==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ACTIN-BINDING PROTEIN 16-JAN-97 2VIL . COMPND 2 MOLECULE: VILLIN 14T; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR M.A.MARKUS,P.MATSUDAIRA,G.WAGNER . 126 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7675.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 78 61.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 15.1 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 . 1 0.8 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 . 10 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 17.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.6 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 1 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 1 0 0 0 1 0 1 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 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 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 V 0 0 101 0, 0.0 28,-0.1 0, 0.0 26,-0.0 0.000 360.0 360.0 360.0 144.7 12.4 -17.3 -28.1 2 2 A E > - 0 0 129 1,-0.1 4,-0.6 3,-0.1 5,-0.1 1.000 360.0-159.4 64.6 66.1 14.9 -14.5 -27.1 3 3 A L H > + 0 0 6 2,-0.1 4,-0.7 4,-0.1 6,-0.5 0.893 65.0 101.2 -44.8 -41.2 12.4 -11.6 -26.7 4 4 A S H 4 S+ 0 0 35 3,-0.3 2,-2.2 1,-0.2 80,-0.0 -0.025 87.5 16.3 -42.5 150.6 15.4 -9.3 -27.2 5 5 A K H 4 S+ 0 0 162 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 -0.452 133.8 43.7 80.5 -72.3 15.5 -7.9 -30.7 6 6 A K H < S+ 0 0 171 -2,-2.2 -1,-0.2 -4,-0.6 -2,-0.2 0.281 141.1 2.4 -88.3 14.5 11.9 -8.7 -31.6 7 7 A V S >< S+ 0 0 13 -4,-0.7 3,-1.6 -5,-0.1 -3,-0.3 0.140 126.2 52.5-157.2 -74.4 10.7 -7.5 -28.2 8 8 A T G > S+ 0 0 5 1,-0.3 3,-0.5 -5,-0.3 -4,-0.2 0.794 105.7 65.8 -49.3 -23.2 13.2 -6.0 -25.8 9 9 A G G 3 S+ 0 0 42 -6,-0.5 -1,-0.3 1,-0.2 -5,-0.1 0.003 121.8 12.7 -89.4 32.9 14.2 -3.8 -28.7 10 10 A K G < S+ 0 0 172 -3,-1.6 -1,-0.2 2,-0.0 -2,-0.2 0.249 82.4 153.9 164.1 47.5 10.7 -2.2 -28.6 11 11 A L < - 0 0 13 -3,-0.5 2,-0.6 1,-0.2 -3,-0.1 0.356 66.3 -40.2 -69.0-147.8 8.8 -3.0 -25.4 12 12 A D + 0 0 30 1,-0.2 -1,-0.2 7,-0.1 3,-0.1 -0.699 67.5 151.5 -83.8 119.6 6.1 -0.6 -24.1 13 13 A K S S+ 0 0 103 -2,-0.6 -1,-0.2 -3,-0.2 44,-0.1 0.497 76.7 16.3-123.0 -12.0 7.2 3.0 -24.5 14 14 A T S S+ 0 0 112 1,-0.1 -1,-0.1 38,-0.0 38,-0.1 -0.335 100.4 83.5-160.8 70.0 3.9 4.8 -24.9 15 15 A T - 0 0 59 36,-0.1 2,-0.9 2,-0.1 -1,-0.1 -0.749 66.2-126.2-175.3 124.2 0.8 2.8 -23.8 16 16 A P S S+ 0 0 94 0, 0.0 2,-0.3 0, 0.0 35,-0.2 -0.638 72.0 78.4 -77.7 106.0 -0.8 2.2 -20.4 17 17 A G E S-A 50 0A 33 33,-1.5 33,-1.7 -2,-0.9 2,-0.4 -0.971 73.1 -99.0 173.3 176.8 -1.1 -1.6 -20.0 18 18 A I E -A 49 0A 23 -2,-0.3 2,-0.4 31,-0.2 31,-0.3 -0.969 24.6-161.8-124.5 134.4 0.9 -4.7 -19.1 19 19 A Q E -A 48 0A 33 29,-2.0 29,-1.2 -2,-0.4 2,-0.2 -0.900 9.6-165.2-112.9 140.8 2.5 -7.2 -21.6 20 20 A I E -AB 47 31A 0 11,-1.5 11,-1.5 -2,-0.4 2,-0.4 -0.594 12.8-136.5-115.1-178.9 3.5 -10.7 -20.6 21 21 A W E -AB 46 30A 0 25,-1.1 25,-1.4 9,-0.3 2,-0.4 -0.959 15.8-135.6-141.4 119.4 5.7 -13.4 -22.2 22 22 A R E -A 45 0A 96 7,-1.5 7,-0.4 -2,-0.4 2,-0.3 -0.613 5.8-158.9 -78.9 128.1 4.7 -17.1 -22.3 23 23 A I > + 0 0 0 21,-2.2 3,-0.8 -2,-0.4 4,-0.1 -0.227 39.9 151.3 -96.5 43.9 7.6 -19.4 -21.4 24 24 A E G > + 0 0 16 -2,-0.3 3,-1.5 1,-0.2 4,-0.2 -0.186 59.6 25.1 -70.3 168.0 5.8 -22.4 -23.1 25 25 A N G 3 S- 0 0 68 1,-0.3 -1,-0.2 2,-0.1 3,-0.1 0.797 134.1 -73.1 47.2 24.6 7.8 -25.2 -24.7 26 26 A M G < S+ 0 0 59 -3,-0.8 -1,-0.3 1,-0.1 -2,-0.2 0.961 121.9 78.4 57.8 50.5 10.4 -24.2 -22.1 27 27 A E S < S- 0 0 74 -3,-1.5 2,-0.3 -4,-0.1 -1,-0.1 -0.130 81.2 -97.0-148.2-111.2 11.3 -21.0 -24.1 28 28 A M - 0 0 1 -4,-0.2 -5,-0.2 -5,-0.1 17,-0.1 -0.914 25.5-173.7 178.9 153.9 9.4 -17.7 -24.3 29 29 A V - 0 0 39 -7,-0.4 -7,-1.5 -2,-0.3 2,-1.2 -0.979 38.2-100.6-160.3 147.6 7.0 -15.7 -26.4 30 30 A P E -B 21 0A 65 0, 0.0 -9,-0.3 0, 0.0 -2,-0.0 -0.567 36.2-156.5 -74.0 94.7 5.5 -12.1 -26.5 31 31 A V E -B 20 0A 7 -11,-1.5 -11,-1.5 -2,-1.2 -2,-0.0 -0.637 14.1-163.7 -76.6 112.7 2.1 -12.5 -24.9 32 32 A P > - 0 0 63 0, 0.0 3,-0.7 0, 0.0 -12,-0.3 0.143 39.7 -85.4 -78.8-161.8 -0.0 -9.6 -26.2 33 33 A T T 3 S+ 0 0 97 1,-0.2 3,-0.2 2,-0.2 -2,-0.1 0.511 118.8 76.1 -88.3 -3.7 -3.3 -8.4 -24.8 34 34 A K T 3 S+ 0 0 173 1,-0.2 -1,-0.2 2,-0.1 -3,-0.0 0.371 113.3 19.4 -87.5 8.3 -5.2 -10.9 -26.8 35 35 A S S X S+ 0 0 71 -3,-0.7 3,-0.8 2,-0.0 -1,-0.2 0.189 84.7 112.5-160.0 21.1 -4.1 -13.7 -24.4 36 36 A Y T 3 S+ 0 0 76 -3,-0.2 3,-0.1 1,-0.2 -3,-0.1 0.012 71.1 69.4 -90.0 32.6 -3.1 -12.0 -21.1 37 37 A G T 3 S+ 0 0 17 1,-0.2 78,-1.6 77,-0.1 2,-0.3 0.475 101.4 36.2-123.3 -10.1 -6.0 -13.5 -19.3 38 38 A N B < +e 115 0B 78 -3,-0.8 2,-0.5 76,-0.2 -1,-0.2 -0.776 63.1 169.6-148.0 100.9 -5.0 -17.2 -19.3 39 39 A F - 0 0 2 76,-1.7 4,-0.1 -2,-0.3 6,-0.1 -0.936 44.3 -99.0-115.2 131.6 -1.4 -18.3 -18.8 40 40 A Y - 0 0 54 -2,-0.5 3,-0.3 76,-0.3 78,-0.2 0.059 27.2-140.2 -39.4 155.2 -0.5 -22.0 -18.2 41 41 A E S S+ 0 0 75 76,-2.2 2,-2.1 1,-0.2 77,-0.2 0.882 92.1 58.5 -91.0 -46.3 0.2 -22.8 -14.5 42 42 A G S S+ 0 0 5 75,-0.6 78,-0.4 26,-0.1 2,-0.2 -0.405 104.8 53.0 -83.0 67.4 3.1 -25.1 -14.8 43 43 A D S S- 0 0 1 -2,-2.1 2,-0.3 -3,-0.3 26,-0.2 -0.748 85.6 -86.1-162.9-148.1 5.4 -22.6 -16.6 44 44 A C - 0 0 0 21,-0.3 -21,-2.2 -2,-0.2 2,-0.4 -0.999 26.0-170.4-144.3 139.8 6.9 -19.1 -16.5 45 45 A Y E -AC 22 64A 10 19,-1.3 19,-2.0 -2,-0.3 2,-0.4 -0.890 12.1-151.1-137.2 109.6 5.4 -15.8 -17.7 46 46 A V E -AC 21 63A 0 -25,-1.4 -25,-1.1 -2,-0.4 2,-0.3 -0.609 19.9-162.4 -78.5 131.2 7.5 -12.6 -17.8 47 47 A L E -AC 20 62A 0 15,-1.6 15,-1.6 -2,-0.4 -27,-0.3 -0.730 13.3-168.4-111.6 163.4 5.2 -9.5 -17.3 48 48 A L E -AC 19 61A 0 -29,-1.2 -29,-2.0 -2,-0.3 13,-0.2 -0.658 6.2-167.2-153.6 92.1 5.9 -5.8 -18.1 49 49 A S E -AC 18 60A 9 11,-2.1 11,-1.8 -31,-0.3 2,-0.4 -0.523 4.0-167.4 -81.3 148.8 3.5 -3.1 -16.8 50 50 A T E +AC 17 59A 1 -33,-1.7 -33,-1.5 9,-0.2 9,-0.2 -0.941 8.3 175.9-140.2 117.0 3.8 0.4 -18.2 51 51 A R E - C 0 58A 140 7,-1.5 7,-1.1 -2,-0.4 2,-0.3 -0.624 27.1-113.9-112.9 175.4 2.1 3.4 -16.7 52 52 A K E + C 0 57A 150 5,-0.2 2,-0.2 -2,-0.2 5,-0.2 -0.762 33.5 171.2-109.0 157.3 2.2 7.2 -17.6 53 53 A T - 0 0 66 3,-1.7 0, 0.0 -2,-0.3 0, 0.0 -0.796 52.5 -81.9-146.8-170.4 3.6 10.0 -15.4 54 54 A G S S+ 0 0 93 -2,-0.2 3,-0.1 1,-0.1 -2,-0.0 0.355 127.8 26.9 -84.0 10.2 4.5 13.7 -15.6 55 55 A S S S- 0 0 119 1,-0.4 2,-0.2 0, 0.0 -1,-0.1 0.552 127.1 -50.9-133.7 -54.7 7.8 12.8 -17.3 56 56 A G S S- 0 0 31 -42,-0.0 -3,-1.7 -5,-0.0 2,-0.4 -0.548 76.5 -46.9-157.5-135.1 7.5 9.5 -19.2 57 57 A F E -C 52 0A 55 -5,-0.2 2,-0.8 -2,-0.2 -5,-0.2 -0.929 38.0-137.4-120.2 144.3 6.3 5.9 -18.5 58 58 A S E -C 51 0A 48 -7,-1.1 -7,-1.5 -2,-0.4 2,-0.2 -0.838 24.1-160.1-101.1 106.8 7.2 3.7 -15.5 59 59 A Y E -C 50 0A 16 -2,-0.8 2,-0.3 32,-0.3 34,-0.3 -0.502 7.3-165.7 -84.6 156.4 7.9 0.2 -16.6 60 60 A N E -C 49 0A 23 -11,-1.8 -11,-2.1 32,-0.3 2,-0.8 -0.853 2.7-163.0-143.7 102.6 7.7 -2.8 -14.3 61 61 A I E +Cd 48 94A 0 32,-1.9 34,-1.6 -2,-0.3 -13,-0.2 -0.770 16.4 178.3 -92.4 112.3 9.3 -6.1 -15.4 62 62 A H E -Cd 47 95A 0 -15,-1.6 -15,-1.6 -2,-0.8 2,-0.4 -0.655 19.7-144.7-105.1 167.0 8.0 -9.1 -13.4 63 63 A Y E -Cd 46 96A 64 32,-1.3 34,-1.8 -17,-0.2 2,-0.4 -0.868 7.6-158.8-138.0 106.6 8.9 -12.7 -13.7 64 64 A W E -Cd 45 97A 1 -19,-2.0 -19,-1.3 -2,-0.4 2,-0.3 -0.646 3.4-167.3 -82.4 131.6 6.2 -15.4 -13.0 65 65 A L E - d 0 98A 8 32,-0.8 2,-1.0 -2,-0.4 34,-0.9 -0.480 4.7-164.0-119.3 65.2 7.6 -18.8 -12.2 66 66 A G > - 0 0 0 32,-0.3 3,-0.9 -2,-0.3 2,-0.4 -0.231 39.5-116.2 -49.5 91.1 4.7 -21.2 -12.4 67 67 A K T 3 S+ 0 0 134 -2,-1.0 -1,-0.2 1,-0.2 -23,-0.1 -0.019 96.2 78.6 -37.7 88.0 6.7 -23.9 -10.5 68 68 A N T 3 + 0 0 104 -2,-0.4 -1,-0.2 -25,-0.2 -26,-0.1 0.243 64.0 89.6-162.8 -43.7 6.8 -26.5 -13.3 69 69 A S S < S- 0 0 12 -3,-0.9 -1,-0.1 -26,-0.2 -26,-0.1 -0.082 88.5 -87.6 -60.3 168.6 9.5 -25.5 -15.8 70 70 A S > - 0 0 41 1,-0.1 4,-1.7 -3,-0.1 5,-0.2 -0.249 43.6 -97.6 -73.9 168.9 13.1 -26.7 -15.2 71 71 A Q H >> S+ 0 0 169 1,-0.2 4,-1.5 2,-0.2 3,-0.7 0.957 127.3 51.1 -53.3 -51.2 15.5 -24.8 -13.0 72 72 A D H 3> S+ 0 0 97 1,-0.3 4,-1.4 2,-0.2 3,-0.3 0.910 103.0 60.4 -55.3 -39.3 17.1 -23.2 -16.1 73 73 A E H >> S+ 0 0 21 1,-0.3 4,-2.3 2,-0.2 3,-0.5 0.920 101.8 52.8 -56.5 -38.7 13.6 -22.2 -17.3 74 74 A Q H X S+ 0 0 84 -4,-0.8 4,-1.9 1,-0.2 3,-0.5 0.930 105.9 54.2 -65.5 -41.3 16.9 -13.5 -17.1 80 80 A Y H 3X S+ 0 0 23 -4,-2.0 4,-1.6 1,-0.3 -1,-0.2 0.863 107.4 52.4 -61.5 -29.4 14.6 -12.1 -19.9 81 81 A T H 3< S+ 0 0 2 -4,-1.5 4,-0.4 1,-0.2 -1,-0.3 0.794 108.0 51.2 -75.5 -25.5 13.3 -9.7 -17.2 82 82 A T H S+ 0 0 14 -4,-0.4 5,-1.1 2,-0.2 7,-0.5 0.916 112.2 26.8 -75.5 -41.6 15.4 -4.0 -17.4 86 86 A E H ><5S+ 0 0 149 -4,-0.9 3,-0.5 3,-0.2 -2,-0.2 0.787 120.2 57.0 -90.0 -29.2 18.5 -2.3 -18.7 87 87 A Y H 3<5S+ 0 0 151 -4,-1.5 -3,-0.2 1,-0.2 -2,-0.2 0.859 98.7 60.9 -70.2 -32.3 17.3 -2.3 -22.4 88 88 A L T 3<5S- 0 0 6 -4,-1.2 -1,-0.2 -5,-0.1 -2,-0.2 0.785 131.1 -92.4 -66.2 -22.4 14.2 -0.4 -21.4 89 89 A G T < 5 - 0 0 46 -3,-0.5 -3,-0.2 -4,-0.3 -2,-0.1 0.528 57.7 -79.1 121.1 14.6 16.4 2.5 -20.2 90 90 A S S > -d 65 0A 19 -2,-0.3 4,-1.6 -34,-0.3 3,-1.0 -0.892 55.6 -74.2-155.4-175.2 5.4 -17.7 -8.8 99 99 A Q T 34 S+ 0 0 81 -34,-0.9 -33,-0.1 1,-0.3 -35,-0.0 0.574 138.7 23.6 -69.8 -2.0 2.4 -20.2 -9.0 100 100 A G T 34 S+ 0 0 58 3,-0.0 -1,-0.3 0, 0.0 3,-0.0 0.140 120.7 58.9-144.5 16.1 1.8 -19.1 -5.4 101 101 A H T <4 S+ 0 0 92 -3,-1.0 4,-0.3 2,-0.1 -2,-0.2 0.520 87.9 69.7-122.5 -16.4 3.5 -15.7 -5.3 102 102 A E X> + 0 0 18 -4,-1.6 5,-1.1 3,-0.1 4,-0.6 0.107 69.5 125.9 -90.1 24.3 1.6 -13.8 -8.0 103 103 A S H >5S- 0 0 69 1,-0.2 4,-1.8 3,-0.2 5,-0.3 0.865 87.8 -6.2 -48.6-107.6 -1.5 -13.8 -5.8 104 104 A E H >5S+ 0 0 162 1,-0.2 4,-0.9 3,-0.2 -1,-0.2 0.724 135.2 63.6 -67.2 -17.4 -2.8 -10.2 -5.5 105 105 A T H >5S+ 0 0 50 -4,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.980 109.6 34.0 -72.2 -55.0 0.3 -8.9 -7.3 106 106 A F H >X5S+ 0 0 0 -4,-0.6 4,-1.3 1,-0.2 3,-1.0 0.995 122.9 46.0 -63.6 -57.5 -0.4 -10.6 -10.7 107 107 A R H 3< - 0 0 44 -78,-0.4 3,-0.7 1,-0.2 -1,-0.2 0.926 55.9-171.2 43.2 84.6 4.6 -28.5 -22.0 121 121 A V T 3 + 0 0 65 1,-0.2 -1,-0.2 2,-0.1 -97,-0.0 0.303 68.3 88.8 -88.6 13.0 2.5 -27.7 -25.1 122 122 A A T 3 - 0 0 61 1,-0.1 -1,-0.2 2,-0.0 -2,-0.1 0.762 69.4-163.4 -80.4 -23.3 4.8 -30.0 -27.1 123 123 A S < + 0 0 125 -3,-0.7 -2,-0.1 1,-0.2 -1,-0.1 0.805 66.2 100.6 45.8 25.5 2.6 -33.0 -26.2 124 124 A G + 0 0 63 2,-0.1 -1,-0.2 0, 0.0 2,-0.1 0.230 67.1 67.3-121.6 12.4 5.7 -35.0 -27.4 125 125 A M 0 0 163 -5,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.215 360.0 360.0-112.2-154.4 7.1 -35.9 -23.9 126 126 A K 0 0 278 -2,-0.1 -2,-0.1 0, 0.0 -3,-0.0 -0.828 360.0 360.0-100.8 360.0 5.9 -38.1 -21.1