==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, STRUCTURAL PROTEIN 26-APR-06 2DNU . COMPND 2 MOLECULE: SH3 MULTIPLE DOMAINS 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.OHASHI,H.HIROTA,T.NAGASHIMA,C.KUROSAKI,F.HAYASHI, . 71 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5566.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 41 57.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 28.2 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 . 1 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 1.4 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 . 12 16.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 7.0 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+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 2 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 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 G 0 0 120 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-136.9 -9.8 13.5 -11.3 2 2 A S + 0 0 114 1,-0.1 0, 0.0 2,-0.0 0, 0.0 0.972 360.0 167.7 -56.5 -59.6 -7.5 12.3 -8.5 3 3 A S + 0 0 123 1,-0.1 -1,-0.1 2,-0.0 0, 0.0 0.864 50.4 94.7 43.7 43.1 -4.8 14.9 -9.1 4 4 A G + 0 0 33 2,-0.0 -1,-0.1 0, 0.0 3,-0.1 0.649 32.7 158.6-121.7 -71.3 -3.3 13.9 -5.8 5 5 A S + 0 0 106 1,-0.2 2,-0.4 29,-0.0 -2,-0.0 0.843 46.5 130.4 40.9 41.0 -0.5 11.3 -5.9 6 6 A S + 0 0 95 28,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.960 20.8 121.1-126.5 142.8 0.5 12.7 -2.5 7 7 A G - 0 0 47 -2,-0.4 3,-0.1 1,-0.1 29,-0.1 -0.924 58.8 -98.0-170.6-166.1 1.3 10.9 0.7 8 8 A E S S+ 0 0 181 27,-0.4 2,-0.5 -2,-0.3 -1,-0.1 0.866 102.1 12.3 -99.3 -59.7 3.8 10.1 3.5 9 9 A E E -A 35 0A 63 26,-0.9 26,-2.5 53,-0.0 2,-0.6 -0.936 68.0-155.7-128.2 109.6 5.4 6.8 2.6 10 10 A K E -A 34 0A 85 -2,-0.5 53,-1.2 24,-0.2 24,-0.2 -0.736 19.1-176.4 -87.0 119.6 4.9 5.3 -0.9 11 11 A Y E -AB 33 62A 26 22,-1.8 22,-3.2 -2,-0.6 2,-0.4 -0.573 15.9-133.0-108.9 173.6 5.3 1.5 -0.9 12 12 A V E -AB 32 61A 30 49,-3.0 49,-1.4 20,-0.2 2,-0.3 -0.982 14.5-125.4-131.9 142.1 5.3 -1.1 -3.7 13 13 A T - 0 0 3 18,-1.6 17,-1.2 -2,-0.4 18,-0.3 -0.661 17.3-176.1 -87.1 138.2 3.5 -4.4 -4.0 14 14 A V S S+ 0 0 45 -2,-0.3 15,-0.2 45,-0.3 -1,-0.1 0.470 72.7 31.4-108.1 -7.6 5.6 -7.5 -4.8 15 15 A Q S S- 0 0 102 44,-0.4 -1,-0.2 13,-0.2 12,-0.1 -0.996 85.7-102.6-152.2 146.3 2.6 -9.9 -5.0 16 16 A P - 0 0 84 0, 0.0 2,-0.4 0, 0.0 12,-0.2 -0.410 33.2-160.7 -69.8 141.2 -1.1 -9.8 -6.0 17 17 A Y B -F 27 0B 42 10,-1.9 2,-0.6 -2,-0.1 10,-0.6 -0.989 8.0-149.3-129.5 130.3 -3.7 -9.7 -3.3 18 18 A T - 0 0 114 -2,-0.4 2,-0.3 8,-0.2 8,-0.1 -0.867 15.8-141.2-101.8 116.3 -7.4 -10.6 -3.5 19 19 A S - 0 0 46 -2,-0.6 7,-0.1 1,-0.2 3,-0.1 -0.586 10.9-166.6 -77.6 130.8 -9.7 -8.7 -1.2 20 20 A Q S S+ 0 0 131 -2,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.835 73.3 15.2 -84.0 -36.4 -12.5 -10.8 0.2 21 21 A S S > S- 0 0 68 1,-0.1 3,-1.8 4,-0.0 -1,-0.2 -0.893 84.5-100.6-135.6 164.9 -14.5 -7.8 1.6 22 22 A K T 3 S+ 0 0 188 -2,-0.3 32,-0.2 1,-0.3 -1,-0.1 0.915 115.2 70.2 -49.4 -49.6 -14.7 -4.0 1.1 23 23 A D T 3 S+ 0 0 119 30,-0.1 31,-2.3 -3,-0.0 2,-0.3 0.808 102.4 53.9 -38.1 -37.1 -12.7 -3.6 4.4 24 24 A E B < S-c 54 0A 40 -3,-1.8 2,-0.4 29,-0.3 31,-0.2 -0.769 79.7-142.8-104.8 149.6 -9.8 -5.0 2.4 25 25 A I - 0 0 13 29,-0.9 2,-0.5 -2,-0.3 28,-0.1 -0.930 8.6-146.4-114.8 133.6 -8.4 -3.7 -0.9 26 26 A G + 0 0 26 -2,-0.4 2,-0.2 -7,-0.1 -8,-0.2 -0.837 24.5 166.2-102.1 132.8 -7.1 -6.0 -3.6 27 27 A F B -F 17 0B 14 -10,-0.6 -10,-1.9 -2,-0.5 2,-0.2 -0.711 29.1-107.1-131.2-178.0 -4.2 -4.9 -5.9 28 28 A E > - 0 0 110 -2,-0.2 2,-0.6 -12,-0.2 3,-0.6 -0.585 37.3 -92.6-108.9 172.8 -1.8 -6.3 -8.4 29 29 A K T 3 S+ 0 0 137 1,-0.2 -15,-0.2 -2,-0.2 -17,-0.0 -0.771 106.1 32.7 -90.5 119.3 2.0 -7.1 -8.3 30 30 A G T 3 S+ 0 0 56 -17,-1.2 2,-0.3 -2,-0.6 -1,-0.2 0.701 89.9 118.0 109.4 30.4 4.1 -4.2 -9.6 31 31 A V < - 0 0 21 -3,-0.6 -18,-1.6 -18,-0.3 2,-0.4 -0.793 62.0-110.0-123.6 166.8 2.1 -1.2 -8.6 32 32 A T E -A 12 0A 93 -2,-0.3 2,-0.3 -20,-0.2 -20,-0.2 -0.824 33.2-175.1-101.1 134.8 2.6 1.9 -6.4 33 33 A V E -A 11 0A 1 -22,-3.2 -22,-1.8 -2,-0.4 2,-0.6 -0.885 22.7-129.6-126.8 158.0 0.7 2.3 -3.1 34 34 A E E -AD 10 47A 16 13,-1.1 13,-1.0 -2,-0.3 2,-0.6 -0.913 18.4-145.0-112.4 109.4 0.4 5.0 -0.5 35 35 A V E +AD 9 46A 4 -26,-2.5 -26,-0.9 -2,-0.6 -27,-0.4 -0.608 29.2 163.0 -75.2 113.7 0.9 3.8 3.1 36 36 A I + 0 0 62 9,-3.1 2,-0.3 -2,-0.6 10,-0.2 0.899 62.5 18.6 -94.4 -59.7 -1.4 5.9 5.4 37 37 A R - 0 0 165 8,-1.3 2,-0.4 0, 0.0 8,-0.4 -0.803 61.5-154.4-115.1 156.8 -1.5 3.9 8.7 38 38 A K + 0 0 109 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.915 16.3 179.5-135.8 108.2 0.7 1.2 10.1 39 39 A N - 0 0 68 4,-2.5 3,-0.1 -2,-0.4 0, 0.0 -0.267 33.9-123.3 -95.2-175.4 -0.6 -1.3 12.6 40 40 A L S S+ 0 0 162 1,-0.2 2,-2.5 2,-0.1 -1,-0.1 0.736 95.8 78.4 -99.9 -31.1 1.1 -4.2 14.4 41 41 A E S S- 0 0 139 1,-0.2 -1,-0.2 2,-0.1 3,-0.1 -0.323 122.9 -89.8 -77.1 58.7 -1.3 -7.0 13.2 42 42 A G S S+ 0 0 42 -2,-2.5 15,-0.6 1,-0.2 2,-0.5 0.811 92.7 133.7 36.1 40.8 0.4 -7.1 9.8 43 43 A W E + E 0 56A 76 13,-0.2 -4,-2.5 14,-0.1 2,-0.6 -0.946 30.8 176.5-125.1 111.7 -2.1 -4.5 8.7 44 44 A W E - E 0 55A 51 11,-2.8 11,-0.6 -2,-0.5 2,-0.4 -0.916 25.6-138.3-118.4 106.3 -1.0 -1.5 6.8 45 45 A Y E + E 0 54A 52 -2,-0.6 -9,-3.1 -8,-0.4 -8,-1.3 -0.463 35.6 170.6 -64.5 115.4 -3.7 0.9 5.6 46 46 A I E -DE 35 53A 0 7,-1.4 7,-1.5 -2,-0.4 2,-0.5 -0.714 30.1-125.6-121.9 173.4 -2.8 1.9 2.1 47 47 A R E +DE 34 52A 94 -13,-1.0 -13,-1.1 -2,-0.2 2,-0.3 -0.976 34.6 156.5-127.2 121.0 -4.5 3.8 -0.8 48 48 A Y E > + E 0 51A 50 3,-2.5 3,-1.0 -2,-0.5 -15,-0.1 -0.998 63.5 6.8-144.1 145.0 -5.0 2.4 -4.3 49 49 A L T 3 S- 0 0 128 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.840 129.3 -60.6 54.5 34.8 -7.3 3.0 -7.2 50 50 A G T 3 S+ 0 0 62 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.861 117.3 108.3 62.5 36.3 -8.7 5.9 -5.2 51 51 A K E < - E 0 48A 127 -3,-1.0 -3,-2.5 2,-0.0 2,-0.5 -0.992 60.1-141.8-147.2 136.3 -9.8 3.7 -2.4 52 52 A E E + E 0 47A 100 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.859 37.2 144.2-101.9 126.2 -8.6 3.1 1.1 53 53 A G E - E 0 46A 0 -7,-1.5 -7,-1.4 -2,-0.5 2,-0.5 -0.871 50.2 -82.6-147.6 179.9 -8.5 -0.4 2.5 54 54 A W E +cE 24 45A 76 -31,-2.3 -29,-0.9 -2,-0.3 -9,-0.2 -0.804 45.5 174.8 -95.3 126.4 -6.7 -2.9 4.7 55 55 A A E - E 0 44A 0 -11,-0.6 -11,-2.8 -2,-0.5 2,-0.4 -0.976 36.0-104.0-133.0 145.7 -3.7 -4.7 3.2 56 56 A P E > - E 0 43A 19 0, 0.0 3,-1.9 0, 0.0 -13,-0.2 -0.514 20.3-141.6 -69.8 121.8 -1.1 -7.2 4.6 57 57 A A G > S+ 0 0 25 -15,-0.6 3,-1.6 -2,-0.4 -14,-0.1 0.752 99.0 72.7 -53.5 -24.1 2.2 -5.5 5.1 58 58 A S G 3 S+ 0 0 108 -16,-0.3 -1,-0.3 1,-0.3 -44,-0.1 0.877 94.4 50.4 -59.5 -39.0 3.7 -8.8 3.9 59 59 A Y G < S+ 0 0 77 -3,-1.9 -44,-0.4 -46,-0.1 2,-0.3 -0.001 108.3 71.6 -89.4 29.3 2.6 -8.0 0.3 60 60 A L < - 0 0 15 -3,-1.6 2,-0.3 -47,-0.2 -47,-0.2 -0.987 54.8-179.0-144.2 152.3 4.2 -4.5 0.6 61 61 A K E -B 12 0A 113 -49,-1.4 -49,-3.0 -2,-0.3 2,-0.2 -0.991 37.9 -96.2-153.2 144.3 7.7 -3.1 0.6 62 62 A K E -B 11 0A 134 -2,-0.3 -51,-0.2 -51,-0.2 2,-0.1 -0.415 43.6-132.6 -62.9 125.6 9.3 0.4 0.9 63 63 A A - 0 0 29 -53,-1.2 2,-0.5 -2,-0.2 -53,-0.1 -0.425 7.8-140.9 -79.3 155.2 10.1 1.7 -2.5 64 64 A K - 0 0 191 -2,-0.1 2,-0.3 2,-0.0 -53,-0.0 -0.894 13.9-162.0-122.7 101.7 13.5 3.3 -3.3 65 65 A D - 0 0 140 -2,-0.5 2,-0.5 1,-0.0 -2,-0.0 -0.646 13.3-137.2 -84.4 135.4 13.4 6.3 -5.6 66 66 A S + 0 0 118 -2,-0.3 -1,-0.0 2,-0.0 -2,-0.0 -0.806 41.2 135.9 -96.2 127.4 16.6 7.3 -7.3 67 67 A G - 0 0 55 -2,-0.5 -2,-0.0 2,-0.2 0, 0.0 -0.991 62.9-112.2-164.5 160.1 17.5 11.0 -7.4 68 68 A P S S+ 0 0 133 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.685 70.4 131.8 -69.6 -18.5 20.3 13.6 -7.0 69 69 A S - 0 0 109 1,-0.1 2,-0.7 -3,-0.0 -2,-0.2 -0.028 52.4-142.6 -38.2 129.8 18.5 14.9 -3.9 70 70 A S 0 0 118 1,-0.2 -1,-0.1 0, 0.0 0, 0.0 -0.884 360.0 360.0-106.8 108.1 21.1 15.2 -1.1 71 71 A G 0 0 123 -2,-0.7 -1,-0.2 0, 0.0 0, 0.0 0.591 360.0 360.0 63.4 360.0 19.7 14.3 2.3