==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE, STRUCTURAL PROTEIN 28-APR-03 1P5V . COMPND 2 MOLECULE: CHAPERONE PROTEIN CAF1M; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA PESTIS; . AUTHOR A.V.ZAVIALOV,J.BERGLUND,A.F.PUDNEY,L.J.FOOKS,T.M.IBRAHIM, . 327 5 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14951.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 212 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 6.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 125 38.2 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 . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 . 33 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 6.1 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 . 0 1 0 0 1 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 PARALLEL BRIDGES PER LADDER . 3 5 2 4 3 4 1 1 1 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 . 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 7 A F 0 0 171 0, 0.0 2,-0.2 0, 0.0 208,-0.1 0.000 360.0 360.0 360.0 126.3 -6.5 37.9 -8.5 2 8 A A - 0 0 63 206,-0.2 205,-2.7 204,-0.1 2,-0.3 -0.576 360.0-160.8 -79.3 144.6 -5.1 34.6 -7.4 3 9 A S E -A 206 0A 85 203,-0.2 2,-0.4 -2,-0.2 203,-0.2 -0.871 5.8-157.3-118.8 158.4 -3.5 34.3 -3.9 4 10 A K E -A 205 0A 37 201,-1.7 201,-2.4 -2,-0.3 2,-0.4 -0.977 12.5-144.3-132.5 137.9 -1.1 31.7 -2.4 5 11 A E E +A 204 0A 49 -2,-0.4 2,-0.3 199,-0.2 199,-0.2 -0.863 16.3 179.5-109.4 146.2 -0.6 31.0 1.4 6 12 A Y E +A 203 0A 22 197,-2.5 197,-2.3 -2,-0.4 2,-0.2 -0.965 7.8 161.1-137.4 148.1 2.5 30.1 3.2 7 13 A G E -A 202 0A 5 -2,-0.3 24,-0.6 195,-0.2 25,-0.4 -0.837 16.2-178.7-167.9 138.5 3.1 29.4 6.9 8 14 A V E -AB 201 30A 6 193,-1.9 193,-1.9 -2,-0.2 2,-0.4 -0.997 14.4-163.4-131.5 128.6 5.6 27.8 9.3 9 15 A T E -AB 200 29A 22 20,-2.1 20,-2.3 -2,-0.4 2,-0.4 -0.971 5.9-160.0-113.4 127.7 5.0 27.7 13.1 10 16 A I E -AB 199 28A 0 189,-2.5 189,-2.5 -2,-0.4 18,-0.2 -0.907 25.9-128.0 -99.3 138.3 7.7 26.9 15.7 11 17 A G S S+ 0 0 34 16,-1.9 2,-0.3 -2,-0.4 17,-0.1 0.541 90.7 30.2 -69.4 -11.8 6.2 25.8 19.1 12 18 A E - 0 0 51 15,-0.3 187,-0.4 187,-0.1 172,-0.1 -0.982 67.7-139.1-142.1 163.5 8.2 28.4 21.0 13 19 A S S S+ 0 0 11 184,-1.3 93,-0.7 -2,-0.3 2,-0.3 0.412 88.6 16.0-100.8 -1.9 9.6 31.9 20.2 14 20 A R E -c 106 0A 8 91,-0.2 2,-0.5 183,-0.2 93,-0.2 -0.920 66.6-139.5-161.4 152.9 12.9 31.4 21.9 15 21 A I E -c 107 0A 4 91,-2.1 93,-3.0 -2,-0.3 2,-0.7 -0.998 6.2-158.0-119.6 123.5 15.0 28.5 23.2 16 22 A I E -c 108 0A 49 -2,-0.5 93,-0.2 91,-0.2 91,-0.1 -0.903 17.5-162.8 -98.2 115.2 16.8 28.8 26.4 17 23 A Y E -c 109 0A 0 91,-2.9 93,-2.3 -2,-0.7 2,-0.3 -0.852 16.1-132.1-108.5 114.7 19.5 26.1 26.1 18 24 A P E > -c 110 0A 43 0, 0.0 3,-2.5 0, 0.0 91,-0.1 -0.530 37.7-103.6 -68.1 127.3 21.1 25.1 29.4 19 25 A L T 3 S+ 0 0 17 91,-1.8 93,-0.3 -2,-0.3 90,-0.0 -0.266 102.8 6.8 -54.0 128.1 24.9 25.2 28.7 20 26 A D T 3 S+ 0 0 126 1,-0.3 -1,-0.3 91,-0.1 -3,-0.0 0.371 90.1 143.1 76.6 0.5 26.2 21.6 28.3 21 27 A A < - 0 0 30 -3,-2.5 47,-0.6 1,-0.1 -1,-0.3 -0.355 61.8-117.5 -61.8 152.7 22.7 19.9 28.3 22 28 A A S S- 0 0 77 1,-0.2 2,-0.3 45,-0.1 46,-0.2 0.895 74.3 -59.0 -55.2 -41.7 22.4 16.9 25.9 23 29 A G - 0 0 25 44,-0.2 2,-0.3 42,-0.0 -1,-0.2 -0.979 41.7-124.1 171.4 167.9 19.7 18.6 23.9 24 30 A V E - D 0 66A 33 42,-2.1 42,-2.5 -2,-0.3 2,-0.4 -0.963 22.4-128.4-132.0 160.4 16.3 20.2 23.8 25 31 A M E - D 0 65A 105 -2,-0.3 2,-0.3 40,-0.2 40,-0.2 -0.868 21.4-176.9-111.0 142.9 13.3 19.4 21.6 26 32 A V E - D 0 64A 3 38,-2.6 38,-3.0 -2,-0.4 2,-0.2 -0.999 19.4-131.4-136.1 140.6 11.3 22.0 19.6 27 33 A S E - D 0 63A 44 -2,-0.3 -16,-1.9 36,-0.2 2,-0.4 -0.601 14.1-165.4 -93.2 151.0 8.1 21.4 17.5 28 34 A V E -BD 10 62A 0 34,-2.3 34,-2.3 -2,-0.2 2,-0.4 -0.987 6.6-163.4-128.9 135.9 7.6 22.6 13.9 29 35 A K E -BD 9 61A 74 -20,-2.3 -20,-2.1 -2,-0.4 2,-0.9 -0.993 16.0-147.6-121.8 134.7 4.1 22.6 12.3 30 36 A N E -B 8 0A 2 30,-2.8 29,-1.0 -2,-0.4 -22,-0.2 -0.864 19.2-176.9 -92.7 101.5 3.3 22.9 8.6 31 37 A T + 0 0 38 -2,-0.9 -1,-0.1 -24,-0.6 -23,-0.1 0.491 49.2 92.4 -86.6 5.2 0.1 24.8 8.9 32 38 A Q S S- 0 0 26 -25,-0.4 27,-1.2 2,-0.2 28,-0.2 -0.329 82.3-114.6 -98.3 174.4 -0.6 24.7 5.2 33 39 A D S S+ 0 0 132 25,-0.2 25,-0.2 -28,-0.1 -1,-0.1 0.433 94.0 61.0 -93.3 5.4 -2.5 22.4 2.8 34 40 A Y S S- 0 0 56 23,-0.1 25,-0.3 1,-0.0 -2,-0.2 -0.864 90.0-101.0-125.1 157.1 0.5 21.1 0.9 35 41 A P - 0 0 54 0, 0.0 2,-0.3 0, 0.0 22,-0.2 -0.439 38.2-169.7 -71.1 152.9 3.6 19.2 2.0 36 42 A V E -E 56 0A 12 20,-2.6 20,-3.1 53,-0.2 2,-0.5 -0.892 26.4-121.8-132.4 158.3 6.9 21.0 2.6 37 43 A L E -EF 55 88A 74 51,-2.1 51,-3.0 -2,-0.3 2,-0.6 -0.929 30.9-142.4 -90.4 131.5 10.6 20.1 3.3 38 44 A I E -EF 54 87A 0 16,-3.4 16,-1.3 -2,-0.5 2,-0.5 -0.912 15.5-166.6 -98.1 122.9 11.6 21.7 6.6 39 45 A Q E -EF 53 86A 43 47,-2.5 47,-2.6 -2,-0.6 2,-0.4 -0.937 5.9-169.3-114.0 113.1 15.2 22.9 6.4 40 46 A S E + F 0 85A 3 12,-2.2 2,-0.3 -2,-0.5 45,-0.2 -0.874 10.4 166.9-116.0 138.2 16.6 23.8 9.8 41 47 A R E - F 0 84A 127 43,-2.1 43,-3.0 -2,-0.4 2,-0.5 -0.993 27.3-136.2-145.9 151.0 19.9 25.7 10.4 42 48 A I E F 0 83A 43 -2,-0.3 41,-0.2 41,-0.2 5,-0.1 -0.933 360.0 360.0-110.2 133.7 21.7 27.4 13.2 43 49 A Y 0 0 143 39,-2.4 39,-2.3 -2,-0.5 -2,-0.0 -0.852 360.0 360.0-118.6 360.0 23.5 30.8 12.6 44 ! 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 45 59 A D 0 0 188 0, 0.0 24,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 67.8 28.9 23.9 14.1 46 60 A P + 0 0 29 0, 0.0 23,-3.0 0, 0.0 2,-0.3 0.780 360.0 51.4 -71.3 -25.0 28.8 23.6 17.8 47 61 A F E S-G 68 0A 8 21,-0.2 2,-0.4 -5,-0.1 21,-0.2 -0.830 70.6-160.3-106.2 141.9 24.9 22.9 17.7 48 62 A V E -G 67 0A 70 19,-2.3 19,-2.8 -2,-0.3 2,-0.5 -0.981 5.5-153.1-117.8 142.5 23.3 20.3 15.5 49 63 A V E -G 66 0A 9 -2,-0.4 17,-0.2 17,-0.2 -9,-0.1 -0.965 26.1-125.1-105.3 128.2 19.7 20.3 14.5 50 64 A T E S+G 65 0A 71 15,-3.1 15,-2.4 -2,-0.5 -2,-0.0 -0.977 90.4 20.4-125.6 130.4 18.3 16.9 13.8 51 65 A P S S- 0 0 48 0, 0.0 -1,-0.2 0, 0.0 3,-0.2 0.677 72.3-168.7 -78.1 148.3 16.9 16.2 11.2 52 66 A P S S+ 0 0 79 0, 0.0 -12,-2.2 0, 0.0 2,-0.3 0.665 79.8 13.9 -72.5 -25.0 18.4 19.1 9.1 53 67 A L E S+E 39 0A 85 -14,-0.2 2,-0.3 2,-0.0 -14,-0.2 -0.922 76.9 149.1-147.9 134.8 16.0 18.5 6.3 54 68 A F E -E 38 0A 25 -16,-1.3 -16,-3.4 -2,-0.3 2,-0.4 -0.985 46.2 -99.6-161.5 154.6 12.8 16.3 6.3 55 69 A R E -E 37 0A 149 -2,-0.3 2,-0.5 -18,-0.2 -18,-0.3 -0.639 31.1-170.6 -79.1 128.3 9.4 16.1 4.7 56 70 A L E -E 36 0A 4 -20,-3.1 -20,-2.6 -2,-0.4 3,-0.1 -0.987 19.8-136.9-122.8 120.2 6.5 17.5 6.8 57 71 A D > - 0 0 70 -2,-0.5 3,-2.3 -22,-0.2 -27,-0.3 -0.178 40.4 -66.2 -75.9 165.0 3.1 16.7 5.3 58 72 A A T 3 S+ 0 0 27 1,-0.3 -25,-0.2 -25,-0.2 -1,-0.2 -0.236 120.2 0.9 -53.6 129.3 0.2 19.2 5.1 59 73 A K T 3 S+ 0 0 109 -27,-1.2 -1,-0.3 -29,-1.0 2,-0.2 0.424 103.7 130.1 72.6 6.5 -1.2 20.1 8.6 60 74 A Q < - 0 0 99 -3,-2.3 -30,-2.8 -28,-0.2 2,-0.3 -0.552 43.5-152.4 -96.9 158.3 1.4 17.9 10.4 61 75 A Q E +D 29 0A 114 -32,-0.2 2,-0.3 -2,-0.2 -32,-0.2 -0.889 16.2 171.9-120.8 145.2 3.8 18.6 13.3 62 76 A N E -D 28 0A 76 -34,-2.3 -34,-2.3 -2,-0.3 2,-0.3 -0.908 28.1-110.6-137.1 175.7 7.1 17.0 14.1 63 77 A S E -D 27 0A 52 -2,-0.3 2,-0.4 -36,-0.2 -36,-0.2 -0.905 16.3-154.1-115.4 142.6 9.9 17.6 16.6 64 78 A L E -D 26 0A 0 -38,-3.0 -38,-2.6 -2,-0.3 2,-0.4 -0.851 12.3-142.1-106.0 145.9 13.5 18.8 16.0 65 79 A R E -DG 25 50A 106 -15,-2.4 -15,-3.1 -2,-0.4 2,-0.5 -0.942 12.0-164.1-105.0 132.0 16.3 17.9 18.4 66 80 A I E -DG 24 49A 0 -42,-2.5 -42,-2.1 -2,-0.4 2,-0.4 -0.975 17.4-179.1-116.0 122.6 18.9 20.8 19.0 67 81 A A E - G 0 48A 8 -19,-2.8 -19,-2.3 -2,-0.5 2,-0.7 -0.989 32.7-129.2-136.3 130.7 22.0 19.4 20.6 68 82 A Q E + G 0 47A 31 -47,-0.6 2,-0.4 -2,-0.4 -21,-0.2 -0.695 33.7 171.5 -71.9 110.7 25.3 21.0 21.8 69 83 A A - 0 0 57 -23,-3.0 2,-0.3 -2,-0.7 -1,-0.1 -0.725 63.5 -29.7-129.4 78.6 27.9 18.8 20.1 70 84 A G S S+ 0 0 48 -2,-0.4 0, 0.0 1,-0.3 0, 0.0 -0.719 81.9 122.8 103.8-159.5 31.1 20.5 20.7 71 85 A G - 0 0 40 -2,-0.3 2,-0.3 -3,-0.1 -1,-0.3 0.614 45.9-139.9 70.2 125.8 31.6 24.2 21.2 72 86 A V - 0 0 75 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 -0.811 29.4-179.7-102.4 159.4 33.1 25.8 24.3 73 87 A F - 0 0 47 -2,-0.3 6,-0.0 6,-0.0 5,-0.0 -0.935 35.5 -68.5-155.1 155.5 31.3 29.0 25.3 74 88 A P - 0 0 62 0, 0.0 5,-0.1 0, 0.0 3,-0.0 -0.287 30.6-156.0 -56.3 143.4 31.7 31.6 28.1 75 89 A R S S+ 0 0 43 1,-0.1 38,-0.1 35,-0.1 39,-0.1 0.483 90.2 46.9-103.2 -6.9 30.9 30.6 31.9 76 90 A D S S+ 0 0 48 1,-0.1 2,-0.2 2,-0.1 -1,-0.1 0.513 115.4 36.2-104.1 -7.5 30.0 34.1 33.4 77 91 A K S S- 0 0 89 86,-0.1 65,-0.2 37,-0.0 2,-0.1 -0.908 81.0-102.5-146.5 153.7 27.5 35.4 30.5 78 92 A E - 0 0 3 63,-2.4 2,-0.3 -2,-0.2 32,-0.2 -0.424 32.0-149.4 -74.2 163.6 24.7 34.1 28.0 79 93 A S E - H 0 109A 17 30,-2.0 30,-2.3 -2,-0.1 2,-0.5 -0.910 8.2-137.8-132.0 160.2 25.5 33.5 24.3 80 94 A L E + H 0 108A 28 -2,-0.3 2,-0.3 28,-0.2 28,-0.2 -0.953 26.1 158.4-130.2 136.0 23.3 33.9 21.4 81 95 A K E - H 0 107A 59 26,-2.6 26,-2.9 -2,-0.5 2,-0.4 -0.791 32.2-123.1-134.6 175.0 22.6 31.9 18.2 82 96 A W E - H 0 106A 56 -39,-2.3 -39,-2.4 -2,-0.3 2,-0.5 -0.995 8.2-153.7-121.6 136.4 19.6 31.8 15.9 83 97 A L E -FH 42 105A 0 22,-2.8 22,-2.9 -2,-0.4 2,-0.4 -0.916 19.4-166.8-103.3 122.0 17.6 28.6 14.9 84 98 A a E -FH 41 104A 8 -43,-3.0 -43,-2.1 -2,-0.5 2,-0.5 -0.939 6.9-167.2-116.0 130.2 16.0 29.2 11.5 85 99 A V E -FH 40 103A 0 18,-2.4 18,-3.0 -2,-0.4 2,-0.4 -0.962 6.2-168.3-124.4 113.3 13.3 26.9 10.1 86 100 A K E -FH 39 102A 43 -47,-2.6 -47,-2.5 -2,-0.5 2,-0.8 -0.873 13.4-149.6-109.7 131.1 12.4 27.1 6.5 87 101 A G E -FH 38 101A 5 14,-2.1 14,-0.5 -2,-0.4 -49,-0.2 -0.881 13.2-160.7-101.4 110.8 9.4 25.5 4.8 88 102 A I E F 37 0A 49 -51,-3.0 -51,-2.1 -2,-0.8 12,-0.1 -0.809 360.0 360.0 -95.1 109.5 10.3 24.7 1.2 89 103 A P 0 0 59 0, 0.0 -53,-0.2 0, 0.0 -83,-0.0 -0.282 360.0 360.0 -73.7 360.0 7.0 24.2 -0.9 90 ! 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 91 124 A K 0 0 90 0, 0.0 122,-2.6 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -29.5 2.5 40.9 -25.4 92 125 A D E -I 212 0A 67 120,-0.2 226,-1.7 225,-0.1 2,-0.5 -0.349 360.0-157.8 -66.1 141.5 1.8 39.4 -21.9 93 126 A V E -Ij 211 318A 3 118,-2.3 118,-0.6 224,-0.2 2,-0.3 -0.952 17.3-158.0-114.6 99.3 4.6 39.1 -19.3 94 127 A G E - 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