==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SH3-DOMAIN 14-APR-04 1V1C . COMPND 2 MOLECULE: OBSCURIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.PFUHL,M.GAUTEL . 68 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5620.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 40 58.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 35.3 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 1.5 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 . 9 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 8.8 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+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 1 2 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 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 1 A I 0 0 185 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -53.1 11.8 8.1 -6.2 2 2 A F - 0 0 89 28,-0.0 2,-0.5 1,-0.0 30,-0.1 -0.355 360.0-117.7 -91.2 174.6 8.6 6.4 -4.8 3 3 A D - 0 0 82 28,-0.4 28,-1.1 -2,-0.1 2,-0.7 -0.932 17.6-155.0-122.3 110.2 7.3 6.5 -1.2 4 4 A I E -AB 30 65A 15 -2,-0.5 61,-0.5 61,-0.5 26,-0.3 -0.730 16.4-165.3 -85.4 114.5 7.0 3.3 0.8 5 5 A Y E -AB 29 64A 32 24,-2.4 24,-1.4 -2,-0.7 2,-0.4 -0.617 7.0-141.4 -97.8 158.8 4.4 3.5 3.5 6 6 A V E -AB 28 63A 11 57,-1.0 57,-1.1 -2,-0.2 2,-0.8 -0.955 13.9-124.6-124.6 141.3 3.8 1.2 6.4 7 7 A V E + B 0 62A 2 20,-0.8 19,-0.4 -2,-0.4 20,-0.2 -0.734 34.8 163.5 -85.9 108.7 0.6 -0.1 8.0 8 8 A T S S+ 0 0 83 53,-0.9 -1,-0.1 -2,-0.8 54,-0.1 0.139 76.2 45.4-109.7 17.6 0.7 0.8 11.7 9 9 A A S S- 0 0 54 52,-0.2 -1,-0.1 15,-0.0 16,-0.1 0.201 108.3-113.8-141.9 12.3 -3.0 0.3 12.3 10 10 A D - 0 0 52 1,-0.1 2,-0.2 51,-0.1 14,-0.1 0.395 20.5-138.8 63.8 152.9 -3.7 -3.0 10.5 11 11 A Y B +F 23 0B 51 12,-0.7 12,-1.4 -4,-0.1 -1,-0.1 -0.707 27.4 164.2-151.0 93.6 -5.9 -3.3 7.4 12 12 A L - 0 0 95 -2,-0.2 2,-0.2 10,-0.1 10,-0.1 -0.926 36.0-128.8-116.3 109.3 -8.3 -6.2 7.0 13 13 A P - 0 0 43 0, 0.0 2,-1.1 0, 0.0 4,-0.1 -0.347 17.7-140.7 -57.9 120.1 -11.1 -5.8 4.3 14 14 A L - 0 0 167 -2,-0.2 2,-0.4 2,-0.1 -2,-0.0 -0.716 67.9 -27.4 -87.6 96.6 -14.4 -6.6 5.9 15 15 A G S S- 0 0 71 -2,-1.1 2,-0.6 2,-0.1 0, 0.0 -0.842 114.2 -19.9 106.2-138.7 -16.3 -8.5 3.3 16 16 A A - 0 0 96 -2,-0.4 2,-0.5 2,-0.0 -2,-0.1 -0.927 59.1-177.7-118.1 108.9 -15.8 -8.3 -0.5 17 17 A E > - 0 0 123 -2,-0.6 3,-0.9 -4,-0.1 2,-0.2 -0.914 19.4-137.5-108.9 126.4 -14.0 -5.1 -1.7 18 18 A Q T 3 S+ 0 0 158 -2,-0.5 3,-0.1 1,-0.2 -2,-0.0 -0.577 85.9 7.8 -82.5 142.1 -13.5 -4.6 -5.5 19 19 A D T 3 S+ 0 0 107 -2,-0.2 37,-1.4 1,-0.2 2,-0.3 0.745 105.5 126.4 61.3 24.2 -10.2 -3.2 -6.7 20 20 A A B < -c 56 0A 35 -3,-0.9 2,-0.4 35,-0.2 -1,-0.2 -0.762 47.5-150.5-112.8 158.8 -8.9 -3.6 -3.2 21 21 A I - 0 0 26 35,-0.7 2,-0.1 -2,-0.3 34,-0.1 -0.971 18.8-116.8-130.5 144.6 -5.8 -5.4 -1.7 22 22 A T - 0 0 103 -2,-0.4 2,-0.3 -10,-0.1 -10,-0.1 -0.461 33.0-174.6 -78.0 150.0 -5.2 -7.0 1.6 23 23 A L B -F 11 0B 9 -12,-1.4 -12,-0.7 -2,-0.1 2,-0.4 -0.989 16.2-142.3-145.8 152.6 -2.5 -5.7 4.0 24 24 A R > - 0 0 154 -2,-0.3 3,-1.2 -14,-0.1 2,-0.8 -0.941 36.4 -99.8-119.2 139.0 -0.9 -6.6 7.3 25 25 A E T 3 S+ 0 0 117 -2,-0.4 -17,-0.2 1,-0.3 -19,-0.0 -0.367 114.4 34.7 -57.2 99.8 0.2 -4.2 10.0 26 26 A G T 3 S+ 0 0 39 -2,-0.8 -1,-0.3 -19,-0.4 2,-0.2 0.542 86.8 130.7 126.2 20.8 3.9 -4.0 9.3 27 27 A Q < - 0 0 76 -3,-1.2 -20,-0.8 -20,-0.2 2,-0.4 -0.619 45.9-137.3-101.0 161.3 4.1 -4.2 5.6 28 28 A Y E +A 6 0A 118 -2,-0.2 17,-0.7 -22,-0.2 2,-0.3 -0.967 28.0 158.2-122.7 135.1 6.0 -2.0 3.1 29 29 A V E -AD 5 44A 2 -24,-1.4 -24,-2.4 -2,-0.4 15,-0.2 -0.881 28.4-138.4-159.5 123.5 4.7 -0.7 -0.2 30 30 A E E -AD 4 43A 37 13,-0.5 13,-1.8 -26,-0.3 2,-0.4 -0.441 28.4-112.7 -78.9 153.2 5.7 2.3 -2.4 31 31 A V E - D 0 42A 19 -28,-1.1 -28,-0.4 11,-0.2 11,-0.3 -0.711 23.7-170.1 -90.2 135.8 3.1 4.5 -4.1 32 32 A L E - 0 0 34 9,-2.1 2,-0.3 -2,-0.4 10,-0.2 0.948 65.7 -10.5 -85.7 -66.5 2.8 4.4 -7.9 33 33 A D E - D 0 41A 110 8,-0.7 8,-2.1 0, 0.0 2,-0.7 -0.975 59.4-126.4-138.8 151.7 0.5 7.3 -8.8 34 34 A A E + 0 0 75 -2,-0.3 6,-0.1 6,-0.2 8,-0.0 -0.862 37.9 155.3-102.6 108.3 -1.8 9.7 -6.9 35 35 A A E + 0 0 56 -2,-0.7 -1,-0.2 1,-0.3 5,-0.2 0.897 63.9 6.3 -92.2 -77.9 -5.4 9.7 -8.3 36 36 A H E > - D 0 39A 126 3,-1.2 3,-0.6 1,-0.1 -1,-0.3 -0.875 65.2-125.0-113.4 145.2 -7.9 10.8 -5.7 37 37 A P T 3 S+ 0 0 104 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.725 110.3 63.6 -56.7 -21.7 -7.2 12.1 -2.1 38 38 A L T 3 S+ 0 0 137 1,-0.3 2,-0.3 20,-0.1 22,-0.3 0.942 121.6 0.4 -68.9 -49.5 -9.4 9.3 -0.9 39 39 A R E < -D 36 0A 93 -3,-0.6 -3,-1.2 19,-0.2 -4,-0.3 -0.985 67.8-152.3-147.1 132.3 -7.2 6.4 -2.1 40 40 A W E - E 0 57A 81 17,-1.1 17,-1.5 -2,-0.3 2,-0.4 -0.702 29.1-102.8-103.6 155.8 -3.9 6.4 -4.0 41 41 A L E +DE 33 56A 25 -8,-2.1 -9,-2.1 -2,-0.3 -8,-0.7 -0.637 48.1 169.0 -79.4 126.2 -2.5 3.8 -6.3 42 42 A V E -DE 31 55A 5 13,-0.7 13,-1.5 -2,-0.4 2,-0.4 -0.965 21.7-161.8-138.5 154.3 0.1 1.5 -4.7 43 43 A R E -DE 30 54A 113 -13,-1.8 -13,-0.5 -2,-0.3 11,-0.2 -0.947 22.0-127.9-141.6 117.0 2.0 -1.7 -5.6 44 44 A T E -D 29 0A 23 9,-1.5 -15,-0.2 -2,-0.4 -40,-0.0 -0.159 30.3-109.4 -58.8 154.7 3.8 -3.9 -3.1 45 45 A K - 0 0 114 -17,-0.7 2,-0.1 7,-0.1 -17,-0.1 -0.749 29.5-125.8 -91.6 132.1 7.4 -4.9 -3.8 46 46 A P - 0 0 83 0, 0.0 2,-0.4 0, 0.0 6,-0.1 -0.436 24.4-164.9 -75.9 149.1 8.1 -8.5 -4.8 47 47 A T > - 0 0 100 3,-0.4 3,-2.5 -2,-0.1 2,-2.1 -0.999 56.7 -27.9-139.8 135.9 10.7 -10.6 -2.9 48 48 A K T 3 S- 0 0 203 -2,-0.4 0, 0.0 1,-0.3 0, 0.0 -0.410 132.3 -26.4 65.0 -81.1 12.5 -13.8 -3.7 49 49 A S T 3 S+ 0 0 101 -2,-2.1 -1,-0.3 2,-0.1 0, 0.0 0.199 99.8 127.7-147.9 12.5 9.7 -15.3 -5.9 50 50 A S < - 0 0 68 -3,-2.5 -3,-0.4 1,-0.1 -2,-0.0 -0.668 60.9-120.8 -81.1 120.5 6.6 -13.6 -4.6 51 51 A P - 0 0 110 0, 0.0 2,-0.5 0, 0.0 -4,-0.1 -0.269 26.6-112.7 -60.2 142.5 4.6 -11.9 -7.4 52 52 A S - 0 0 61 -6,-0.1 2,-0.3 -9,-0.0 -7,-0.1 -0.664 33.3-161.9 -82.1 126.1 4.0 -8.2 -7.1 53 53 A R - 0 0 166 -2,-0.5 -9,-1.5 -8,-0.0 2,-0.5 -0.824 4.8-151.7-109.7 148.1 0.4 -7.2 -6.5 54 54 A Q E + E 0 43A 79 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.974 25.4 152.0-123.6 127.1 -1.2 -3.8 -7.0 55 55 A G E - E 0 42A 3 -13,-1.5 -13,-0.7 -2,-0.5 2,-0.3 -0.996 44.2-103.5-151.8 151.8 -4.2 -2.5 -5.1 56 56 A W E -cE 20 41A 69 -37,-1.4 -35,-0.7 -2,-0.3 2,-0.3 -0.569 42.2-178.1 -77.4 135.8 -5.8 0.8 -4.0 57 57 A V E - E 0 40A 4 -17,-1.5 -17,-1.1 -2,-0.3 -35,-0.0 -0.857 31.5-101.5-131.2 166.0 -5.3 1.6 -0.3 58 58 A S > - 0 0 34 -2,-0.3 3,-1.3 -19,-0.2 -19,-0.2 -0.793 17.9-158.1 -92.3 119.8 -6.3 4.4 2.1 59 59 A P G > S+ 0 0 31 0, 0.0 3,-0.7 0, 0.0 -1,-0.1 0.516 83.0 84.5 -72.5 -3.7 -3.5 6.9 2.9 60 60 A A G 3 S+ 0 0 85 -22,-0.3 -21,-0.0 1,-0.2 -22,-0.0 0.529 99.5 35.8 -75.4 -5.0 -5.4 7.7 6.2 61 61 A Y G < S+ 0 0 122 -3,-1.3 -53,-0.9 2,-0.0 2,-0.5 0.248 101.1 92.8-128.0 6.8 -3.6 4.8 7.7 62 62 A L E < -B 7 0A 21 -3,-0.7 2,-0.3 -55,-0.1 -55,-0.1 -0.901 57.3-158.3-109.2 131.5 -0.3 5.0 5.9 63 63 A D E -B 6 0A 84 -57,-1.1 -57,-1.0 -2,-0.5 2,-0.2 -0.831 30.5 -97.7-109.1 146.4 2.7 6.9 7.4 64 64 A R E +B 5 0A 227 -2,-0.3 2,-0.4 -59,-0.2 -59,-0.1 -0.404 49.9 172.6 -62.4 126.8 5.7 8.4 5.5 65 65 A R E -B 4 0A 123 -61,-0.5 -61,-0.5 -2,-0.2 2,-0.3 -0.999 19.7-150.6-142.3 136.8 8.6 6.0 5.7 66 66 A L - 0 0 151 -2,-0.4 2,-0.1 -63,-0.1 -63,-0.1 -0.836 15.5-131.3-109.1 144.6 12.0 6.0 4.0 67 67 A K 0 0 115 -2,-0.3 -1,-0.0 1,-0.1 -63,-0.0 -0.461 360.0 360.0 -88.6 163.4 14.2 3.0 3.1 68 68 A L 0 0 233 -2,-0.1 -1,-0.1 0, 0.0 0, 0.0 0.931 360.0 360.0 -82.1 360.0 17.9 2.5 3.9