 55 55 1 Q G < S+ 0 0 68 -3,-2.1 -12,-0.5 2,-0.1 -11,-0.3 0.367 76.7 108.9 -85.1 1.3 53.7 18.9 128.6 56 56 1 T S < S- 0 0 7 -3,-1.2 2,-0.4 -14,-0.1 -14,-0.1 -0.406 88.8 -91.4 -72.5 151.4 51.4 21.5 127.1 57 57 1 H > - 0 0 103 -16,-0.5 3,-1.7 1,-0.1 6,-0.3 -0.599 28.6-133.2 -73.3 132.5 49.4 23.4 129.8 58 58 1 K T 3 S+ 0 0 134 -2,-0.4 -1,-0.1 1,-0.3 9,-0.1 0.613 101.6 43.6 -59.3 -14.3 46.0 21.7 130.5 59 59 1 H T 3 S+ 0 0 145 5,-0.1 -1,-0.3 4,-0.1 2,-0.1 0.410 86.4 104.6-112.5 -3.9 44.0 25.0 130.4 60 60 1 G S <> S- 0 0 29 -3,-1.7 4,-3.2 1,-0.1 5,-0.4 -0.437 86.4-106.8 -73.6 156.7 45.6 26.6 127.3 61 61 1 I H > S+ 0 0 99 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.904 119.3 39.0 -52.7 -45.6 43.4 26.5 124.2 62 62 1 V H > S+ 0 0 5 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.942 119.5 45.2 -70.5 -50.2 45.6 23.8 122.5 63 63 1 G H > S+ 0 0 0 -6,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.840 114.0 49.2 -62.7 -37.9 46.2 21.7 125.6 64 64 1 A H X S+ 0 0 12 -4,-3.2 4,-0.8 -7,-0.2 -2,-0.2 0.976 115.8 43.8 -64.8 -51.8 42.6 21.9 126.7 65 65 1 L H >< S+ 0 0 46 -4,-1.9 3,-0.7 -5,-0.4 -2,-0.2 0.886 112.0 51.9 -61.9 -41.6 41.4 20.9 123.2 66 66 1 L H >< S+ 0 0 1 -4,-3.1 3,-1.3 1,-0.3 -1,-0.2 0.935 109.4 50.2 -62.1 -44.7 44.0 18.1 122.8 67 67 1 R H 3< S+ 0 0 65 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.628 97.5 69.6 -68.7 -14.1 43.0 16.6 126.2 68 68 1 A T << S+ 0 0 18 -4,-0.8 103,-1.9 -3,-0.7 2,-0.3 0.130 97.4 65.0 -88.5 18.1 39.4 16.7 125.0 69 69 1 A E < -C 170 0B 3 -3,-1.3 59,-0.2 101,-0.3 100,-0.2 -0.976 68.1-152.1-136.8 148.0 40.3 13.9 122.6 70 70 1 T E S+ 0 0 0 98,-1.9 58,-2.0 99,-1.3 59,-0.6 0.902 82.4 23.1 -86.5 -47.4 41.5 10.4 123.2 71 71 1 Y E +CD 168 127B 9 97,-1.8 97,-2.4 56,-0.2 2,-0.3 -0.887 69.6 170.0-121.4 152.4 43.6 9.8 120.1 72 72 1 Y E -CD 167 126B 3 54,-2.3 54,-2.6 -2,-0.3 2,-0.3 -0.947 16.5-160.7-153.5 169.3 45.3 12.2 117.8 73 73 1 F E +C 166 0B 21 93,-1.7 93,-2.1 -2,-0.3 2,-0.3 -0.971 23.2 140.7-153.2 145.8 47.7 12.6 114.9 74 74 1 S E - 0 0 0 -2,-0.3 90,-0.2 91,-0.2 2,-0.2 -0.963 41.1-121.1-177.9 159.3 49.8 15.5 113.5 75 75 1 D E -C 163 0B 3 88,-3.0 88,-2.2 -2,-0.3 2,-0.3 -0.417 43.3-132.9 -92.4-175.9 53.0 16.7 112.1 76 76 1 L E -CE 162 117B 2 41,-2.7 41,-3.4 86,-0.2 2,-0.4 -0.971 22.9-162.3-150.3 156.4 54.8 19.5 113.9 77 77 1 E E -CE 161 116B 25 84,-1.8 84,-2.6 -2,-0.3 2,-0.4 -0.977 18.2-167.3-131.7 142.8 56.6 22.8 113.9 78 78 1 I E -CE 160 115B 0 37,-2.0 37,-2.4 -2,-0.4 2,-0.5 -0.981 14.5-159.5-133.9 144.7 58.8 24.0 116.7 79 79 1 V E -CE 159 114B 16 80,-2.2 80,-2.6 -2,-0.4 2,-0.4 -0.998 20.4-174.5-118.6 123.9 60.4 27.4 117.6 80 80 1 V E -CE 158 113B 0 33,-2.6 33,-2.8 -2,-0.5 2,-0.7 -0.988 19.0-159.8-127.0 127.3 63.4 27.0 119.8 81 81 1 R E +C 157 0B 106 76,-2.2 75,-2.3 -2,-0.4 76,-1.4 -0.932 39.0 155.0-101.6 114.6 65.4 29.8 121.5 82 82 1 H E -C 155 0B 10 -2,-0.7 2,-0.3 73,-0.2 73,-0.2 -0.963 46.5-118.7-145.2 160.7 68.8 28.3 122.3 83 83 1 D E S-C 154 0B 77 71,-2.2 70,-1.5 -2,-0.3 71,-0.9 -0.756 84.7 -6.3 -96.1 141.9 72.5 28.8 123.0 84 84 1 G S S- 0 0 20 -2,-0.3 2,-0.2 68,-0.2 -2,-0.1 -0.323 113.9 -24.9 72.6-158.1 74.8 27.0 120.7 85 85 1 N - 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