==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 29-MAR-09 3GUF . COMPND 2 MOLECULE: LOW MOLECULAR WEIGHT HEAT SHOCK PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOMONAS AXONOPODIS PV. CITRI; . AUTHOR E.HILARIO,F.J.MEDRANO,M.C.BERTOLINI . 197 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10479.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 144 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 41.1 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 . 6 3.0 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 . 38 19.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 10.7 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+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 . 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 0 0 PARALLEL BRIDGES PER LADDER . 2 2 0 1 5 0 2 2 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 1 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 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 40 A A 0 0 90 0, 0.0 65,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 106.7 11.4 -17.0 -11.6 2 41 A Q + 0 0 133 63,-2.7 2,-0.3 1,-0.5 64,-0.2 0.504 360.0 29.7-124.9 -28.0 12.3 -13.4 -12.4 3 42 A W S S- 0 0 18 62,-1.6 -1,-0.5 59,-0.1 64,-0.4 -0.946 75.3-142.9-114.7 157.1 15.6 -13.4 -10.4 4 43 A V - 0 0 68 -2,-0.3 62,-0.1 -3,-0.1 3,-0.1 -0.867 16.1-152.9-113.2 92.2 17.7 -16.5 -9.8 5 44 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 17,-0.1 -0.390 32.3 -98.8 -55.6 150.0 19.1 -16.3 -6.2 6 45 A R - 0 0 98 15,-0.4 15,-3.1 152,-0.1 2,-0.4 -0.584 42.6-174.1 -78.7 132.6 22.4 -18.3 -5.9 7 46 A V E -A 20 0A 0 -2,-0.3 2,-0.4 13,-0.2 13,-0.2 -0.988 12.0-159.9-129.3 129.3 22.1 -21.7 -4.6 8 47 A D E -A 19 0A 0 11,-2.7 11,-2.9 -2,-0.4 2,-0.5 -0.884 12.3-160.3 -98.9 139.3 25.0 -24.0 -3.7 9 48 A I E -AB 18 156A 4 147,-2.7 146,-1.6 -2,-0.4 147,-1.3 -0.967 8.4-175.9-124.5 123.6 24.2 -27.7 -3.5 10 49 A K E -AB 17 154A 23 7,-3.4 7,-2.2 -2,-0.5 2,-0.6 -0.899 13.9-152.2-113.6 137.9 26.3 -30.1 -1.7 11 50 A E E -A 16 0A 74 142,-3.5 5,-0.2 -2,-0.4 2,-0.2 -0.949 20.0-176.4-108.5 118.1 25.8 -33.9 -1.5 12 51 A E - 0 0 34 3,-3.7 3,-0.0 -2,-0.6 138,-0.0 -0.470 43.4 -91.4 -96.0-179.7 27.2 -35.5 1.6 13 52 A V S S+ 0 0 112 1,-0.2 -1,-0.1 -2,-0.2 3,-0.0 0.990 122.8 12.6 -51.9 -58.7 27.3 -39.2 2.6 14 53 A N S S+ 0 0 103 1,-0.1 82,-2.0 81,-0.1 2,-0.3 0.186 130.3 18.3-115.5 13.3 24.0 -39.0 4.4 15 54 A H E - C 0 95A 33 80,-0.3 -3,-3.7 61,-0.0 2,-0.3 -0.988 60.5-121.0-166.4 165.3 22.5 -35.7 3.4 16 55 A F E -AC 11 94A 1 78,-3.6 78,-3.0 -2,-0.3 2,-0.4 -0.842 18.4-159.8-105.4 158.1 22.3 -32.9 1.1 17 56 A V E -AC 10 93A 0 -7,-2.2 -7,-3.4 -2,-0.3 2,-0.4 -0.997 3.3-168.9-134.4 133.6 22.7 -29.2 1.9 18 57 A L E -AC 9 92A 0 74,-1.9 74,-2.9 -2,-0.4 2,-0.5 -0.958 4.7-163.6-114.0 133.1 21.5 -26.3 -0.2 19 58 A Y E -AC 8 91A 6 -11,-2.9 -11,-2.7 -2,-0.4 2,-0.6 -0.986 10.7-171.2-117.5 115.3 22.7 -22.9 0.6 20 59 A A E -AC 7 90A 0 70,-3.7 70,-4.1 -2,-0.5 2,-1.1 -0.954 19.5-141.1-115.0 121.3 20.6 -20.3 -1.0 21 60 A D E + C 0 89A 10 -15,-3.1 -15,-0.4 -2,-0.6 68,-0.3 -0.739 36.5 159.2 -75.7 99.4 21.6 -16.6 -0.9 22 61 A L > - 0 0 2 66,-3.2 3,-1.1 -2,-1.1 66,-0.1 -0.485 14.3-179.5-117.0 63.7 18.3 -15.0 -0.3 23 62 A P T 3 + 0 0 3 0, 0.0 163,-0.2 0, 0.0 162,-0.1 -0.269 64.3 24.2 -67.6 151.6 19.0 -11.5 1.1 24 63 A G T 3 S+ 0 0 31 161,-1.5 2,-0.4 160,-0.4 22,-0.4 0.585 97.2 106.3 84.3 9.6 16.1 -9.2 2.0 25 64 A I S < S- 0 0 7 -3,-1.1 -1,-0.2 160,-0.4 63,-0.1 -0.963 72.1-122.5-122.1 141.0 13.6 -11.9 2.5 26 65 A D > - 0 0 80 -2,-0.4 3,-6.8 1,-0.1 4,-0.5 -0.729 24.6-127.8 -81.1 125.0 12.2 -13.1 5.7 27 66 A P T 3 S+ 0 0 48 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.648 111.9 62.7 -53.2 -13.2 12.9 -16.8 6.0 28 67 A S T 3 S+ 0 0 96 1,-0.2 -2,-0.0 3,-0.1 -3,-0.0 0.574 97.8 57.2 -85.3 -9.2 9.2 -17.2 6.7 29 68 A Q S < S+ 0 0 114 -3,-6.8 2,-0.5 2,-0.0 15,-0.3 0.552 90.9 85.9 -89.8 -7.5 8.5 -15.8 3.2 30 69 A I - 0 0 19 -4,-0.5 2,-0.6 -3,-0.5 13,-0.2 -0.846 67.4-150.9-104.4 118.7 10.6 -18.5 1.4 31 70 A E E -E 42 0B 86 11,-3.5 11,-3.1 -2,-0.5 2,-0.6 -0.874 7.9-167.8 -94.4 120.2 8.9 -21.8 0.6 32 71 A V E +E 41 0B 34 -2,-0.6 2,-0.3 9,-0.2 9,-0.2 -0.949 22.4 165.5-102.9 118.8 11.1 -24.8 0.5 33 72 A Q E -E 40 0B 84 7,-2.4 7,-3.4 -2,-0.6 2,-0.4 -0.965 28.8-159.5-134.6 146.1 9.3 -27.6 -1.1 34 73 A M E +E 39 0B 28 -2,-0.3 2,-0.4 5,-0.3 5,-0.2 -0.998 15.0 174.4-121.8 135.1 10.0 -31.0 -2.5 35 74 A D E > S-E 38 0B 95 3,-2.3 3,-1.1 -2,-0.4 -2,-0.0 -0.886 73.3 -22.5-143.4 101.5 7.5 -32.6 -4.9 36 75 A K T 3 S- 0 0 195 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.936 129.4 -45.0 61.0 46.9 8.3 -35.8 -6.5 37 76 A G T 3 S+ 0 0 18 1,-0.2 35,-1.8 39,-0.1 2,-0.5 0.255 111.8 117.9 89.1 -11.2 12.1 -35.3 -6.1 38 77 A I E < -EF 35 71B 48 -3,-1.1 -3,-2.3 33,-0.2 2,-0.5 -0.800 52.4-153.1 -96.0 124.9 12.1 -31.7 -7.2 39 78 A L E -EF 34 70B 0 31,-3.6 31,-2.8 -2,-0.5 2,-0.4 -0.904 15.3-168.3 -99.0 122.9 13.3 -29.3 -4.6 40 79 A S E -EF 33 69B 4 -7,-3.4 -7,-2.4 -2,-0.5 2,-0.5 -0.876 16.8-167.9-113.8 137.3 11.8 -25.9 -5.1 41 80 A I E +EF 32 68B 0 27,-2.6 27,-2.4 -2,-0.4 2,-0.4 -0.966 28.4 172.5-124.9 110.0 12.8 -22.7 -3.3 42 81 A R E +EF 31 67B 134 -11,-3.1 -11,-3.5 -2,-0.5 2,-0.3 -0.959 13.2 93.3-132.0 131.7 10.2 -20.3 -4.1 43 82 A G E - F 0 66B 13 23,-2.0 23,-3.2 -2,-0.4 2,-0.4 -0.964 54.5 -85.9-174.9-142.0 9.3 -16.8 -3.0 44 83 A E E - F 0 65B 92 -15,-0.3 2,-0.6 -2,-0.3 21,-0.3 -0.999 14.8-150.8-148.3 130.7 9.6 -13.1 -3.7 45 84 A R E - F 0 64B 1 19,-3.0 19,-2.4 -2,-0.4 2,-0.5 -0.954 11.8-154.8-103.9 122.6 12.1 -10.5 -2.9 46 85 A K - 0 0 135 -2,-0.6 2,-0.5 -22,-0.4 -2,-0.0 -0.808 14.2-160.0 -79.9 127.4 10.6 -7.0 -2.6 47 86 A S > - 0 0 2 -2,-0.5 3,-2.5 1,-0.1 4,-0.4 -0.972 24.0-134.3-110.8 133.6 13.4 -4.6 -3.3 48 87 A E T 3 S+ 0 0 72 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.0 0.409 100.8 85.5 -63.1 1.8 13.0 -1.0 -2.1 49 88 A S T 3 S+ 0 0 2 1,-0.2 -1,-0.3 12,-0.0 7,-0.1 0.539 84.2 55.7 -77.9 -8.2 14.3 -0.4 -5.7 50 89 A S S X S+ 0 0 62 -3,-2.5 2,-0.7 1,-0.1 3,-0.7 0.815 95.6 73.0 -85.8 -37.7 10.6 -0.7 -6.6 51 90 A T T 3 S- 0 0 86 -4,-0.4 -1,-0.1 1,-0.2 0, 0.0 -0.725 120.6 -6.8 -83.0 113.2 9.5 2.0 -4.2 52 91 A E T > S+ 0 0 85 -2,-0.7 3,-1.1 2,-0.0 -1,-0.2 0.932 80.4 174.5 69.4 53.6 10.5 5.5 -5.5 53 92 A T G X + 0 0 60 -3,-0.7 3,-2.4 1,-0.3 -2,-0.1 0.808 66.4 66.1 -68.8 -40.2 12.5 4.1 -8.4 54 93 A E G 3 S+ 0 0 164 1,-0.3 -1,-0.3 54,-0.0 -2,-0.0 0.798 94.7 66.1 -44.9 -32.8 13.5 7.4 -10.2 55 94 A R G < S+ 0 0 73 -3,-1.1 54,-3.2 53,-0.1 2,-0.6 0.478 78.3 102.4 -71.4 -6.0 15.5 8.1 -7.1 56 95 A F E < -G 108 0C 24 -3,-2.4 52,-0.3 52,-0.3 3,-0.2 -0.726 43.4-179.2 -92.7 116.4 18.0 5.2 -7.7 57 96 A S E S+ 0 0 84 50,-2.0 2,-0.3 -2,-0.6 51,-0.2 0.546 78.9 16.6 -87.1 -9.3 21.4 6.2 -9.1 58 97 A R E -G 107 0C 100 49,-1.4 49,-3.7 3,-0.0 2,-0.5 -0.845 60.2-177.8-167.8 123.3 22.5 2.5 -9.3 59 98 A I + 0 0 80 47,-0.3 47,-0.2 -2,-0.3 -3,-0.0 -0.959 23.2 145.9-130.9 105.9 20.6 -0.7 -9.2 60 99 A E + 0 0 33 -2,-0.5 2,-0.3 45,-0.3 46,-0.2 0.574 48.4 98.5-108.6 -23.0 22.6 -3.9 -9.3 61 100 A R - 0 0 5 56,-0.1 2,-0.2 -3,-0.1 -14,-0.0 -0.518 61.5-148.7 -81.8 133.3 20.4 -5.9 -7.0 62 101 A R + 0 0 127 -2,-0.3 2,-0.3 -58,-0.0 -59,-0.1 -0.628 26.5 149.6-101.9 152.6 17.9 -8.3 -8.5 63 102 A Y + 0 0 78 -2,-0.2 2,-0.3 -61,-0.1 -17,-0.1 -0.876 14.0 103.8-162.9-167.5 14.5 -9.2 -7.1 64 103 A G E S-F 45 0B 5 -19,-2.4 -19,-3.0 -2,-0.3 2,-0.1 -0.759 82.6 -24.6 107.5-165.0 11.1 -10.2 -7.9 65 104 A S E -F 44 0B 35 -2,-0.3 -63,-2.7 -21,-0.3 -62,-1.6 -0.505 62.7-165.7 -84.4 155.3 9.7 -13.7 -7.5 66 105 A F E -F 43 0B 1 -23,-3.2 -23,-2.0 -65,-0.3 2,-0.2 -0.989 16.5-178.6-138.7 150.9 12.1 -16.6 -7.6 67 106 A H E -F 42 0B 27 -64,-0.4 2,-0.3 -2,-0.3 -25,-0.2 -0.605 8.4-175.5-150.3 85.8 11.6 -20.2 -8.1 68 107 A R E -F 41 0B 23 -27,-2.4 -27,-2.6 -2,-0.2 2,-0.4 -0.686 8.9-173.3 -82.2 138.9 14.7 -22.3 -7.9 69 108 A R E -F 40 0B 145 -2,-0.3 2,-0.4 -29,-0.2 -29,-0.2 -0.993 9.0-175.6-130.3 142.9 14.1 -25.9 -8.6 70 109 A F E -F 39 0B 19 -31,-2.8 -31,-3.6 -2,-0.4 2,-1.2 -0.992 25.7-134.7-136.2 142.8 16.6 -28.8 -8.4 71 110 A A E -F 38 0B 82 -2,-0.4 -33,-0.2 -33,-0.2 3,-0.1 -0.817 35.6-165.0 -96.9 94.1 15.9 -32.3 -9.4 72 111 A L - 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