==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS 08-AUG-11 3ZX8 . COMPND 2 MOLECULE: CAPSID PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: TURNIP CRINKLE VIRUS; . AUTHOR S.E.BAKKER,J.ROBOTTOM,J.M.HOGLE,A.MAEDA,A.R.PEARSON,P.G.STOC . 829 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40246.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 334 40.3 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 . 102 12.3 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 4 0.5 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 . 107 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 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 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 . 30 9 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 3 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 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 81 A G 0 0 63 0, 0.0 155,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 166.3 -17.2 32.7 115.6 2 82 A I - 0 0 47 153,-0.3 2,-0.2 154,-0.0 154,-0.0 0.033 360.0-152.5-104.6-106.2 -18.8 35.9 116.2 3 83 A T - 0 0 48 151,-0.1 2,-0.2 152,-0.1 151,-0.2 -0.994 9.4-161.3 148.0-175.2 -16.4 39.5 116.6 4 84 A R - 0 0 84 149,-0.9 2,-0.3 -2,-0.2 35,-0.0 -0.867 11.2-136.8-161.8-168.3 -16.1 43.0 118.1 5 85 A S - 0 0 82 -2,-0.2 147,-0.4 147,-0.2 145,-0.1 -0.925 35.0 -94.9-165.8 144.3 -14.4 46.5 118.1 6 86 A G + 0 0 16 145,-3.3 144,-0.2 -2,-0.3 48,-0.0 0.267 45.7 141.8 -59.0-174.4 -13.2 48.7 120.9 7 87 A S + 0 0 70 142,-1.0 2,-0.3 1,-0.0 143,-0.1 0.423 33.6 125.2 130.4 82.0 -14.5 51.6 123.0 8 88 A E - 0 0 24 28,-0.1 141,-0.4 29,-0.1 2,-0.3 -0.871 49.4-139.2-145.8 162.7 -13.6 51.5 126.6 9 89 A L - 0 0 86 -2,-0.3 2,-1.4 139,-0.2 139,-0.3 -0.712 15.2-158.7-136.0 84.0 -11.9 54.0 128.8 10 90 A I - 0 0 18 -2,-0.3 138,-0.1 25,-0.1 235,-0.1 -0.117 45.4 -77.1 -57.1 39.0 -9.4 52.1 131.0 11 91 A T - 0 0 48 -2,-1.4 2,-0.2 136,-0.2 136,-0.2 0.202 54.5-109.4 70.2 152.8 -8.7 54.6 134.5 12 92 A T - 0 0 67 1,-0.3 134,-0.1 134,-0.1 2,-0.1 -0.708 12.6-111.7-126.4 175.5 -6.4 57.7 134.6 13 93 A L - 0 0 22 132,-0.4 -1,-0.3 -2,-0.2 2,-0.2 0.118 20.4-146.7-109.3-163.9 -3.9 58.8 135.7 14 94 A K - 0 0 182 1,-0.6 129,-0.1 122,-0.1 122,-0.1 -0.755 43.5 -75.3-167.9 115.0 -3.3 61.5 138.3 15 95 A K - 0 0 70 127,-0.8 -1,-0.6 -2,-0.2 121,-0.1 0.283 32.4-162.2 21.1-154.0 -0.4 64.0 138.5 16 96 A N + 0 0 16 -3,-0.1 2,-7.5 121,-0.1 4,-0.3 0.211 9.8 179.3 158.6 10.5 3.0 62.8 139.6 17 97 A T + 0 0 94 122,-0.2 122,-0.3 120,-0.1 2,-0.2 0.205 57.4 99.9 -30.1 49.4 4.7 66.0 140.5 18 98 A D S S- 0 0 84 -2,-7.5 120,-0.2 120,-1.3 0, 0.0 -0.889 81.2-117.0-141.1 167.2 7.6 63.6 141.4 19 99 A T S S+ 0 0 134 -2,-0.2 -2,-0.1 118,-0.1 118,-0.1 0.125 93.7 58.6-101.3 22.7 11.0 62.3 139.7 20 100 A E S S- 0 0 99 -4,-0.3 116,-0.1 118,-0.1 118,-0.1 -0.996 88.8-116.8-141.2 119.4 10.3 58.6 139.3 21 101 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 116,-0.1 -0.178 22.3-149.6 -55.3-162.0 7.3 57.4 137.2 22 102 A K - 0 0 104 63,-0.0 114,-0.6 112,-0.0 2,-0.2 -0.806 12.0-143.2-172.6 121.4 4.6 55.5 138.8 23 103 A Y B -A 135 0A 49 -2,-0.3 112,-0.2 60,-0.2 110,-0.0 -0.660 24.1-168.4-107.8 150.1 2.5 52.8 137.0 24 104 A T - 0 0 34 110,-1.3 108,-0.1 -2,-0.2 111,-0.1 0.159 28.1-167.8-113.8 9.7 -1.2 51.6 136.9 25 105 A T - 0 0 14 109,-0.2 2,-0.4 1,-0.1 108,-0.3 0.417 5.3-161.9 -5.1 117.9 -0.4 48.5 134.8 26 106 A A B -B 132 0B 4 106,-0.8 106,-5.3 104,-0.0 2,-0.2 -0.979 12.8-123.0-123.0 132.5 -3.8 47.2 133.7 27 107 A V - 0 0 23 -2,-0.4 2,-0.5 104,-0.3 104,-0.2 -0.489 15.9-142.2 -85.7 143.9 -4.3 43.6 132.5 28 108 A L + 0 0 3 102,-0.2 102,-0.2 -2,-0.2 50,-0.1 -0.913 41.8 120.4-113.7 120.8 -5.8 42.5 129.1 29 109 A N S S- 0 0 0 -2,-0.5 3,-0.3 99,-0.1 99,-0.1 -0.895 73.5 -99.1-169.5 143.3 -8.1 39.5 128.5 30 110 A P S S+ 0 0 10 0, 0.0 2,-0.5 0, 0.0 5,-0.1 0.796 120.7 37.5 -42.7 -29.0 -11.6 39.3 127.1 31 111 A S S S+ 0 0 40 1,-0.1 87,-0.3 9,-0.1 6,-0.1 -0.815 77.4 102.5-132.4 95.3 -12.7 39.2 130.8 32 112 A E - 0 0 25 -2,-0.5 4,-0.2 -3,-0.3 214,-0.1 -0.394 52.7-159.4-160.0 66.2 -10.8 41.3 133.2 33 113 A P S > S+ 0 0 9 0, 0.0 2,-4.7 0, 0.0 3,-4.5 0.646 83.4 80.8 -44.3 -37.4 -13.1 44.3 133.7 34 114 A G T 3 S+ 0 0 10 1,-0.3 167,-0.1 2,-0.1 -7,-0.1 0.222 113.3 25.6 -51.2 27.0 -10.4 46.4 135.0 35 115 A T T 3 S+ 0 0 3 -2,-4.7 -1,-0.3 165,-0.2 -25,-0.1 0.210 132.5 31.7-175.9 15.8 -9.9 46.6 131.2 36 116 A F < + 0 0 3 -3,-4.5 -4,-0.3 -4,-0.2 3,-0.3 -0.367 44.0 163.2 173.4 98.5 -13.3 46.0 129.7 37 117 A N S S+ 0 0 62 1,-0.2 2,-0.1 2,-0.1 165,-0.1 0.404 83.6 48.6-100.9 -3.8 -16.6 46.9 131.4 38 118 A Q S S+ 0 0 125 -5,-0.1 -1,-0.2 1,-0.0 163,-0.0 -0.580 114.0 34.4-139.2 71.2 -18.5 46.5 128.1 39 119 A L S > S+ 0 0 5 -3,-0.3 3,-0.8 -2,-0.1 -2,-0.1 0.161 89.6 88.7 163.6 -7.3 -17.6 43.2 126.5 40 120 A I T 3 S+ 0 0 21 1,-0.2 -9,-0.1 2,-0.1 -4,-0.0 0.037 83.7 66.4 -92.7 20.9 -17.1 41.2 129.6 41 121 A K T 3 S+ 0 0 178 1,-0.0 -1,-0.2 2,-0.0 -10,-0.1 0.235 98.1 47.6-123.2 1.5 -20.8 40.5 129.1 42 122 A E S < S+ 0 0 47 -3,-0.8 -2,-0.1 1,-0.1 -1,-0.0 -0.099 95.0 71.3-137.5 32.7 -20.5 38.5 125.9 43 123 A A S S+ 0 0 21 118,-0.1 117,-0.1 2,-0.1 74,-0.1 -0.010 75.4 82.7-133.7 18.0 -17.7 36.2 126.9 44 124 A A S S+ 0 0 30 1,-0.1 117,-6.2 115,-0.1 3,-0.1 0.032 96.4 45.2-106.6 16.1 -20.0 34.3 129.2 45 125 A Q S S+ 0 0 96 115,-0.4 114,-3.6 114,-0.1 2,-0.2 0.234 118.1 35.0-140.3 -0.1 -21.1 32.4 126.2 46 126 A Y B -C 158 0C 41 112,-0.3 114,-0.3 113,-0.2 111,-0.2 -0.798 57.8-150.5-143.3-175.2 -17.8 31.7 124.5 47 127 A E + 0 0 4 109,-1.5 2,-0.2 110,-0.7 596,-0.1 -0.518 60.1 43.6-170.7 94.6 -14.1 30.8 125.3 48 128 A K - 0 0 18 -2,-0.1 2,-0.3 79,-0.1 108,-0.3 -0.455 58.7-160.8 140.1 149.1 -11.2 31.8 123.1 49 129 A Y B -D 115 0D 4 66,-2.2 66,-1.5 106,-0.2 106,-0.2 -0.980 24.8-157.6-178.3 171.9 -10.1 34.9 121.2 50 130 A R - 0 0 53 104,-0.4 63,-0.2 -2,-0.3 103,-0.2 0.802 12.5-155.7 -94.3 -82.8 -8.4 36.9 118.9 51 131 A F + 0 0 7 59,-0.1 102,-0.2 61,-0.1 3,-0.1 0.546 18.0 167.1 68.8 133.9 -7.7 40.5 118.8 52 132 A T S S+ 0 0 88 100,-1.0 2,-0.3 1,-0.4 101,-0.1 0.300 72.4 28.5-146.3 -20.9 -7.1 42.0 115.4 53 133 A S B +E 152 0E 34 99,-0.8 99,-1.4 96,-0.0 -1,-0.4 -0.978 65.0 138.5-150.8 133.8 -7.3 45.6 116.4 54 134 A L + 0 0 5 -2,-0.3 54,-0.9 97,-0.3 2,-0.3 -0.650 10.6 154.3 179.2 119.0 -6.5 47.4 119.7 55 135 A R B -F 107 0F 108 95,-0.2 95,-4.5 -2,-0.2 2,-0.5 -0.971 30.4-133.7-147.6 154.1 -4.7 50.6 120.5 56 136 A F - 0 0 0 50,-0.9 2,-0.4 -2,-0.3 50,-0.4 -0.963 17.8-160.7-118.9 127.5 -4.8 53.1 123.4 57 137 A R - 0 0 109 -2,-0.5 2,-1.7 48,-0.2 91,-0.3 -0.860 18.4-137.9-108.4 138.3 -5.0 56.8 122.9 58 138 A Y B -G 104 0G 1 46,-2.2 46,-0.9 -2,-0.4 89,-0.2 -0.748 26.6-150.1 -90.3 81.5 -4.1 59.5 125.3 59 139 A S - 0 0 26 87,-1.9 2,-0.4 -2,-1.7 87,-0.2 -0.123 15.2-130.9 -40.1 154.6 -6.9 61.5 124.6 60 140 A P + 0 0 67 0, 0.0 2,-0.2 0, 0.0 85,-0.1 -0.771 46.8 148.3-117.9 89.8 -5.5 64.8 125.3 61 141 A M + 0 0 116 -2,-0.4 82,-0.1 83,-0.2 40,-0.1 -0.421 48.4 79.6-124.2 59.8 -7.8 67.0 127.6 62 142 A S S S- 0 0 17 38,-0.2 4,-0.2 -2,-0.2 82,-0.0 -0.822 77.8-108.1-165.8 122.1 -5.3 69.3 129.7 63 143 A P - 0 0 102 0, 0.0 3,-0.5 0, 0.0 39,-0.1 0.121 27.6-112.2 -54.1 167.4 -3.5 72.5 128.6 64 144 A S S S+ 0 0 74 1,-0.3 37,-0.1 37,-0.2 38,-0.0 0.617 101.7 90.9 -76.3 -18.5 0.2 72.8 127.9 65 145 A T S S+ 0 0 141 36,-0.0 2,-0.3 2,-0.0 -1,-0.3 0.433 90.5 62.0 -58.3 6.2 0.7 75.0 131.0 66 146 A T S S+ 0 0 8 -3,-0.5 2,-0.3 -4,-0.2 35,-0.2 -0.921 72.0 159.4-130.2 153.6 1.2 71.5 132.3 67 147 A G + 0 0 28 73,-0.3 72,-0.7 -2,-0.3 73,-0.5 -0.979 19.6 104.2-165.9 176.7 3.9 68.9 131.3 68 148 A G - 0 0 43 -2,-0.3 2,-0.3 70,-0.2 70,-0.2 -0.950 69.3 -62.8 145.1-118.1 6.1 65.8 132.0 69 149 A K - 0 0 31 68,-0.4 68,-0.4 -2,-0.3 30,-0.2 -0.966 21.0-152.9-159.3 163.1 5.4 62.4 130.3 70 150 A V - 0 0 2 28,-1.6 66,-0.3 -2,-0.3 29,-0.1 -0.450 23.0-157.1-143.1 62.0 2.7 59.8 130.1 71 151 A A + 0 0 0 26,-0.1 64,-0.7 63,-0.1 26,-0.2 0.091 19.1 169.6 -34.5 154.3 4.5 56.5 129.3 72 152 A L + 0 0 2 62,-0.2 24,-0.6 2,-0.0 2,-0.3 -0.424 12.4 134.9 179.3 94.2 2.1 54.0 127.7 73 153 A A - 0 0 2 22,-0.2 2,-0.2 60,-0.1 22,-0.1 -0.958 40.2-131.3-154.0 134.2 3.4 50.7 126.1 74 154 A F - 0 0 8 -2,-0.3 2,-0.4 33,-0.1 58,-0.2 -0.476 8.2-154.6 -91.9 155.2 2.1 47.1 126.3 75 155 A D - 0 0 14 56,-1.4 56,-0.2 1,-0.2 4,-0.1 -0.908 16.7-139.2-131.4 100.5 4.1 44.0 127.0 76 156 A R S S+ 0 0 12 -2,-0.4 2,-3.4 1,-0.2 -1,-0.2 0.742 98.8 73.8 -17.4 -72.5 2.7 40.7 125.7 77 157 A D S S- 0 0 13 1,-0.2 2,-0.5 53,-0.2 53,-0.4 -0.227 77.8-169.9 -51.4 72.8 3.8 39.0 128.9 78 158 A A + 0 0 1 -2,-3.4 2,-0.3 51,-1.1 52,-0.3 0.221 59.6 61.2 -59.3 14.4 0.9 40.9 130.5 79 159 A A + 0 0 21 -2,-0.5 -1,-0.1 50,-0.2 -2,-0.0 -0.877 63.2 86.3-156.0 125.6 2.1 39.9 134.0 80 160 A K S S- 0 0 57 -2,-0.3 309,-0.1 3,-0.0 51,-0.1 -0.756 82.5 -60.5 156.8 153.0 5.3 40.6 135.9 81 161 A P - 0 0 101 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.253 48.2-126.5 -57.4 139.4 6.4 43.5 138.2 82 162 A P - 0 0 38 0, 0.0 3,-0.0 0, 0.0 7,-0.0 -0.375 45.5-103.0 -67.1 161.4 6.5 46.8 136.4 83 163 A P - 0 0 19 0, 0.0 -60,-0.2 0, 0.0 3,-0.1 -0.154 12.9-125.6 -67.7-156.9 9.9 47.8 137.1 84 164 A N S S+ 0 0 63 1,-0.1 2,-0.4 -3,-0.1 -61,-0.0 0.480 88.2 60.9-109.7 -36.8 10.6 50.2 139.6 85 165 A D S S- 0 0 76 1,-0.1 4,-0.5 -65,-0.1 3,-0.4 -0.906 71.4-131.9-125.7 144.2 12.5 52.3 137.1 86 166 A L S >> S+ 0 0 55 -2,-0.4 3,-4.2 2,-0.3 4,-2.3 0.876 104.9 53.8 -33.6 -87.1 12.1 54.2 133.8 87 167 A A T 34 S+ 0 0 50 1,-0.3 -1,-0.3 2,-0.3 5,-0.1 0.806 110.2 55.6 -24.2 -45.8 15.0 53.1 131.7 88 168 A S T >4 S+ 0 0 21 -3,-0.4 3,-0.5 1,-0.2 -1,-0.3 0.893 115.8 34.7 -54.7 -45.7 13.4 49.7 132.7 89 169 A L G X4 S+ 0 0 5 -3,-4.2 3,-2.1 -4,-0.5 2,-0.3 0.911 113.2 59.4 -73.4 -46.4 10.2 51.0 131.2 90 170 A Y G 3< S+ 0 0 105 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.053 103.9 54.9 -75.3 24.2 11.9 53.0 128.4 91 171 A N G < S+ 0 0 90 -3,-0.5 2,-0.7 -5,-0.4 -1,-0.3 0.374 87.2 85.3-134.1 -9.8 13.4 49.7 127.3 92 172 A I S X S- 0 0 14 -3,-2.1 3,-0.7 1,-0.3 337,-0.2 -0.883 87.3-116.9-104.2 108.6 10.2 47.7 126.9 93 173 A E T 3 S+ 0 0 37 -2,-0.7 2,-3.1 335,-0.7 -1,-0.3 0.521 86.0 96.8 -12.5-136.6 8.6 48.3 123.5 94 174 A G T 3 - 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