==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 18-OCT-00 1G2B . COMPND 2 MOLECULE: SPECTRIN ALPHA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR R.BERISIO,A.R.VIGUERA,L.SERRANO,M.WILMANNS . 62 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4561.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 34 54.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 35.5 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 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 . 3 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 6.5 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+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 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 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 0 3 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 A M 0 0 137 0, 0.0 2,-0.1 0, 0.0 60,-0.1 0.000 360.0 360.0 360.0 -91.1 -13.4 -0.5 20.4 2 48 A D - 0 0 85 58,-0.1 2,-0.3 60,-0.0 60,-0.2 -0.466 360.0-171.6 -57.1 136.4 -11.2 0.7 17.6 3 49 A R E -A 61 0A 163 58,-2.1 58,-2.2 -2,-0.1 2,-0.4 -0.965 11.8-155.3-137.0 150.0 -10.0 4.2 18.5 4 50 A Q E +A 60 0A 97 -2,-0.3 2,-0.3 56,-0.2 56,-0.2 -0.978 35.4 101.5-129.2 141.0 -8.1 6.9 16.5 5 51 A G E -A 59 0A 5 54,-2.1 54,-2.8 -2,-0.4 32,-0.3 -0.980 60.7 -49.1 172.8-169.7 -5.9 9.7 17.7 6 52 A F E +Ab 58 37A 69 30,-2.5 32,-1.1 -2,-0.3 52,-0.2 -0.610 36.3 178.0 -95.1 141.8 -2.5 11.0 18.3 7 53 A V E -A 57 0A 0 50,-2.3 50,-2.5 -2,-0.3 2,-0.2 -0.946 46.0 -84.5-128.4 158.3 0.5 9.5 20.0 8 54 A P E > -A 56 0A 17 0, 0.0 3,-2.1 0, 0.0 48,-0.3 -0.461 33.8-136.7 -63.5 129.4 4.0 10.9 20.4 9 55 A A G > S+ 0 0 12 46,-2.2 3,-1.5 1,-0.3 47,-0.1 0.816 101.0 62.7 -55.2 -35.1 6.0 10.1 17.3 10 56 A A G 3 S+ 0 0 77 45,-0.4 -1,-0.3 1,-0.2 46,-0.1 0.658 96.1 61.1 -63.3 -20.3 9.1 9.1 19.4 11 57 A Y G < S+ 0 0 96 -3,-2.1 16,-2.6 16,-0.1 17,-0.8 0.356 101.4 55.5 -95.2 3.2 7.1 6.3 20.9 12 58 A V E < -C 26 0A 9 -3,-1.5 2,-0.5 14,-0.2 14,-0.2 -0.945 67.8-144.4-133.0 155.9 6.4 4.4 17.7 13 59 A K E -C 25 0A 131 12,-2.1 12,-2.5 -2,-0.3 2,-0.2 -0.972 23.0-121.7-124.0 125.4 8.7 3.0 14.9 14 60 A K E -C 24 0A 111 -2,-0.5 10,-0.3 10,-0.2 2,-0.2 -0.454 21.3-145.4 -63.3 131.0 7.6 3.0 11.2 15 61 A L - 0 0 60 8,-2.3 8,-0.3 -2,-0.2 3,-0.1 -0.592 37.1 -86.1 -82.3 149.8 7.5 -0.4 9.6 16 62 A D - 0 0 160 -2,-0.2 -1,-0.1 1,-0.1 7,-0.1 -0.306 53.1 -97.9 -55.3 144.4 8.6 -0.5 6.0 17 2 A S + 0 0 84 5,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.327 59.4 144.3 -61.8 151.4 5.7 0.1 3.5 18 3 A G - 0 0 63 2,-0.3 2,-0.2 3,-0.2 -1,-0.1 -0.551 53.3 -14.8-153.6-143.4 4.0 -2.9 2.0 19 4 A T S S- 0 0 151 -2,-0.2 -1,-0.1 3,-0.0 2,-0.1 -0.508 111.2 -11.8 -71.3 135.5 0.6 -4.0 1.0 20 5 A G S S+ 0 0 60 -2,-0.2 -2,-0.3 -3,-0.1 0, 0.0 -0.365 111.6 5.8 76.1-147.6 -2.3 -1.7 2.3 21 6 A K S S- 0 0 145 1,-0.1 -3,-0.2 -4,-0.1 28,-0.1 -0.151 79.0 -93.8 -77.8 160.4 -1.9 0.9 4.9 22 7 A E - 0 0 75 26,-0.4 26,-2.6 -5,-0.1 2,-0.3 -0.408 43.5-157.1 -67.6 149.4 1.2 2.2 6.7 23 8 A L E - D 0 47A 65 -8,-0.3 -8,-2.3 24,-0.3 2,-0.3 -0.945 10.6-166.6-131.9 147.9 2.1 0.4 10.0 24 9 A V E -CD 14 46A 0 22,-2.3 22,-2.9 -2,-0.3 2,-0.5 -0.958 19.6-128.6-127.5 156.6 4.0 1.4 13.1 25 10 A L E -CD 13 45A 53 -12,-2.5 -12,-2.1 -2,-0.3 2,-0.6 -0.877 24.3-128.2 -99.8 126.3 5.3 -0.7 16.1 26 11 A A E -C 12 0A 1 18,-2.7 17,-2.8 -2,-0.5 -14,-0.2 -0.643 21.3-170.6 -73.3 118.4 4.5 0.7 19.6 27 12 A L + 0 0 44 -16,-2.6 2,-0.3 -2,-0.6 -1,-0.2 0.754 65.7 16.0 -82.7 -22.1 7.8 0.9 21.4 28 13 A Y S S- 0 0 126 -17,-0.8 2,-0.3 13,-0.1 -1,-0.1 -0.956 85.6 -93.2-145.9 154.3 6.3 1.7 24.9 29 14 A D - 0 0 106 -2,-0.3 2,-0.4 12,-0.2 12,-0.2 -0.588 45.8-176.3 -62.8 138.2 3.0 1.6 26.8 30 15 A Y B -F 40 0B 22 10,-2.8 10,-2.5 -2,-0.3 2,-0.5 -0.915 15.1-158.8-145.6 113.0 1.4 5.0 26.4 31 16 A Q - 0 0 155 -2,-0.4 8,-0.1 8,-0.2 10,-0.0 -0.804 38.5-101.8 -87.9 133.9 -1.9 6.0 28.1 32 17 A E - 0 0 88 -2,-0.5 7,-0.1 1,-0.1 -1,-0.1 -0.174 31.5-168.8 -55.5 135.9 -3.6 8.9 26.5 33 18 A K S S+ 0 0 175 1,-0.2 -1,-0.1 5,-0.1 6,-0.0 0.482 71.5 22.1-106.2 -10.7 -3.1 12.2 28.4 34 19 A S S > S- 0 0 36 4,-0.0 3,-2.1 1,-0.0 -1,-0.2 -0.966 88.0-101.5-153.4 156.7 -5.6 14.3 26.5 35 20 A P T 3 S+ 0 0 134 0, 0.0 -3,-0.0 0, 0.0 -1,-0.0 0.772 116.2 62.3 -54.8 -31.3 -8.8 13.5 24.5 36 21 A R T 3 S+ 0 0 162 -31,-0.1 -30,-2.5 2,-0.0 2,-0.1 0.594 98.9 71.7 -73.1 -8.3 -7.0 14.0 21.1 37 22 A E B < -b 6 0A 15 -3,-2.1 2,-0.3 -32,-0.3 -30,-0.2 -0.256 69.0-144.4 -93.9 179.2 -4.7 11.1 21.9 38 23 A V - 0 0 3 -32,-1.1 2,-0.4 -33,-0.2 -5,-0.1 -0.959 19.7-110.3-139.5 162.0 -5.2 7.3 22.1 39 24 A T + 0 0 61 -2,-0.3 2,-0.3 -8,-0.1 -8,-0.2 -0.764 33.5 179.0 -95.7 139.2 -3.8 4.6 24.3 40 25 A M B -F 30 0B 5 -10,-2.5 -10,-2.8 -2,-0.4 2,-0.4 -0.942 19.7-135.4-136.1 158.5 -1.3 1.9 23.0 41 26 A K > - 0 0 132 -2,-0.3 3,-2.5 -12,-0.2 -15,-0.2 -0.917 39.1 -91.9-109.9 143.5 0.5 -1.0 24.5 42 27 A K T 3 S+ 0 0 134 -2,-0.4 -15,-0.2 1,-0.3 -13,-0.1 -0.219 114.2 24.6 -50.8 132.8 4.1 -1.9 24.0 43 28 A G T 3 S+ 0 0 43 -17,-2.8 -1,-0.3 1,-0.3 -16,-0.1 0.235 86.4 141.2 90.6 -10.8 4.4 -4.3 21.0 44 29 A D < - 0 0 27 -3,-2.5 -18,-2.7 -19,-0.1 2,-0.6 -0.305 48.9-137.6 -62.6 144.3 1.1 -3.2 19.4 45 30 A I E -D 25 0A 98 -20,-0.2 2,-0.4 -22,-0.0 -20,-0.2 -0.925 30.6-167.4-104.3 111.7 1.1 -3.0 15.6 46 31 A L E -D 24 0A 4 -22,-2.9 -22,-2.3 -2,-0.6 2,-0.4 -0.852 25.2-118.8-109.7 139.8 -0.8 0.1 14.7 47 32 A T E -DE 23 60A 32 13,-1.2 13,-2.3 -2,-0.4 2,-0.6 -0.660 31.3-138.5 -71.8 124.6 -2.2 1.5 11.5 48 33 A L E + E 0 59A 15 -26,-2.6 -26,-0.4 -2,-0.4 11,-0.2 -0.838 28.0 172.4 -91.6 116.9 -0.5 4.8 10.8 49 34 A L E + 0 0 63 9,-2.5 2,-0.3 -2,-0.6 10,-0.2 0.752 66.7 6.0 -94.2 -37.6 -3.0 7.4 9.6 50 35 A N E + E 0 58A 62 8,-1.8 8,-2.6 1,-0.1 -1,-0.3 -0.866 46.8 166.4-156.6 120.0 -1.0 10.6 9.5 51 36 A S + 0 0 43 -2,-0.3 6,-0.1 6,-0.2 -1,-0.1 -0.041 47.4 113.4-120.6 29.0 2.8 11.2 10.1 52 37 A T + 0 0 124 4,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.748 64.5 70.6 -73.7 -24.7 3.0 14.8 8.7 53 38 A N S S- 0 0 77 3,-0.5 -44,-0.0 -3,-0.1 -3,-0.0 -0.737 76.2-141.9 -93.3 142.9 3.7 16.4 12.1 54 39 A K S S+ 0 0 174 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.748 97.6 34.6 -75.6 -22.6 7.1 15.7 13.7 55 40 A D S S+ 0 0 92 1,-0.2 -46,-2.2 -46,-0.1 2,-0.5 0.760 118.5 40.0-101.5 -35.8 5.8 15.4 17.2 56 41 A W E -A 8 0A 69 -48,-0.3 -3,-0.5 -47,-0.1 2,-0.4 -0.984 60.3-169.4-130.3 120.4 2.4 13.8 17.0 57 42 A W E -A 7 0A 36 -50,-2.5 -50,-2.3 -2,-0.5 2,-0.5 -0.901 21.9-129.6-110.0 139.1 1.3 10.9 14.7 58 43 A K E +AE 6 50A 74 -8,-2.6 -9,-2.5 -2,-0.4 -8,-1.8 -0.749 37.9 167.2 -90.2 124.6 -2.3 9.9 14.2 59 44 A V E -AE 5 48A 0 -54,-2.8 -54,-2.1 -2,-0.5 2,-0.4 -0.888 35.5-125.1-128.6 163.8 -2.8 6.1 14.6 60 45 A E E -AE 4 47A 48 -13,-2.3 -13,-1.2 -2,-0.3 2,-0.2 -0.986 32.4-172.7-116.1 129.5 -5.6 3.6 15.0 61 46 A V E A 3 0A 6 -58,-2.2 -58,-2.1 -2,-0.4 -21,-0.1 -0.720 360.0 360.0-113.0 160.4 -5.4 1.3 18.1 62 47 A N 0 0 150 -2,-0.2 -22,-0.1 -60,-0.2 -58,-0.1 0.374 360.0 360.0 -90.2 360.0 -7.3 -1.6 19.2