==== 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 CONTRACTILE PROTEIN 19-SEP-01 1K0K . COMPND 2 MOLECULE: PROFILIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR S.VOROBIEV,A.A.FEDOROV,S.C.ALMO . 125 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6057.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 95 76.0 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 . 37 29.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 4 3.2 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 . 5 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 2 0 0 0 0 0 0 1 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 0 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 S > 0 0 124 0, 0.0 4,-0.7 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 58.5 107.9 115.0 81.9 2 2 A W H >> + 0 0 59 1,-0.2 4,-1.4 2,-0.2 3,-0.7 0.844 360.0 62.9 -68.2 -32.2 104.9 116.6 83.4 3 3 A Q H 3> S+ 0 0 76 1,-0.3 4,-2.3 26,-0.2 -1,-0.2 0.843 95.0 59.8 -61.8 -34.4 103.8 113.2 84.7 4 4 A A H 3> S+ 0 0 39 -3,-0.3 4,-2.6 1,-0.2 -1,-0.3 0.842 100.7 56.8 -63.6 -31.8 107.0 113.0 86.8 5 5 A Y H < S+ 0 0 10 -4,-2.3 3,-1.3 1,-0.2 6,-0.6 0.961 114.7 38.8 -59.1 -56.9 104.0 115.0 94.6 10 10 A I H >< S+ 0 0 52 -4,-2.2 3,-1.1 1,-0.3 -1,-0.2 0.775 105.8 69.4 -68.4 -22.1 101.9 112.0 95.6 11 11 A G H 3< S+ 0 0 64 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.744 92.2 59.8 -65.9 -22.0 105.1 110.0 96.2 12 12 A T T << S- 0 0 70 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.704 103.5-132.5 -77.1 -21.9 105.7 112.2 99.2 13 13 A G S < S+ 0 0 47 -3,-1.1 -3,-0.1 2,-0.5 -2,-0.1 0.344 86.3 99.9 85.1 -7.9 102.5 111.2 100.8 14 14 A K S S+ 0 0 68 -5,-0.5 2,-0.4 1,-0.2 95,-0.1 0.647 89.5 33.9 -83.1 -16.1 101.6 114.8 101.5 15 15 A V - 0 0 1 -6,-0.6 -2,-0.5 85,-0.2 85,-0.3 -0.993 62.5-172.6-135.6 136.8 99.3 114.9 98.5 16 16 A D S S+ 0 0 55 83,-2.3 2,-0.3 -2,-0.4 84,-0.1 0.599 75.7 29.4-107.7 -12.9 97.3 111.9 97.4 17 17 A K E +A 99 0A 51 82,-1.2 82,-2.8 17,-0.1 2,-0.3 -0.981 65.5 169.7-147.7 131.6 96.0 113.3 94.1 18 18 A A E -AB 98 32A 0 14,-2.3 14,-2.3 -2,-0.3 2,-0.4 -0.999 7.4-174.9-147.3 141.9 97.5 115.8 91.7 19 19 A V E -AB 97 31A 3 78,-2.7 78,-2.8 -2,-0.3 2,-0.5 -0.990 13.7-150.4-137.6 143.9 96.8 117.1 88.3 20 20 A I E -AB 96 30A 0 10,-3.0 9,-3.0 -2,-0.4 10,-1.3 -0.971 21.0-179.4-117.0 121.4 98.5 119.5 85.9 21 21 A Y E -AB 95 28A 32 74,-3.2 74,-2.3 -2,-0.5 7,-0.2 -0.739 36.0 -97.1-112.4 162.8 96.3 121.4 83.5 22 22 A S E > -A 94 0A 9 5,-1.8 3,-2.0 -2,-0.3 72,-0.3 -0.444 48.3-100.6 -72.5 156.5 97.2 124.0 80.8 23 23 A R T 3 S+ 0 0 103 70,-2.6 71,-0.2 1,-0.3 -1,-0.1 0.847 126.8 48.7 -47.3 -38.5 96.7 127.5 82.1 24 24 A A T 3 S- 0 0 64 69,-0.2 -1,-0.3 1,-0.0 22,-0.1 0.650 109.6-124.8 -78.8 -15.8 93.4 127.7 80.2 25 25 A G S < S+ 0 0 13 -3,-2.0 -2,-0.1 2,-0.2 3,-0.1 0.743 76.4 121.5 78.0 23.3 92.2 124.4 81.7 26 26 A D S S+ 0 0 125 1,-0.2 2,-0.3 16,-0.0 -3,-0.1 0.363 71.5 30.7 -99.1 4.1 91.6 123.0 78.2 27 27 A A - 0 0 39 -5,-0.2 -5,-1.8 0, 0.0 2,-0.6 -0.960 68.0-130.9-163.2 143.4 94.0 120.0 78.5 28 28 A V E +B 21 0A 72 -2,-0.3 -7,-0.2 -7,-0.2 3,-0.1 -0.858 20.1 177.2 -97.3 121.4 95.4 117.6 81.1 29 29 A W E + 0 0 85 -9,-3.0 2,-0.3 -2,-0.6 -26,-0.2 0.666 69.9 0.5 -95.5 -21.2 99.2 117.3 81.0 30 30 A A E -B 20 0A 3 -10,-1.3 -10,-3.0 -28,-0.1 -1,-0.3 -0.947 56.2-177.0-167.4 146.5 99.5 115.0 84.0 31 31 A T E +B 19 0A 49 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.987 6.1 173.7-149.0 137.4 97.5 113.2 86.6 32 32 A S E > +B 18 0A 8 -14,-2.3 -14,-2.3 -2,-0.3 3,-0.6 -0.988 65.6 27.4-143.0 147.6 98.5 111.0 89.6 33 33 A G T 3 S- 0 0 47 -2,-0.3 -14,-0.1 -16,-0.2 -16,-0.0 0.335 117.2 -82.2 85.2 -10.3 96.4 109.5 92.4 34 34 A G T 3 + 0 0 52 1,-0.2 2,-0.3 -16,-0.2 -1,-0.2 0.790 65.5 174.3 85.6 29.3 93.3 109.4 90.2 35 35 A L < + 0 0 10 -3,-0.6 2,-0.4 -17,-0.2 -1,-0.2 -0.556 2.9 177.7 -72.6 127.9 92.0 112.9 90.6 36 36 A S - 0 0 80 -2,-0.3 2,-0.0 -17,-0.0 -5,-0.0 -0.917 14.3-150.7-137.1 109.1 89.1 113.5 88.3 37 37 A L - 0 0 29 -2,-0.4 25,-0.1 1,-0.1 0, 0.0 -0.291 24.6-104.2 -75.4 160.7 87.2 116.8 88.2 38 38 A Q >> - 0 0 92 23,-0.2 3,-2.0 1,-0.1 4,-0.7 -0.499 46.5 -91.0 -80.1 155.8 83.5 117.2 87.4 39 39 A P T 34 S+ 0 0 114 0, 0.0 4,-0.2 0, 0.0 3,-0.1 0.747 123.1 26.1 -35.0 -46.8 82.6 118.6 84.0 40 40 A N T 3> S+ 0 0 128 1,-0.1 4,-1.5 2,-0.1 -3,-0.0 0.362 97.0 92.3-107.1 7.6 82.6 122.3 85.0 41 41 A E H <> S+ 0 0 11 -3,-2.0 4,-2.0 1,-0.2 5,-0.2 0.920 83.6 51.0 -68.1 -44.7 84.9 122.3 88.0 42 42 A I H X S+ 0 0 22 -4,-0.7 4,-2.8 1,-0.2 5,-0.2 0.857 108.4 55.5 -62.1 -33.3 88.2 123.1 86.2 43 43 A G H > S+ 0 0 35 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.912 105.5 49.8 -65.3 -43.4 86.4 126.1 84.6 44 44 A E H X S+ 0 0 63 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.911 114.0 46.8 -61.7 -41.7 85.4 127.5 87.9 45 45 A I H X S+ 0 0 1 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.961 112.5 47.6 -65.0 -52.9 88.9 127.2 89.2 46 46 A V H >X S+ 0 0 23 -4,-2.8 4,-0.6 1,-0.2 3,-0.5 0.920 117.0 43.8 -54.3 -47.4 90.6 128.7 86.1 47 47 A Q H >X S+ 0 0 105 -4,-2.6 4,-1.9 1,-0.2 3,-0.9 0.871 104.7 66.3 -66.3 -36.9 88.1 131.6 86.1 48 48 A G H 3< S+ 0 0 2 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.815 89.8 63.4 -55.5 -34.9 88.5 132.0 89.9 49 49 A F H << S+ 0 0 4 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.884 113.4 33.7 -59.4 -39.2 92.2 133.0 89.6 50 50 A D H << S+ 0 0 114 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.716 135.3 25.9 -88.3 -24.0 91.2 136.2 87.7 51 51 A N >X + 0 0 73 -4,-1.9 3,-0.9 22,-0.1 4,-0.7 -0.674 61.8 172.9-143.3 84.9 87.9 136.7 89.5 52 52 A P H 3> S+ 0 0 46 0, 0.0 4,-2.6 0, 0.0 3,-0.4 0.845 76.3 70.0 -59.5 -38.5 87.8 135.2 93.1 53 53 A A H 3> S+ 0 0 64 1,-0.3 4,-1.5 2,-0.2 -5,-0.1 0.874 93.5 61.0 -48.3 -38.4 84.4 136.7 93.9 54 54 A G H <4 S+ 0 0 16 -3,-0.9 3,-0.5 1,-0.2 4,-0.4 0.955 109.0 39.3 -53.7 -54.8 83.1 134.2 91.4 55 55 A L H X S+ 0 0 2 -4,-0.7 4,-2.2 -3,-0.4 -2,-0.2 0.963 104.4 68.4 -59.2 -55.5 84.3 131.3 93.4 56 56 A Q H < S+ 0 0 125 -4,-2.6 -1,-0.2 2,-0.1 -2,-0.2 0.770 101.5 50.5 -32.1 -45.9 83.4 132.8 96.8 57 57 A S T < S+ 0 0 82 -4,-1.5 -2,-0.1 -3,-0.5 3,-0.1 0.907 122.5 17.0 -62.5-104.0 79.7 132.5 95.9 58 58 A N T 4 S- 0 0 74 -4,-0.4 -2,-0.1 1,-0.1 2,-0.1 0.780 112.1-127.6 -41.1 -35.8 78.6 129.0 94.7 59 59 A G < - 0 0 4 -4,-2.2 2,-0.6 -5,-0.4 -1,-0.1 -0.414 24.2 -60.5 109.3 173.7 81.9 127.7 96.2 60 60 A L E -F 67 0B 1 7,-1.3 7,-3.1 -2,-0.1 2,-0.5 -0.866 51.0-168.5 -99.7 122.7 84.9 125.6 95.1 61 61 A H E +F 66 0B 65 -2,-0.6 2,-0.4 5,-0.2 5,-0.2 -0.952 11.0 176.4-120.1 130.5 84.0 122.1 94.0 62 62 A I E > S-F 65 0B 3 3,-2.7 3,-1.4 -2,-0.5 -25,-0.1 -0.998 76.7 -15.0-130.0 129.1 86.4 119.3 93.4 63 63 A Q T 3 S- 0 0 57 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.824 127.8 -57.8 47.0 34.6 85.2 115.7 92.5 64 64 A G T 3 S+ 0 0 41 1,-0.3 -1,-0.3 -26,-0.0 2,-0.1 -0.157 113.7 114.9 93.2 -41.2 81.8 116.8 93.7 65 65 A Q E < -F 62 0B 78 -3,-1.4 -3,-2.7 -2,-0.3 2,-0.3 -0.395 63.0-131.8 -66.6 137.0 82.9 117.8 97.2 66 66 A K E -F 61 0B 107 -5,-0.2 2,-0.4 -2,-0.1 -5,-0.2 -0.677 20.2-160.5 -89.8 145.1 82.6 121.4 98.1 67 67 A F E -F 60 0B 4 -7,-3.1 -7,-1.3 -2,-0.3 14,-0.2 -0.985 22.6-113.2-128.8 138.5 85.5 123.2 99.7 68 68 A M E -C 80 0A 125 12,-3.3 12,-1.8 -2,-0.4 2,-1.3 -0.409 34.6-118.2 -64.0 141.6 85.5 126.4 101.8 69 69 A L E +C 79 0A 27 10,-0.2 10,-0.2 1,-0.2 3,-0.1 -0.696 42.5 167.0 -87.5 94.6 87.4 129.1 99.9 70 70 A L E + 0 0 91 8,-1.8 2,-0.3 -2,-1.3 -1,-0.2 0.840 67.0 4.5 -75.5 -34.0 90.3 129.8 102.3 71 71 A R E +C 78 0A 110 7,-1.4 7,-1.7 -3,-0.2 2,-0.2 -0.999 56.8 172.5-154.6 149.0 92.3 131.8 99.7 72 72 A A E +C 77 0A 29 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.787 20.0 131.9-163.2 113.1 92.1 133.2 96.2 73 73 A D S S- 0 0 42 3,-2.4 -22,-0.1 -2,-0.2 -2,-0.0 -0.786 70.6 -65.1-143.8-172.0 94.3 135.5 94.2 74 74 A D S S+ 0 0 115 -2,-0.2 -25,-0.1 1,-0.2 3,-0.1 0.719 130.5 17.1 -55.0 -25.8 96.0 135.7 90.8 75 75 A R S S+ 0 0 56 1,-0.2 15,-2.5 14,-0.1 2,-0.4 0.656 119.7 52.0-122.0 -23.3 98.2 132.7 91.5 76 76 A S E + D 0 89A 0 13,-0.2 -3,-2.4 -27,-0.1 2,-0.4 -0.951 42.4 177.1-128.3 142.8 96.8 130.7 94.4 77 77 A I E -CD 72 88A 0 11,-2.7 11,-2.6 -2,-0.4 2,-0.5 -0.969 14.6-164.7-137.5 115.4 93.5 129.2 95.4 78 78 A Y E -CD 71 87A 22 -7,-1.7 -8,-1.8 -2,-0.4 -7,-1.4 -0.909 2.6-161.6-108.7 126.9 93.2 127.2 98.6 79 79 A G E -CD 69 86A 0 7,-3.3 7,-1.7 -2,-0.5 2,-0.4 -0.784 6.8-165.4-105.0 149.6 90.3 124.9 99.4 80 80 A R E +CD 68 85A 57 -12,-1.8 -12,-3.3 -2,-0.3 5,-0.2 -0.993 24.5 167.0-142.4 134.1 89.3 123.6 102.8 81 81 A H E > S- D 0 84A 69 3,-2.9 3,-2.1 1,-0.4 2,-0.2 -0.684 70.2 -78.0-141.0 81.0 87.1 120.9 104.2 82 82 A D T 3 S- 0 0 147 1,-0.3 -1,-0.4 -2,-0.2 -14,-0.0 -0.418 115.6 -3.1 59.9-125.8 88.0 120.5 107.9 83 83 A A T 3 S+ 0 0 59 -2,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.626 130.0 64.3 -72.6 -13.8 91.2 118.5 108.0 84 84 A E E < +D 81 0A 47 -3,-2.1 -3,-2.9 19,-0.1 2,-0.3 -0.649 62.3 150.3-107.5 168.8 91.4 117.9 104.3 85 85 A G E -DE 80 100A 0 15,-1.6 15,-1.7 -5,-0.2 2,-0.3 -0.962 33.8-108.2-170.9-170.9 91.8 120.3 101.4 86 86 A V E -DE 79 99A 1 -7,-1.7 -7,-3.3 -2,-0.3 2,-0.5 -0.997 14.1-153.1-143.5 143.5 93.0 121.3 98.0 87 87 A V E -DE 78 98A 1 11,-3.1 11,-2.6 -2,-0.3 2,-0.5 -0.978 11.9-175.8-122.4 121.9 95.8 123.5 96.6 88 88 A C E +DE 77 97A 0 -11,-2.6 -11,-2.7 -2,-0.5 2,-0.4 -0.974 6.9 175.5-120.1 121.3 95.4 125.2 93.2 89 89 A V E -DE 76 96A 0 7,-2.4 7,-3.3 -2,-0.5 2,-0.5 -0.967 17.4-148.7-127.8 142.4 98.3 127.2 91.8 90 90 A R E + E 0 95A 14 -15,-2.5 5,-0.2 -2,-0.4 2,-0.1 -0.934 17.3 178.6-113.3 132.1 98.7 128.9 88.4 91 91 A T - 0 0 4 3,-2.6 27,-0.1 -2,-0.5 26,-0.1 -0.279 52.4 -73.2-110.3-162.2 102.0 129.3 86.7 92 92 A K S S+ 0 0 116 1,-0.2 33,-0.1 -2,-0.1 29,-0.0 0.874 128.5 5.4 -65.7 -37.1 103.0 130.8 83.3 93 93 A Q S S+ 0 0 84 32,-1.7 -70,-2.6 -70,-0.1 2,-0.3 0.446 123.1 57.3-127.5 -2.7 101.5 127.9 81.4 94 94 A T E -A 22 0A 0 31,-0.5 -3,-2.6 -72,-0.3 2,-0.4 -0.811 53.0-146.7-132.9 171.1 99.8 125.7 83.9 95 95 A V E -AE 21 90A 0 -74,-2.3 -74,-3.2 -2,-0.3 2,-0.5 -0.986 23.9-159.2-134.1 117.1 97.2 125.2 86.6 96 96 A I E -AE 20 89A 0 -7,-3.3 -7,-2.4 -2,-0.4 2,-0.5 -0.884 7.2-172.0-103.9 129.8 98.3 122.7 89.2 97 97 A I E +AE 19 88A 0 -78,-2.8 -78,-2.7 -2,-0.5 2,-0.4 -0.978 9.0 173.5-125.7 120.2 95.6 121.1 91.4 98 98 A A E -AE 18 87A 1 -11,-2.6 -11,-3.1 -2,-0.5 2,-0.4 -0.953 16.7-153.8-128.6 147.3 96.5 118.9 94.4 99 99 A H E -AE 17 86A 18 -82,-2.8 -83,-2.3 -2,-0.4 -82,-1.2 -0.950 5.6-160.7-120.7 136.3 94.5 117.3 97.2 100 100 A Y E - E 0 85A 2 -15,-1.7 -15,-1.6 -2,-0.4 -85,-0.2 -0.949 19.4-125.5-116.9 138.3 95.8 116.4 100.6 101 101 A P > - 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