==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS/RNA 28-MAR-02 1LAJ . COMPND 2 MOLECULE: CAPSID PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: TOMATO ASPERMY VIRUS; . AUTHOR R.W.LUCAS,S.B.LARSON,M.A.CANADY,A.MCPHERSON . 540 3 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31813.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 307 56.9 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 . 124 23.0 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 . 0 0.0 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-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 . 58 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 10.0 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 3 1 0 0 3 0 1 0 1 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 . 0 8 5 1 4 3 0 3 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 0 3 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 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 44 A N > 0 0 166 0, 0.0 4,-1.6 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 41.0 56.5 1.3 76.4 2 45 A I H > + 0 0 139 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.784 360.0 57.4 -78.6 -29.0 58.2 4.3 78.0 3 46 A A H > S+ 0 0 80 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.922 108.3 43.7 -63.3 -47.2 56.9 2.7 81.3 4 47 A S H 4 S+ 0 0 73 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.922 112.5 54.2 -64.8 -42.7 58.7 -0.6 80.6 5 48 A S H < S+ 0 0 95 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.880 111.9 42.3 -58.4 -43.2 61.9 1.3 79.5 6 49 A S H < S+ 0 0 90 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.742 87.0 101.3 -76.3 -24.0 62.1 3.4 82.7 7 50 A A < + 0 0 70 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.708 48.4 117.8 -29.0 -47.5 61.3 0.3 84.8 8 51 A P + 0 0 97 0, 0.0 2,-0.2 0, 0.0 -3,-0.0 0.018 34.4 114.9 -34.7 126.1 65.0 -0.3 85.8 9 52 A S + 0 0 84 10,-0.0 2,-0.2 0, 0.0 -3,-0.0 -0.655 22.5 157.5 167.4 135.5 65.6 -0.0 89.6 10 53 A L + 0 0 161 -2,-0.2 2,-0.3 2,-0.0 8,-0.1 -0.769 14.6 126.4-174.3 124.6 66.6 -2.4 92.4 11 54 A Q - 0 0 120 -2,-0.2 6,-0.1 6,-0.1 0, 0.0 -0.925 24.7-161.0-176.0 153.6 68.2 -1.9 95.9 12 55 A H - 0 0 110 -2,-0.3 2,-0.9 4,-0.1 4,-0.3 -0.996 43.5 -80.8-146.6 149.3 67.7 -2.8 99.6 13 56 A P S S+ 0 0 141 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.269 89.2 92.7 -52.1 94.1 68.9 -1.6 103.0 14 57 A T S S- 0 0 58 -2,-0.9 3,-0.1 3,-0.1 -2,-0.1 -0.973 87.3 -96.0-170.5 174.4 72.4 -3.3 103.2 15 58 A F S S+ 0 0 89 -2,-0.3 2,-0.2 1,-0.2 105,-0.2 0.035 104.0 74.2 -93.8 28.2 76.1 -2.9 102.5 16 59 A I + 0 0 115 -4,-0.3 2,-0.2 103,-0.0 -1,-0.2 -0.646 69.6 88.5-141.9 80.9 75.7 -4.7 99.1 17 60 A A + 0 0 29 -2,-0.2 2,-0.2 -3,-0.1 104,-0.1 -0.835 30.2 154.3-175.4 135.3 74.1 -2.6 96.3 18 61 A S - 0 0 70 -2,-0.2 -7,-0.0 -8,-0.1 0, 0.0 -0.855 12.7-169.9-169.0 130.0 75.0 -0.1 93.6 19 62 A K - 0 0 129 -2,-0.2 2,-0.3 0, 0.0 -2,-0.0 0.366 22.2-121.6 -93.6-135.1 73.6 1.1 90.2 20 63 A K - 0 0 126 142,-0.0 2,-0.6 3,-0.0 3,-0.0 -0.905 13.8-110.5-175.5 149.1 75.1 3.3 87.5 21 64 A a S S- 0 0 25 -2,-0.3 42,-0.2 1,-0.0 41,-0.1 -0.794 78.6 -21.6 -95.5 120.6 74.5 6.5 85.6 22 65 A R S S- 0 0 162 -2,-0.6 3,-0.3 40,-0.1 2,-0.1 0.476 71.1-112.3 61.8 147.7 73.6 6.3 81.9 23 66 A A S S+ 0 0 61 1,-0.2 3,-0.1 -3,-0.0 -2,-0.0 -0.311 96.3 53.8 -97.8-173.0 74.4 3.3 79.7 24 67 A G S S+ 0 0 34 1,-0.3 141,-1.2 -2,-0.1 2,-0.3 0.555 92.2 113.4 61.9 0.9 76.9 3.2 76.8 25 68 A Y E -A 164 0A 47 -3,-0.3 2,-0.3 139,-0.2 -1,-0.3 -0.778 50.6-167.0-103.3 149.1 79.2 4.6 79.5 26 69 A T E -A 163 0A 66 137,-2.3 137,-2.4 -2,-0.3 2,-0.2 -0.739 10.9-145.9-123.3 172.7 82.1 2.6 80.9 27 70 A Y - 0 0 148 -2,-0.3 2,-0.3 135,-0.2 135,-0.2 -0.723 4.8-143.7-132.3-173.8 84.0 3.4 84.0 28 71 A T - 0 0 37 -2,-0.2 133,-1.5 133,-0.1 2,-0.2 -0.958 13.3-145.5-155.2 132.1 87.5 3.2 85.5 29 72 A S - 0 0 46 -2,-0.3 2,-0.3 131,-0.2 131,-0.2 -0.538 8.2-154.6 -99.1 168.7 88.6 2.5 89.0 30 73 A L - 0 0 25 -2,-0.2 129,-1.2 129,-0.1 2,-0.4 -0.987 10.1-133.7-140.9 149.6 91.5 3.8 91.0 31 74 A D E +B 158 0A 81 -2,-0.3 2,-0.2 127,-0.2 127,-0.2 -0.859 21.6 177.0-108.1 138.7 93.6 2.5 93.9 32 75 A V E -B 157 0A 13 125,-1.6 125,-1.2 -2,-0.4 126,-0.0 -0.608 12.3-177.2-146.1 87.2 94.5 4.6 96.9 33 76 A R - 0 0 124 -2,-0.2 123,-0.2 123,-0.2 120,-0.1 -0.631 31.5-140.6 -74.9 135.8 96.4 3.3 99.9 34 77 A P - 0 0 14 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.194 16.4 -98.2 -78.5-153.7 96.4 6.3 102.3 35 78 A T - 0 0 73 116,-0.1 2,-5.0 3,-0.1 115,-0.1 -0.916 38.3 -95.6-129.0 154.9 99.2 7.5 104.5 36 79 A R - 0 0 115 -2,-0.3 2,-0.4 115,-0.2 115,-0.2 -0.261 63.9-179.2 -66.2 60.6 99.9 6.9 108.1 37 80 A T - 0 0 19 -2,-5.0 113,-0.6 1,-0.1 6,-0.1 -0.547 24.2-110.7 -74.9 127.0 98.2 10.3 108.5 38 81 A E - 0 0 102 -2,-0.4 112,-0.4 111,-0.2 107,-0.4 0.378 36.8 -80.3 -43.9 175.8 97.9 11.4 112.1 39 82 A K S S+ 0 0 103 1,-0.2 107,-0.2 110,-0.2 -1,-0.1 -0.625 122.7 11.4 -80.7 144.4 94.9 11.8 114.3 40 83 A D S S+ 0 0 63 105,-4.0 2,-0.3 -2,-0.3 -1,-0.2 0.214 108.8 117.1 69.6 -20.4 93.1 15.0 113.5 41 84 A K - 0 0 67 104,-0.2 104,-1.7 103,-0.1 2,-0.3 -0.620 59.2-142.2 -83.6 138.2 95.4 15.1 110.5 42 85 A S E -F 144 0B 6 49,-0.4 2,-0.4 -2,-0.3 102,-0.3 -0.729 9.0-157.5-100.0 146.7 93.8 14.9 107.1 43 86 A F E +F 143 0B 33 100,-1.9 100,-1.4 -2,-0.3 2,-0.3 -0.941 14.7 177.2-121.2 146.0 95.1 13.0 104.1 44 87 A G E -F 142 0B 35 -2,-0.4 2,-0.4 98,-0.2 98,-0.2 -0.993 15.0-162.3-149.2 155.9 94.2 13.7 100.5 45 88 A Q E -F 141 0B 65 96,-2.2 96,-1.6 -2,-0.3 -2,-0.0 -0.999 21.7-124.5-141.0 134.9 95.0 12.6 97.0 46 89 A R E -F 140 0B 74 -2,-0.4 2,-1.5 94,-0.2 94,-0.3 -0.278 40.3 -91.9 -73.2 164.3 94.4 14.3 93.6 47 90 A L - 0 0 24 92,-1.5 2,-1.6 90,-0.6 -1,-0.1 -0.606 43.8-171.5 -79.1 90.4 92.5 12.7 90.8 48 91 A I - 0 0 91 -2,-1.5 -1,-0.1 88,-0.1 6,-0.1 -0.582 11.9-152.6 -87.5 81.0 95.3 11.0 88.9 49 92 A I - 0 0 47 -2,-1.6 -19,-0.0 84,-0.2 -2,-0.0 -0.236 25.8-107.5 -52.1 136.1 93.5 9.8 85.8 50 93 A P >> - 0 0 41 0, 0.0 4,-3.2 0, 0.0 3,-0.8 -0.203 29.3 -95.6 -70.6 162.4 95.3 6.8 84.4 51 94 A V T 34 S+ 0 0 122 1,-0.2 4,-0.1 2,-0.2 -2,-0.1 0.677 114.4 44.0 -47.0 -39.1 97.4 6.5 81.3 52 95 A P T 34 S+ 0 0 88 0, 0.0 -1,-0.2 0, 0.0 3,-0.2 0.798 123.2 34.0 -87.1 -21.7 95.0 5.3 78.6 53 96 A V T X4 S+ 0 0 13 -3,-0.8 3,-2.1 1,-0.2 -2,-0.2 0.882 96.5 79.4 -91.8 -47.9 92.1 7.6 79.5 54 97 A S T 3< S+ 0 0 28 -4,-3.2 -1,-0.2 1,-0.3 -3,-0.1 0.548 82.4 77.2 -40.0 -4.4 94.0 10.6 80.6 55 98 A E T 3 S+ 0 0 63 1,-0.2 -1,-0.3 -5,-0.2 -2,-0.1 0.350 87.9 50.5 -94.2 6.9 94.4 11.2 76.8 56 99 A Y X + 0 0 50 -3,-2.1 3,-3.8 1,-0.1 77,-0.5 -0.386 58.4 167.3-138.5 57.0 90.9 12.5 76.1 57 100 A P T 3 S+ 0 0 9 0, 0.0 77,-1.5 0, 0.0 78,-0.6 0.608 75.7 66.8 -48.1 -10.7 90.5 15.3 78.7 58 101 A K T 3 S+ 0 0 33 439,-0.5 2,-0.1 74,-0.2 440,-0.1 0.497 75.2 106.6 -92.6 -5.1 87.5 16.3 76.6 59 102 A K S < S- 0 0 29 -3,-3.8 74,-2.3 -6,-0.2 2,-0.2 -0.446 72.5-113.3 -74.9 147.7 85.5 13.1 77.4 60 103 A K E -C 132 0A 46 72,-0.2 104,-1.9 -2,-0.1 2,-0.4 -0.590 19.2-150.5 -90.6 146.7 82.6 13.6 79.8 61 104 A V E -CD 131 163A 2 70,-3.5 70,-0.7 -2,-0.2 102,-0.3 -0.917 11.7-178.5-113.4 135.7 82.1 12.2 83.3 62 105 A S E - 0 0 2 100,-1.9 64,-4.3 -2,-0.4 65,-0.8 0.895 64.7 -12.5 -93.5 -70.7 78.7 11.3 84.8 63 106 A a E -E 125 0A 18 62,-0.3 99,-0.8 63,-0.2 -1,-0.3 -0.657 49.3-151.4-123.8-177.3 79.3 10.1 88.3 64 107 A V E -ED 124 161A 10 60,-1.3 60,-1.1 -2,-0.2 97,-0.2 -0.711 14.6-166.4-162.5 99.8 82.2 9.0 90.5 65 108 A Q E -ED 123 160A 32 95,-1.0 95,-1.3 58,-0.3 2,-0.3 -0.482 7.1-153.6 -87.2 160.7 81.6 6.5 93.3 66 109 A V E + D 0 159A 14 56,-2.9 2,-0.3 93,-0.2 93,-0.2 -0.798 13.7 179.4-139.3 94.3 84.1 5.8 96.0 67 110 A R E - D 0 158A 54 91,-1.4 91,-2.2 -2,-0.3 2,-0.4 -0.649 12.2-157.4 -89.4 151.5 83.9 2.4 97.5 68 111 A L E - D 0 157A 4 -2,-0.3 89,-0.2 89,-0.2 -2,-0.0 -0.889 8.1-161.5-137.6 109.7 86.5 1.7 100.3 69 112 A N E - D 0 156A 67 87,-1.3 87,-2.0 -2,-0.4 2,-0.2 -0.790 21.5-155.9 -88.5 116.7 87.5 -1.8 101.2 70 113 A P E - D 0 155A 42 0, 0.0 85,-0.3 0, 0.0 84,-0.1 -0.508 14.6-113.4 -89.8 163.5 89.1 -1.5 104.7 71 114 A S > - 0 0 29 83,-1.3 3,-1.4 -2,-0.2 82,-0.0 -0.580 29.2-111.5 -90.5 158.9 91.6 -3.9 106.2 72 115 A P T 3 S+ 0 0 139 0, 0.0 -1,-0.1 0, 0.0 82,-0.1 0.730 121.0 59.3 -61.8 -20.0 90.7 -6.0 109.3 73 116 A K T 3 S+ 0 0 97 80,-0.3 81,-0.1 2,-0.0 82,-0.1 0.734 74.0 118.9 -79.2 -25.8 93.2 -3.8 111.1 74 117 A F < + 0 0 5 -3,-1.4 81,-0.1 80,-0.2 76,-0.0 -0.184 27.5 148.5 -44.3 124.1 91.2 -0.7 110.2 75 118 A N + 0 0 68 2,-0.0 36,-0.6 73,-0.0 -1,-0.2 0.627 33.3 90.9-128.6 -48.0 90.3 0.7 113.6 76 119 A S - 0 0 2 34,-0.1 2,-0.4 71,-0.1 35,-0.4 0.176 69.9-125.3 -48.7 170.3 90.1 4.5 113.5 77 120 A T + 0 0 15 71,-0.2 70,-1.2 33,-0.2 69,-0.9 -0.986 36.9 179.3-122.9 133.4 87.0 6.4 112.7 78 121 A I E -GH 109 145B 9 31,-1.6 31,-2.9 -2,-0.4 2,-0.4 -0.972 28.9-136.7-143.6 155.8 87.2 8.9 109.8 79 122 A W E +GH 108 144B 94 65,-2.0 65,-2.8 -2,-0.3 2,-0.3 -0.832 31.0 178.0-105.7 146.9 85.4 11.4 107.7 80 123 A V E +GH 107 143B 14 27,-3.1 27,-2.8 -2,-0.4 2,-0.2 -0.998 15.1 124.1-154.2 147.9 85.9 11.5 104.0 81 124 A S E - H 0 142B 6 61,-1.1 61,-2.7 -2,-0.3 2,-0.2 -0.800 32.4-131.3-167.4-152.3 84.8 13.3 100.8 82 125 A L E + H 0 141B 29 59,-0.3 2,-0.3 -2,-0.2 59,-0.2 -0.875 19.3 165.2 178.6 150.2 86.2 15.2 97.8 83 126 A R E - H 0 140B 52 57,-1.5 57,-1.2 -2,-0.2 -2,-0.0 -0.904 38.2 -84.4-156.8-178.3 85.8 18.3 95.7 84 127 A R + 0 0 65 -2,-0.3 2,-0.3 55,-0.3 55,-0.2 -0.139 54.8 128.6 -84.5-171.5 87.5 20.5 93.1 85 128 A L - 0 0 55 54,-0.1 2,-0.5 -2,-0.0 3,-0.0 -0.916 53.6 -71.4 152.8-176.1 90.1 23.2 93.8 86 129 A D > - 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