==== 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 CHAPERONE 02-MAR-04 1UYD . COMPND 2 MOLECULE: HEAT SHOCK PROTEIN HSP 90-ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.WRIGHT,X.BARRIL,B.DYMOCK,L.SHERIDAN,A.SURGENOR,M.BESWICK, . 209 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11020.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 158 75.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 19.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 1 0.5 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 . 17 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 58 27.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.9 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 1 0 0 0 0 0 1 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 0 0 2 0 3 0 1 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 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 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 16 A E 0 0 195 0, 0.0 2,-0.5 0, 0.0 158,-0.3 0.000 360.0 360.0 360.0 125.7 7.7 28.5 38.6 2 17 A V - 0 0 89 156,-0.1 2,-0.4 154,-0.0 156,-0.2 -0.753 360.0-150.2 -73.9 124.4 8.1 27.6 34.9 3 18 A E E -A 157 0A 62 154,-2.8 154,-2.4 -2,-0.5 2,-0.4 -0.866 4.4-151.2-101.4 135.5 10.9 25.0 34.7 4 19 A T E -A 156 0A 99 -2,-0.4 2,-0.3 152,-0.2 152,-0.2 -0.900 14.6-176.1-112.1 130.5 13.2 24.7 31.6 5 20 A F E -A 155 0A 49 150,-3.5 150,-2.3 -2,-0.4 2,-0.4 -0.898 25.0-123.2-122.2 152.3 14.9 21.4 30.5 6 21 A A E -A 154 0A 83 -2,-0.3 148,-0.2 148,-0.2 2,-0.1 -0.776 29.1-126.6 -87.6 132.6 17.3 20.4 27.8 7 22 A F - 0 0 19 146,-2.0 -1,-0.0 -2,-0.4 148,-0.0 -0.534 40.2 -92.4 -63.9 148.3 16.1 17.6 25.5 8 23 A Q > - 0 0 69 -2,-0.1 4,-2.4 1,-0.1 3,-0.4 -0.333 42.4-109.1 -48.2 146.3 18.5 14.7 25.3 9 24 A A H > S+ 0 0 74 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.846 118.4 53.0 -51.3 -41.7 20.9 15.3 22.3 10 25 A E H > S+ 0 0 73 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.863 110.4 47.1 -67.4 -40.5 19.3 12.5 20.2 11 26 A I H > S+ 0 0 2 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.910 111.5 50.0 -64.3 -48.5 15.8 13.9 20.7 12 27 A A H X S+ 0 0 24 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.874 111.3 51.8 -52.8 -38.2 16.9 17.4 19.8 13 28 A Q H X S+ 0 0 116 -4,-1.9 4,-2.5 -5,-0.3 -2,-0.2 0.958 108.2 48.4 -73.8 -47.4 18.5 15.9 16.8 14 29 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.890 110.9 52.4 -44.8 -52.9 15.3 14.1 15.6 15 30 A M H X S+ 0 0 2 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.941 109.0 48.8 -58.7 -47.2 13.3 17.3 16.1 16 31 A S H X S+ 0 0 62 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.928 110.8 52.4 -58.0 -45.8 15.8 19.3 13.9 17 32 A L H X S+ 0 0 49 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.871 110.3 46.7 -54.0 -42.1 15.6 16.5 11.3 18 33 A I H < S+ 0 0 2 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.900 117.2 43.8 -70.5 -42.2 11.7 16.7 11.2 19 34 A I H < S+ 0 0 65 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.871 123.2 36.5 -64.4 -39.4 11.8 20.5 11.0 20 35 A N H < S+ 0 0 122 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.782 90.1 94.5 -95.3 -35.9 14.6 20.6 8.4 21 36 A T S < S- 0 0 60 -4,-2.6 2,-0.6 -5,-0.2 -4,-0.0 -0.340 78.0-118.3 -56.3 138.5 14.1 17.6 6.0 22 37 A F + 0 0 186 2,-0.0 2,-0.3 -2,-0.0 -1,-0.1 -0.731 53.3 149.6 -77.9 121.3 12.1 18.4 2.8 23 38 A Y - 0 0 37 -2,-0.6 3,-0.1 1,-0.1 -2,-0.0 -0.783 30.0-169.7-160.9 106.3 9.0 16.2 3.0 24 39 A S S S+ 0 0 90 -2,-0.3 2,-2.7 1,-0.2 3,-0.3 0.785 71.5 82.3 -73.0 -31.5 5.7 17.1 1.5 25 40 A N > + 0 0 57 1,-0.2 3,-0.9 2,-0.1 -1,-0.2 -0.240 49.5 142.7 -76.1 54.3 3.5 14.3 3.1 26 41 A K G > + 0 0 42 -2,-2.7 3,-1.8 1,-0.2 -1,-0.2 0.697 46.5 86.3 -66.7 -21.9 3.1 16.3 6.4 27 42 A E G > + 0 0 16 -3,-0.3 3,-1.7 1,-0.3 4,-0.5 0.718 68.4 78.7 -58.6 -25.1 -0.6 15.2 6.9 28 43 A I G <> S+ 0 0 1 -3,-0.9 4,-1.2 1,-0.3 -1,-0.3 0.548 70.5 85.2 -60.4 -8.0 0.4 12.0 8.7 29 44 A F H <> S+ 0 0 1 -3,-1.8 4,-1.7 1,-0.2 -1,-0.3 0.827 85.6 56.9 -61.7 -30.6 1.0 14.1 11.9 30 45 A L H <> S+ 0 0 2 -3,-1.7 4,-2.6 1,-0.2 5,-0.3 0.951 103.4 48.1 -77.3 -43.8 -2.7 13.7 12.7 31 46 A R H > S+ 0 0 64 -4,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.811 109.4 56.5 -62.4 -24.7 -3.0 9.9 12.7 32 47 A E H X S+ 0 0 12 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.932 111.5 41.7 -71.7 -45.7 0.1 9.8 14.9 33 48 A L H X S+ 0 0 3 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.945 115.8 48.6 -63.9 -51.2 -1.6 12.1 17.5 34 49 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.835 111.1 50.9 -53.6 -41.2 -5.0 10.3 17.3 35 50 A S H X S+ 0 0 40 -4,-1.8 4,-2.7 -5,-0.3 -1,-0.2 0.881 108.2 52.4 -68.3 -40.0 -3.3 6.9 17.7 36 51 A N H X S+ 0 0 61 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.924 111.9 47.0 -55.0 -47.2 -1.4 8.2 20.8 37 52 A S H X S+ 0 0 5 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.914 110.7 51.1 -58.3 -50.3 -4.8 9.3 22.2 38 53 A S H X S+ 0 0 14 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.895 110.1 49.9 -56.2 -46.8 -6.3 5.9 21.3 39 54 A D H X S+ 0 0 92 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.939 111.4 49.6 -55.5 -46.7 -3.4 4.1 23.1 40 55 A A H X S+ 0 0 19 -4,-2.2 41,-2.8 2,-0.2 4,-1.5 0.751 111.0 48.1 -62.5 -30.0 -4.0 6.4 26.1 41 56 A L H X S+ 0 0 0 -4,-1.7 4,-2.3 39,-0.3 -1,-0.2 0.853 109.1 53.7 -81.8 -37.6 -7.8 5.7 26.2 42 57 A D H X S+ 0 0 60 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.872 108.4 52.6 -56.3 -42.8 -7.1 1.9 25.9 43 58 A K H X S+ 0 0 118 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.944 110.6 43.3 -64.3 -51.1 -4.8 2.2 28.9 44 59 A I H X S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.936 113.7 52.2 -61.6 -43.8 -7.3 3.9 31.2 45 60 A R H X S+ 0 0 119 -4,-2.3 4,-0.7 2,-0.2 -2,-0.2 0.936 112.6 46.1 -57.0 -47.8 -10.1 1.5 30.1 46 61 A Y H >X S+ 0 0 168 -4,-2.6 3,-1.3 1,-0.2 4,-0.7 0.957 111.6 50.3 -61.1 -50.3 -7.9 -1.5 30.9 47 62 A E H 3< S+ 0 0 44 -4,-2.7 3,-0.4 1,-0.2 -1,-0.2 0.784 104.4 60.3 -57.3 -28.9 -6.7 -0.1 34.3 48 63 A S H 3< S+ 0 0 13 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.660 88.7 70.9 -78.8 -15.7 -10.4 0.6 35.3 49 64 A L H << S+ 0 0 127 -3,-1.3 -1,-0.2 -4,-0.7 -2,-0.2 0.885 111.7 30.7 -62.8 -41.5 -11.4 -3.1 35.0 50 65 A T S < S+ 0 0 125 -4,-0.7 -1,-0.2 -3,-0.4 -2,-0.2 0.316 134.9 32.8 -99.4 6.1 -9.4 -3.9 38.1 51 66 A D > - 0 0 60 -4,-0.2 3,-2.3 1,-0.1 4,-0.2 -0.396 60.1-179.2-158.0 76.5 -10.0 -0.4 39.6 52 67 A P G > S+ 0 0 86 0, 0.0 3,-1.4 0, 0.0 -4,-0.1 0.682 79.2 72.3 -50.2 -21.1 -13.3 1.2 38.8 53 68 A S G > S+ 0 0 65 1,-0.3 3,-1.9 2,-0.2 4,-0.2 0.721 78.0 77.7 -71.7 -19.5 -12.3 4.3 40.9 54 69 A K G < S+ 0 0 48 -3,-2.3 3,-0.4 1,-0.3 -1,-0.3 0.688 90.2 55.9 -58.4 -21.1 -9.9 5.3 38.1 55 70 A L G X S+ 0 0 20 -3,-1.4 3,-2.2 -4,-0.2 -1,-0.3 0.387 75.2 95.9 -95.1 3.0 -12.9 6.5 36.1 56 71 A D T < S+ 0 0 130 -3,-1.9 -1,-0.2 1,-0.3 3,-0.2 0.704 79.1 62.6 -61.1 -20.7 -14.1 8.9 38.9 57 72 A S T 3 S- 0 0 36 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.455 133.5 -39.5 -83.2 -1.5 -12.2 11.6 37.0 58 73 A G < - 0 0 21 -3,-2.2 -1,-0.3 108,-0.1 -2,-0.1 -0.145 42.4-148.3 143.4 125.7 -14.6 11.0 34.1 59 74 A K + 0 0 133 -3,-0.2 2,-0.2 -2,-0.1 -3,-0.1 0.761 69.4 99.3 -77.6 -28.6 -16.2 8.0 32.5 60 75 A E - 0 0 134 -5,-0.1 2,-0.6 1,-0.1 0, 0.0 -0.457 54.3-162.7 -75.2 127.7 -16.4 9.2 28.8 61 76 A L + 0 0 32 -2,-0.2 2,-0.3 17,-0.1 19,-0.1 -0.908 36.5 122.8-112.6 106.0 -13.6 7.9 26.5 62 77 A H - 0 0 50 -2,-0.6 17,-1.5 139,-0.2 2,-0.4 -0.922 50.9-124.5-157.8 171.6 -13.3 10.1 23.4 63 78 A I E -Bc 78 203A 0 139,-2.2 141,-2.8 -2,-0.3 2,-0.4 -0.995 18.9-165.3-130.1 129.1 -11.2 12.3 21.1 64 79 A N E -Bc 77 204A 24 13,-2.8 13,-3.2 -2,-0.4 2,-0.5 -0.958 7.0-157.1-116.4 134.0 -12.0 15.9 20.1 65 80 A L E -Bc 76 205A 0 139,-2.8 141,-2.0 -2,-0.4 11,-0.2 -0.977 16.4-173.3-107.6 117.8 -10.3 17.7 17.2 66 81 A I E -B 75 0A 52 9,-3.1 9,-2.2 -2,-0.5 2,-0.3 -0.887 6.4-168.8-122.8 105.3 -10.6 21.5 17.7 67 82 A P E -B 74 0A 9 0, 0.0 2,-0.3 0, 0.0 7,-0.2 -0.624 2.9-175.3 -85.4 144.1 -9.4 23.9 15.0 68 83 A N E >> -B 73 0A 48 5,-2.5 5,-2.0 -2,-0.3 4,-1.3 -0.795 10.3-174.7-142.0 103.5 -9.2 27.6 15.8 69 84 A K T 45S+ 0 0 112 -2,-0.3 -1,-0.1 1,-0.2 5,-0.0 0.819 84.7 59.5 -65.8 -33.2 -8.3 30.0 13.0 70 85 A Q T 45S+ 0 0 180 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.844 119.0 27.0 -69.1 -38.2 -8.0 33.0 15.2 71 86 A D T 45S- 0 0 102 -3,-0.4 -1,-0.2 2,-0.1 -2,-0.2 0.508 106.1-127.5 -93.0 -7.5 -5.3 31.5 17.4 72 87 A R T <5 + 0 0 76 -4,-1.3 103,-1.8 1,-0.2 2,-0.4 0.933 61.7 138.6 56.3 53.0 -4.0 29.4 14.5 73 88 A T E < -BD 68 174A 11 -5,-2.0 -5,-2.5 101,-0.2 2,-0.4 -0.950 45.6-160.8-126.9 146.5 -4.2 26.2 16.6 74 89 A L E -BD 67 173A 0 99,-2.0 99,-3.3 -2,-0.4 2,-0.4 -1.000 20.6-162.7-118.3 127.7 -5.3 22.7 16.1 75 90 A T E -BD 66 172A 14 -9,-2.2 -9,-3.1 -2,-0.4 2,-0.6 -0.919 11.3-157.7-118.3 132.1 -6.0 20.9 19.4 76 91 A I E -BD 65 171A 1 95,-2.0 95,-1.9 -2,-0.4 2,-0.4 -0.954 20.0-170.7-110.9 106.8 -6.2 17.1 19.8 77 92 A V E +BD 64 170A 21 -13,-3.2 -13,-2.8 -2,-0.6 2,-0.3 -0.848 10.7 166.7-105.4 133.5 -8.2 16.4 23.0 78 93 A D E -BD 63 169A 7 91,-2.4 91,-1.6 -2,-0.4 -15,-0.2 -0.959 36.1-142.8-138.5 157.8 -8.6 13.0 24.7 79 94 A T + 0 0 25 -17,-1.5 89,-0.2 -2,-0.3 -16,-0.1 -0.212 61.6 129.4-108.1 42.0 -9.9 11.7 28.1 80 95 A G S S- 0 0 0 89,-0.1 -39,-0.3 -18,-0.1 -40,-0.1 0.023 79.2 -66.0 -82.7-167.2 -7.2 8.9 28.2 81 96 A I - 0 0 12 -41,-2.8 59,-0.5 -44,-0.2 87,-0.2 0.728 68.2-152.2 -61.2 -25.8 -4.8 8.0 31.0 82 97 A G - 0 0 5 57,-0.2 2,-0.4 85,-0.1 57,-0.2 -0.136 16.3 -84.8 77.8 178.4 -2.8 11.3 30.9 83 98 A M - 0 0 42 85,-0.4 56,-0.5 62,-0.1 62,-0.2 -0.964 27.4-136.0-127.6 143.8 0.8 11.8 31.9 84 99 A T > - 0 0 24 -2,-0.4 4,-2.0 54,-0.1 3,-0.3 -0.441 35.7-101.6 -84.3 168.3 2.6 12.4 35.2 85 100 A K H > S+ 0 0 69 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.894 124.3 54.6 -55.8 -41.8 5.4 14.9 35.7 86 101 A A H >>S+ 0 0 46 1,-0.2 5,-2.8 2,-0.2 4,-1.8 0.847 106.5 52.4 -65.0 -32.4 7.9 12.1 35.6 87 102 A D H 4>S+ 0 0 33 -3,-0.3 5,-2.1 3,-0.2 6,-0.5 0.979 112.6 44.9 -56.4 -55.7 6.6 11.1 32.2 88 103 A L H <5S+ 0 0 17 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.844 124.5 30.4 -60.6 -44.6 6.9 14.6 30.9 89 104 A I H <5S- 0 0 35 -4,-2.5 -1,-0.2 -5,-0.1 -3,-0.2 0.902 138.8 -7.3 -88.0 -47.5 10.4 15.3 32.3 90 105 A N T X5S+ 0 0 109 -4,-1.8 4,-1.8 -5,-0.3 3,-0.3 0.826 115.5 58.6-115.3 -62.4 12.1 11.9 32.3 91 106 A N H > S+ 0 0 17 -6,-0.5 4,-1.4 -3,-0.3 -1,-0.2 0.787 106.8 58.2 -67.2 -32.0 12.3 10.7 26.7 94 109 A T H X S+ 0 0 93 -4,-1.8 4,-0.6 2,-0.2 -2,-0.2 0.925 112.3 38.9 -64.3 -46.7 14.2 7.7 28.1 95 110 A I H >X S+ 0 0 113 -4,-1.7 4,-1.2 1,-0.2 3,-0.7 0.888 113.2 59.1 -59.9 -42.7 12.0 5.3 26.0 96 111 A A H 3X S+ 0 0 9 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.779 90.8 71.6 -64.6 -25.6 12.1 7.8 23.2 97 112 A K H 3X S+ 0 0 94 -4,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.911 101.5 40.0 -61.4 -44.6 15.9 7.6 23.0 98 113 A S H S+ 0 0 25 -4,-2.6 5,-1.8 1,-0.2 -1,-0.2 0.834 100.9 60.6 -65.3 -35.7 15.9 3.2 9.2 107 122 A L H ><5S+ 0 0 38 -4,-2.0 3,-1.1 3,-0.2 2,-1.0 0.844 100.4 57.8 -61.2 -37.0 15.8 6.6 7.3 108 123 A Q T 3<5S+ 0 0 166 -4,-1.2 -1,-0.2 1,-0.2 4,-0.1 -0.823 102.2 50.7 -89.1 94.8 19.3 5.8 6.1 109 124 A A T 3 5S- 0 0 101 -2,-1.0 -1,-0.2 2,-0.1 -2,-0.2 -0.038 134.7 -92.6 145.2 -4.8 18.2 2.5 4.4 110 125 A G T < 5S+ 0 0 67 -3,-1.1 -3,-0.2 1,-0.2 2,-0.2 0.844 75.7 147.0 70.4 39.1 15.5 4.6 2.8 111 126 A A < - 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