==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 20-SEP-11 2LJL . COMPND 2 MOLECULE: 12 KDA HEAT SHOCK PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR K.SINGARAPU,J.MARKLEY,CENTER FOR EUKARYOTIC STRUCTURAL GENOM . 109 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12722.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 35 32.1 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 . 0 0.0 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 . 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 0.9 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 . 2 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 20.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 228 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 102.1 2.1 -0.0 -1.2 2 2 A S + 0 0 117 1,-0.2 0, 0.0 0, 0.0 0, 0.0 -0.937 360.0 77.2-164.5-177.1 5.5 1.7 -0.9 3 3 A D + 0 0 162 -2,-0.3 2,-0.3 1,-0.1 -1,-0.2 0.964 61.2 134.7 63.3 90.4 9.3 1.1 -1.0 4 4 A A + 0 0 103 -3,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.919 24.6 175.7-153.9 177.3 10.3 0.8 -4.6 5 5 A G - 0 0 65 -2,-0.3 2,-0.2 0, 0.0 0, 0.0 -0.973 16.5-151.3-171.7-178.7 12.9 1.9 -7.2 6 6 A R + 0 0 238 -2,-0.3 -2,-0.0 1,-0.0 0, 0.0 -0.569 13.5 170.1-175.4 104.4 14.3 1.6 -10.7 7 7 A K - 0 0 209 -2,-0.2 2,-0.1 1,-0.0 -1,-0.0 0.966 26.7-173.5 -81.5 -71.1 17.8 2.1 -11.9 8 8 A G - 0 0 72 2,-0.0 2,-0.3 0, 0.0 -1,-0.0 -0.388 24.9 -72.8 101.4 178.5 17.9 0.9 -15.5 9 9 A F + 0 0 207 -2,-0.1 2,-0.3 0, 0.0 0, 0.0 -0.816 69.1 84.3-115.7 156.1 20.7 0.4 -18.1 10 10 A G - 0 0 71 -2,-0.3 2,-0.2 0, 0.0 -2,-0.0 -0.984 63.6 -68.2 152.9-161.7 22.7 2.9 -20.1 11 11 A E - 0 0 168 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.547 16.4-147.3-118.1-175.8 25.8 5.2 -19.9 12 12 A K S S- 0 0 202 -2,-0.2 -1,-0.1 0, 0.0 0, 0.0 0.662 71.4 -57.0-121.3 -42.7 26.9 8.3 -18.1 13 13 A A + 0 0 81 2,-0.0 -2,-0.0 0, 0.0 0, 0.0 0.084 63.6 176.6-167.1 -64.0 29.1 10.2 -20.5 14 14 A S - 0 0 87 1,-0.1 2,-0.3 2,-0.0 -3,-0.0 0.057 24.5-119.2 63.2 179.6 32.2 8.3 -21.8 15 15 A E + 0 0 169 1,-0.1 -1,-0.1 2,-0.0 -2,-0.0 -0.968 39.6 154.3-159.4 141.3 34.6 9.8 -24.4 16 16 A A - 0 0 95 -2,-0.3 -1,-0.1 0, 0.0 -2,-0.0 0.547 27.8-172.1-134.4 -41.7 35.8 8.9 -27.9 17 17 A L - 0 0 133 2,-0.0 -2,-0.0 0, 0.0 0, 0.0 0.119 33.4 -72.6 62.8 175.3 36.9 12.1 -29.5 18 18 A K - 0 0 186 1,-0.2 0, 0.0 2,-0.0 0, 0.0 -0.669 45.4-106.5-104.9 160.7 37.9 12.4 -33.2 19 19 A P - 0 0 104 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.112 15.3-134.2 -69.7-171.1 41.0 11.1 -35.0 20 20 A D - 0 0 149 1,-0.5 -2,-0.0 0, 0.0 0, 0.0 -0.102 45.4-106.0-141.8 36.8 43.9 13.2 -36.4 21 21 A S - 0 0 86 1,-0.0 -1,-0.5 0, 0.0 2,-0.3 -0.003 38.2-141.2 63.2-175.3 44.4 11.8 -39.9 22 22 A Q - 0 0 158 -3,-0.1 2,-0.3 2,-0.0 -1,-0.0 -0.976 10.0-150.8-172.8 167.5 47.4 9.6 -40.7 23 23 A K + 0 0 180 -2,-0.3 2,-0.2 2,-0.0 0, 0.0 -0.994 19.2 154.1-153.0 148.3 50.0 8.8 -43.4 24 24 A S + 0 0 124 -2,-0.3 2,-0.3 0, 0.0 -2,-0.0 -0.615 27.6 99.3-178.5 112.8 52.0 5.7 -44.5 25 25 A Y + 0 0 197 1,-0.2 -2,-0.0 -2,-0.2 0, 0.0 -0.957 29.1 87.0-174.4-172.7 53.6 4.9 -47.9 26 26 A A + 0 0 84 -2,-0.3 2,-0.3 1,-0.1 -1,-0.2 0.892 49.7 158.4 63.5 104.2 56.7 4.9 -50.0 27 27 A E + 0 0 177 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.990 7.1 146.5-154.1 156.1 58.7 1.7 -49.6 28 28 A Q - 0 0 146 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.954 31.9-145.6-170.7-175.8 61.4 -0.4 -51.3 29 29 A G + 0 0 51 -2,-0.3 2,-2.6 2,-0.1 -1,-0.1 0.564 16.3 178.4-135.5 -43.7 64.4 -2.7 -50.9 30 30 A K + 0 0 135 1,-0.0 79,-0.0 79,-0.0 -1,-0.0 -0.408 22.5 173.2 69.2 -75.5 66.9 -2.1 -53.7 31 31 A E - 0 0 138 -2,-2.6 2,-0.3 78,-0.2 -2,-0.1 0.197 7.8-169.7 57.2 173.1 69.4 -4.7 -52.4 32 32 A Y - 0 0 123 77,-0.2 69,-0.1 66,-0.1 76,-0.1 -0.944 37.6 -20.0-173.0-170.1 72.5 -5.7 -54.3 33 33 A I - 0 0 117 -2,-0.3 74,-0.3 74,-0.2 2,-0.2 -0.198 62.0-165.2 -52.6 138.3 75.4 -8.1 -54.6 34 34 A T - 0 0 23 1,-0.2 64,-0.1 72,-0.1 -1,-0.1 -0.537 21.5 -85.1-117.5-175.4 76.2 -9.8 -51.2 35 35 A D - 0 0 87 62,-0.3 2,-0.2 -2,-0.2 -1,-0.2 0.007 40.8-122.0 -78.9-170.2 79.0 -11.8 -49.7 36 36 A K + 0 0 154 61,-0.1 -1,-0.1 60,-0.1 54,-0.0 -0.786 61.4 37.0-130.8 174.2 79.7 -15.6 -50.0 37 37 A A + 0 0 72 -2,-0.2 -2,-0.0 1,-0.0 60,-0.0 0.309 43.6 150.5 63.8 159.4 80.0 -18.6 -47.8 38 38 A D - 0 0 64 58,-0.0 55,-0.0 3,-0.0 -2,-0.0 -0.179 20.6-168.6-179.2 -74.6 78.1 -19.2 -44.6 39 39 A K + 0 0 208 1,-0.0 3,-0.0 0, 0.0 54,-0.0 0.992 47.4 116.9 56.9 75.3 77.3 -22.8 -43.6 40 40 A V + 0 0 106 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 0.539 41.5 93.8-135.3 -41.0 74.8 -22.2 -40.8 41 41 A A + 0 0 92 51,-0.1 2,-0.1 2,-0.0 -3,-0.0 0.001 41.1 139.5 -53.8 165.3 71.5 -23.9 -41.9 42 42 A G + 0 0 67 -3,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.128 16.7 108.3 150.1 109.9 70.7 -27.4 -40.8 43 43 A K - 0 0 176 17,-0.1 2,-0.3 -2,-0.1 17,-0.1 -0.957 32.5-150.7-173.5-173.6 67.6 -29.1 -39.7 44 44 A V - 0 0 62 -2,-0.3 17,-0.1 15,-0.1 18,-0.0 -0.921 11.2-132.2-175.3 149.9 64.8 -31.6 -40.5 45 45 A Q - 0 0 151 -2,-0.3 -2,-0.0 1,-0.1 0, 0.0 -0.724 32.2 -97.8-110.3 160.6 61.2 -32.4 -39.8 46 46 A P + 0 0 119 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.164 42.4 170.0 -69.8 166.9 59.4 -35.7 -38.9 47 47 A E - 0 0 94 2,-0.0 2,-0.3 11,-0.0 10,-0.0 -0.928 12.9-178.7-175.3 151.4 57.6 -38.0 -41.3 48 48 A D + 0 0 138 -2,-0.3 2,-0.3 2,-0.0 0, 0.0 -0.937 18.3 132.9-162.0 136.3 56.0 -41.4 -41.6 49 49 A N - 0 0 152 -2,-0.3 2,-0.3 3,-0.0 3,-0.1 -0.904 20.8-166.1-179.2 151.3 54.3 -43.4 -44.4 50 50 A K + 0 0 183 1,-0.3 -2,-0.0 -2,-0.3 0, 0.0 -0.995 61.3 18.6-148.7 150.0 54.2 -46.9 -46.0 51 51 A G S S+ 0 0 76 -2,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.958 72.8 156.1 53.6 90.0 52.9 -48.4 -49.2 52 52 A V - 0 0 92 -3,-0.1 -1,-0.2 2,-0.1 -3,-0.0 -0.999 44.2-148.9-147.4 143.3 52.2 -45.6 -51.6 53 53 A F S S+ 0 0 215 -2,-0.3 2,-0.2 0, 0.0 -2,-0.0 -0.254 72.2 88.4-104.1 43.9 51.9 -45.2 -55.4 54 54 A Q S S- 0 0 171 1,-0.3 -2,-0.1 -2,-0.0 0, 0.0 -0.559 82.9 -84.5-125.3-170.0 53.3 -41.6 -55.5 55 55 A G - 0 0 68 1,-0.2 -1,-0.3 -2,-0.2 2,-0.2 0.695 61.7 -75.8 -68.9-124.4 56.6 -39.8 -55.7 56 56 A V - 0 0 142 2,-0.1 -1,-0.2 0, 0.0 0, 0.0 -0.692 22.8-155.2-132.4-174.8 58.7 -39.1 -52.6 57 57 A H + 0 0 163 -2,-0.2 2,-0.3 -10,-0.0 -2,-0.0 -0.342 53.8 81.2-168.0 75.1 58.9 -36.9 -49.6 58 58 A D + 0 0 79 1,-0.1 -2,-0.1 -11,-0.0 3,-0.0 -0.978 29.4 175.1-170.1 166.7 62.3 -36.4 -48.0 59 59 A S S S- 0 0 113 -2,-0.3 2,-0.3 0, 0.0 -1,-0.1 0.397 70.6 -16.4-144.7 -60.5 65.6 -34.4 -48.3 60 60 A A - 0 0 64 -17,-0.1 2,-0.3 6,-0.0 -17,-0.1 -0.894 55.5-174.3-162.7 128.7 68.0 -35.1 -45.4 61 61 A E - 0 0 135 -2,-0.3 2,-0.3 -17,-0.1 -17,-0.0 -0.786 37.9 -87.4-121.9 165.8 67.7 -36.6 -42.0 62 62 A K S S+ 0 0 160 -2,-0.3 2,-0.3 1,-0.1 -18,-0.0 -0.567 86.2 64.9 -75.1 129.0 70.0 -37.1 -39.0 63 63 A G S S- 0 0 57 -2,-0.3 2,-0.2 3,-0.0 -1,-0.1 -0.868 82.9 -76.5 165.5-128.1 72.1 -40.3 -39.2 64 64 A K S S+ 0 0 200 -2,-0.3 3,-0.1 3,-0.0 -2,-0.1 -0.610 80.6 81.1-176.3 109.9 74.8 -41.6 -41.4 65 65 A D + 0 0 160 -2,-0.2 0, 0.0 1,-0.2 0, 0.0 0.124 61.2 97.9-177.0 -43.6 74.6 -43.1 -44.9 66 66 A N + 0 0 149 2,-0.0 -1,-0.2 0, 0.0 -6,-0.0 0.087 67.3 42.2 -55.4 175.4 74.5 -40.4 -47.5 67 67 A A + 0 0 85 -3,-0.1 2,-0.3 1,-0.0 11,-0.0 0.300 62.5 174.2 63.8 159.9 77.6 -39.2 -49.4 68 68 A E + 0 0 123 6,-0.0 3,-0.1 7,-0.0 -1,-0.0 -0.964 23.7 173.9-176.0-173.6 80.2 -41.6 -50.7 69 69 A G + 0 0 46 1,-0.5 9,-0.1 -2,-0.3 -2,-0.0 -0.019 53.5 82.5-172.4 -70.5 83.4 -41.9 -52.8 70 70 A Q + 0 0 185 4,-0.1 -1,-0.5 2,-0.1 4,-0.2 -0.011 63.9 76.6 -52.1 161.7 85.2 -45.2 -53.0 71 71 A G S S- 0 0 56 1,-0.1 4,-0.4 3,-0.1 -3,-0.0 0.002 77.1-110.6 108.9 145.0 83.9 -47.8 -55.5 72 72 A E S S+ 0 0 194 2,-0.1 -1,-0.1 1,-0.1 -2,-0.1 0.026 115.3 33.6 -96.2 26.3 84.2 -48.2 -59.3 73 73 A S S >> S+ 0 0 89 -3,-0.1 3,-1.3 3,-0.0 4,-0.8 0.464 105.1 62.0-142.9 -44.2 80.5 -47.5 -59.7 74 74 A L H 3> S+ 0 0 47 1,-0.3 4,-2.2 -4,-0.2 5,-0.2 0.691 86.6 82.4 -64.8 -17.5 79.4 -44.9 -57.1 75 75 A A H 3> S+ 0 0 55 -4,-0.4 4,-2.0 1,-0.2 -1,-0.3 0.876 92.6 46.3 -54.3 -40.2 81.9 -42.5 -58.8 76 76 A D H <> S+ 0 0 125 -3,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.949 108.8 52.7 -68.4 -50.9 79.2 -41.7 -61.4 77 77 A Q H X S+ 0 0 124 -4,-0.8 4,-1.6 1,-0.2 -2,-0.2 0.840 112.5 47.9 -53.9 -34.9 76.4 -41.2 -59.0 78 78 A A H X S+ 0 0 33 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.905 107.1 53.8 -73.5 -43.4 78.6 -38.8 -57.1 79 79 A R H X S+ 0 0 181 -4,-2.0 4,-1.5 -5,-0.2 -2,-0.2 0.797 108.1 53.6 -61.4 -28.6 79.7 -36.9 -60.2 80 80 A D H X S+ 0 0 128 -4,-1.9 4,-0.8 2,-0.2 -1,-0.2 0.947 114.2 37.6 -71.5 -50.7 76.0 -36.4 -61.0 81 81 A Y H X S+ 0 0 158 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.776 109.6 67.2 -72.0 -26.8 75.0 -34.9 -57.7 82 82 A M H >X S+ 0 0 101 -4,-2.5 4,-1.3 1,-0.2 3,-0.8 0.978 98.8 46.8 -57.1 -61.4 78.3 -33.0 -57.6 83 83 A G H 3X S+ 0 0 52 -4,-1.5 4,-1.1 1,-0.3 -1,-0.2 0.795 115.7 48.6 -52.3 -29.6 77.6 -30.7 -60.5 84 84 A A H 3X S+ 0 0 46 -4,-0.8 4,-2.0 1,-0.2 -1,-0.3 0.779 100.7 63.7 -81.4 -29.0 74.2 -30.1 -58.9 85 85 A A H X S+ 0 0 103 -4,-1.6 4,-2.2 1,-0.2 3,-0.6 0.948 103.8 52.8 -56.4 -52.9 75.1 -24.1 -53.1 90 90 A N H 3X S+ 0 0 111 -4,-2.0 4,-2.2 1,-0.3 -1,-0.2 0.807 105.9 57.7 -53.7 -30.5 75.1 -20.6 -54.7 91 91 A D H 3X S+ 0 0 111 -4,-0.9 4,-0.8 -3,-0.3 -1,-0.3 0.910 107.4 44.6 -67.6 -43.5 71.3 -20.7 -54.2 92 92 A A H S+ 0 0 20 -4,-2.2 4,-2.7 1,-0.2 5,-0.7 0.960 103.0 53.0 -64.1 -53.5 74.3 -18.4 -50.3 94 94 A E H <5S+ 0 0 132 -4,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.787 112.8 49.3 -53.1 -28.1 72.3 -15.7 -52.0 95 95 A Y H X5S+ 0 0 188 -4,-0.8 4,-1.0 2,-0.2 -2,-0.2 0.969 118.4 33.6 -76.3 -58.3 69.6 -16.5 -49.4 96 96 A V H ><5S+ 0 0 40 -4,-2.4 3,-1.2 1,-0.2 4,-0.5 0.974 124.9 42.6 -62.1 -57.4 71.8 -16.4 -46.2 97 97 A S G ><5S+ 0 0 2 -4,-2.7 3,-0.8 1,-0.3 4,-0.4 0.800 109.8 61.1 -60.3 -28.9 74.2 -13.7 -47.5 98 98 A G G >4