==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 08-FEB-06 2FYQ . COMPND 2 MOLECULE: CHYMOTRYPSIN-LIKE CYSTEINE PROTEINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NORWALK VIRUS; . AUTHOR C.E.ZEITLER,M.K.ESTES,B.V.VENKATARAM PRASAD . 170 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8713.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 67 39.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 3.5 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 . 20 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 2.4 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 1 2 2 2 1 0 1 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 0 1 0 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 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 A 0 0 59 0, 0.0 135,-0.0 0, 0.0 140,-0.0 0.000 360.0 360.0 360.0 129.9 -35.3 84.5 0.9 2 2 A P >> - 0 0 58 0, 0.0 4,-2.0 0, 0.0 3,-0.7 -0.348 360.0-103.1 -77.1 161.8 -34.4 86.0 4.4 3 3 A P H 3> S+ 0 0 111 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.867 119.7 55.3 -49.7 -42.9 -30.8 86.1 5.8 4 4 A T H 3> S+ 0 0 85 1,-0.2 4,-0.6 2,-0.2 64,-0.0 0.882 106.7 50.8 -62.4 -37.2 -31.5 83.1 8.2 5 5 A L H X4 S+ 0 0 7 -3,-0.7 3,-1.4 1,-0.2 4,-0.5 0.945 110.5 48.4 -64.6 -48.6 -32.5 81.0 5.3 6 6 A W H >< S+ 0 0 25 -4,-2.0 3,-1.6 1,-0.2 -1,-0.2 0.840 101.4 66.4 -55.4 -34.6 -29.4 81.9 3.4 7 7 A S H 3< S+ 0 0 42 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.688 91.7 62.5 -65.0 -17.9 -27.4 81.1 6.5 8 8 A R T << S+ 0 0 9 -3,-1.4 11,-1.8 -4,-0.6 2,-0.4 0.715 81.1 93.9 -75.4 -24.6 -28.4 77.4 6.1 9 9 A V E < -A 18 0A 3 -3,-1.6 2,-0.4 -4,-0.5 9,-0.2 -0.639 64.0-174.2 -76.1 125.5 -26.5 77.3 2.7 10 10 A T E -A 17 0A 26 7,-2.8 7,-2.3 -2,-0.4 2,-0.1 -0.966 31.0-112.1-136.2 130.6 -23.1 76.0 3.6 11 11 A K E +A 16 0A 87 -2,-0.4 2,-0.3 5,-0.2 5,-0.3 -0.407 46.9 168.6 -59.3 132.7 -19.8 75.4 1.7 12 12 A F E > -A 15 0A 12 3,-2.3 3,-2.5 1,-0.1 -2,-0.0 -0.918 48.0 -45.9-155.7 123.0 -19.3 71.6 1.5 13 13 A G T 3 S- 0 0 38 -2,-0.3 19,-0.2 1,-0.3 -1,-0.1 -0.274 121.1 -20.4 55.8-133.0 -16.9 69.5 -0.5 14 14 A S T 3 S+ 0 0 75 17,-1.8 -1,-0.3 2,-0.1 115,-0.2 0.241 140.9 8.5 -90.8 14.1 -16.7 70.7 -4.1 15 15 A G E < S-A 12 0A 0 -3,-2.5 -3,-2.3 16,-0.3 2,-0.3 -0.360 92.2 -69.4-153.0-127.8 -20.1 72.4 -3.7 16 16 A W E -A 11 0A 16 113,-1.9 12,-0.7 -5,-0.3 2,-0.3 -0.897 27.3-164.8-143.2 165.5 -22.7 73.3 -1.1 17 17 A G E -AB 10 27A 0 -7,-2.3 -7,-2.8 -2,-0.3 2,-0.4 -0.838 17.2-123.8-144.8-172.9 -25.2 71.8 1.3 18 18 A F E -AB 9 26A 0 8,-2.4 8,-2.4 -2,-0.3 2,-0.9 -0.988 10.6-132.1-146.3 124.5 -28.1 73.0 3.4 19 19 A W E + B 0 25A 10 -11,-1.8 6,-0.2 -2,-0.4 -11,-0.0 -0.694 21.9 177.6 -76.5 107.5 -29.0 72.7 7.1 20 20 A V S S- 0 0 10 4,-2.1 51,-1.7 -2,-0.9 -1,-0.2 0.792 73.0 -16.2 -74.9 -30.6 -32.6 71.5 7.2 21 21 A S S S- 0 0 18 3,-1.4 49,-0.1 49,-0.2 -1,-0.1 -0.876 91.3 -71.2-156.0-177.9 -32.5 71.5 11.1 22 22 A P S S+ 0 0 19 0, 0.0 42,-2.3 0, 0.0 43,-1.8 0.769 133.0 21.7 -55.8 -25.3 -29.9 71.6 13.8 23 23 A T S S+ 0 0 24 40,-0.2 37,-2.8 41,-0.2 2,-0.5 0.514 107.0 83.3-121.0 -9.6 -28.8 68.1 13.0 24 24 A V E + C 0 59A 7 35,-0.2 -4,-2.1 41,-0.1 -3,-1.4 -0.888 47.5 175.8-111.0 125.8 -29.9 67.4 9.4 25 25 A F E -BC 19 58A 0 33,-2.4 33,-3.0 -2,-0.5 2,-0.3 -0.976 9.0-163.9-126.7 133.6 -27.8 68.5 6.4 26 26 A I E +BC 18 57A 0 -8,-2.4 -8,-2.4 -2,-0.4 2,-0.3 -0.914 18.1 151.8-119.6 149.6 -28.6 67.7 2.7 27 27 A T E -BC 17 56A 0 29,-2.5 29,-2.6 -2,-0.3 2,-0.5 -0.941 48.2 -79.0-159.2 177.4 -26.4 68.0 -0.3 28 28 A T E >> - C 0 55A 0 -12,-0.7 3,-2.1 -2,-0.3 4,-0.6 -0.786 37.7-132.3 -92.2 129.3 -25.7 66.6 -3.8 29 29 A T G >4 S+ 0 0 37 25,-1.8 3,-1.5 -2,-0.5 -1,-0.1 0.849 100.8 59.0 -50.9 -43.2 -23.9 63.2 -3.7 30 30 A H G 34 S+ 0 0 96 1,-0.3 -1,-0.3 24,-0.1 -16,-0.1 0.621 103.0 53.1 -69.8 -10.9 -21.3 64.1 -6.3 31 31 A V G <4 S+ 0 0 2 -3,-2.1 -17,-1.8 -15,-0.1 -16,-0.3 0.582 79.4 113.1 -94.6 -11.3 -19.9 67.0 -4.2 32 32 A V S << S- 0 0 27 -3,-1.5 -19,-0.1 -4,-0.6 -20,-0.0 -0.438 77.5-110.3 -64.2 124.3 -19.4 64.9 -1.0 33 33 A P - 0 0 46 0, 0.0 3,-0.4 0, 0.0 2,-0.2 -0.265 30.6-133.6 -61.9 144.0 -15.7 64.7 -0.3 34 34 A T S S+ 0 0 137 1,-0.2 -21,-0.0 -3,-0.1 0, 0.0 -0.592 76.2 20.1 -94.4 152.2 -14.1 61.4 -0.8 35 35 A G S S+ 0 0 82 -2,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.753 86.2 134.0 65.9 29.0 -11.6 59.6 1.5 36 36 A V - 0 0 57 -3,-0.4 -1,-0.2 1,-0.1 3,-0.1 -0.726 48.9-153.5-107.3 160.7 -12.5 61.5 4.7 37 37 A K S S+ 0 0 185 -2,-0.3 7,-1.7 1,-0.1 2,-0.3 0.359 78.1 26.2-112.6 1.3 -13.2 60.2 8.2 38 38 A E E -E 43 0B 110 5,-0.3 2,-0.4 6,-0.1 -1,-0.1 -0.985 58.9-144.6-155.8 157.0 -15.4 63.1 9.3 39 39 A F E > S-E 42 0B 14 3,-2.0 3,-2.5 -2,-0.3 -27,-0.0 -0.999 91.6 -8.0-124.5 133.3 -17.8 65.8 8.2 40 40 A F T 3 S- 0 0 78 -2,-0.4 -1,-0.1 1,-0.3 -28,-0.0 0.815 132.2 -56.4 50.9 33.1 -17.8 69.1 10.0 41 41 A G T 3 S+ 0 0 40 1,-0.2 -1,-0.3 0, 0.0 0, 0.0 0.412 111.8 121.0 84.1 -1.8 -15.5 67.5 12.6 42 42 A E E < -E 39 0B 32 -3,-2.5 -3,-2.0 20,-0.0 -1,-0.2 -0.840 67.5-116.6 -99.2 128.2 -17.9 64.7 13.4 43 43 A P E > -E 38 0B 63 0, 0.0 3,-2.3 0, 0.0 -5,-0.3 -0.278 25.1-118.2 -62.3 146.2 -16.7 61.1 12.8 44 44 A L G > S+ 0 0 61 -7,-1.7 3,-2.0 1,-0.3 -6,-0.1 0.834 112.4 62.1 -55.3 -35.9 -18.6 59.2 10.2 45 45 A S G 3 S+ 0 0 120 1,-0.3 -1,-0.3 -8,-0.2 -7,-0.1 0.655 98.5 57.9 -66.7 -14.6 -19.8 56.6 12.7 46 46 A S G < S+ 0 0 24 -3,-2.3 15,-1.0 2,-0.0 2,-0.4 0.346 99.3 75.3 -93.0 4.6 -21.6 59.4 14.6 47 47 A I E < S-D 60 0A 16 -3,-2.0 2,-0.8 13,-0.2 13,-0.2 -0.938 72.8-139.6-121.1 137.0 -23.7 60.3 11.5 48 48 A A E -D 59 0A 44 11,-2.6 11,-2.2 -2,-0.4 2,-0.6 -0.895 29.0-165.4 -91.4 110.9 -26.6 58.6 9.9 49 49 A I E -D 58 0A 62 -2,-0.8 2,-0.5 9,-0.2 9,-0.2 -0.901 9.7-176.2-107.6 114.9 -25.8 59.0 6.2 50 50 A H E +D 57 0A 121 7,-2.8 7,-2.9 -2,-0.6 2,-0.4 -0.954 6.9 176.6-114.1 119.2 -28.6 58.3 3.7 51 51 A Q E +D 56 0A 103 -2,-0.5 2,-0.4 5,-0.2 5,-0.2 -0.990 11.3 168.7-128.6 131.4 -27.7 58.4 0.1 52 52 A A E > -D 55 0A 44 3,-2.6 3,-2.3 -2,-0.4 -23,-0.1 -0.916 67.2 -53.5-142.7 109.2 -30.0 57.7 -2.9 53 53 A G T 3 S- 0 0 52 -2,-0.4 61,-0.1 1,-0.3 -1,-0.1 -0.388 123.3 -14.6 58.1-128.1 -28.7 58.7 -6.3 54 54 A E T 3 S+ 0 0 26 61,-0.2 -25,-1.8 -25,-0.1 2,-0.6 0.359 117.8 94.7 -87.2 3.2 -27.7 62.3 -6.2 55 55 A F E < +CD 28 52A 10 -3,-2.3 -3,-2.6 -27,-0.2 2,-0.4 -0.874 50.8 179.0-101.6 120.0 -29.5 63.0 -2.9 56 56 A T E -CD 27 51A 0 -29,-2.6 -29,-2.5 -2,-0.6 2,-0.4 -0.971 4.9-175.3-119.6 132.4 -27.4 62.8 0.3 57 57 A Q E -CD 26 50A 30 -7,-2.9 -7,-2.8 -2,-0.4 2,-0.4 -0.989 6.0-163.8-122.4 136.6 -28.7 63.5 3.8 58 58 A F E -CD 25 49A 0 -33,-3.0 -33,-2.4 -2,-0.4 2,-0.5 -0.966 3.2-166.9-111.1 133.1 -26.6 63.5 7.0 59 59 A R E -CD 24 48A 128 -11,-2.2 -11,-2.6 -2,-0.4 -35,-0.2 -0.954 19.3-153.4-115.3 108.1 -28.2 63.3 10.4 60 60 A F E - D 0 47A 7 -37,-2.8 -13,-0.2 -2,-0.5 4,-0.1 -0.429 18.3-139.9 -77.7 152.7 -25.6 64.2 13.0 61 61 A S S S+ 0 0 97 -15,-1.0 2,-0.3 -2,-0.1 -1,-0.1 0.789 90.1 64.4 -75.6 -33.6 -25.6 63.0 16.6 62 62 A K S S- 0 0 121 -16,-0.2 2,-0.8 -39,-0.1 -2,-0.1 -0.690 96.8-110.4 -89.6 141.9 -24.4 66.4 17.8 63 63 A K + 0 0 119 -2,-0.3 -40,-0.2 1,-0.2 -2,-0.1 -0.673 40.5 176.6 -68.8 111.4 -26.6 69.6 17.3 64 64 A M S S+ 0 0 38 -42,-2.3 -41,-0.2 -2,-0.8 -1,-0.2 0.788 76.0 24.5 -91.5 -34.4 -24.5 71.3 14.7 65 65 A R > + 0 0 48 -43,-1.8 3,-2.2 -3,-0.1 -1,-0.2 -0.528 65.8 162.4-130.1 66.9 -26.8 74.3 14.1 66 66 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -43,-0.1 0.625 71.2 70.8 -63.9 -11.3 -28.8 74.7 17.4 67 67 A D T 3 S+ 0 0 103 -45,-0.1 2,-0.3 -3,-0.1 -2,-0.0 0.678 87.8 84.5 -71.5 -20.3 -29.6 78.3 16.3 68 68 A L S < S- 0 0 9 -3,-2.2 2,-0.2 1,-0.0 -3,-0.1 -0.652 70.8-136.9 -93.9 142.9 -31.9 77.0 13.6 69 69 A T - 0 0 105 -2,-0.3 2,-0.2 -48,-0.1 -2,-0.1 -0.507 38.1-101.1 -72.7 155.3 -35.5 75.9 13.6 70 70 A G - 0 0 51 -2,-0.2 2,-0.3 -49,-0.1 -49,-0.2 -0.519 42.2-163.6 -67.0 149.2 -36.4 72.7 11.7 71 71 A M - 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