==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 16-JUL-09 3IBR . COMPND 2 MOLECULE: BACTERIOPHYTOCHROME; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR X.YANG,J.KUK,K.MOFFAT . 914 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44550.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 625 68.4 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 . 196 21.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 54 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 102 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 259 28.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 4 2 1 1 1 4 0 1 1 0 1 3 2 1 0 0 0 0 0 0 0 0 0 0 0 0 2 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 . 6 8 2 6 3 5 2 3 2 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 . 1 2 0 2 4 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 6 A P 0 0 156 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 167.4 71.7 68.9 8.7 2 7 A V + 0 0 62 8,-0.0 2,-0.2 3,-0.0 5,-0.1 -0.897 360.0 148.7-128.0 102.3 68.6 68.6 10.9 3 8 A T >> - 0 0 83 -2,-0.5 4,-0.6 415,-0.0 3,-0.6 -0.623 61.5 -86.9-119.1-176.7 66.9 71.6 12.6 4 9 A L T 34 S+ 0 0 72 1,-0.3 4,-0.2 2,-0.2 3,-0.0 0.696 127.7 49.9 -65.7 -22.1 63.4 72.6 13.7 5 10 A A T 34 S+ 0 0 69 1,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.764 114.3 46.2 -80.6 -26.9 62.7 74.1 10.2 6 11 A N T <4 S+ 0 0 86 -3,-0.6 3,-0.3 1,-0.2 -2,-0.2 0.391 89.9 81.8-100.9 -0.5 63.9 71.0 8.6 7 12 A C S >< S+ 0 0 30 -4,-0.6 3,-0.7 1,-0.2 -1,-0.2 0.743 79.3 68.8 -80.0 -21.4 62.1 68.4 10.7 8 13 A E T 3 S+ 0 0 138 -3,-0.3 184,-0.4 -4,-0.2 -1,-0.2 0.886 108.6 33.4 -59.1 -38.5 58.8 68.8 8.7 9 14 A D T 3 S+ 0 0 134 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.130 80.5 148.0-110.6 17.1 60.2 67.1 5.5 10 15 A E < - 0 0 29 -3,-0.7 2,-1.5 1,-0.1 183,-0.2 -0.291 45.2-137.7 -67.6 134.2 62.7 64.5 6.8 11 16 A P > + 0 0 70 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 -0.600 34.9 163.7 -90.0 80.1 63.2 61.3 4.7 12 17 A I T 3 + 0 0 23 -2,-1.5 -2,-0.1 1,-0.2 227,-0.0 0.507 67.0 66.9 -77.3 -5.3 63.3 58.8 7.6 13 18 A H T 3 S+ 0 0 47 1,-0.3 217,-1.8 -3,-0.1 -1,-0.2 0.768 106.3 40.9 -83.0 -27.0 62.8 55.9 5.3 14 19 A V < + 0 0 39 -3,-0.9 -1,-0.3 215,-0.2 215,-0.1 -0.757 64.7 138.8-124.6 83.2 66.1 56.4 3.6 15 20 A P - 0 0 54 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.811 55.1-135.2 -88.2 -36.0 68.8 57.2 6.2 16 21 A G S S+ 0 0 9 212,-0.3 200,-2.9 1,-0.2 2,-0.3 0.680 79.1 79.0 79.2 20.1 71.6 55.1 4.9 17 22 A A E -A 215 0A 13 198,-0.3 220,-1.8 220,-0.1 198,-0.3 -0.972 58.2-164.9-155.4 145.7 72.3 54.0 8.4 18 23 A I E -AB 214 236A 0 196,-2.4 196,-2.5 -2,-0.3 218,-0.2 -0.503 36.5 -81.1-113.8-172.2 70.8 51.5 10.9 19 24 A Q > - 0 0 1 216,-2.1 3,-0.7 194,-0.2 -1,-0.1 -0.576 37.1-119.6 -92.2 159.0 71.1 51.0 14.6 20 25 A P T 3 S+ 0 0 35 0, 0.0 -1,-0.1 0, 0.0 215,-0.0 0.523 95.4 81.7 -81.8 -9.8 74.1 49.1 16.1 21 26 A H T 3 S+ 0 0 36 214,-0.1 86,-1.6 85,-0.0 2,-0.2 0.355 106.7 18.1 -82.4 10.5 72.4 46.2 17.8 22 27 A G S < S- 0 0 0 -3,-0.7 2,-0.3 84,-0.2 84,-0.2 -0.781 77.0-125.4-151.4-168.2 72.3 44.4 14.5 23 28 A A - 0 0 0 -2,-0.2 82,-2.6 82,-0.2 2,-0.4 -0.975 16.5-140.6-149.8 156.0 73.9 44.6 11.1 24 29 A L E -C 104 0B 1 -2,-0.3 13,-2.7 80,-0.2 2,-0.5 -0.965 14.2-177.9-129.7 133.8 72.6 44.9 7.6 25 30 A V E -CD 103 36B 3 78,-1.3 78,-2.3 -2,-0.4 2,-0.3 -0.990 12.1-161.2-124.7 122.1 73.5 43.4 4.2 26 31 A T E -CD 102 35B 1 9,-2.2 8,-1.8 -2,-0.5 9,-1.3 -0.787 13.0-174.9 -95.5 145.6 71.6 44.5 1.2 27 32 A L E -CD 101 33B 0 74,-2.5 74,-2.9 -2,-0.3 6,-0.2 -0.998 20.2-122.5-143.1 141.1 71.7 42.2 -1.8 28 33 A R > - 0 0 63 4,-2.8 3,-2.9 -2,-0.3 72,-0.1 -0.115 48.2 -80.0 -77.6-178.3 70.4 42.5 -5.4 29 34 A A T 3 S+ 0 0 64 70,-0.4 -1,-0.1 1,-0.3 71,-0.1 0.654 132.1 49.4 -62.4 -16.7 68.1 40.0 -7.1 30 35 A D T 3 S- 0 0 69 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.248 122.9-105.6-101.9 10.5 70.9 37.6 -7.9 31 36 A G < + 0 0 5 -3,-2.9 23,-0.5 1,-0.3 2,-0.3 0.503 69.0 151.0 81.0 4.1 72.1 37.8 -4.3 32 37 A X B -H 53 0C 35 21,-0.1 -4,-2.8 1,-0.1 2,-0.3 -0.532 53.6-110.4 -71.3 131.3 75.1 40.0 -5.1 33 38 A V E +D 27 0B 0 19,-3.1 18,-2.5 -2,-0.3 -6,-0.3 -0.442 40.8 170.7 -65.1 122.6 76.0 42.2 -2.1 34 39 A L E - 0 0 7 -8,-1.8 2,-0.3 1,-0.3 -7,-0.2 0.726 64.6 -4.8-103.1 -29.1 75.3 45.8 -2.9 35 40 A A E -D 26 0B 0 -9,-1.3 -9,-2.2 14,-0.1 -1,-0.3 -0.988 56.7-167.1-159.5 161.0 75.8 47.4 0.5 36 41 A A E -DE 25 217B 8 181,-1.7 181,-1.4 -2,-0.3 -11,-0.2 -0.993 33.0 -98.9-153.8 148.8 76.5 46.6 4.1 37 42 A S E > - E 0 216B 2 -13,-2.7 3,-0.7 -2,-0.3 179,-0.2 -0.174 38.2-118.3 -57.5 163.1 76.5 48.2 7.6 38 43 A E T 3 S+ 0 0 59 177,-1.7 3,-0.3 1,-0.2 4,-0.3 0.547 109.3 61.0 -85.9 -7.5 79.9 49.4 8.7 39 44 A N T 3> + 0 0 5 176,-0.2 4,-4.3 1,-0.2 5,-0.4 0.307 68.1 107.6-100.4 6.1 79.9 47.1 11.8 40 45 A I H <> S+ 0 0 13 -3,-0.7 4,-2.4 1,-0.2 -1,-0.2 0.864 85.1 43.7 -51.9 -39.3 79.7 43.9 9.7 41 46 A Q H 4 S+ 0 0 136 -3,-0.3 -1,-0.2 2,-0.2 -2,-0.1 0.915 116.0 48.7 -71.7 -41.8 83.3 43.1 10.6 42 47 A A H 4 S+ 0 0 84 -4,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.927 121.4 34.4 -62.7 -45.9 82.7 44.2 14.2 43 48 A L H < S+ 0 0 27 -4,-4.3 44,-0.3 1,-0.1 2,-0.3 0.840 132.5 11.9 -78.4 -35.1 79.6 42.1 14.5 44 49 A L S < S- 0 0 3 -4,-2.4 -1,-0.1 -5,-0.4 15,-0.1 -0.901 78.4-104.4-140.5 169.4 80.7 39.2 12.2 45 50 A G S S+ 0 0 58 -2,-0.3 -1,-0.1 13,-0.3 14,-0.1 0.923 85.2 86.7 -59.5 -48.1 83.8 37.8 10.5 46 51 A F - 0 0 13 12,-0.3 2,-0.5 1,-0.1 -2,-0.2 0.144 63.5-144.6 -61.1 161.8 83.2 38.9 7.0 47 52 A V - 0 0 87 -6,-0.1 2,-0.6 2,-0.0 -1,-0.1 -0.868 26.3-151.1-117.7 91.4 83.9 42.1 5.1 48 53 A A - 0 0 10 -2,-0.5 -8,-0.1 -11,-0.1 -7,-0.1 -0.537 18.8-169.1 -66.0 112.1 80.8 42.1 2.9 49 54 A S > - 0 0 60 -2,-0.6 3,-2.5 4,-0.1 -16,-0.2 -0.899 30.7-100.8-113.4 132.0 82.0 43.9 -0.2 50 55 A P T 3 S+ 0 0 76 0, 0.0 -16,-0.2 0, 0.0 3,-0.1 -0.229 114.4 30.6 -46.9 130.8 79.8 45.2 -3.0 51 56 A G T 3 S+ 0 0 31 -18,-2.5 -17,-0.1 1,-0.4 -3,-0.0 -0.275 96.2 114.0 108.1 -44.6 80.2 42.6 -5.8 52 57 A S < - 0 0 30 -3,-2.5 -19,-3.1 -20,-0.1 -1,-0.4 -0.140 56.8-144.2 -52.8 146.9 80.7 39.7 -3.4 53 58 A Y B -H 32 0C 112 -21,-0.2 -21,-0.1 -3,-0.1 -4,-0.1 -0.912 30.0-102.4-106.9 149.5 78.3 36.9 -3.1 54 59 A L - 0 0 21 -23,-0.5 2,-0.3 -2,-0.4 -6,-0.0 -0.373 35.6-158.7 -69.2 149.5 77.7 35.3 0.3 55 60 A T >> - 0 0 63 1,-0.1 3,-2.8 -2,-0.1 4,-1.5 -0.959 30.2-113.3-128.8 149.2 79.4 32.0 1.0 56 61 A Q H 3> S+ 0 0 108 -2,-0.3 4,-2.3 1,-0.3 6,-0.1 0.779 114.5 62.6 -48.5 -31.7 78.5 29.3 3.6 57 62 A E H 34 S+ 0 0 167 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.370 109.5 38.6 -83.2 4.1 81.8 30.0 5.4 58 63 A Q H <4 S+ 0 0 54 -3,-2.8 -12,-0.3 2,-0.2 28,-0.3 0.678 134.6 14.0-107.9 -37.9 80.8 33.6 6.2 59 64 A V H X S- 0 0 2 -4,-1.5 4,-0.5 1,-0.3 -2,-0.2 0.362 101.4-109.2-131.6 -4.4 77.2 33.3 7.0 60 65 A G H X - 0 0 16 -4,-2.3 4,-1.3 -5,-0.3 -1,-0.3 -0.081 31.4 -92.9 82.3 167.7 76.3 29.6 7.6 61 66 A P H > S+ 0 0 62 0, 0.0 4,-3.3 0, 0.0 5,-0.2 0.709 118.9 66.4 -89.4 -28.0 74.2 27.4 5.3 62 67 A E H > S+ 0 0 85 2,-0.2 4,-2.1 1,-0.2 -2,-0.1 0.947 107.4 40.5 -61.2 -48.8 71.0 28.2 7.1 63 68 A V H X S+ 0 0 1 -4,-0.5 4,-3.3 2,-0.2 5,-0.3 0.967 116.4 48.8 -62.5 -53.0 71.2 31.8 5.9 64 69 A L H X S+ 0 0 36 -4,-1.3 4,-1.3 1,-0.3 -2,-0.2 0.866 113.8 47.9 -55.4 -37.5 72.4 30.8 2.4 65 70 A R H X S+ 0 0 151 -4,-3.3 4,-1.5 2,-0.2 -1,-0.3 0.886 113.8 48.1 -67.3 -40.1 69.5 28.3 2.2 66 71 A X H >X S+ 0 0 6 -4,-2.1 4,-1.4 -5,-0.2 3,-0.9 0.980 109.4 50.0 -63.4 -59.0 67.1 30.9 3.5 67 72 A L H 3X S+ 0 0 9 -4,-3.3 4,-2.5 1,-0.3 -1,-0.2 0.786 106.9 58.9 -50.9 -32.7 68.2 33.6 1.1 68 73 A E H 3X S+ 0 0 115 -4,-1.3 4,-1.6 -5,-0.3 5,-0.3 0.904 99.7 53.6 -66.8 -44.0 67.9 31.0 -1.7 69 74 A E H - G 0 100B 55 3,-2.1 3,-2.5 -2,-0.4 132,-0.1 -0.997 65.8 -19.2-138.6 145.6 61.5 45.8 -0.9 98 103 A K T 3 S- 0 0 142 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 -0.467 129.5 -39.6 50.0-126.2 61.5 47.5 -4.2 99 104 A E T 3 S+ 0 0 170 -2,-0.1 -70,-0.4 -3,-0.1 2,-0.3 -0.000 118.3 100.2-115.6 34.3 64.1 45.4 -6.0 100 105 A V E < - G 0 97B 9 -3,-2.5 -3,-2.1 -72,-0.1 2,-0.6 -0.890 59.3-144.3-121.3 145.7 66.4 44.9 -3.1 101 106 A F E -CG 27 96B 22 -74,-2.9 -74,-2.5 -2,-0.3 2,-0.4 -0.946 16.7-161.1-111.3 119.8 67.0 42.1 -0.6 102 107 A Y E -CG 26 95B 1 -7,-3.1 -7,-1.7 -2,-0.6 2,-0.4 -0.781 7.7-167.3-101.0 140.5 67.8 43.0 3.0 103 108 A L E -CG 25 94B 0 -78,-2.3 -78,-1.3 -2,-0.4 2,-0.4 -0.860 9.3-170.0-124.9 95.6 69.4 40.6 5.5 104 109 A E E -CG 24 93B 0 -11,-3.1 -11,-2.7 -2,-0.4 2,-0.7 -0.746 8.1-159.3 -90.3 131.5 69.3 42.0 9.0 105 110 A F E - G 0 92B 1 -82,-2.6 2,-0.3 -2,-0.4 -13,-0.2 -0.799 14.8-175.6-111.3 85.8 71.3 40.1 11.6 106 111 A E E - G 0 91B 1 -15,-2.1 -15,-3.3 -2,-0.7 2,-0.5 -0.689 33.4-106.1 -91.5 136.5 69.8 41.1 14.9 107 112 A I E - G 0 90B 36 -86,-1.6 2,-0.4 -2,-0.3 -17,-0.2 -0.441 30.1-145.6 -69.6 110.4 71.6 39.7 18.0 108 113 A R + 0 0 17 -19,-1.5 -19,-0.4 -2,-0.5 2,-0.2 -0.615 21.4 175.5 -78.5 129.6 69.6 36.9 19.6 109 114 A T + 0 0 116 -2,-0.4 2,-0.3 2,-0.1 -1,-0.1 -0.625 48.7 46.9-136.2 74.6 69.9 36.8 23.4 110 115 A A S S- 0 0 67 -2,-0.2 2,-0.2 3,-0.0 3,-0.0 -0.945 88.7 -71.7-176.3-171.7 67.7 34.1 25.0 111 116 A D S S- 0 0 99 -2,-0.3 2,-0.2 1,-0.1 -2,-0.1 -0.546 70.8 -73.3 -89.8 170.2 66.7 30.5 24.6 112 117 A T - 0 0 104 -2,-0.2 2,-0.5 1,-0.1 -1,-0.1 -0.467 43.7-130.3 -67.2 131.1 64.6 29.5 21.7 113 118 A L - 0 0 34 -2,-0.2 -1,-0.1 4,-0.1 464,-0.0 -0.741 28.0-129.2 -77.4 122.9 60.9 30.6 22.0 114 119 A S > - 0 0 19 -2,-0.5 4,-2.8 1,-0.1 5,-0.2 -0.264 15.8-115.5 -68.3 162.3 58.9 27.5 21.2 115 120 A I H > S+ 0 0 28 2,-0.2 4,-1.8 1,-0.2 -1,-0.1 0.881 118.6 50.4 -67.2 -36.9 56.1 27.7 18.7 116 121 A T H > S+ 0 0 8 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.949 109.6 48.2 -64.5 -51.4 53.6 27.0 21.5 117 122 A S H > S+ 0 0 36 1,-0.3 4,-2.1 2,-0.2 3,-0.3 0.934 110.6 52.9 -57.2 -45.4 55.0 29.7 23.7 118 123 A F H X S+ 0 0 1 -4,-2.8 4,-1.8 1,-0.2 -1,-0.3 0.897 107.4 55.2 -53.0 -40.0 54.9 32.0 20.7 119 124 A T H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.853 107.6 44.2 -68.6 -36.4 51.3 31.1 20.4 120 125 A L H X S+ 0 0 102 -4,-1.9 4,-3.6 -3,-0.3 5,-0.3 0.817 106.4 59.2 -85.0 -24.3 50.1 32.0 23.9 121 126 A N H X S+ 0 0 47 -4,-2.1 4,-1.8 -5,-0.2 5,-0.3 0.983 112.7 43.7 -51.9 -53.2 51.9 35.3 24.0 122 127 A A H X S+ 0 0 1 -4,-1.8 4,-2.8 -5,-0.2 3,-0.4 0.979 119.3 40.4 -51.4 -62.5 49.8 35.9 21.0 123 128 A Q H X S+ 0 0 23 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.805 109.8 58.8 -66.2 -32.3 46.6 34.5 22.5 124 129 A R H X S+ 0 0 93 -4,-3.6 4,-0.7 2,-0.2 -1,-0.2 0.934 114.8 36.5 -58.2 -45.5 47.1 36.0 26.0 125 130 A I H >X S+ 0 0 0 -4,-1.8 4,-0.9 -3,-0.4 3,-0.7 0.905 115.4 52.2 -81.2 -41.5 47.2 39.5 24.6 126 131 A I H >X S+ 0 0 0 -4,-2.8 3,-2.1 -5,-0.3 4,-0.6 0.948 102.9 61.9 -53.7 -47.2 44.6 39.0 21.9 127 132 A A H >< S+ 0 0 35 -4,-2.5 3,-1.0 1,-0.3 -1,-0.3 0.834 99.9 54.5 -49.8 -35.8 42.4 37.6 24.7 128 133 A Q H X< S+ 0 0 43 -4,-0.7 3,-0.7 -3,-0.7 -1,-0.3 0.769 101.6 59.1 -71.3 -23.1 42.7 41.1 26.4 129 134 A V H << S+ 0 0 0 -3,-2.1 -1,-0.2 -4,-0.9 -2,-0.2 0.579 104.1 50.7 -81.7 -7.8 41.4 42.7 23.2 130 135 A Q T << S+ 0 0 42 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.1 0.053 84.3 80.3-125.8 29.1 38.1 40.8 23.2 131 136 A L S < S+ 0 0 117 -3,-0.7 2,-0.2 7,-0.0 -1,-0.1 0.727 90.0 53.6 -95.2 -27.7 36.6 41.2 26.6 132 137 A H - 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