==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 23-MAR-01 1IAQ . COMPND 2 MOLECULE: TRANSFORMING PROTEIN P21/H-RAS-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.SPOERNER,C.HERRMANN,I.R.VETTER,H.R.KALBITZER, . 453 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20746.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 324 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 75 16.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 3 0.7 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 . 55 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 114 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.3 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 1 3 0 0 0 6 3 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 0 3 3 3 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 . 2 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 3 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 M 0 0 137 0, 0.0 2,-0.2 0, 0.0 43,-0.2 0.000 360.0 360.0 360.0-172.2 9.5 15.4 62.3 2 2 A T E -a 44 0A 63 41,-1.2 43,-2.6 1,-0.0 2,-0.4 -0.586 360.0-141.7 -85.9 148.6 12.8 14.0 61.1 3 3 A E E -a 45 0A 100 -2,-0.2 2,-0.4 41,-0.2 43,-0.2 -0.930 13.2-169.1-117.8 136.6 14.9 15.9 58.5 4 4 A Y E -a 46 0A 17 41,-2.8 43,-2.9 -2,-0.4 2,-0.7 -0.974 10.7-152.5-124.5 133.8 17.0 14.5 55.6 5 5 A K E -a 47 0A 47 -2,-0.4 56,-2.9 41,-0.2 57,-2.2 -0.883 17.1-173.5-108.7 107.4 19.5 16.3 53.4 6 6 A L E -ab 48 62A 0 41,-1.9 43,-2.4 -2,-0.7 2,-0.5 -0.808 8.0-158.4-101.0 138.8 19.8 14.7 50.0 7 7 A V E -ab 49 63A 0 55,-3.0 57,-2.8 -2,-0.4 2,-0.6 -0.956 3.3-155.6-119.4 117.1 22.4 15.8 47.4 8 8 A V E +ab 50 64A 0 41,-1.3 43,-1.4 -2,-0.5 2,-0.3 -0.807 23.8 171.1 -92.7 123.7 22.0 15.1 43.7 9 9 A V E + b 0 65A 6 55,-2.4 57,-2.5 -2,-0.6 2,-0.2 -0.861 7.5 117.0-127.6 162.0 25.3 15.1 41.8 10 10 A G E - b 0 66A 0 42,-0.5 57,-0.2 -2,-0.3 3,-0.1 -0.831 57.3 -46.8 157.4 164.1 26.4 14.1 38.3 11 11 A A S > S- 0 0 5 55,-0.8 3,-1.1 63,-0.3 5,-0.2 -0.185 77.5 -82.5 -52.6 146.5 27.9 14.7 34.8 12 12 A G T 3 S+ 0 0 45 41,-1.0 -1,-0.1 1,-0.2 62,-0.1 -0.238 110.3 13.4 -57.8 135.9 26.5 17.8 33.2 13 13 A G T 3 S+ 0 0 56 -3,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.713 83.0 124.4 75.0 23.0 23.1 17.4 31.4 14 14 A V S < S- 0 0 0 -3,-1.1 53,-0.1 -4,-0.1 55,-0.1 0.661 87.4 -95.5 -88.8 -14.7 22.2 14.0 32.8 15 15 A G S > S+ 0 0 15 51,-0.1 4,-2.3 -5,-0.1 5,-0.2 0.650 73.4 144.4 110.1 20.1 18.9 15.2 34.2 16 16 A K H > S+ 0 0 14 -5,-0.2 4,-2.0 1,-0.2 5,-0.1 0.963 82.2 38.8 -53.1 -53.0 19.8 16.0 37.8 17 17 A S H > S+ 0 0 47 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.919 109.2 59.3 -65.5 -46.8 17.3 18.8 37.8 18 18 A A H > S+ 0 0 10 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.902 109.8 45.8 -48.4 -46.0 14.6 17.1 35.8 19 19 A L H >X S+ 0 0 1 -4,-2.3 4,-1.6 2,-0.2 3,-0.8 0.971 113.3 47.9 -60.6 -58.3 14.5 14.4 38.5 20 20 A T H >X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.3 3,-0.5 0.912 114.3 46.0 -49.1 -52.1 14.4 16.9 41.4 21 21 A I H 3X S+ 0 0 30 -4,-3.1 4,-1.9 1,-0.2 6,-0.8 0.721 108.1 58.7 -66.8 -21.2 11.7 19.0 39.8 22 22 A Q H << S+ 0 0 6 -4,-1.1 4,-0.4 -3,-0.8 -1,-0.2 0.810 110.4 42.0 -77.3 -30.9 9.7 15.8 39.0 23 23 A L H << S+ 0 0 5 -4,-1.6 -2,-0.2 -3,-0.5 -1,-0.2 0.829 123.1 37.3 -83.6 -35.9 9.6 14.9 42.7 24 24 A I H < S+ 0 0 27 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.884 135.1 18.5 -84.8 -43.3 8.8 18.3 44.0 25 25 A Q S < S- 0 0 116 -4,-1.9 -3,-0.1 -5,-0.2 -2,-0.1 0.023 95.4-127.3-119.7 25.6 6.5 19.7 41.2 26 26 A N + 0 0 98 -4,-0.4 2,-0.3 1,-0.1 -4,-0.2 0.667 69.7 94.5 32.4 42.6 5.4 16.5 39.6 27 27 A H S S- 0 0 99 -6,-0.8 2,-0.4 -9,-0.2 -2,-0.2 -0.997 72.7-103.8-154.5 159.9 6.2 17.3 35.9 28 28 A F 0 0 93 -2,-0.3 104,-0.1 104,-0.2 -9,-0.1 -0.681 360.0 360.0 -87.3 130.7 8.9 17.0 33.2 29 29 A V 0 0 100 -2,-0.4 -1,-0.1 102,-0.1 -11,-0.0 -0.228 360.0 360.0 -63.3 360.0 11.0 20.0 32.3 30 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 31 38 A D 0 0 118 0, 0.0 19,-0.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 145.5 19.2 25.5 44.0 32 39 A S E +C 49 0A 76 17,-0.2 2,-0.3 2,-0.0 17,-0.2 -0.895 360.0 178.9-118.2 142.9 17.1 24.7 47.1 33 40 A Y E -C 48 0A 23 15,-0.7 15,-2.2 -2,-0.3 2,-0.3 -0.961 6.2-173.4-149.4 129.8 14.0 22.4 47.6 34 41 A R + 0 0 147 -2,-0.3 2,-0.2 13,-0.2 13,-0.2 -0.737 9.9 175.0-111.5 161.6 11.9 21.4 50.6 35 42 A K - 0 0 56 -2,-0.3 11,-2.7 11,-0.2 2,-0.5 -0.775 25.6-141.2-173.7 123.0 9.1 18.8 50.7 36 43 A Q E +D 45 0A 107 -2,-0.2 2,-0.3 9,-0.2 9,-0.2 -0.764 41.0 153.6 -87.2 128.0 6.9 17.3 53.3 37 44 A V E -D 44 0A 20 7,-2.0 7,-2.4 -2,-0.5 2,-0.5 -0.993 40.4-128.5-154.9 156.6 6.4 13.6 52.7 38 45 A V E -D 43 0A 90 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.943 23.1-176.0-112.1 124.1 5.6 10.4 54.4 39 46 A I S S- 0 0 3 3,-2.2 3,-0.4 -2,-0.5 -2,-0.0 -0.966 72.2 -17.5-124.1 118.4 7.9 7.4 53.9 40 47 A D S S- 0 0 12 -2,-0.5 2,-1.5 1,-0.3 -1,-0.2 0.891 124.7 -59.9 58.7 38.2 7.1 4.0 55.4 41 48 A G S S+ 0 0 30 1,-0.2 -1,-0.3 241,-0.1 224,-0.0 -0.435 114.6 109.4 90.7 -65.8 4.8 5.7 57.8 42 49 A E - 0 0 26 -2,-1.5 -3,-2.2 -3,-0.4 2,-0.4 -0.101 66.6-132.3 -46.5 141.8 7.3 8.0 59.4 43 50 A T E + D 0 38A 59 -5,-0.2 -41,-1.2 -3,-0.1 2,-0.3 -0.819 36.4 160.7-101.1 140.9 6.8 11.6 58.4 44 51 A C E -aD 2 37A 0 -7,-2.4 -7,-2.0 -2,-0.4 2,-0.5 -0.994 39.9-110.6-158.6 162.9 9.8 13.7 57.3 45 52 A L E -aD 3 36A 44 -43,-2.6 -41,-2.8 -2,-0.3 2,-0.7 -0.868 24.3-151.7-101.6 123.2 11.2 16.7 55.5 46 53 A L E -a 4 0A 1 -11,-2.7 2,-0.8 -2,-0.5 -11,-0.2 -0.855 8.9-168.9 -96.5 110.1 13.2 16.1 52.3 47 54 A D E -a 5 0A 21 -43,-2.9 -41,-1.9 -2,-0.7 2,-0.6 -0.857 10.9-170.7-102.7 97.9 15.8 18.8 51.8 48 55 A I E -aC 6 33A 0 -15,-2.2 2,-0.7 -2,-0.8 -15,-0.7 -0.814 10.7-165.5 -98.6 120.2 17.0 18.4 48.2 49 56 A L E -aC 7 32A 39 -43,-2.4 -41,-1.3 -2,-0.6 2,-0.5 -0.861 9.2-155.2-106.3 100.5 20.0 20.3 47.0 50 57 A D E -a 8 0A 15 -2,-0.7 2,-0.2 -19,-0.6 -41,-0.1 -0.627 20.4-167.0 -76.8 119.9 20.3 20.2 43.1 51 58 A T - 0 0 31 -43,-1.4 -34,-0.1 -2,-0.5 2,-0.1 -0.479 22.8 -79.7-105.8 177.1 23.9 20.8 42.1 52 59 A A 0 0 89 -2,-0.2 -42,-0.5 1,-0.1 -1,-0.1 -0.349 360.0 360.0 -74.4 152.1 25.9 21.6 39.0 53 60 A G 0 0 52 -44,-0.1 -41,-1.0 -2,-0.1 -1,-0.1 -0.314 360.0 360.0 -71.2 360.0 26.8 19.1 36.3 54 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 55 70 A Q > 0 0 147 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 -42.9 31.5 22.9 51.9 56 71 A Y T 3> + 0 0 160 1,-0.2 4,-0.7 2,-0.2 0, 0.0 0.435 360.0 57.8 -76.0 -5.2 27.8 22.4 51.1 57 72 A M T 34 S+ 0 0 21 2,-0.2 -1,-0.2 1,-0.1 -50,-0.1 0.493 93.4 63.6-101.8 -14.2 28.5 18.7 50.4 58 73 A R T <4 S+ 0 0 128 -3,-0.8 -2,-0.2 1,-0.1 -1,-0.1 0.646 105.2 51.9 -81.9 -15.2 29.9 18.0 53.8 59 74 A T T 4 S+ 0 0 65 -4,-0.3 -2,-0.2 2,-0.0 -54,-0.1 0.885 85.6 95.0 -85.6 -46.0 26.4 18.9 54.9 60 75 A G < - 0 0 0 -4,-0.7 -54,-0.2 1,-0.1 3,-0.1 -0.131 55.8-161.4 -49.2 142.9 24.4 16.5 52.7 61 76 A E S S+ 0 0 79 -56,-2.9 2,-0.4 1,-0.3 -55,-0.2 0.793 72.2 29.1 -97.8 -36.1 23.5 13.2 54.4 62 77 A G E S-b 6 0A 0 -57,-2.2 -55,-3.0 32,-0.1 2,-0.4 -0.974 71.5-145.8-130.0 145.5 22.6 11.1 51.4 63 78 A F E -be 7 96A 0 32,-2.1 34,-2.3 -2,-0.4 2,-0.7 -0.894 7.6-158.0-119.0 140.0 23.9 11.3 47.8 64 79 A L E -be 8 97A 0 -57,-2.8 -55,-2.4 -2,-0.4 2,-0.9 -0.871 12.3-162.6-111.5 97.1 22.4 10.6 44.4 65 80 A C E -be 9 98A 1 32,-1.6 34,-3.3 -2,-0.7 2,-0.3 -0.724 19.5-170.2 -83.2 108.9 25.1 9.8 41.8 66 81 A V E +be 10 99A 0 -57,-2.5 -55,-0.8 -2,-0.9 2,-0.3 -0.722 19.0 162.8-106.8 149.0 23.4 10.3 38.4 67 82 A F E - e 0 100A 0 32,-2.1 34,-2.7 -2,-0.3 2,-0.3 -0.972 36.2-114.4-153.6 153.0 24.4 9.5 34.8 68 83 A A E > - e 0 101A 1 -2,-0.3 3,-1.5 3,-0.3 34,-0.2 -0.747 14.5-137.9 -93.8 142.6 22.4 9.2 31.6 69 84 A I T 3 S+ 0 0 0 32,-2.3 40,-2.8 -2,-0.3 41,-1.2 0.607 106.0 55.2 -73.5 -8.8 22.2 5.8 29.9 70 85 A N T 3 S+ 0 0 57 31,-0.3 2,-0.3 38,-0.3 -1,-0.3 0.142 99.2 69.8-105.6 16.8 22.7 7.5 26.5 71 86 A N <> - 0 0 57 -3,-1.5 4,-1.1 1,-0.1 -3,-0.3 -0.802 56.4-175.6-138.6 95.1 25.9 9.2 27.7 72 87 A T H > S+ 0 0 57 -2,-0.3 4,-2.0 1,-0.2 3,-0.4 0.876 85.7 53.4 -58.4 -42.4 28.9 6.9 28.2 73 88 A K H > S+ 0 0 133 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.921 102.8 57.1 -61.3 -43.1 31.2 9.6 29.5 74 89 A S H 4 S+ 0 0 1 1,-0.2 4,-0.4 2,-0.2 -63,-0.3 0.824 108.9 49.3 -56.8 -29.6 28.7 10.6 32.2 75 90 A F H >< S+ 0 0 25 -4,-1.1 3,-0.9 -3,-0.4 4,-0.4 0.887 108.4 50.8 -75.1 -40.6 28.9 7.0 33.3 76 91 A E H 3< S+ 0 0 129 -4,-2.0 4,-0.3 1,-0.2 3,-0.2 0.664 104.6 61.1 -69.7 -17.9 32.7 7.0 33.4 77 92 A D T 3X S+ 0 0 29 -4,-1.6 4,-1.5 -5,-0.2 3,-0.5 0.620 78.2 85.2 -86.0 -13.8 32.5 10.2 35.5 78 93 A I H <> S+ 0 0 2 -3,-0.9 4,-3.1 -4,-0.4 5,-0.3 0.935 85.0 58.0 -52.0 -48.8 30.7 8.6 38.4 79 94 A H H > S+ 0 0 100 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.879 102.6 55.8 -49.4 -42.1 34.0 7.4 39.9 80 95 A Q H > S+ 0 0 125 -3,-0.5 4,-2.3 -4,-0.3 -1,-0.2 0.951 113.6 37.5 -56.8 -54.0 35.2 11.0 39.9 81 96 A Y H X S+ 0 0 32 -4,-1.5 4,-2.6 2,-0.2 5,-0.2 0.915 111.4 60.1 -65.1 -44.2 32.2 12.2 42.0 82 97 A R H X S+ 0 0 19 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.869 111.3 41.7 -50.1 -42.3 32.1 9.1 44.2 83 98 A E H X S+ 0 0 73 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 0.903 109.6 55.3 -75.6 -44.1 35.7 9.8 45.2 84 99 A Q H X S+ 0 0 88 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.852 115.4 42.4 -57.7 -31.3 35.2 13.6 45.7 85 100 A I H < S+ 0 0 0 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.972 110.1 52.7 -75.0 -59.6 32.3 12.6 48.0 86 101 A K H <>S+ 0 0 42 -4,-2.5 5,-1.2 -5,-0.2 3,-0.5 0.759 112.8 52.3 -46.5 -26.6 34.1 9.8 49.8 87 102 A R H ><5S+ 0 0 188 -4,-2.0 2,-2.0 1,-0.2 3,-1.5 0.987 102.4 50.1 -77.5 -65.4 36.8 12.4 50.4 88 103 A V T 3<5S+ 0 0 56 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.1 -0.002 116.5 46.1 -68.6 36.8 35.0 15.4 51.9 89 104 A K T 3 5S- 0 0 59 -2,-2.0 -1,-0.3 -3,-0.5 -2,-0.1 0.066 95.8-131.4-165.1 31.0 33.4 13.0 54.5 90 105 A D T < 5 + 0 0 168 -3,-1.5 2,-0.3 1,-0.1 -3,-0.1 0.602 68.6 115.9 9.8 59.3 36.2 10.8 55.7 91 106 A S < - 0 0 37 -5,-1.2 3,-0.2 -6,-0.1 -2,-0.1 -0.986 60.1-153.7-150.8 137.5 34.2 7.7 55.2 92 107 A D S S+ 0 0 135 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.684 95.3 40.9 -80.9 -19.6 34.5 4.6 53.0 93 108 A D + 0 0 100 -7,-0.1 -1,-0.2 2,-0.0 30,-0.0 -0.934 68.4 164.0-134.7 110.3 30.7 4.1 53.1 94 109 A V - 0 0 17 -2,-0.4 -32,-0.1 -3,-0.2 -31,-0.1 -0.969 51.5 -88.7-124.1 138.2 28.4 7.1 52.9 95 110 A P S S+ 0 0 15 0, 0.0 -32,-2.1 0, 0.0 2,-0.3 -0.220 70.5 139.6 -48.1 126.8 24.6 6.9 52.0 96 111 A M E -e 63 0A 4 -34,-0.2 2,-0.4 -32,-0.1 -32,-0.2 -0.963 38.1-151.5-171.5 150.0 24.3 7.0 48.3 97 112 A V E -e 64 0A 0 -34,-2.3 -32,-1.6 -2,-0.3 2,-0.4 -0.997 18.5-132.3-133.9 133.9 22.5 5.5 45.2 98 113 A L E -ef 65 126A 0 27,-2.7 29,-2.2 -2,-0.4 2,-0.5 -0.715 27.9-164.1 -84.7 130.9 23.7 5.1 41.6 99 114 A V E -ef 66 127A 0 -34,-3.3 -32,-2.1 -2,-0.4 2,-0.9 -0.964 18.5-161.9-126.1 126.1 21.1 6.3 39.2 100 115 A G E -ef 67 128A 0 27,-2.3 29,-2.1 -2,-0.5 3,-0.3 -0.869 27.1-167.7-102.1 100.5 20.9 5.7 35.5 101 116 A N E +e 68 0A 3 -34,-2.7 -32,-2.3 -2,-0.9 -31,-0.3 -0.315 57.2 43.3 -86.7 169.0 18.5 8.4 34.1 102 117 A K > + 0 0 60 27,-0.4 3,-1.7 -34,-0.2 28,-0.2 0.815 58.5 157.2 66.3 34.7 16.8 8.8 30.8 103 118 A C T 3 + 0 0 19 26,-1.7 27,-0.2 -3,-0.3 -1,-0.1 0.393 58.7 79.4 -70.4 7.4 15.7 5.1 30.6 104 119 A D T 3 S+ 0 0 56 25,-0.2 -1,-0.3 31,-0.0 2,-0.1 0.506 78.7 86.6 -91.4 -4.9 13.0 6.2 28.3 105 120 A L < - 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