==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SH3-DOMAIN 21-JUN-04 1W1F . COMPND 2 MOLECULE: TYROSINE-PROTEIN KINASE LYN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.BAUER,K.SCHWEIMER,S.HOFFMANN,P.ROESCH,H.STICHT . 60 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4532.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 35 58.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 38.3 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 . 1 1.7 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 . 5 8.3 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 . 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 PARALLEL BRIDGES PER LADDER . 1 1 0 1 2 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 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 9 A Q 0 0 243 0, 0.0 30,-0.0 0, 0.0 29,-0.0 0.000 360.0 360.0 360.0 -35.9 11.4 -14.8 -13.0 2 10 A G - 0 0 27 2,-0.0 2,-0.3 28,-0.0 28,-0.2 0.388 360.0-137.9 109.2 114.8 14.4 -13.1 -14.7 3 11 A D E -A 29 0A 88 26,-1.0 26,-2.8 54,-0.0 2,-0.5 -0.756 12.5-133.6-102.9 151.0 17.0 -14.8 -16.9 4 12 A I E +A 28 0A 82 -2,-0.3 2,-0.3 24,-0.2 54,-0.3 -0.880 27.4 175.2-106.0 129.7 20.7 -14.1 -16.8 5 13 A V E -A 27 0A 5 22,-3.9 22,-4.4 -2,-0.5 2,-0.5 -0.934 22.9-135.3-129.3 154.6 22.6 -13.5 -20.0 6 14 A V E -AB 26 56A 12 50,-3.4 50,-1.5 52,-0.4 20,-0.3 -0.918 31.8-106.2-113.4 133.9 26.2 -12.6 -20.7 7 15 A A E - B 0 55A 0 18,-4.1 17,-2.1 -2,-0.5 18,-0.3 -0.347 35.1-179.6 -56.3 115.9 27.1 -9.9 -23.3 8 16 A L S S+ 0 0 46 46,-1.7 47,-0.2 -2,-0.3 -1,-0.2 0.781 73.5 26.3 -88.4 -27.8 28.6 -11.9 -26.2 9 17 A Y S S- 0 0 151 45,-1.4 -1,-0.3 -3,-0.1 12,-0.1 -0.997 92.4-104.5-136.7 140.3 29.2 -8.7 -28.2 10 18 A P - 0 0 66 0, 0.0 2,-0.4 0, 0.0 12,-0.3 -0.277 34.7-164.0 -61.0 141.5 29.8 -5.1 -27.1 11 19 A Y B -E 21 0B 33 10,-4.2 2,-0.7 12,-0.0 10,-0.7 -0.977 9.7-155.7-133.2 124.1 26.8 -2.8 -27.5 12 20 A D - 0 0 130 -2,-0.4 6,-0.1 8,-0.2 7,-0.1 -0.851 42.3-101.2-102.3 111.3 27.0 1.1 -27.3 13 21 A G + 0 0 42 -2,-0.7 7,-0.1 1,-0.2 6,-0.1 0.107 57.6 160.9 -28.1 89.7 23.7 2.6 -26.4 14 22 A I + 0 0 126 5,-0.1 -1,-0.2 3,-0.0 5,-0.1 0.625 59.6 52.3 -94.6 -14.1 22.7 3.6 -29.9 15 23 A H S S- 0 0 125 3,-0.2 34,-0.0 34,-0.1 0, 0.0 -0.628 93.7-106.9-113.5 175.1 19.0 3.9 -29.0 16 24 A P S S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.836 119.2 20.0 -71.8 -34.3 17.2 5.8 -26.2 17 25 A D S S+ 0 0 91 2,-0.1 32,-1.8 31,-0.1 2,-0.4 0.532 92.1 117.6-112.1 -10.7 16.4 2.6 -24.2 18 26 A D - 0 0 14 30,-0.3 2,-0.3 1,-0.1 -3,-0.2 -0.408 61.9-139.1 -60.3 116.2 19.0 0.3 -25.6 19 27 A L - 0 0 1 -2,-0.4 2,-0.3 30,-0.4 29,-0.2 -0.598 15.8-126.8 -78.7 135.0 21.2 -0.6 -22.6 20 28 A S + 0 0 53 -2,-0.3 2,-0.3 27,-0.1 -8,-0.2 -0.639 33.0 175.3 -83.5 136.6 24.9 -0.7 -23.5 21 29 A F B -E 11 0B 3 -10,-0.7 -10,-4.2 -2,-0.3 2,-0.4 -0.989 21.6-138.5-139.4 147.9 26.9 -3.9 -22.6 22 30 A K > - 0 0 118 -2,-0.3 3,-2.8 -12,-0.3 -15,-0.2 -0.873 37.5 -93.6-108.5 140.0 30.4 -5.0 -23.3 23 31 A K T 3 S+ 0 0 118 -2,-0.4 -15,-0.2 1,-0.3 3,-0.1 -0.035 117.8 32.1 -42.2 152.1 31.4 -8.5 -24.4 24 32 A G T 3 S+ 0 0 62 -17,-2.1 -1,-0.3 1,-0.3 2,-0.2 0.284 97.9 118.1 78.5 -16.6 32.3 -10.5 -21.3 25 33 A E < - 0 0 51 -3,-2.8 -18,-4.1 -18,-0.3 2,-0.3 -0.515 61.3-132.2 -82.7 152.0 29.8 -8.4 -19.3 26 34 A K E -A 6 0A 123 -20,-0.3 16,-1.3 -2,-0.2 2,-0.3 -0.808 23.3-175.8-105.8 146.0 26.8 -10.1 -17.7 27 35 A M E -AC 5 41A 0 -22,-4.4 -22,-3.9 -2,-0.3 2,-0.4 -0.971 15.1-146.1-138.2 154.2 23.2 -8.8 -18.0 28 36 A K E -AC 4 40A 78 12,-1.4 12,-1.2 -2,-0.3 2,-0.6 -0.962 14.6-138.1-121.8 136.4 19.8 -9.9 -16.5 29 37 A V E -AC 3 39A 11 -26,-2.8 -26,-1.0 -2,-0.4 10,-0.3 -0.822 16.4-177.1 -98.0 120.0 16.5 -9.6 -18.4 30 38 A L E S+ 0 0 82 8,-2.2 2,-0.3 -2,-0.6 -1,-0.1 0.694 75.6 16.7 -86.3 -18.2 13.6 -8.3 -16.3 31 39 A E E - C 0 38A 112 7,-1.0 7,-1.8 -28,-0.1 2,-0.4 -0.983 67.1-144.2-154.2 141.0 11.1 -8.7 -19.2 32 40 A E E - C 0 37A 128 -2,-0.3 5,-0.2 5,-0.2 3,-0.1 -0.887 12.1-179.0-108.6 135.2 11.0 -10.6 -22.5 33 41 A H - 0 0 105 3,-2.1 2,-0.8 -2,-0.4 3,-0.3 -0.091 57.5 -93.0-121.0 35.0 9.3 -9.2 -25.6 34 42 A G S S+ 0 0 51 1,-0.2 -1,-0.2 18,-0.0 3,-0.0 -0.795 109.5 6.4 94.8-110.0 9.8 -12.0 -28.0 35 43 A E S S+ 0 0 146 -2,-0.8 17,-1.3 -3,-0.1 2,-0.4 0.571 133.9 52.7 -85.8 -7.1 13.1 -11.4 -30.0 36 44 A W E + D 0 51A 102 -3,-0.3 -3,-2.1 15,-0.2 2,-0.3 -0.979 63.9 172.5-130.0 141.9 13.9 -8.3 -27.9 37 45 A W E -CD 32 50A 23 13,-2.1 13,-3.5 -2,-0.4 2,-0.6 -0.921 31.6-117.2-140.0 167.7 14.1 -8.0 -24.1 38 46 A K E +CD 31 49A 55 -7,-1.8 -8,-2.2 -2,-0.3 -7,-1.0 -0.918 39.4 170.0-110.8 118.8 15.1 -5.4 -21.5 39 47 A A E -CD 29 48A 0 9,-1.3 9,-2.1 -2,-0.6 2,-0.3 -0.505 23.1-130.7-115.4-172.8 18.1 -6.3 -19.3 40 48 A K E -CD 28 47A 85 -12,-1.2 -12,-1.4 7,-0.3 2,-0.5 -0.986 19.0-116.9-140.8 150.2 20.4 -4.5 -16.8 41 49 A S E > -C 27 0A 1 5,-3.0 4,-2.0 -2,-0.3 5,-0.3 -0.760 10.7-152.1 -90.9 125.9 24.1 -4.3 -16.3 42 50 A L T 4 S+ 0 0 121 -16,-1.3 -1,-0.1 -2,-0.5 -15,-0.1 0.681 96.5 56.8 -69.1 -12.2 25.4 -5.8 -13.1 43 51 A L T 4 S+ 0 0 130 -17,-0.3 -1,-0.2 3,-0.1 -16,-0.0 0.949 130.3 7.1 -83.1 -55.3 28.3 -3.4 -13.4 44 52 A T T 4 S- 0 0 79 2,-0.1 -2,-0.2 0, 0.0 3,-0.1 0.309 92.9-129.0-108.7 8.1 26.4 -0.1 -13.6 45 53 A K < + 0 0 149 -4,-2.0 2,-0.2 1,-0.2 -3,-0.2 0.797 55.6 155.6 50.9 25.3 23.0 -1.6 -12.9 46 54 A K - 0 0 119 -5,-0.3 -5,-3.0 -26,-0.1 2,-0.4 -0.586 29.2-153.6 -82.1 144.8 21.9 0.2 -16.0 47 55 A E E +D 40 0A 80 -7,-0.3 -7,-0.3 -2,-0.2 2,-0.3 -0.925 28.7 133.1-120.8 145.6 18.8 -1.2 -17.8 48 56 A G E -D 39 0A 0 -9,-2.1 -9,-1.3 -2,-0.4 2,-0.4 -0.902 56.4 -61.1-164.8-167.3 17.9 -1.0 -21.5 49 57 A F E -D 38 0A 48 -32,-1.8 -30,-0.4 -2,-0.3 -11,-0.3 -0.789 46.4-171.2 -96.9 134.3 16.7 -3.0 -24.5 50 58 A I E -D 37 0A 0 -13,-3.5 -13,-2.1 -2,-0.4 2,-0.1 -0.965 21.2-121.2-126.2 142.5 19.0 -5.8 -25.7 51 59 A P E >> -D 36 0A 7 0, 0.0 3,-0.8 0, 0.0 4,-0.7 -0.363 21.9-122.5 -75.6 157.5 18.6 -7.9 -28.9 52 60 A S T 34 S+ 0 0 45 -17,-1.3 -16,-0.1 1,-0.2 -2,-0.0 0.097 107.4 54.0 -89.6 29.0 18.3 -11.7 -28.7 53 61 A N T 34 S+ 0 0 134 -18,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.359 100.4 54.5-137.2 -0.4 21.4 -12.2 -30.9 54 62 A Y T <4 S+ 0 0 104 -3,-0.8 -46,-1.7 1,-0.1 -45,-1.4 0.686 111.7 35.8-106.6 -25.7 24.1 -10.1 -29.1 55 63 A V E < +B 7 0A 5 -4,-0.7 2,-0.2 -48,-0.2 -48,-0.2 -0.828 64.3 160.4-123.5 164.7 23.8 -11.7 -25.6 56 64 A A E -B 6 0A 36 -50,-1.5 -50,-3.4 -2,-0.3 2,-0.5 -0.864 47.4 -54.2-160.7-165.5 23.1 -15.2 -24.4 57 65 A K S S- 0 0 159 -52,-0.3 -52,-0.2 -2,-0.2 -54,-0.0 -0.739 96.0 -38.9 -89.7 129.4 23.5 -17.6 -21.4 58 66 A L + 0 0 142 -2,-0.5 -52,-0.4 -54,-0.3 -2,-0.1 0.097 65.7 170.5 45.4-171.8 27.0 -17.9 -20.0 59 67 A N 0 0 85 1,-0.1 -1,-0.1 -54,-0.1 -51,-0.1 -0.423 360.0 360.0 172.1 -88.0 29.8 -17.9 -22.6 60 68 A T 0 0 192 -2,-0.1 -1,-0.1 0, 0.0 -2,-0.0 -0.834 360.0 360.0 -96.5 360.0 33.5 -17.7 -21.6