==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 11-NOV-09 3KMT . COMPND 2 MOLECULE: A612L PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PARAMECIUM BURSARIA CHLORELLA VIRUS 1; . AUTHOR H.WEI,M.M.ZHOU . 384 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18066.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 236 61.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 28.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.6 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 . 22 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 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 RESIDUES PER ALPHA HELIX . 5 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 0 PARALLEL BRIDGES PER LADDER . 7 3 3 0 12 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 . 3 1 8 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 1 A M 0 0 30 0, 0.0 7,-2.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 116.8 26.7 1.2 26.3 2 2 A F B -A 7 0A 125 150,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.978 360.0-165.8-164.6 173.1 24.3 3.9 27.4 3 3 A N - 0 0 10 3,-2.3 120,-0.1 -2,-0.3 0, 0.0 -0.715 56.4 -71.7-147.5-163.1 23.6 7.4 28.7 4 4 A D S S+ 0 0 98 -2,-0.2 3,-0.1 1,-0.1 119,-0.1 0.790 129.0 37.7 -72.9 -26.2 20.6 9.2 30.2 5 5 A R S S+ 0 0 43 1,-0.1 16,-3.3 16,-0.1 17,-1.0 0.836 120.7 16.0 -93.3 -40.3 18.7 9.3 26.9 6 6 A V E - B 0 20A 0 14,-0.3 -3,-2.3 15,-0.2 2,-0.3 -0.863 51.5-154.7-136.6 168.6 19.4 6.0 25.2 7 7 A I E -AB 2 19A 52 12,-2.2 12,-3.4 -2,-0.3 2,-0.5 -0.985 18.8-131.4-140.6 148.7 20.8 2.4 25.5 8 8 A V E + B 0 18A 19 -7,-2.5 2,-0.3 -2,-0.3 10,-0.2 -0.891 44.2 138.6-103.5 128.1 22.4 0.0 23.1 9 9 A K E - B 0 17A 91 8,-1.8 8,-2.4 -2,-0.5 -2,-0.0 -0.952 57.3 -51.5-156.9 172.5 21.1 -3.5 23.0 10 10 A K E - B 0 16A 69 -2,-0.3 6,-0.3 6,-0.2 5,-0.1 -0.240 54.2-152.3 -53.6 133.5 20.1 -6.3 20.7 11 11 A S > - 0 0 13 4,-3.1 3,-0.8 1,-0.1 -1,-0.1 -0.879 20.9-138.2-113.4 143.6 17.7 -5.2 17.9 12 12 A P T 3 S+ 0 0 93 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.717 106.1 62.6 -68.6 -19.6 15.0 -7.3 16.1 13 13 A L T 3 S- 0 0 29 1,-0.2 106,-0.2 2,-0.1 2,-0.1 0.787 127.0 -61.1 -75.5 -28.2 16.2 -5.5 12.9 14 14 A G S < S- 0 0 26 -3,-0.8 -1,-0.2 1,-0.3 -3,-0.0 -0.410 87.7 -21.7 146.9 135.8 19.6 -6.9 13.2 15 15 A G S S- 0 0 53 373,-0.2 -4,-3.1 -2,-0.1 -1,-0.3 -0.142 110.4 -9.2 48.9-131.9 22.6 -6.9 15.6 16 16 A Y E +B 10 0A 115 -6,-0.3 2,-0.3 -3,-0.1 -6,-0.2 -0.676 65.6 178.7 -97.3 153.0 22.7 -4.0 18.0 17 17 A G E -B 9 0A 0 -8,-2.4 -8,-1.8 -2,-0.3 2,-0.5 -0.902 31.8-103.3-144.5 170.7 20.4 -0.9 17.8 18 18 A V E -BC 8 101A 0 83,-0.5 83,-3.3 -2,-0.3 2,-0.3 -0.896 37.8-168.3-104.5 128.0 19.8 2.2 19.8 19 19 A F E -BC 7 100A 12 -12,-3.4 -12,-2.2 -2,-0.5 2,-0.3 -0.850 25.8-104.9-118.3 151.1 16.8 2.3 22.1 20 20 A A E -B 6 0A 2 79,-2.5 78,-2.8 -2,-0.3 -14,-0.3 -0.540 23.6-175.5 -74.3 129.0 15.0 5.1 24.1 21 21 A R S S+ 0 0 110 -16,-3.3 2,-0.3 -2,-0.3 -15,-0.2 0.670 78.2 20.3 -92.3 -23.3 15.7 5.1 27.8 22 22 A K S S- 0 0 66 -17,-1.0 2,-0.1 74,-0.1 76,-0.1 -0.848 98.3 -83.5-136.2 170.7 13.2 8.0 28.3 23 23 A S - 0 0 67 -2,-0.3 2,-0.4 74,-0.1 73,-0.2 -0.486 41.7-150.0 -78.3 151.1 10.3 9.4 26.3 24 24 A F B -D 95 0B 2 71,-2.8 71,-1.7 -2,-0.1 2,-0.1 -0.956 5.5-135.1-124.4 143.0 11.1 11.9 23.6 25 25 A E > - 0 0 132 -2,-0.4 3,-1.7 69,-0.2 68,-0.2 -0.460 45.0 -79.4 -87.8 165.2 9.0 14.8 22.2 26 26 A K T 3 S+ 0 0 161 1,-0.3 66,-0.2 -2,-0.1 -1,-0.1 -0.487 118.9 13.0 -66.5 131.5 8.7 15.4 18.5 27 27 A G T 3 S+ 0 0 45 64,-0.4 -1,-0.3 1,-0.3 2,-0.1 0.460 91.3 147.0 82.7 1.6 11.7 17.2 17.2 28 28 A E < - 0 0 60 -3,-1.7 63,-2.4 65,-0.1 2,-0.4 -0.427 55.7-107.7 -73.4 145.6 13.8 16.5 20.3 29 29 A L E +E 90 0C 66 61,-0.2 61,-0.2 1,-0.2 3,-0.1 -0.587 35.9 178.3 -74.4 125.7 17.6 16.0 19.9 30 30 A V E - 0 0 0 59,-3.4 2,-0.3 -2,-0.4 60,-0.2 0.853 63.4 -4.7 -93.7 -44.5 18.5 12.4 20.5 31 31 A E E -E 89 0C 11 58,-1.4 58,-2.8 -26,-0.1 2,-0.4 -0.991 48.4-167.6-156.2 142.0 22.2 12.4 19.9 32 32 A E E +E 88 0C 80 -2,-0.3 2,-0.3 56,-0.2 90,-0.2 -0.991 25.1 168.1-131.0 121.5 25.0 14.8 18.8 33 33 A C E -E 87 0C 1 54,-2.4 54,-2.7 -2,-0.4 2,-0.2 -0.958 33.5-115.5-137.7 155.4 28.3 13.2 18.0 34 34 A L E -E 86 0C 32 -2,-0.3 28,-2.7 52,-0.2 2,-0.3 -0.501 30.4-150.0 -82.3 156.5 31.7 14.1 16.4 35 35 A C E -H 61 0D 14 50,-2.3 2,-0.6 26,-0.2 26,-0.2 -0.962 13.0-131.1-130.1 147.1 32.7 12.4 13.2 36 36 A I E -H 60 0D 9 24,-2.1 24,-2.3 -2,-0.3 2,-0.4 -0.879 33.0-158.9 -96.2 123.5 36.1 11.5 11.7 37 37 A V E +H 59 0D 34 -2,-0.6 2,-0.3 22,-0.2 22,-0.2 -0.908 23.5 146.5-114.8 132.7 36.2 12.7 8.1 38 38 A R E -H 58 0D 92 20,-2.1 20,-2.7 -2,-0.4 5,-0.1 -0.965 54.8 -70.0-152.0 162.7 38.4 11.6 5.2 39 39 A H E > -H 57 0D 67 -2,-0.3 3,-2.1 18,-0.2 18,-0.3 -0.232 52.3-110.4 -55.2 145.7 38.2 11.1 1.4 40 40 A N G > S+ 0 0 31 16,-2.7 3,-0.9 1,-0.3 -1,-0.1 0.813 113.8 55.5 -46.9 -42.0 36.0 8.2 0.4 41 41 A D G 3 S+ 0 0 134 15,-0.3 3,-0.4 1,-0.2 -1,-0.3 0.457 92.0 70.7 -78.4 1.2 38.9 6.1 -0.8 42 42 A D G < S+ 0 0 63 -3,-2.1 124,-2.4 1,-0.2 123,-2.3 0.450 78.9 79.6 -97.0 3.3 40.9 6.2 2.4 43 43 A W S <> S- 0 0 6 -3,-0.9 4,-0.6 1,-0.2 3,-0.3 0.435 75.8-150.2 -92.7 0.9 38.7 3.9 4.5 44 44 A G T 4 - 0 0 31 -3,-0.4 -1,-0.2 1,-0.2 119,-0.2 -0.369 46.3 -68.5 65.1-148.2 39.5 0.4 3.4 45 45 A T T >4 S+ 0 0 90 117,-1.9 3,-1.5 2,-0.1 4,-0.3 0.548 108.1 93.2-117.3 -15.8 36.7 -2.1 3.6 46 46 A A T 34 S+ 0 0 4 116,-2.6 3,-0.3 -3,-0.3 117,-0.1 0.823 97.0 29.6 -48.5 -44.3 36.2 -2.4 7.4 47 47 A L T >X S+ 0 0 1 -4,-0.6 4,-2.1 115,-0.2 3,-1.8 0.112 77.2 123.6-109.4 21.8 33.5 0.3 7.8 48 48 A E T <4 S+ 0 0 61 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.1 0.822 81.0 44.4 -50.5 -36.7 31.8 0.1 4.4 49 49 A D T 34 S+ 0 0 61 -4,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.534 116.8 45.8 -88.1 -6.0 28.4 -0.5 6.1 50 50 A Y T <4 S+ 0 0 30 -3,-1.8 11,-0.3 2,-0.1 -2,-0.2 0.759 85.7 101.7-104.9 -34.5 28.8 2.2 8.8 51 51 A L < - 0 0 1 -4,-2.1 312,-2.2 9,-0.1 2,-0.4 -0.131 55.9-144.4 -61.8 149.0 30.1 5.3 7.0 52 52 A F E -Ij 59 363D 0 7,-2.5 7,-3.3 310,-0.2 2,-0.4 -0.861 24.2-164.2-107.6 144.5 28.1 8.4 6.0 53 53 A S E +I 58 0D 26 310,-2.6 2,-0.4 -2,-0.4 312,-0.2 -0.988 23.7 179.6-141.0 146.7 29.1 10.1 2.8 54 54 A R E > -I 57 0D 65 3,-2.5 3,-2.1 -2,-0.4 2,-0.1 -0.952 69.9 -46.8-141.8 116.3 28.6 13.4 0.9 55 55 A K T 3 S- 0 0 185 -2,-0.4 -15,-0.0 1,-0.3 -1,-0.0 -0.352 125.6 -13.4 58.6-127.7 30.3 13.8 -2.5 56 56 A N T 3 S+ 0 0 83 -3,-0.1 -16,-2.7 -2,-0.1 2,-0.4 0.327 121.7 86.1 -88.6 9.2 33.9 12.6 -2.2 57 57 A M E < -HI 39 54D 59 -3,-2.1 -3,-2.5 -18,-0.3 2,-0.3 -0.888 53.1-167.6-117.3 143.8 34.0 12.5 1.6 58 58 A S E -HI 38 53D 0 -20,-2.7 -20,-2.1 -2,-0.4 2,-0.4 -0.925 7.1-159.5-123.7 149.9 33.0 9.9 4.1 59 59 A A E -HI 37 52D 0 -7,-3.3 -7,-2.5 -2,-0.3 2,-0.6 -0.990 11.4-149.6-134.6 138.8 32.5 10.2 7.9 60 60 A M E -H 36 0D 0 -24,-2.3 -24,-2.1 -2,-0.4 2,-0.2 -0.930 24.2-139.7-106.8 114.4 32.6 7.8 10.7 61 61 A A E > -H 35 0D 0 -2,-0.6 5,-0.5 -11,-0.3 -26,-0.2 -0.531 14.3-158.3 -76.2 135.3 30.3 8.9 13.5 62 62 A L T > 5 + 0 0 8 -28,-2.7 3,-1.5 -2,-0.2 4,-0.2 -0.132 63.6 39.8 -94.1-163.0 31.5 8.4 17.1 63 63 A G B 3 5S-K 183 0E 3 120,-2.5 120,-2.3 1,-0.2 3,-0.2 -0.379 133.0 -36.5 58.7-136.5 29.3 8.3 20.1 64 64 A F T >>5S+ 0 0 14 118,-0.2 3,-2.1 1,-0.2 4,-0.8 0.460 111.5 106.0 -97.6 -3.9 26.1 6.3 19.2 65 65 A G T <45S+ 0 0 0 -3,-1.5 3,-0.5 1,-0.3 -1,-0.2 0.788 78.2 45.9 -45.1 -44.5 25.9 7.6 15.7 66 66 A A T 34 - 0 0 28 5,-2.2 3,-2.5 -2,-0.4 -1,-0.0 -0.028 50.3 -64.9 -69.1 175.3 27.2 19.8 9.3 82 82 A A G > S+ 0 0 89 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 -0.392 131.0 22.7 -60.6 139.5 29.4 21.3 6.6 83 83 A G G 3 S- 0 0 56 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.443 117.1-100.4 80.7 -2.9 32.6 19.2 6.4 84 84 A L G < S+ 0 0 4 -3,-2.5 -1,-0.2 2,-0.1 -2,-0.2 0.699 81.9 140.8 59.7 21.5 30.7 16.3 8.0 85 85 A K < + 0 0 53 -3,-0.9 -50,-2.3 1,-0.1 2,-0.3 0.803 63.9 23.7 -64.8 -34.2 32.3 17.2 11.3 86 86 A R E -E 34 0C 16 -52,-0.2 -5,-2.2 -4,-0.1 2,-0.4 -0.981 64.5-155.5-136.4 148.2 29.3 16.6 13.5 87 87 A M E -EF 33 80C 0 -54,-2.7 -54,-2.4 -2,-0.3 2,-0.4 -0.958 6.7-164.4-123.3 142.7 26.1 14.6 13.2 88 88 A R E -EF 32 79C 66 -9,-2.5 -9,-1.8 -2,-0.4 2,-0.5 -0.981 6.7-156.2-126.7 138.8 22.8 15.2 15.0 89 89 A I E -EF 31 78C 0 -58,-2.8 -59,-3.4 -2,-0.4 -58,-1.4 -0.974 17.3-178.9-114.8 120.3 19.9 12.8 15.4 90 90 A F E -EF 29 77C 38 -13,-2.3 -13,-2.9 -2,-0.5 -61,-0.2 -0.925 27.1-119.6-118.1 143.8 16.5 14.4 15.9 91 91 A T E - F 0 76C 2 -63,-2.4 -64,-0.4 -2,-0.4 -15,-0.3 -0.464 12.7-160.9 -76.7 156.5 13.2 12.6 16.4 92 92 A I S S+ 0 0 65 -17,-2.2 -16,-0.2 1,-0.2 -66,-0.1 0.230 77.6 12.3-118.1 8.3 10.5 13.3 13.9 93 93 A K S S- 0 0 67 -18,-0.7 -1,-0.2 -68,-0.2 -66,-0.2 -0.955 102.3 -64.5-170.6 165.3 7.7 12.1 16.2 94 94 A P - 0 0 90 0, 0.0 2,-0.4 0, 0.0 -69,-0.2 -0.382 47.3-158.3 -64.0 141.2 7.2 11.2 19.8 95 95 A I B -D 24 0B 4 -71,-1.7 -71,-2.8 -2,-0.0 2,-0.1 -0.990 5.1-144.7-125.5 127.8 9.2 8.1 21.0 96 96 A A > - 0 0 53 -2,-0.4 3,-1.9 -73,-0.2 -76,-0.3 -0.459 35.8 -80.5 -87.9 160.8 8.3 6.0 24.0 97 97 A I T 3 S+ 0 0 119 1,-0.3 -76,-0.2 -2,-0.1 -1,-0.1 -0.321 117.3 21.6 -58.9 136.9 10.6 4.3 26.5 98 98 A G T 3 S+ 0 0 49 -78,-2.8 2,-0.3 1,-0.3 -1,-0.3 0.328 91.7 128.0 87.5 -8.2 11.9 1.0 25.1 99 99 A E < - 0 0 75 -3,-1.9 -79,-2.5 -79,-0.1 -1,-0.3 -0.605 63.6-115.4 -82.8 140.3 11.2 1.9 21.5 100 100 A E E -C 19 0A 24 -2,-0.3 2,-0.6 -81,-0.2 -81,-0.3 -0.538 23.6-134.2 -76.2 141.8 14.1 1.5 19.0 101 101 A I E -C 18 0A 0 -83,-3.3 -32,-0.6 -2,-0.2 -83,-0.5 -0.870 31.0-180.0 -99.4 120.8 15.3 4.8 17.4 102 102 A T E -l 69 0F 8 -2,-0.6 -26,-1.3 -34,-0.1 -27,-0.6 -0.869 13.3-170.1-123.9 155.2 15.8 4.5 13.7 103 103 A I E -l 70 0F 0 -34,-2.1 -32,-1.8 -2,-0.3 2,-0.6 -0.643 32.7 -97.2-127.0-175.9 16.9 6.8 10.8 104 104 A S - 0 0 51 -34,-0.2 -26,-0.2 -2,-0.2 260,-0.1 -0.943 21.1-168.9-114.2 117.1 17.0 6.5 7.0 105 105 A Y - 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0 0 103 -2,-0.4 2,-0.4 2,-0.0 -2,-0.1 -0.794 13.0-138.6 -95.6 129.0 17.4 -8.2 3.5 118 118 A Q 0 0 86 -2,-0.5 -47,-0.0 1,-0.1 -105,-0.0 -0.703 360.0 360.0 -87.6 126.9 15.9 -5.1 5.0 119 119 A N 0 0 69 -2,-0.4 -1,-0.1 -106,-0.2 131,-0.1 0.665 360.0 360.0-102.6 360.0 13.7 -5.4 8.1 120 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 121 1 B M 0 0 27 0, 0.0 7,-2.9 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 125.5 29.3 15.1 23.2 122 2 B F B +M 127 0G 110 5,-0.2 5,-0.2 -90,-0.2 2,-0.2 -0.989 360.0 178.0-169.5 163.7 28.5 14.4 26.8 123 3 B N - 0 0 13 3,-2.4 -120,-0.1 -2,-0.3 18,-0.0 -0.774 60.3 -65.0-151.4-166.1 26.8 12.2 29.4 124 4 B D S S+ 0 0 57 -2,-0.2 3,-0.1 1,-0.2 -121,-0.1 0.753 131.5 32.4 -65.4 -22.3 26.5 12.1 33.2 125 5 B R S S+ 0 0 95 1,-0.2 16,-3.3 16,-0.1 17,-1.2 0.854 120.4 17.3-102.9 -45.4 30.3 11.3 33.5 126 6 B V E - N 0 140G 0 14,-0.3 -3,-2.4 15,-0.2 2,-0.3 -0.821 49.2-162.3-130.9 170.3 32.2 12.9 30.7 127 7 B I E -MN 122 139G 23 12,-2.3 12,-3.0 -2,-0.3 2,-0.4 -0.987 20.5-127.4-150.7 141.5 32.1 15.7 28.1 128 8 B V E + N 0 138G 21 -7,-2.9 2,-0.3 -2,-0.3 10,-0.2 -0.756 41.0 140.2 -96.0 138.0 34.2 16.4 24.9 129 9 B K E - 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