==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 01-MAR-10 3LZ8 . COMPND 2 MOLECULE: PUTATIVE CHAPERONE DNAJ; . SOURCE 2 ORGANISM_SCIENTIFIC: KLEBSIELLA PNEUMONIAE SUBSP. PNEUMONIA . AUTHOR E.V.FILIPPOVA,G.MINASOV,L.SHUVALOVA,O.KIRYUKHINA,J.BEARDEN, . 373 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21154.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 231 61.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 19.8 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 42 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 31 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 0 0 2 0 0 0 0 0 0 2 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 1 0 2 1 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 0 2 3 1 2 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 2 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 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 1 113 A A 0 0 148 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 42.3 -68.2 -27.0 -3.9 2 114 A A - 0 0 62 70,-0.1 2,-0.2 1,-0.1 70,-0.0 0.179 360.0-150.2 -69.5 179.0 -65.7 -24.3 -2.5 3 115 A R - 0 0 75 68,-0.2 71,-0.2 69,-0.2 72,-0.1 -0.826 26.7 -70.7-142.2 178.9 -62.4 -24.2 -0.5 4 116 A G - 0 0 29 69,-2.0 2,-0.3 -2,-0.2 72,-0.1 -0.084 24.4-128.8 -83.5 173.0 -60.5 -21.9 2.0 5 117 A H - 0 0 80 70,-0.1 63,-2.5 64,-0.1 70,-0.3 -0.788 27.1-129.7-111.2 155.7 -58.5 -18.7 2.2 6 118 A D - 0 0 80 -2,-0.3 2,-0.3 61,-0.2 71,-0.2 -0.519 11.1-146.3-105.1 171.1 -55.0 -18.3 3.8 7 119 A L E -a 77 0A 32 69,-1.9 71,-4.1 -2,-0.2 2,-0.5 -0.997 3.8-153.2-141.2 137.6 -53.4 -16.0 6.3 8 120 A E E -a 78 0A 118 -2,-0.3 2,-0.5 69,-0.2 71,-0.2 -0.907 15.6-171.1-106.6 132.3 -50.0 -14.5 6.8 9 121 A I E -a 79 0A 32 69,-3.7 71,-2.9 -2,-0.5 2,-0.2 -0.972 17.2-139.2-129.0 116.8 -49.1 -13.6 10.4 10 122 A E E -a 80 0A 122 -2,-0.5 2,-0.4 69,-0.2 71,-0.2 -0.548 16.8-165.7 -70.4 135.7 -46.0 -11.6 11.2 11 123 A V E -a 81 0A 5 69,-3.0 71,-1.4 -2,-0.2 2,-0.2 -0.816 8.7-150.3-129.1 92.4 -44.3 -13.0 14.3 12 124 A A + 0 0 53 -2,-0.4 2,-0.2 69,-0.2 71,-0.2 -0.419 20.1 176.2 -67.2 124.6 -41.6 -10.7 15.7 13 125 A V - 0 0 4 69,-0.5 71,-0.5 -2,-0.2 2,-0.4 -0.762 24.4-126.0-119.5 165.1 -38.7 -12.4 17.5 14 126 A F >> - 0 0 124 -2,-0.2 4,-1.6 69,-0.1 3,-1.0 -0.931 22.5-119.5-113.9 146.0 -35.5 -10.9 19.0 15 127 A L T 34 S+ 0 0 7 -2,-0.4 4,-0.3 69,-0.3 3,-0.3 0.871 116.2 50.9 -50.1 -39.1 -32.1 -12.0 18.1 16 128 A E T >4 S+ 0 0 74 1,-0.2 3,-1.2 2,-0.2 -1,-0.3 0.834 103.2 59.2 -68.9 -32.5 -31.5 -13.0 21.7 17 129 A E G X4 S+ 0 0 64 -3,-1.0 3,-1.6 1,-0.3 -1,-0.2 0.863 92.8 69.0 -63.2 -37.4 -34.7 -15.0 21.9 18 130 A T G 3< S+ 0 0 2 -4,-1.6 36,-1.4 -3,-0.3 -1,-0.3 0.639 77.1 83.0 -54.1 -21.1 -33.4 -17.2 19.0 19 131 A L G < S+ 0 0 33 -3,-1.2 2,-0.3 -4,-0.3 -1,-0.3 0.638 101.8 17.0 -65.0 -14.7 -30.8 -18.7 21.2 20 132 A A S < S- 0 0 57 -3,-1.6 34,-0.2 32,-0.1 2,-0.1 -0.954 94.4 -79.8-150.1 166.0 -33.2 -21.2 22.7 21 133 A E - 0 0 104 -2,-0.3 2,-0.4 32,-0.1 -2,-0.0 -0.465 49.6-164.6 -66.3 140.0 -36.6 -22.8 22.1 22 134 A Q E -C 51 0B 37 29,-2.4 29,-2.8 -2,-0.1 2,-0.4 -0.994 18.9-135.6-136.8 131.0 -39.4 -20.5 23.2 23 135 A T E -C 50 0B 88 -2,-0.4 2,-0.3 27,-0.3 27,-0.2 -0.699 34.5-171.1 -78.2 133.6 -43.1 -21.1 23.8 24 136 A R E -C 49 0B 56 25,-2.6 25,-2.0 -2,-0.4 2,-0.6 -0.953 23.6-147.8-135.6 148.6 -45.1 -18.3 22.2 25 137 A T E -C 48 0B 93 -2,-0.3 2,-0.5 23,-0.2 23,-0.2 -0.852 16.8-169.8-121.2 97.7 -48.7 -17.1 22.2 26 138 A I E -C 47 0B 15 21,-1.9 21,-2.0 -2,-0.6 2,-0.5 -0.740 5.2-159.9 -90.6 127.1 -49.8 -15.4 19.0 27 139 A S E +C 46 0B 91 -2,-0.5 2,-0.2 19,-0.2 19,-0.2 -0.900 25.5 154.2-104.1 133.0 -53.1 -13.7 19.0 28 140 A Y E -C 45 0B 17 17,-2.3 17,-2.2 -2,-0.5 2,-0.4 -0.800 38.1-108.6-143.2-174.3 -54.7 -13.2 15.6 29 141 A N E -C 44 0B 73 15,-0.3 14,-0.2 -2,-0.2 -2,-0.0 -0.983 16.3-146.6-126.2 133.1 -58.0 -12.7 13.9 30 142 A L E -C 43 0B 14 13,-1.9 13,-0.7 -2,-0.4 37,-0.1 -0.897 27.6-128.6-103.5 117.7 -59.8 -15.1 11.6 31 143 A P E -C 42 0B 19 0, 0.0 2,-0.4 0, 0.0 11,-0.2 -0.119 12.9-153.0 -62.0 157.7 -61.8 -13.4 8.8 32 144 A V E -C 41 0B 48 9,-0.8 8,-1.8 36,-0.1 9,-0.8 -0.918 8.5-170.5-138.7 107.2 -65.4 -13.9 7.9 33 145 A Y - 0 0 75 -2,-0.4 0, 0.0 6,-0.2 0, 0.0 -0.807 30.2-115.9 -94.9 136.2 -66.6 -13.3 4.3 34 146 A N - 0 0 61 -2,-0.4 2,-3.3 1,-0.2 -1,-0.1 -0.272 47.4 -88.1 -60.0 158.4 -70.3 -13.3 3.7 35 147 A V S S+ 0 0 161 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 -0.168 128.5 67.7 -73.5 50.5 -71.3 -16.2 1.3 36 148 A F 0 0 191 -2,-3.3 -1,-0.2 0, 0.0 -3,-0.1 0.404 360.0 360.0-116.0 -81.8 -70.5 -13.4 -1.3 37 149 A G 0 0 68 -3,-0.0 -2,-0.1 0, 0.0 0, 0.0 -0.131 360.0 360.0 141.3 360.0 -66.7 -12.9 -1.1 38 ! 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 39 151 A I 0 0 111 0, 0.0 -6,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 131.4 -65.8 -9.2 4.7 40 152 A E + 0 0 128 -8,-1.8 2,-0.2 1,-0.1 -7,-0.1 0.367 360.0 35.3-145.9 4.9 -67.8 -7.9 7.8 41 153 A S E -C 32 0B 51 -9,-0.8 -9,-0.8 2,-0.0 -1,-0.1 -0.772 53.4-149.6-147.1-177.3 -66.5 -9.7 10.9 42 154 A E E -C 31 0B 105 -2,-0.2 -12,-0.1 -11,-0.2 -10,-0.0 -0.234 6.5-161.0-164.2 71.1 -63.2 -11.2 12.5 43 155 A T E -C 30 0B 72 -13,-0.7 -13,-1.9 -14,-0.2 -2,-0.0 -0.353 29.5-143.0 -57.2 105.9 -63.5 -14.3 14.9 44 156 A P E -C 29 0B 93 0, 0.0 -15,-0.3 0, 0.0 2,-0.3 -0.249 20.6-172.9 -76.5 162.9 -60.1 -14.1 16.7 45 157 A K E -C 28 0B 79 -17,-2.2 -17,-2.3 2,-0.0 2,-0.3 -0.833 14.4-148.0-142.7 177.1 -57.9 -16.9 17.8 46 158 A T E -C 27 0B 96 -2,-0.3 2,-0.4 -19,-0.2 -19,-0.2 -0.974 10.9-167.5-152.3 132.7 -54.9 -17.7 19.7 47 159 A L E -C 26 0B 28 -21,-2.0 -21,-1.9 -2,-0.3 2,-0.6 -0.985 15.3-144.2-128.1 150.3 -52.3 -20.4 19.3 48 160 A N E +C 25 0B 108 -2,-0.4 2,-0.4 -23,-0.2 -23,-0.2 -0.932 30.4 169.8-110.4 110.3 -49.6 -21.7 21.4 49 161 A V E -C 24 0B 29 -25,-2.0 -25,-2.6 -2,-0.6 2,-0.8 -0.964 34.2-133.1-126.0 143.4 -46.5 -22.7 19.4 50 162 A K E -C 23 0B 120 -2,-0.4 -27,-0.3 -27,-0.2 -29,-0.0 -0.853 25.0-151.3 -94.7 106.1 -43.0 -23.6 20.4 51 163 A I E -C 22 0B 8 -29,-2.8 -29,-2.4 -2,-0.8 2,-0.1 -0.622 23.1-117.5 -77.6 134.5 -40.7 -21.7 18.1 52 164 A P > - 0 0 69 0, 0.0 3,-1.2 0, 0.0 2,-0.4 -0.353 23.1 -96.3 -82.2 158.7 -37.4 -23.5 17.6 53 165 A A T 3 S+ 0 0 31 1,-0.2 -34,-0.2 -34,-0.1 -32,-0.1 -0.522 107.1 28.6 -67.9 117.6 -33.9 -22.6 18.5 54 166 A G T 3 S+ 0 0 24 -36,-1.4 -1,-0.2 -2,-0.4 92,-0.2 0.517 73.8 160.2 112.5 8.3 -32.3 -21.0 15.5 55 167 A V < - 0 0 6 -3,-1.2 2,-0.3 -37,-0.2 -1,-0.1 -0.030 25.1-145.5 -58.3 170.1 -35.0 -19.4 13.4 56 168 A V > - 0 0 90 1,-0.0 3,-2.6 25,-0.0 25,-0.2 -0.995 28.8 -81.0-142.5 144.9 -34.1 -16.7 10.9 57 169 A D T 3 S+ 0 0 82 -2,-0.3 25,-0.2 1,-0.3 3,-0.1 -0.044 117.0 16.8 -48.1 142.3 -35.7 -13.5 9.6 58 170 A G T 3 S+ 0 0 37 23,-1.4 -1,-0.3 1,-0.2 24,-0.1 0.127 87.4 146.4 82.3 -20.7 -38.3 -14.3 7.0 59 171 A Q < - 0 0 78 -3,-2.6 22,-3.3 21,-0.1 2,-0.4 -0.120 37.1-144.3 -49.1 142.5 -38.6 -18.0 7.9 60 172 A R E -B 80 0A 132 20,-0.2 2,-0.4 -3,-0.1 20,-0.2 -0.935 16.6-169.7-119.2 136.2 -42.1 -19.4 7.5 61 173 A I E -B 79 0A 57 18,-2.2 18,-3.3 -2,-0.4 2,-0.3 -1.000 17.1-149.2-124.9 127.7 -44.0 -22.0 9.5 62 174 A R E -B 78 0A 115 -2,-0.4 2,-0.5 16,-0.2 16,-0.2 -0.691 7.0-158.9 -96.1 142.0 -47.3 -23.3 8.1 63 175 A L E -B 77 0A 42 14,-2.5 14,-3.0 -2,-0.3 2,-0.3 -0.998 25.1-127.5-122.1 126.3 -50.3 -24.5 10.0 64 176 A K S S- 0 0 163 -2,-0.5 12,-0.1 1,-0.2 11,-0.1 -0.532 81.5 -3.2 -81.4 136.6 -52.6 -26.8 8.0 65 177 A G S S+ 0 0 23 9,-0.3 2,-2.2 -2,-0.3 10,-0.2 0.104 94.9 120.0 75.5 -22.5 -56.3 -26.1 7.7 66 178 A Q + 0 0 73 8,-0.1 10,-0.3 11,-0.1 -1,-0.1 -0.027 55.8 75.4 -71.9 42.1 -55.9 -23.1 10.0 67 179 A G S S- 0 0 4 -2,-2.2 -61,-0.2 8,-2.0 10,-0.1 -0.218 104.0 -34.3-120.4-149.0 -57.2 -20.6 7.4 68 180 A T 0 0 20 -63,-2.5 7,-4.0 8,-0.2 -1,-0.5 -0.251 360.0 360.0 -67.1 164.3 -60.8 -20.0 6.4 69 181 A P 0 0 88 0, 0.0 3,-0.2 0, 0.0 5,-0.1 -0.505 360.0 360.0 -83.7 360.0 -63.0 -23.1 6.3 70 ! 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 71 185 A G 0 0 101 0, 0.0 -68,-0.2 0, 0.0 -67,-0.0 0.000 360.0 360.0 360.0 1.8 -68.1 -26.1 1.0 72 186 A G + 0 0 39 1,-0.3 -69,-0.2 -3,-0.2 -70,-0.1 -0.422 360.0 2.8-143.9-140.9 -64.8 -28.1 1.2 73 187 A P - 0 0 84 0, 0.0 -69,-2.0 0, 0.0 -1,-0.3 -0.200 67.5-116.1 -62.2 147.4 -61.2 -28.0 2.6 74 188 A N - 0 0 89 -71,-0.2 -9,-0.3 1,-0.1 -8,-0.1 -0.323 27.8-103.6 -82.7 161.5 -60.1 -25.1 4.8 75 189 A G - 0 0 4 -7,-4.0 -8,-2.0 -70,-0.3 2,-0.3 -0.097 36.2-106.4 -74.4 176.9 -57.3 -22.6 4.1 76 190 A D - 0 0 26 -10,-0.3 -69,-1.9 -12,-0.1 2,-0.5 -0.801 16.9-130.6-111.9 151.9 -53.8 -22.5 5.6 77 191 A L E -aB 7 63A 0 -14,-3.0 -14,-2.5 -2,-0.3 2,-0.6 -0.863 16.2-158.3-104.6 127.5 -52.0 -20.3 8.3 78 192 A W E -aB 8 62A 71 -71,-4.1 -69,-3.7 -2,-0.5 2,-0.8 -0.894 4.0-165.8-110.6 115.3 -48.6 -18.7 7.6 79 193 A L E -aB 9 61A 4 -18,-3.3 -18,-2.2 -2,-0.6 2,-0.7 -0.862 10.7-165.0 -95.3 109.0 -46.4 -17.6 10.5 80 194 A V E -aB 10 60A 13 -71,-2.9 -69,-3.0 -2,-0.8 -20,-0.2 -0.866 12.3-140.3-100.8 114.9 -43.7 -15.4 9.1 81 195 A I E -a 11 0A 4 -22,-3.3 -23,-1.4 -2,-0.7 -69,-0.2 -0.380 16.0-170.0 -64.5 150.3 -40.8 -14.8 11.4 82 196 A H - 0 0 63 -71,-1.4 2,-1.7 -25,-0.2 -69,-0.5 -0.546 9.7-178.8-148.2 76.3 -39.5 -11.3 11.5 83 197 A I - 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