==== 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 24-NOV-06 2NZO . COMPND 2 MOLECULE: PROTEIN CSAA; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR Y.A.SHAPOVA,M.PAETZEL . 438 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19404.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 287 65.5 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 . 154 35.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 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 1.4 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 . 48 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 6.4 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 3 3 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 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 . 5 13 5 0 4 7 1 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 . 6 0 0 0 0 0 4 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 0 A H 0 0 134 0, 0.0 2,-0.2 0, 0.0 123,-0.0 0.000 360.0 360.0 360.0 146.8 -85.2 2.2 17.9 2 1 A M - 0 0 140 121,-0.1 2,-0.2 1,-0.0 181,-0.2 -0.595 360.0-154.5-101.4 154.1 -84.5 5.0 15.4 3 2 A A - 0 0 3 179,-3.0 2,-0.3 -2,-0.2 120,-0.1 -0.645 11.5-132.8-113.8 171.6 -84.7 8.8 15.7 4 3 A V >> - 0 0 67 -2,-0.2 3,-1.8 179,-0.1 4,-1.0 -0.922 31.1-105.3-124.0 159.3 -85.2 11.5 13.1 5 4 A I H 3> S+ 0 0 76 -2,-0.3 4,-2.2 1,-0.3 3,-0.4 0.823 117.7 60.0 -53.5 -31.0 -83.2 14.7 12.8 6 5 A D H 3> S+ 0 0 79 1,-0.3 4,-1.2 2,-0.2 -1,-0.3 0.749 93.4 62.0 -83.0 -11.2 -86.0 16.8 14.2 7 6 A D H <4 S+ 0 0 17 -3,-1.8 4,-0.3 2,-0.2 -1,-0.3 0.858 111.4 43.4 -59.9 -41.3 -85.9 14.9 17.5 8 7 A F H >< S+ 0 0 16 -4,-1.0 3,-1.5 -3,-0.4 -2,-0.2 0.875 108.0 57.0 -68.4 -42.8 -82.4 16.3 17.6 9 8 A E H 3< S+ 0 0 126 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.731 94.2 68.3 -66.6 -23.4 -83.4 19.8 16.4 10 9 A K T 3< S+ 0 0 95 -4,-1.2 -1,-0.3 -5,-0.2 2,-0.2 0.751 90.0 80.6 -62.7 -25.9 -85.8 20.1 19.3 11 10 A L S < S- 0 0 4 -3,-1.5 2,-0.6 -4,-0.3 103,-0.1 -0.582 70.3-149.0 -84.0 147.5 -82.8 20.3 21.6 12 11 A D - 0 0 32 -2,-0.2 57,-2.9 101,-0.1 58,-0.5 -0.925 20.9-175.9-116.4 100.7 -80.8 23.4 22.2 13 12 A I E +A 68 0A 3 -2,-0.6 97,-2.5 97,-0.4 2,-0.3 -0.866 9.8 172.2-106.9 123.6 -77.2 22.3 22.8 14 13 A R E -AB 67 109A 39 53,-2.8 53,-2.6 -2,-0.5 2,-0.3 -0.932 32.2-119.5-132.5 153.8 -74.8 25.0 23.7 15 14 A T E +A 66 0A 0 93,-2.0 92,-2.6 -2,-0.3 2,-0.3 -0.686 37.2 171.2 -84.8 148.5 -71.2 25.5 24.9 16 15 A G E -A 65 0A 0 49,-2.1 49,-3.1 -2,-0.3 2,-0.5 -0.983 30.4-117.8-152.1 163.3 -70.6 27.3 28.2 17 16 A T E -AC 64 37A 21 20,-2.2 20,-3.0 -2,-0.3 2,-0.5 -0.908 25.6-125.3-109.1 126.9 -67.8 28.1 30.7 18 17 A I E + C 0 36A 0 45,-2.6 44,-2.9 -2,-0.5 18,-0.3 -0.552 33.7 170.4 -66.3 115.3 -67.8 26.8 34.2 19 18 A V E + 0 0 65 16,-3.2 2,-0.3 -2,-0.5 17,-0.2 0.685 67.1 21.3-101.4 -27.7 -67.4 29.9 36.4 20 19 A K E - C 0 35A 102 15,-1.7 15,-2.9 40,-0.1 2,-0.4 -0.996 60.4-177.9-136.9 144.6 -68.1 28.3 39.8 21 20 A A E + C 0 34A 11 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.969 11.7 168.0-139.4 125.8 -67.9 24.6 40.9 22 21 A E E - C 0 33A 66 11,-2.2 11,-3.4 -2,-0.4 2,-0.3 -0.987 41.8-104.1-134.9 146.1 -68.9 23.4 44.4 23 22 A E E + C 0 32A 97 -2,-0.3 9,-0.3 9,-0.2 -2,-0.0 -0.558 46.3 161.5 -62.9 128.3 -69.5 20.1 46.1 24 23 A F - 0 0 57 7,-2.9 -1,-0.1 -2,-0.3 -2,-0.0 -0.609 19.0-172.7-152.0 77.0 -73.2 19.8 46.5 25 24 A P - 0 0 77 0, 0.0 2,-0.2 0, 0.0 25,-0.0 -0.246 21.9-125.1 -77.1 165.1 -74.0 16.1 47.1 26 25 A E - 0 0 65 3,-2.8 5,-0.1 1,-0.1 3,-0.0 -0.492 40.6 -98.8 -82.8 173.0 -77.3 14.2 47.3 27 26 A A S S+ 0 0 113 1,-0.2 -1,-0.1 -2,-0.2 0, 0.0 0.939 121.6 26.1 -53.1 -46.6 -78.0 12.0 50.4 28 27 A R S S+ 0 0 246 1,-0.1 -1,-0.2 2,-0.0 0, 0.0 0.515 126.2 35.3-105.0 -5.1 -76.9 8.9 48.6 29 28 A V S S- 0 0 48 -3,-0.0 -3,-2.8 2,-0.0 -1,-0.1 -0.998 76.6-115.8-151.3 137.6 -74.5 10.1 45.9 30 29 A P + 0 0 66 0, 0.0 2,-0.3 0, 0.0 22,-0.3 -0.400 39.5 167.2 -71.8 157.6 -71.9 12.8 45.6 31 30 A A - 0 0 0 19,-0.1 -7,-2.9 20,-0.1 2,-0.4 -0.981 27.9-126.9-164.8 161.0 -72.4 15.6 43.1 32 31 A I E -CD 23 49A 0 17,-2.7 17,-3.1 -2,-0.3 2,-0.6 -0.933 14.6-136.2-118.4 139.0 -71.1 19.0 42.1 33 32 A K E -CD 22 48A 30 -11,-3.4 -11,-2.2 -2,-0.4 2,-0.4 -0.887 25.5-163.0 -90.6 117.8 -73.0 22.2 41.5 34 33 A L E -CD 21 47A 0 13,-2.8 13,-2.1 -2,-0.6 2,-0.5 -0.836 11.7-159.1-100.2 136.0 -71.8 24.0 38.4 35 34 A V E -CD 20 46A 19 -15,-2.9 -16,-3.2 -2,-0.4 -15,-1.7 -0.986 23.0-170.3-112.0 123.0 -72.4 27.6 37.6 36 35 A I E -CD 18 45A 0 9,-3.3 9,-2.9 -2,-0.5 2,-0.8 -0.940 23.0-143.0-126.6 130.3 -72.0 28.0 33.9 37 36 A D E -CD 17 44A 46 -20,-3.0 -20,-2.2 -2,-0.4 7,-0.2 -0.816 15.3-179.2 -91.9 111.5 -71.9 31.1 31.7 38 37 A F > - 0 0 2 5,-2.6 4,-0.5 -2,-0.8 3,-0.2 0.147 53.4 -97.2 -94.4 18.0 -73.6 30.4 28.4 39 38 A G H > - 0 0 14 1,-0.2 4,-2.7 3,-0.1 -1,-0.4 -0.228 55.8 -50.9 91.6-178.6 -72.9 33.9 27.0 40 39 A T H 4 S+ 0 0 156 66,-0.2 -1,-0.2 1,-0.2 4,-0.1 0.829 129.6 47.9 -67.7 -36.5 -75.0 37.1 26.9 41 40 A E H 4 S+ 0 0 159 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.967 125.5 27.2 -70.3 -52.6 -78.3 35.7 25.3 42 41 A I H < S- 0 0 28 -4,-0.5 -2,-0.2 1,-0.2 2,-0.1 0.895 96.9-168.7 -76.5 -38.2 -78.7 32.6 27.6 43 42 A G < - 0 0 20 -4,-2.7 -5,-2.6 2,-0.0 2,-0.4 -0.458 39.3 -18.4 80.9-157.6 -76.8 34.0 30.6 44 43 A I E +D 37 0A 100 -7,-0.2 2,-0.3 -2,-0.1 -7,-0.2 -0.713 63.2 179.9 -91.5 132.0 -75.7 32.1 33.7 45 44 A K E -D 36 0A 65 -9,-2.9 -9,-3.3 -2,-0.4 2,-0.3 -0.931 17.3-136.5-130.3 156.4 -77.2 28.7 34.5 46 45 A Q E -D 35 0A 51 -2,-0.3 36,-3.2 -11,-0.2 37,-0.8 -0.852 18.1-174.2-111.2 153.5 -76.7 26.1 37.2 47 46 A S E -D 34 0A 2 -13,-2.1 -13,-2.8 -2,-0.3 2,-0.6 -1.000 23.9-139.1-145.8 139.9 -76.4 22.4 37.0 48 47 A S E -D 33 0A 14 -2,-0.3 2,-0.4 35,-0.3 -15,-0.2 -0.910 32.7-177.8 -93.0 121.0 -76.2 19.4 39.4 49 48 A A E -D 32 0A 10 -17,-3.1 -17,-2.7 -2,-0.6 2,-2.2 -0.976 30.8-145.9-129.0 124.7 -73.6 17.0 37.9 50 49 A Q + 0 0 84 -2,-0.4 3,-0.2 -19,-0.2 -19,-0.1 -0.457 60.7 125.1 -85.0 68.3 -72.6 13.6 39.3 51 50 A I > + 0 0 6 -2,-2.2 4,-1.2 1,-0.1 3,-0.5 0.032 23.9 110.9-116.0 23.4 -69.1 14.1 38.2 52 51 A T T 4 + 0 0 21 -22,-0.3 -1,-0.1 1,-0.2 -21,-0.1 0.685 59.9 78.6 -80.9 -12.7 -67.1 13.6 41.4 53 52 A K T 4 S+ 0 0 84 40,-0.4 224,-0.3 -3,-0.2 -1,-0.2 0.921 116.6 9.2 -62.4 -44.8 -65.5 10.3 40.3 54 53 A R T 4 S+ 0 0 39 -3,-0.5 221,-0.5 41,-0.3 2,-0.3 0.555 121.2 70.9-109.2 -10.0 -62.8 12.0 38.0 55 54 A Y B < -H 274 0B 16 -4,-1.2 219,-0.1 219,-0.1 -1,-0.0 -0.889 47.8-168.8-125.1 144.0 -63.2 15.7 38.8 56 55 A K > - 0 0 49 217,-0.5 3,-1.3 -2,-0.3 4,-0.2 -0.863 40.5-111.7-115.1 150.0 -62.5 18.3 41.6 57 56 A P G >> S+ 0 0 19 0, 0.0 3,-1.8 0, 0.0 4,-1.3 0.861 117.7 58.2 -46.9 -42.0 -63.9 21.9 41.6 58 57 A E G 34 S+ 0 0 72 214,-0.3 215,-0.2 1,-0.3 216,-0.1 0.766 105.8 49.4 -64.1 -24.8 -60.3 23.2 41.1 59 58 A G G <4 S+ 0 0 7 -3,-1.3 -1,-0.3 214,-0.2 214,-0.1 0.293 110.0 53.9 -93.6 5.9 -60.0 21.2 37.9 60 59 A L T X4 S+ 0 0 0 -3,-1.8 3,-2.0 -4,-0.2 -42,-0.3 0.675 74.7 105.2-112.6 -29.6 -63.3 22.5 36.5 61 60 A I T 3< S+ 0 0 53 -4,-1.3 -42,-0.2 1,-0.3 3,-0.1 -0.313 91.5 14.2 -61.4 137.1 -63.2 26.3 36.7 62 61 A N T 3 S+ 0 0 79 -44,-2.9 -1,-0.3 1,-0.3 2,-0.2 0.362 93.0 136.4 79.4 -1.7 -62.7 27.9 33.2 63 62 A K < - 0 0 13 -3,-2.0 -45,-2.6 -45,-0.2 2,-0.5 -0.553 54.3-130.5 -77.6 140.4 -63.6 24.6 31.4 64 63 A Q E -A 17 0A 41 -47,-0.2 2,-0.2 -2,-0.2 -47,-0.2 -0.789 33.1-175.3 -88.5 129.0 -65.9 24.8 28.4 65 64 A V E -A 16 0A 0 -49,-3.1 -49,-2.1 -2,-0.5 2,-0.4 -0.739 23.2-123.5-122.3 170.5 -68.7 22.3 28.7 66 65 A I E +A 15 0A 0 32,-0.4 20,-2.8 20,-0.4 2,-0.3 -0.972 36.5 170.5-117.8 130.4 -71.6 21.2 26.5 67 66 A A E -AE 14 85A 0 -53,-2.6 -53,-2.8 -2,-0.4 2,-0.7 -0.988 41.0-121.6-145.6 148.3 -75.1 21.3 27.8 68 67 A V E +AE 13 84A 0 16,-2.4 16,-1.9 -2,-0.3 3,-0.3 -0.824 33.1 179.8 -81.7 119.9 -78.8 21.0 26.8 69 68 A V + 0 0 23 -57,-2.9 -1,-0.1 -2,-0.7 -56,-0.1 0.559 63.2 64.8-100.3 -10.3 -80.2 24.4 27.8 70 69 A N S S+ 0 0 23 -58,-0.5 45,-2.2 46,-0.0 -1,-0.1 0.059 72.4 109.0-110.4 26.7 -83.9 24.2 26.9 71 70 A F S S- 0 0 26 11,-0.3 45,-0.2 -3,-0.3 3,-0.1 -0.562 79.3 -93.6 -82.6 161.3 -85.2 21.5 29.3 72 71 A P - 0 0 59 0, 0.0 -1,-0.1 0, 0.0 45,-0.1 -0.452 50.2-106.4 -63.2 147.2 -87.5 22.2 32.3 73 72 A P - 0 0 74 0, 0.0 2,-0.3 0, 0.0 9,-0.2 -0.305 34.0-154.3 -67.6 163.6 -85.5 22.7 35.4 74 73 A R E -I 81 0C 131 7,-2.0 7,-3.5 2,-0.1 2,-0.5 -0.983 16.2-118.9-135.0 149.9 -85.5 20.0 38.1 75 74 A R E +I 80 0C 187 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.770 48.3 145.8 -88.8 131.3 -84.9 20.1 41.9 76 75 A I E > +I 79 0C 18 3,-2.7 3,-1.4 -2,-0.5 -2,-0.1 -0.950 57.9 10.2-167.3 141.8 -81.9 18.2 43.1 77 76 A A T 3 S- 0 0 23 -2,-0.3 3,-0.1 1,-0.2 -46,-0.0 0.758 131.0 -55.9 52.0 31.6 -79.2 18.4 45.8 78 77 A G T 3 S+ 0 0 76 1,-0.2 2,-0.3 -54,-0.0 -1,-0.2 0.603 121.0 71.7 82.5 14.1 -81.2 21.3 47.3 79 78 A F E < S-I 76 0C 13 -3,-1.4 -3,-2.7 -5,-0.1 2,-0.8 -0.943 87.8 -87.8-147.9 172.9 -81.3 23.6 44.3 80 79 A K E -I 75 0C 91 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.773 35.8-155.3 -86.5 110.9 -82.9 24.1 40.9 81 80 A S E +I 74 0C 6 -7,-3.5 -7,-2.0 -2,-0.8 -34,-0.2 -0.782 16.8 175.8 -89.1 123.5 -80.7 22.4 38.2 82 81 A E + 0 0 43 -36,-3.2 -11,-0.3 -2,-0.5 2,-0.3 0.574 54.9 43.2-107.9 -11.9 -81.4 24.2 34.9 83 82 A V - 0 0 6 -37,-0.8 2,-0.7 -13,-0.1 -35,-0.3 -0.971 67.7-132.8-143.6 140.8 -79.0 22.6 32.3 84 83 A L E -E 68 0A 51 -16,-1.9 -16,-2.4 -2,-0.3 2,-0.4 -0.900 22.4-151.2 -99.8 110.6 -78.0 19.0 31.5 85 84 A V E -E 67 0A 15 -2,-0.7 2,-0.3 -18,-0.2 -18,-0.2 -0.650 19.7-132.6 -84.6 127.8 -74.2 18.9 31.1 86 85 A L + 0 0 6 -20,-2.8 12,-2.2 -2,-0.4 -20,-0.4 -0.590 34.6 154.9 -92.8 138.6 -73.2 16.1 28.7 87 86 A G E -J 97 0D 0 -2,-0.3 136,-2.4 10,-0.3 10,-0.3 -0.992 45.1 -96.7-148.9 158.3 -70.6 13.5 29.2 88 87 A G E -JK 96 222D 0 8,-2.8 8,-2.4 -2,-0.3 134,-0.2 -0.508 32.7-143.9 -65.9 142.8 -69.6 10.0 28.1 89 88 A I E + K 0 221D 81 132,-2.9 132,-0.5 6,-0.2 6,-0.2 -0.781 26.6 168.2-116.0 90.6 -70.7 7.3 30.6 90 89 A P - 0 0 44 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.646 65.0 -23.3 -79.3 -12.4 -68.0 4.6 30.8 91 90 A G S > S- 0 0 33 3,-0.4 3,-2.1 129,-0.0 2,-0.0 -0.968 95.3 -36.6-177.5 175.2 -69.4 2.8 33.8 92 91 A Q T 3 S- 0 0 198 -2,-0.3 3,-0.1 1,-0.3 -3,-0.0 -0.295 126.6 -4.2 -52.8 126.3 -71.5 3.1 37.0 93 92 A G T 3 S+ 0 0 60 1,-0.2 -40,-0.4 -4,-0.0 2,-0.4 0.508 107.3 124.6 67.3 8.2 -71.1 6.5 38.6 94 93 A D < + 0 0 16 -3,-2.1 -3,-0.4 -41,-0.1 2,-0.3 -0.803 33.8 176.4-108.5 137.7 -68.5 7.5 36.0 95 94 A V - 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