==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 10-JUL-92 1ZRP . COMPND 2 MOLECULE: RUBREDOXIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR P.R.BLAKE,J.B.PARK,Z.H.ZHOU,D.R.HARE,M.W.W.ADAMS,M.F.SUMMERS . 53 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3750.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 30 56.6 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 . 14 26.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 1.9 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-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 . 4 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 17.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.9 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 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 . 3 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 A 0 0 41 0, 0.0 13,-1.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 130.6 0.9 -7.4 6.0 2 2 A K E -A 13 0A 99 11,-0.2 49,-2.1 12,-0.1 2,-0.3 -0.921 360.0-171.6-104.0 138.0 -0.4 -3.9 6.6 3 3 A W E -AB 12 50A 29 9,-3.4 9,-1.8 -2,-0.4 2,-0.3 -0.832 3.5-157.7-118.1 166.7 1.2 -0.9 4.9 4 4 A V E -AB 11 49A 35 45,-3.7 45,-1.7 7,-0.3 2,-0.8 -0.933 24.4-113.2-137.7 155.6 0.6 2.9 5.4 5 5 A C E > - B 0 48A 2 5,-3.6 4,-1.6 -2,-0.3 43,-0.2 -0.822 19.8-160.6 -84.2 118.1 1.1 6.1 3.6 6 6 A K T 4 S+ 0 0 136 41,-1.4 42,-0.1 -2,-0.8 -1,-0.1 0.334 87.3 49.7 -88.8 17.1 3.8 8.1 5.4 7 7 A I T 4 S+ 0 0 91 40,-0.2 -1,-0.2 36,-0.1 41,-0.1 0.707 126.0 10.4-101.3 -79.6 2.4 11.1 3.7 8 8 A C T 4 S- 0 0 59 1,-0.1 -2,-0.2 35,-0.1 -4,-0.0 0.660 98.4-112.1 -80.4 -30.3 -1.3 11.5 4.0 9 9 A G < + 0 0 45 -4,-1.6 -3,-0.1 1,-0.2 -1,-0.1 0.586 66.1 144.4 99.5 20.8 -1.9 8.7 6.6 10 10 A Y - 0 0 70 -5,-0.2 -5,-3.6 -6,-0.1 2,-0.3 -0.233 36.3-141.7 -73.4 170.3 -3.8 6.4 4.3 11 11 A I E -A 4 0A 86 -7,-0.3 2,-0.4 37,-0.1 -7,-0.3 -0.995 11.4-151.8-142.3 139.7 -3.3 2.6 4.7 12 12 A Y E -A 3 0A 1 -9,-1.8 -9,-3.4 -2,-0.3 2,-0.5 -0.901 8.3-164.0-104.0 141.2 -3.0 -0.5 2.6 13 13 A D E >> -AC 2 17A 50 4,-0.5 4,-3.2 -2,-0.4 3,-0.7 -0.804 11.1-157.8-125.0 107.6 -4.0 -3.9 3.9 14 14 A E T 34 S+ 0 0 23 -13,-1.7 12,-1.7 -2,-0.5 13,-0.5 0.714 96.6 56.2 -62.1 -17.8 -2.7 -6.7 1.8 15 15 A D T 34 S+ 0 0 119 -14,-0.4 -1,-0.3 10,-0.2 3,-0.1 0.973 112.9 34.7 -61.0 -77.7 -5.6 -8.7 3.4 16 16 A A T <4 S- 0 0 66 -3,-0.7 -2,-0.2 1,-0.2 2,-0.1 0.773 101.2-166.3 -60.4 -14.9 -8.4 -6.4 2.2 17 17 A G B < -C 13 0A 9 -4,-3.2 -4,-0.5 7,-0.2 -1,-0.2 -0.454 28.2 -88.8 61.3-151.6 -6.4 -5.8 -0.9 18 18 A D B > > +D 23 0B 9 5,-1.5 3,-2.0 -2,-0.1 5,-1.8 -0.187 49.4 160.7-161.1 56.7 -7.3 -2.9 -3.2 19 19 A P G > 5S+ 0 0 93 0, 0.0 3,-0.9 0, 0.0 5,-0.1 0.793 73.3 77.1 -52.5 -19.1 -9.9 -4.0 -5.9 20 20 A D G 3 5S+ 0 0 150 1,-0.3 -2,-0.0 3,-0.1 -3,-0.0 0.884 111.2 21.8 -61.3 -33.0 -10.5 -0.3 -6.2 21 21 A N G < 5S- 0 0 89 -3,-2.0 -1,-0.3 2,-0.1 0, 0.0 0.121 133.4 -78.5-128.8 23.5 -7.3 -0.1 -8.2 22 22 A G T < 5S+ 0 0 67 -3,-0.9 2,-0.4 -4,-0.3 -2,-0.1 0.829 84.5 135.3 85.6 44.3 -7.0 -3.7 -9.4 23 23 A I B < -D 18 0B 5 -5,-1.8 -5,-1.5 9,-0.1 -1,-0.3 -0.974 43.1-141.7-120.7 136.3 -5.6 -5.5 -6.3 24 24 A S > - 0 0 85 -2,-0.4 3,-1.9 -7,-0.2 2,-0.7 -0.627 35.3 -94.4 -93.1 143.9 -6.9 -8.8 -5.0 25 25 A P T 3 S+ 0 0 88 0, 0.0 -10,-0.2 0, 0.0 -9,-0.1 -0.345 118.2 36.8 -55.0 89.7 -7.3 -9.6 -1.3 26 26 A G T 3 S+ 0 0 51 -12,-1.7 2,-0.2 -2,-0.7 -11,-0.2 0.446 80.6 134.1 132.7 19.1 -4.0 -11.4 -0.8 27 27 A T < - 0 0 31 -3,-1.9 -1,-0.3 -13,-0.5 2,-0.3 -0.502 51.0-122.5 -87.1 150.1 -1.6 -9.4 -3.0 28 28 A K > - 0 0 124 -2,-0.2 3,-0.5 3,-0.1 -1,-0.0 -0.737 16.1-113.1 -94.5 166.1 1.8 -8.4 -1.6 29 29 A F G > S+ 0 0 13 1,-0.3 3,-2.3 -2,-0.3 -1,-0.1 0.929 119.3 30.0 -61.7 -66.0 3.3 -4.9 -1.2 30 30 A E G 3 S+ 0 0 166 1,-0.3 -1,-0.3 -3,-0.1 4,-0.0 0.487 111.6 71.2 -79.0 7.1 6.2 -5.3 -3.7 31 31 A E G < S+ 0 0 124 -3,-0.5 -1,-0.3 2,-0.0 -2,-0.2 0.210 83.3 99.1-102.2 20.5 3.9 -7.7 -5.5 32 32 A L S < S- 0 0 14 -3,-2.3 -9,-0.1 1,-0.2 -3,-0.0 -0.518 88.7 -74.2 -90.2 168.9 1.8 -4.6 -6.5 33 33 A P > - 0 0 63 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 -0.183 34.1-123.4 -54.3 151.8 2.0 -2.8 -9.8 34 34 A D T 3 S+ 0 0 155 1,-0.3 11,-0.3 -3,-0.1 -2,-0.1 0.940 115.6 48.5 -61.0 -42.0 5.0 -0.6 -10.6 35 35 A D T 3 S+ 0 0 155 9,-0.1 2,-0.8 10,-0.1 -1,-0.3 0.251 80.8 129.0 -94.0 20.1 2.6 2.3 -11.2 36 36 A W < + 0 0 9 -3,-1.4 9,-1.9 8,-0.0 2,-0.2 -0.613 32.0 160.4 -72.7 108.9 0.8 1.6 -7.9 37 37 A V B -E 44 0C 56 -2,-0.8 6,-0.1 7,-0.3 -2,-0.0 -0.741 49.4 -56.1-117.3-176.9 0.7 4.9 -6.1 38 38 A C > - 0 0 4 5,-1.0 4,-1.5 -2,-0.2 5,-0.1 -0.345 36.8-144.0 -63.9 126.0 -1.4 6.3 -3.2 39 39 A P T 4 S+ 0 0 53 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.663 99.2 33.2 -61.3 -12.7 -5.1 6.2 -4.0 40 40 A I T 4 S+ 0 0 95 3,-0.1 -2,-0.0 0, 0.0 -3,-0.0 0.834 131.1 16.7-103.6 -81.2 -5.2 9.5 -2.1 41 41 A C T 4 S- 0 0 61 2,-0.1 -3,-0.0 1,-0.1 0, 0.0 0.593 94.5-117.4 -80.3 -20.9 -2.2 11.8 -2.4 42 42 A G < + 0 0 41 -4,-1.5 -1,-0.1 1,-0.3 0, 0.0 0.637 59.8 152.8 85.0 25.2 -0.7 10.2 -5.4 43 43 A A - 0 0 12 -6,-0.1 -5,-1.0 -5,-0.1 -1,-0.3 -0.709 46.3-121.5 -85.8 111.8 2.5 9.2 -3.6 44 44 A P B > -E 37 0C 61 0, 0.0 3,-3.3 0, 0.0 -7,-0.3 0.146 35.3 -91.7 -46.4 158.3 4.0 6.1 -5.3 45 45 A K G > S+ 0 0 71 -9,-1.9 3,-2.1 1,-0.3 -8,-0.1 0.734 122.1 78.4 -60.9 -11.1 4.4 3.0 -3.2 46 46 A S G 3 S+ 0 0 89 1,-0.3 -1,-0.3 3,-0.0 -9,-0.1 0.648 91.7 54.2 -60.8 -20.5 7.9 4.3 -2.5 47 47 A E G < S+ 0 0 87 -3,-3.3 -41,-1.4 -4,-0.2 2,-0.5 0.237 85.8 103.5-106.1 18.2 6.1 6.6 0.0 48 48 A F E < -B 5 0A 11 -3,-2.1 -43,-0.3 -43,-0.2 2,-0.1 -0.849 55.6-156.8-112.3 112.7 4.3 3.8 1.9 49 49 A E E -B 4 0A 105 -45,-1.7 -45,-3.7 -2,-0.5 2,-0.3 -0.456 16.6-120.4 -77.8 162.9 5.7 2.8 5.3 50 50 A K E -B 3 0A 106 -47,-0.3 2,-0.3 -2,-0.1 -47,-0.2 -0.787 8.7-132.1 -98.2 161.1 5.0 -0.6 6.9 51 51 A L S S- 0 0 114 -49,-2.1 -49,-0.1 -2,-0.3 -48,-0.1 -0.312 72.1 -80.5 -96.9 36.5 3.3 -1.4 10.2 52 52 A E 0 0 174 -2,-0.3 -50,-0.1 1,-0.2 -1,-0.1 0.946 360.0 360.0 57.8 104.7 6.2 -3.7 11.0 53 53 A D 0 0 158 -52,-0.1 -1,-0.2 0, 0.0 -3,-0.0 -0.949 360.0 360.0-161.0 360.0 5.9 -7.0 9.3