==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 16-JUN-04 1TQ5 . COMPND 2 MOLECULE: PROTEIN YHHW; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.ADAMS,Z.JIA,MONTREAL-KINGSTON BACTERIAL STRUCTURAL . 234 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10658.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 112 47.9 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.7 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-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 . 39 16.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 5.6 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 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 0 1 6 6 0 3 1 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 2 0 0 1 1 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 X 0 0 100 0, 0.0 207,-1.9 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 122.0 60.8 43.6 6.4 2 2 A I E -A 207 0A 50 205,-0.2 2,-0.4 207,-0.0 205,-0.2 -0.967 360.0-174.8-145.5 124.1 59.0 40.8 4.6 3 3 A Y E -A 206 0A 61 203,-3.0 203,-2.9 -2,-0.3 2,-0.5 -0.975 17.3-139.3-130.0 135.7 58.0 37.4 6.1 4 4 A L E -A 205 0A 53 -2,-0.4 2,-0.9 201,-0.2 201,-0.2 -0.786 5.3-161.6 -95.0 123.4 56.4 34.4 4.6 5 5 A R E -A 204 0A 6 199,-3.7 199,-2.1 -2,-0.5 5,-0.1 -0.842 25.8-141.6-101.0 93.7 53.8 32.5 6.6 6 6 A K > - 0 0 88 -2,-0.9 3,-1.1 197,-0.2 4,-0.3 -0.279 7.9-132.4 -60.5 138.7 53.8 29.1 4.8 7 7 A A G > S+ 0 0 17 1,-0.2 3,-1.1 194,-0.2 -1,-0.1 0.873 105.4 52.3 -57.6 -41.2 50.5 27.4 4.3 8 8 A N G 3 S+ 0 0 115 1,-0.2 -1,-0.2 13,-0.0 -2,-0.1 0.607 104.3 56.7 -74.6 -12.4 51.8 24.0 5.5 9 9 A E G < S+ 0 0 111 -3,-1.1 -1,-0.2 2,-0.0 -2,-0.2 0.372 81.9 114.8 -99.3 5.4 53.2 25.5 8.7 10 10 A R S < S- 0 0 21 -3,-1.1 13,-0.2 -4,-0.3 14,-0.0 -0.322 81.0 -92.5 -70.5 156.6 49.8 26.9 9.8 11 11 A G E -G 22 0B 4 11,-2.3 11,-2.5 13,-0.1 2,-0.4 -0.382 49.6-160.1 -65.3 151.4 48.2 25.6 13.0 12 12 A H E +G 21 0B 87 9,-0.2 2,-0.4 -3,-0.1 9,-0.2 -0.987 21.5 173.0-145.3 133.1 45.8 22.8 12.1 13 13 A A E -G 20 0B 29 7,-2.1 7,-2.9 -2,-0.4 2,-0.5 -0.996 8.8-168.8-137.5 129.1 42.9 21.1 13.8 14 14 A N E +G 19 0B 98 -2,-0.4 5,-0.2 5,-0.2 3,-0.0 -0.957 17.0 164.6-123.9 112.9 40.6 18.5 12.2 15 15 A H - 0 0 117 3,-3.2 2,-1.9 -2,-0.5 4,-0.2 0.129 55.0-115.5-109.5 16.8 37.4 17.5 13.9 16 16 A G S S+ 0 0 56 2,-0.4 33,-0.1 1,-0.2 3,-0.1 -0.455 113.4 52.3 84.4 -67.6 35.8 15.8 10.9 17 17 A W S S+ 0 0 67 -2,-1.9 32,-2.5 1,-0.2 2,-0.4 0.795 121.5 33.4 -70.9 -28.8 32.9 18.2 10.5 18 18 A L E - H 0 48B 12 30,-0.2 -3,-3.2 2,-0.0 2,-0.5 -0.997 62.0-173.7-132.0 133.7 35.4 21.1 10.6 19 19 A D E -GH 14 47B 37 28,-1.9 28,-1.9 -2,-0.4 2,-0.4 -0.980 21.2-176.3-125.4 112.8 39.0 21.2 9.2 20 20 A S E -GH 13 46B 5 -7,-2.9 -7,-2.1 -2,-0.5 2,-0.5 -0.937 22.2-162.5-124.7 134.0 40.7 24.4 10.1 21 21 A W E -GH 12 45B 66 24,-1.9 24,-2.6 -2,-0.4 2,-0.5 -0.947 18.9-150.6-109.3 124.4 44.1 26.0 9.3 22 22 A H E -GH 11 44B 16 -11,-2.5 -11,-2.3 -2,-0.5 22,-0.2 -0.849 15.8-170.2-100.8 123.6 45.1 28.8 11.7 23 23 A T S S+ 0 0 0 20,-2.5 2,-0.3 -2,-0.5 -1,-0.2 0.861 79.0 25.2 -75.4 -35.5 47.4 31.6 10.4 24 24 A F S S- 0 0 3 19,-0.3 11,-0.2 1,-0.1 19,-0.2 -0.835 109.8 -64.1-125.4 163.7 47.8 33.0 14.0 25 25 A S + 0 0 22 9,-1.8 2,-0.4 6,-0.3 5,-0.2 -0.183 62.3 178.4 -45.7 128.0 47.6 31.6 17.5 26 26 A F B > -N 29 0C 54 3,-1.0 3,-3.6 -4,-0.1 2,-0.1 -0.992 47.6 -45.9-143.5 132.4 44.0 30.6 18.0 27 27 A A T 3 S- 0 0 92 -2,-0.4 -2,-0.0 1,-0.3 0, 0.0 -0.259 132.6 -4.2 50.0-112.3 42.3 28.9 20.9 28 28 A N T 3 S+ 0 0 172 -2,-0.1 2,-0.4 -3,-0.0 -1,-0.3 0.420 117.1 94.6 -89.9 -0.8 44.7 26.2 22.0 29 29 A Y B < -N 26 0C 53 -3,-3.6 -3,-1.0 -5,-0.1 2,-0.4 -0.798 55.0-172.8 -94.5 133.0 47.1 26.8 19.1 30 30 A Y - 0 0 160 -2,-0.4 5,-0.1 -5,-0.2 -2,-0.0 -0.984 13.4-176.5-132.2 126.9 50.1 29.0 19.8 31 31 A D - 0 0 24 -2,-0.4 -6,-0.3 3,-0.3 -2,-0.0 -0.976 17.6-151.4-121.7 116.9 52.7 30.4 17.5 32 32 A P S S+ 0 0 81 0, 0.0 202,-0.2 0, 0.0 3,-0.2 0.753 96.3 34.1 -56.0 -30.9 55.5 32.5 19.1 33 33 A N S S+ 0 0 57 1,-0.2 2,-1.5 200,-0.2 3,-0.3 0.899 116.6 51.1 -91.6 -53.1 56.1 34.6 16.0 34 34 A F + 0 0 18 1,-0.2 -9,-1.8 200,-0.1 -3,-0.3 -0.619 61.7 137.6 -90.3 79.9 52.6 34.9 14.5 35 35 A X S S- 0 0 59 -2,-1.5 -1,-0.2 1,-0.3 2,-0.2 0.744 81.6 -45.5 -90.1 -30.2 50.6 36.0 17.5 36 36 A G - 0 0 10 -3,-0.3 2,-0.9 -13,-0.1 -1,-0.3 -0.537 52.2-121.7 159.6 133.3 48.6 38.6 15.5 37 37 A F B > -I 40 0B 5 3,-1.5 3,-2.2 -2,-0.2 2,-0.1 -0.792 65.1 -66.4-100.2 99.9 49.6 41.2 12.9 38 38 A S T 3 S- 0 0 24 -2,-0.9 82,-0.1 1,-0.3 193,-0.0 -0.397 118.8 -12.6 58.4-132.0 48.5 44.7 14.0 39 39 A A T 3 S+ 0 0 5 190,-0.2 81,-2.5 120,-0.1 2,-0.9 0.608 118.5 96.8 -73.9 -11.4 44.7 44.8 14.1 40 40 A L E < +IJ 37 119B 0 -3,-2.2 -3,-1.5 79,-0.2 79,-0.2 -0.709 43.5 159.3 -82.3 109.6 44.6 41.5 12.2 41 41 A R E + 0 0 92 77,-2.2 2,-0.4 -2,-0.9 -1,-0.2 0.787 54.6 28.3-102.7 -33.3 44.1 38.9 14.9 42 42 A V E + J 0 118B 9 76,-1.5 76,-1.9 -5,-0.1 2,-0.3 -0.993 42.1 170.9-139.7 139.1 42.7 35.8 13.2 43 43 A I E + J 0 117B 1 -2,-0.4 -20,-2.5 74,-0.2 2,-0.5 -0.847 17.4 179.2-142.3 99.7 42.7 34.1 9.8 44 44 A N E -HJ 22 116B 6 72,-2.2 72,-2.7 -2,-0.3 2,-0.9 -0.925 20.4-153.1-109.9 128.4 41.1 30.7 9.8 45 45 A D E -HJ 21 115B 8 -24,-2.6 -24,-1.9 -2,-0.5 2,-0.4 -0.862 29.9-173.0 -97.7 97.3 40.9 28.7 6.6 46 46 A D E -HJ 20 114B 4 68,-2.8 68,-3.0 -2,-0.9 2,-0.5 -0.798 23.3-170.8-106.3 140.5 37.9 26.5 7.4 47 47 A V E -HJ 19 113B 29 -28,-1.9 -28,-1.9 -2,-0.4 2,-0.4 -0.987 16.5-164.9-125.4 118.0 36.3 23.6 5.5 48 48 A I E -HJ 18 112B 1 64,-3.1 64,-2.7 -2,-0.5 -30,-0.2 -0.904 17.8-120.4-113.9 134.4 32.9 22.5 6.9 49 49 A E > - 0 0 105 -32,-2.5 3,-2.2 -2,-0.4 56,-0.3 -0.243 48.3 -79.5 -64.9 149.5 31.0 19.3 6.2 50 50 A A T 3 S+ 0 0 28 1,-0.3 58,-0.2 59,-0.1 -1,-0.2 -0.220 116.5 9.2 -52.6 134.6 27.5 19.4 4.6 51 51 A G T 3 S+ 0 0 53 56,-1.1 -1,-0.3 54,-1.0 2,-0.2 0.400 108.6 107.6 75.9 -3.7 24.9 20.2 7.2 52 52 A Q < + 0 0 79 -3,-2.2 53,-3.6 55,-0.1 2,-0.3 -0.509 34.4 131.2-101.8 173.1 27.4 21.0 9.9 53 53 A G E -O 104 0D 16 51,-0.3 2,-0.6 -2,-0.2 51,-0.3 -0.979 55.7 -50.6 168.5-176.1 28.5 24.3 11.5 54 54 A F E -O 103 0D 56 49,-2.8 49,-1.3 -2,-0.3 3,-0.1 -0.758 50.5-137.5 -89.2 120.3 29.2 26.3 14.6 55 55 A G E - 0 0 53 -2,-0.6 46,-0.2 47,-0.2 48,-0.1 -0.024 49.4 -57.2 -63.2 178.4 26.4 26.3 17.2 56 56 A T E + 0 0 103 46,-0.1 46,-0.2 44,-0.1 -1,-0.2 -0.378 67.8 160.0 -66.3 134.6 25.5 29.5 19.0 57 57 A H E -O 101 0D 53 44,-1.5 44,-2.1 -3,-0.1 2,-0.1 -0.988 34.2-107.7-152.4 151.0 28.3 31.2 20.9 58 58 A P E -O 100 0D 91 0, 0.0 2,-0.3 0, 0.0 42,-0.3 -0.441 25.7-173.0 -84.7 156.2 29.0 34.8 22.2 59 59 A H E -O 99 0D 35 40,-2.7 40,-1.5 -2,-0.1 2,-0.3 -0.986 1.4-169.3-144.3 148.3 31.4 37.4 21.0 60 60 A K - 0 0 133 -2,-0.3 37,-0.2 38,-0.2 36,-0.2 -0.994 62.2 -5.6-142.4 144.0 32.4 40.8 22.4 61 61 A D S S+ 0 0 49 35,-3.1 2,-0.2 -2,-0.3 -1,-0.2 0.882 95.2 108.5 36.1 81.3 34.4 43.7 21.0 62 62 A X - 0 0 29 58,-0.1 33,-2.9 -3,-0.1 2,-0.7 -0.844 63.8-128.3-178.4 138.5 35.6 42.3 17.6 63 63 A E E -KL 94 119B 1 56,-2.8 56,-3.1 -2,-0.2 2,-0.6 -0.869 27.9-162.2 -95.9 116.5 35.0 42.7 13.9 64 64 A I E -KL 93 118B 4 29,-3.5 29,-1.9 -2,-0.7 2,-0.4 -0.893 7.7-173.8-106.8 113.9 34.3 39.3 12.4 65 65 A L E -KL 92 117B 2 52,-3.3 52,-3.4 -2,-0.6 2,-0.4 -0.878 5.0-163.5-109.1 136.0 34.6 39.0 8.6 66 66 A T E -KL 91 116B 2 25,-2.6 25,-1.3 -2,-0.4 2,-0.5 -0.959 5.6-172.0-119.8 134.4 33.7 36.0 6.5 67 67 A Y E -KL 90 115B 9 48,-2.2 48,-2.6 -2,-0.4 2,-0.5 -0.970 15.8-148.2-125.7 112.8 34.8 35.3 2.9 68 68 A V E + L 0 114B 0 21,-2.0 20,-3.8 -2,-0.5 46,-0.2 -0.723 20.8 173.1 -86.1 123.2 33.1 32.3 1.3 69 69 A L E + 0 0 44 44,-2.7 2,-0.3 -2,-0.5 45,-0.2 0.783 69.0 9.3 -96.2 -36.2 35.4 30.5 -1.3 70 70 A E E S- L 0 113B 68 43,-1.9 43,-2.7 17,-0.1 -1,-0.3 -0.990 112.1 -2.7-150.2 138.0 33.2 27.4 -2.1 71 71 A G S S- 0 0 10 -2,-0.3 16,-1.3 41,-0.2 2,-0.3 -0.529 87.5 -62.7 86.6-151.5 29.7 26.4 -1.2 72 72 A T E -P 86 0D 40 14,-0.2 2,-0.4 -2,-0.2 35,-0.3 -0.987 34.2-155.8-140.9 148.3 27.2 28.4 0.9 73 73 A V E -P 85 0D 0 12,-1.7 12,-3.0 -2,-0.3 2,-0.5 -0.980 9.2-147.2-126.8 139.8 27.1 29.5 4.6 74 74 A E E -PQ 84 104D 19 30,-2.8 30,-1.7 -2,-0.4 2,-0.4 -0.927 14.9-157.1-108.6 123.3 24.0 30.3 6.6 75 75 A H E +PQ 83 103D 1 8,-3.4 8,-1.8 -2,-0.5 2,-0.3 -0.803 15.1 172.6-103.9 142.0 24.3 33.0 9.3 76 76 A Q E -PQ 82 102D 56 26,-1.9 26,-2.5 -2,-0.4 2,-0.3 -0.989 9.8-176.0-144.2 133.4 22.1 33.5 12.3 77 77 A D E - Q 0 101D 18 4,-1.3 2,-3.7 -2,-0.3 24,-0.3 -0.926 46.1 -87.0-136.2 160.6 22.7 35.9 15.2 78 78 A S S S+ 0 0 50 22,-3.7 2,-0.2 -2,-0.3 23,-0.1 -0.316 115.4 47.9 -60.6 71.2 21.3 37.0 18.6 79 79 A X S S- 0 0 140 -2,-3.7 20,-0.0 2,-0.1 -2,-0.0 -0.785 117.8 -73.4-176.6-144.3 19.0 39.3 16.6 80 80 A G S S+ 0 0 64 -2,-0.2 2,-0.4 -4,-0.1 -2,-0.1 0.403 81.2 133.8-115.5 -0.6 16.8 38.6 13.6 81 81 A N + 0 0 56 -4,-0.1 -4,-1.3 -5,-0.0 2,-0.4 -0.339 21.6 163.1 -60.5 109.1 19.6 38.4 11.2 82 82 A K E +P 76 0D 115 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.993 11.9 156.8-125.7 130.7 19.3 35.4 9.0 83 83 A E E -P 75 0D 70 -8,-1.8 -8,-3.4 -2,-0.4 2,-0.5 -0.981 35.0-142.8-160.1 144.4 21.4 35.3 5.8 84 84 A Q E -P 74 0D 98 -2,-0.3 -10,-0.2 -10,-0.2 -2,-0.0 -0.948 17.0-164.6-112.2 122.8 22.9 32.9 3.2 85 85 A V E -P 73 0D 0 -12,-3.0 -12,-1.7 -2,-0.5 3,-0.1 -0.907 8.4-157.6-111.0 109.4 26.3 33.9 1.8 86 86 A P E > -P 72 0D 45 0, 0.0 3,-1.9 0, 0.0 -18,-0.3 -0.255 40.0 -67.4 -79.3 170.6 27.3 32.0 -1.4 87 87 A A T 3 S+ 0 0 47 -16,-1.3 -18,-0.2 1,-0.3 3,-0.1 -0.269 122.0 31.8 -57.2 139.7 30.9 31.6 -2.7 88 88 A G T 3 S+ 0 0 30 -20,-3.8 -1,-0.3 1,-0.3 47,-0.2 0.200 100.7 104.1 96.7 -15.4 32.5 34.8 -3.7 89 89 A E < - 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