==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SH3 DOMAIN 07-AUG-97 1NEB . COMPND 2 MOLECULE: NEBULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.S.POLITOU,A.PASTORE . 60 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4500.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 29 48.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 23.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.7 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 . 0 0.0 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 . 6 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 3.3 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 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 T 0 0 202 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 43.4 -0.9 -2.0 -8.6 2 2 A A + 0 0 94 2,-0.0 28,-0.1 1,-0.0 0, 0.0 -0.225 360.0 130.2-162.2 61.9 2.9 -1.9 -9.2 3 3 A G + 0 0 70 26,-0.0 -1,-0.0 2,-0.0 0, 0.0 0.066 35.3 140.9-106.3 25.6 3.9 0.2 -12.3 4 4 A K - 0 0 132 26,-0.1 2,-0.4 1,-0.1 26,-0.1 0.014 45.9-127.9 -57.7 175.0 6.5 2.2 -10.5 5 5 A I - 0 0 105 24,-0.1 55,-1.0 2,-0.0 2,-0.2 -0.989 20.2-167.5-132.7 138.1 9.8 3.0 -12.3 6 6 A F E -AB 28 59A 34 22,-2.2 22,-0.9 -2,-0.4 2,-0.3 -0.661 3.0-158.3-115.9 174.6 13.4 2.5 -11.2 7 7 A R E -AB 27 58A 103 51,-1.6 51,-1.4 -2,-0.2 2,-0.4 -0.974 14.3-131.2-155.3 138.4 16.8 3.8 -12.5 8 8 A A E - B 0 57A 0 18,-1.2 17,-2.9 -2,-0.3 18,-0.2 -0.733 15.1-176.1 -92.6 137.5 20.4 2.6 -12.2 9 9 A M + 0 0 48 47,-1.1 2,-0.4 -2,-0.4 15,-0.2 0.155 65.1 65.5-116.2 18.8 23.1 5.1 -11.2 10 10 A Y S S- 0 0 113 13,-0.2 2,-1.8 12,-0.1 12,-0.2 -0.982 77.8-128.1-143.4 130.8 26.1 2.9 -11.5 11 11 A D - 0 0 107 -2,-0.4 12,-0.2 12,-0.1 2,-0.1 -0.523 41.2-179.4 -77.1 85.6 27.7 1.2 -14.6 12 12 A Y - 0 0 58 -2,-1.8 2,-0.4 10,-1.3 10,-0.2 -0.423 19.5-144.7 -83.2 162.7 27.8 -2.4 -13.2 13 13 A M - 0 0 150 8,-0.1 8,-0.2 -2,-0.1 -2,-0.0 -0.876 17.1-128.3-132.1 103.4 29.2 -5.3 -15.3 14 14 A A - 0 0 33 -2,-0.4 7,-0.1 1,-0.2 3,-0.0 -0.242 24.3-175.4 -49.6 117.0 27.6 -8.8 -14.8 15 15 A A + 0 0 81 5,-0.1 2,-0.2 -2,-0.0 -1,-0.2 0.741 67.0 15.3 -90.0 -23.8 30.5 -11.1 -14.1 16 16 A D S S- 0 0 117 4,-0.1 3,-0.5 0, 0.0 0, 0.0 -0.671 91.0 -90.5-134.0-169.8 28.4 -14.3 -14.0 17 17 A A S S+ 0 0 103 -2,-0.2 3,-0.0 1,-0.2 -3,-0.0 0.162 104.0 86.7 -93.5 21.4 25.0 -15.5 -15.1 18 18 A D S S+ 0 0 101 32,-0.1 33,-2.2 2,-0.1 -1,-0.2 0.813 99.2 12.5 -89.0 -31.7 23.4 -14.6 -11.7 19 19 A E B S-c 51 0B 28 -3,-0.5 33,-0.2 31,-0.3 2,-0.1 -0.601 76.2-117.9-129.1-168.2 22.7 -11.0 -12.6 20 20 A V - 0 0 1 31,-1.3 2,-0.4 -2,-0.2 -6,-0.1 -0.358 25.2-106.9-118.8-158.9 22.5 -8.7 -15.6 21 21 A S + 0 0 50 -8,-0.2 2,-0.3 -2,-0.1 27,-0.1 -0.966 37.3 159.7-140.8 124.7 24.3 -5.6 -16.8 22 22 A F - 0 0 4 -2,-0.4 -10,-1.3 -12,-0.2 2,-0.1 -0.992 26.4-135.3-142.7 150.2 23.0 -2.0 -17.0 23 23 A K > - 0 0 121 -2,-0.3 3,-1.3 -12,-0.2 2,-0.6 -0.374 47.1 -70.5 -96.1 179.8 24.6 1.5 -17.2 24 24 A D T 3 S+ 0 0 83 1,-0.2 -15,-0.3 -15,-0.2 -1,-0.1 -0.575 122.8 26.7 -73.6 118.1 23.7 4.6 -15.2 25 25 A G T 3 S+ 0 0 40 -17,-2.9 -1,-0.2 -2,-0.6 -16,-0.1 0.103 83.9 137.9 118.4 -22.1 20.3 5.9 -16.6 26 26 A D < - 0 0 9 -3,-1.3 -18,-1.2 -18,-0.2 2,-0.5 -0.117 52.8-123.4 -52.5 154.3 18.9 2.5 -17.8 27 27 A A E +A 7 0A 53 -20,-0.2 17,-1.6 -22,-0.0 2,-0.3 -0.889 40.5 157.1-107.4 129.0 15.2 2.0 -16.9 28 28 A I E -A 6 0A 7 -22,-0.9 -22,-2.2 -2,-0.5 2,-0.3 -0.904 25.8-140.2-141.3 170.5 14.2 -1.1 -14.9 29 29 A I - 0 0 73 -2,-0.3 2,-1.8 -24,-0.2 13,-0.4 -0.938 27.2-110.7-133.7 157.4 11.3 -2.3 -12.7 30 30 A N + 0 0 74 -2,-0.3 11,-0.2 1,-0.2 -26,-0.1 -0.500 40.0 169.4 -86.0 73.8 11.0 -4.3 -9.5 31 31 A V - 0 0 68 -2,-1.8 2,-0.3 9,-0.4 -1,-0.2 0.883 67.9 -36.1 -53.3 -36.3 9.4 -7.4 -11.0 32 32 A Q B -D 40 0B 138 8,-1.2 8,-1.0 -3,-0.2 2,-0.3 -0.960 56.7-148.4-169.0-175.5 10.0 -9.2 -7.6 33 33 A A - 0 0 60 -2,-0.3 6,-0.1 6,-0.2 5,-0.1 -0.943 12.2-146.3-168.9 145.9 12.4 -9.5 -4.7 34 34 A I - 0 0 117 4,-0.4 -1,-0.1 -2,-0.3 5,-0.1 0.956 51.5 -98.5 -82.2 -73.4 13.6 -12.1 -2.2 35 35 A D S S+ 0 0 143 3,-0.3 2,-0.4 2,-0.2 3,-0.1 -0.045 91.1 10.5-174.9 -68.7 14.3 -10.2 1.1 36 36 A E S S+ 0 0 180 1,-0.1 3,-0.1 3,-0.0 -3,-0.0 -0.752 105.1 60.9-135.7 90.8 17.9 -9.3 1.9 37 37 A G S S- 0 0 41 1,-0.4 -3,-0.2 -2,-0.4 -2,-0.2 0.017 103.6 -47.7 154.1 90.7 20.4 -9.8 -1.0 38 38 A W - 0 0 94 13,-0.1 -1,-0.4 -3,-0.1 -4,-0.4 0.142 65.6-121.5 53.3 177.4 20.2 -8.1 -4.4 39 39 A M E - E 0 52B 25 13,-3.0 13,-1.5 -6,-0.1 2,-0.4 -0.538 15.2-104.8-134.7-157.9 16.9 -8.0 -6.2 40 40 A Y E +DE 32 51B 90 -8,-1.0 -8,-1.2 11,-0.3 -9,-0.4 -0.953 43.5 142.9-143.9 123.3 15.4 -9.1 -9.6 41 41 A G E - E 0 50B 0 9,-1.7 9,-1.6 -2,-0.4 2,-0.6 -0.929 43.8-116.3-148.8 172.5 14.5 -6.9 -12.6 42 42 A T E - E 0 49B 30 -13,-0.4 7,-0.2 -2,-0.3 -13,-0.1 -0.880 27.6-131.6-120.6 104.2 14.6 -7.0 -16.4 43 43 A V > - 0 0 0 5,-1.5 4,-1.6 -2,-0.6 5,-0.4 -0.275 11.1-155.5 -52.1 120.3 16.8 -4.4 -18.1 44 44 A Q T 4 S+ 0 0 126 -17,-1.6 -1,-0.2 1,-0.2 -16,-0.1 0.509 83.1 75.7 -79.2 -0.6 14.7 -2.8 -20.8 45 45 A R T 4 S- 0 0 176 -18,-0.2 -1,-0.2 3,-0.1 -23,-0.1 0.961 123.8 -4.1 -75.5 -51.0 17.8 -1.9 -22.7 46 46 A T T 4 S- 0 0 98 -3,-0.2 -2,-0.2 2,-0.1 -1,-0.1 0.588 97.3-112.4-115.5 -18.8 18.6 -5.3 -24.1 47 47 A G < + 0 0 46 -4,-1.6 2,-0.6 1,-0.3 -3,-0.2 0.739 60.0 155.8 92.5 24.6 15.9 -7.4 -22.4 48 48 A R - 0 0 133 -5,-0.4 -5,-1.5 -27,-0.1 2,-0.4 -0.736 28.3-154.8 -88.7 124.0 18.2 -9.4 -20.1 49 49 A T E + E 0 42B 73 -2,-0.6 2,-0.3 -7,-0.2 -7,-0.2 -0.796 36.8 112.8 -99.3 138.0 16.6 -10.7 -17.0 50 50 A G E - E 0 41B 8 -9,-1.6 -9,-1.7 -2,-0.4 -31,-0.3 -0.982 66.5 -56.0 179.1 177.3 18.7 -11.4 -13.8 51 51 A M E -cE 19 40B 53 -33,-2.2 -31,-1.3 -2,-0.3 -11,-0.3 -0.382 50.4-150.7 -71.6 152.3 19.4 -10.4 -10.2 52 52 A L E - E 0 39B 1 -13,-1.5 -13,-3.0 -33,-0.2 2,-0.7 -0.934 22.8-103.8-126.6 151.5 20.4 -6.7 -9.7 53 53 A P >> - 0 0 7 0, 0.0 4,-1.8 0, 0.0 3,-1.8 -0.585 25.0-162.7 -73.6 110.0 22.5 -5.0 -7.0 54 54 A A T 34 S+ 0 0 44 -2,-0.7 -14,-0.0 1,-0.3 0, 0.0 0.810 90.1 60.5 -64.6 -25.9 20.1 -3.3 -4.6 55 55 A N T 34 S+ 0 0 153 1,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.428 110.5 41.3 -81.9 5.1 23.0 -1.2 -3.3 56 56 A Y T <4 S+ 0 0 105 -3,-1.8 -47,-1.1 1,-0.1 2,-0.2 0.666 110.1 54.3-119.5 -33.3 23.5 0.2 -6.8 57 57 A V E < +B 8 0A 15 -4,-1.8 2,-0.3 -49,-0.2 -49,-0.2 -0.618 61.7 173.9-100.8 163.7 20.0 0.9 -8.1 58 58 A E E -B 7 0A 91 -51,-1.4 -51,-1.6 -2,-0.2 2,-0.1 -0.985 32.4 -93.2-159.6 167.2 17.2 2.9 -6.4 59 59 A A E B 6 0A 52 -2,-0.3 -53,-0.2 -53,-0.2 -55,-0.0 -0.385 360.0 360.0 -83.2 166.1 13.7 4.3 -7.0 60 60 A I 0 0 139 -55,-1.0 -54,-0.1 -2,-0.1 -1,-0.1 0.132 360.0 360.0-139.9 360.0 13.0 7.8 -8.3