==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 23-DEC-09 2KS0 . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: DESULFITOBACTERIUM HAFNIENSE; . AUTHOR Y.YANG,T.A.RAMELOT,J.R.CORT,H.WANG,C.CICCOSANTI,E.L.FOOTE,M. . 132 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9626.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 65.9 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 . 56 42.4 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 3.0 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 . 21 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 4.5 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 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 . 1 0 0 1 5 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 3 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 M 0 0 233 0, 0.0 2,-0.9 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-163.5 -11.7 11.6 -13.6 2 2 A D + 0 0 109 1,-0.2 0, 0.0 2,-0.0 0, 0.0 -0.722 360.0 163.5 -86.4 109.5 -11.8 8.6 -11.2 3 3 A N + 0 0 61 -2,-0.9 50,-0.3 2,-0.0 2,-0.2 0.328 38.4 117.2-105.0 5.9 -9.2 9.1 -8.5 4 4 A R + 0 0 79 48,-0.1 2,-0.3 46,-0.0 48,-0.2 -0.488 41.7 177.8 -73.9 143.0 -10.7 6.5 -6.2 5 5 A Q E -A 51 0A 4 46,-1.4 46,-1.7 -2,-0.2 2,-0.4 -0.978 24.7-132.9-144.6 158.0 -8.5 3.4 -5.5 6 6 A F E -A 50 0A 93 -2,-0.3 72,-0.5 44,-0.2 2,-0.4 -0.938 17.3-168.0-114.9 132.7 -8.6 0.2 -3.4 7 7 A L E -A 49 0A 25 42,-1.5 42,-1.0 -2,-0.4 2,-0.3 -0.972 6.8-176.9-121.7 130.3 -5.7 -0.9 -1.2 8 8 A S E +AB 48 76A 28 68,-0.8 68,-0.6 -2,-0.4 2,-0.3 -0.948 8.1 160.6-127.0 147.4 -5.5 -4.4 0.4 9 9 A L E +A 47 0A 23 38,-1.8 38,-1.6 -2,-0.3 2,-0.2 -0.991 6.9 174.2-158.6 160.5 -3.0 -5.9 2.8 10 10 A T + 0 0 28 64,-0.3 36,-0.1 -2,-0.3 3,-0.1 -0.793 54.0 72.7-151.5-165.9 -2.6 -8.8 5.2 11 11 A G + 0 0 24 34,-0.5 17,-0.7 -2,-0.2 -1,-0.1 0.848 68.1 176.7 56.5 28.3 -0.0 -10.6 7.4 12 12 A V E -D 27 0B 38 15,-0.2 15,-0.3 1,-0.1 -1,-0.2 -0.411 31.5-144.9 -66.4 137.8 -0.3 -7.5 9.6 13 13 A S E S- 0 0 54 13,-2.7 2,-0.3 1,-0.3 14,-0.2 0.894 73.4 -29.8 -72.6 -37.0 1.8 -7.7 12.8 14 14 A K E -D 26 0B 127 12,-1.5 12,-1.6 3,-0.0 2,-1.0 -0.982 61.6-100.9-170.4 163.6 -0.8 -5.8 14.9 15 15 A V E + 0 0 102 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.768 32.7 176.0 -98.5 96.5 -3.6 -3.1 14.6 16 16 A Q E S- 0 0 106 -2,-1.0 2,-0.3 8,-0.5 9,-0.2 0.913 70.0 -30.2 -66.2 -38.8 -2.0 0.1 15.9 17 17 A S E -D 24 0B 40 7,-2.1 7,-1.0 -3,-0.2 2,-0.3 -0.979 50.0-149.9-170.3 161.5 -5.2 2.0 15.0 18 18 A F E +D 23 0B 130 -2,-0.3 5,-0.2 5,-0.2 -3,-0.0 -0.846 28.5 154.9-146.6 105.5 -8.1 2.0 12.6 19 19 A D - 0 0 52 3,-1.2 3,-0.3 -2,-0.3 -2,-0.0 -0.958 47.6-128.3-131.9 151.6 -9.9 5.3 11.6 20 20 A P S S+ 0 0 89 0, 0.0 19,-1.4 0, 0.0 3,-0.1 0.691 115.6 42.1 -70.9 -16.8 -11.8 6.4 8.5 21 21 A K S S+ 0 0 144 1,-0.3 15,-0.7 17,-0.1 2,-0.3 0.531 133.0 9.0-105.0 -10.6 -9.6 9.5 8.2 22 22 A E E - E 0 35B 68 -3,-0.3 -3,-1.2 13,-0.2 2,-0.4 -0.860 61.8-162.7-169.3 131.4 -6.3 7.6 9.0 23 23 A I E -DE 18 34B 3 11,-1.4 11,-2.3 -2,-0.3 2,-0.5 -0.974 4.3-170.1-123.8 129.3 -5.4 3.9 9.4 24 24 A L E +DE 17 33B 33 -7,-1.0 -7,-2.1 -2,-0.4 -8,-0.5 -0.958 12.9 166.1-120.5 118.4 -2.2 2.7 11.1 25 25 A L E - E 0 32B 35 7,-1.6 7,-1.7 -2,-0.5 2,-0.6 -0.991 27.9-139.7-133.4 127.9 -1.2 -1.0 10.8 26 26 A E E -DE 14 31B 56 -12,-1.6 -13,-2.7 -2,-0.4 -12,-1.5 -0.760 24.7-177.4 -91.0 123.8 2.2 -2.5 11.7 27 27 A T E > -DE 12 30B 6 3,-1.6 2,-2.1 -2,-0.6 3,-1.2 -0.894 60.9 -23.5-119.4 149.2 3.4 -5.1 9.2 28 28 A I T 3 S- 0 0 47 -17,-0.7 94,-0.1 -2,-0.3 -2,-0.1 -0.200 127.2 -44.9 50.5 -80.0 6.6 -7.2 9.3 29 29 A Q T 3 S+ 0 0 132 -2,-2.1 -1,-0.3 42,-0.1 2,-0.2 0.413 119.9 78.9-153.5 -18.2 8.4 -4.6 11.5 30 30 A G E < S-E 27 0B 14 -3,-1.2 -3,-1.6 91,-0.3 2,-0.5 -0.513 73.3-120.4 -95.7 168.9 7.7 -1.1 10.1 31 31 A V E -E 26 0B 29 -5,-0.2 2,-0.5 -2,-0.2 -5,-0.2 -0.921 18.5-155.7-113.4 131.9 4.5 1.0 10.5 32 32 A L E -E 25 0B 20 -7,-1.7 -7,-1.6 -2,-0.5 2,-0.5 -0.899 4.9-161.4-108.2 128.8 2.4 2.1 7.5 33 33 A S E -EF 24 57B 12 24,-1.6 24,-1.6 -2,-0.5 2,-0.5 -0.925 3.6-158.3-111.4 126.2 0.2 5.2 7.8 34 34 A I E -EF 23 56B 17 -11,-2.3 -11,-1.4 -2,-0.5 2,-0.4 -0.891 9.8-175.1-106.5 127.5 -2.7 5.7 5.2 35 35 A K E +EF 22 55B 83 20,-1.8 20,-1.7 -2,-0.5 19,-1.6 -0.967 31.2 96.0-122.9 135.1 -4.1 9.2 4.7 36 36 A G E - F 0 53B 3 -15,-0.7 2,-0.3 -2,-0.4 17,-0.2 -0.935 64.2 -79.3 178.2-156.5 -7.0 10.1 2.5 37 37 A E E S+ F 0 52B 81 15,-1.3 15,-1.3 -2,-0.3 3,-0.1 -0.985 97.0 13.4-135.8 146.4 -10.8 10.7 2.6 38 38 A K + 0 0 152 -2,-0.3 2,-1.4 1,-0.2 -1,-0.2 0.969 67.3 172.9 55.8 56.4 -13.8 8.3 2.9 39 39 A L 0 0 6 -19,-1.4 12,-0.2 -3,-0.2 -1,-0.2 -0.521 360.0 360.0 -93.6 68.8 -11.6 5.2 3.7 40 40 A G 0 0 83 -2,-1.4 10,-1.5 10,-1.2 -3,-0.0 -0.654 360.0 360.0-108.4 360.0 -14.5 2.8 4.4 41 ! 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 42 46 A L 0 0 173 0, 0.0 4,-0.3 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 -82.2 -13.1 -11.1 6.6 43 47 A K > + 0 0 185 1,-0.2 3,-1.9 2,-0.1 0, 0.0 0.430 360.0 40.7 55.9 152.6 -12.3 -14.6 5.2 44 48 A A T 3 S- 0 0 85 1,-0.3 -1,-0.2 3,-0.0 3,-0.1 0.491 116.6 -99.8 57.5 -4.0 -8.9 -15.4 3.7 45 49 A G T 3 S+ 0 0 42 1,-0.2 -34,-0.5 -35,-0.1 2,-0.3 0.804 89.1 128.5 63.8 24.4 -7.6 -13.3 6.6 46 50 A Q < - 0 0 87 -3,-1.9 2,-0.4 -4,-0.3 -1,-0.2 -0.821 46.6-152.3-112.0 153.1 -7.2 -10.4 4.2 47 51 A V E -A 9 0A 54 -38,-1.6 -38,-1.8 -2,-0.3 2,-0.3 -0.972 6.4-160.6-126.9 139.2 -8.5 -6.8 4.6 48 52 A E E -A 8 0A 157 -2,-0.4 2,-0.4 -40,-0.2 -40,-0.2 -0.782 2.6-155.5-114.8 160.1 -9.5 -4.4 1.8 49 53 A V E -A 7 0A 32 -42,-1.0 -42,-1.5 -2,-0.3 2,-0.5 -0.999 1.2-159.7-137.4 138.2 -9.9 -0.6 1.9 50 54 A E E +A 6 0A 97 -10,-1.5 -10,-1.2 -2,-0.4 2,-0.3 -0.963 46.4 81.2-120.7 124.8 -12.0 1.8 -0.4 51 55 A G E S-A 5 0A 4 -46,-1.7 -46,-1.4 -2,-0.5 2,-0.5 -0.921 77.0 -75.9 163.5 172.8 -11.1 5.5 -0.6 52 56 A L E -F 37 0B 33 -15,-1.3 -15,-1.3 -2,-0.3 2,-0.7 -0.830 39.7-134.7 -98.0 127.6 -8.8 8.0 -2.3 53 57 A I E +F 36 0B 18 -2,-0.5 -17,-0.3 -50,-0.3 3,-0.1 -0.691 26.5 174.2 -83.0 117.1 -5.2 8.2 -1.0 54 58 A D E - 0 0 50 -19,-1.6 2,-0.3 -2,-0.7 -18,-0.2 0.590 69.1 -5.3 -97.0 -12.2 -4.3 11.8 -0.5 55 59 A A E -F 35 0B 15 -20,-1.7 -20,-1.8 73,-0.0 2,-0.4 -0.952 56.6-151.7-173.9 154.3 -0.9 11.0 1.2 56 60 A L E -F 34 0B 11 -2,-0.3 2,-0.4 -22,-0.2 70,-0.2 -0.999 10.2-173.7-137.2 134.7 1.2 8.1 2.5 57 61 A V E +F 33 0B 53 -24,-1.6 -24,-1.6 -2,-0.4 68,-0.1 -0.971 11.7 161.3-133.2 123.8 3.9 8.2 5.3 58 62 A Y - 0 0 21 -2,-0.4 66,-0.2 66,-0.3 68,-0.1 -0.962 41.6-117.2-139.7 120.7 6.2 5.3 6.3 59 63 A P - 0 0 71 0, 0.0 2,-0.3 0, 0.0 65,-0.2 -0.346 20.8-159.3 -56.9 127.9 9.4 5.7 8.3 60 64 A L > - 0 0 65 63,-0.1 3,-1.9 -2,-0.1 2,-1.8 -0.310 12.4-178.1-103.6 49.8 12.4 4.6 6.1 61 65 A E T 3 + 0 0 180 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 -0.202 68.0 63.2 -51.1 84.5 14.8 4.0 9.0 62 66 A H T 3 + 0 0 162 -2,-1.8 -1,-0.2 1,-0.3 2,-0.2 0.184 68.5 105.4-176.0 -30.4 17.7 3.0 6.6 63 67 A H < + 0 0 127 -3,-1.9 -1,-0.3 1,-0.2 -3,-0.0 -0.496 26.1 153.3 -70.4 134.0 18.4 6.1 4.5 64 68 A H - 0 0 176 -2,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 0.575 25.9-169.7-127.6 -39.7 21.7 7.9 5.6 65 69 A H - 0 0 145 2,-0.1 -2,-0.0 1,-0.0 0, 0.0 0.419 30.7-108.0 57.4 151.8 22.8 9.6 2.4 66 70 A H 0 0 196 1,-0.2 -1,-0.0 0, 0.0 0, 0.0 0.982 360.0 360.0 -76.6 -68.4 26.3 11.2 2.2 67 71 A H 0 0 227 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.128 360.0 360.0 -87.4 360.0 25.5 15.0 2.2 68 !* 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 69 1 B M 0 0 199 0, 0.0 -41,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.6 3.0 -14.2 11.3 70 2 B D - 0 0 106 1,-0.1 -42,-0.2 -42,-0.0 3,-0.0 0.019 360.0-111.6 60.1-176.6 5.7 -14.4 8.6 71 3 B N S S+ 0 0 55 -44,-0.1 50,-0.4 -42,-0.0 -1,-0.1 0.500 80.9 103.5-126.6 -18.5 6.9 -11.3 6.7 72 4 B R + 0 0 129 48,-0.1 2,-0.3 -44,-0.1 48,-0.2 -0.437 48.0 173.8 -68.8 141.0 5.5 -12.1 3.2 73 5 B Q E - C 0 119A 5 46,-1.5 46,-1.8 -2,-0.1 2,-0.4 -0.983 29.8-122.2-146.7 158.3 2.4 -10.1 2.3 74 6 B F E + C 0 118A 90 -2,-0.3 2,-0.4 44,-0.2 -64,-0.3 -0.851 27.7 179.9-103.8 135.6 0.1 -9.5 -0.7 75 7 B L E + C 0 117A 24 42,-2.3 42,-2.7 -2,-0.4 2,-0.3 -0.979 2.4 174.5-138.4 125.5 -0.4 -5.9 -2.0 76 8 B S E -BC 8 116A 32 -68,-0.6 -68,-0.8 -2,-0.4 2,-0.3 -0.953 3.9-176.5-129.4 149.3 -2.6 -4.9 -5.0 77 9 B L E - 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