==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 14-DEC-06 2JMZ . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN MJ0781; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR M.A.JOHNSON,M.W.SOUTHWORTH,T.HERRMANN,L.BRACE,F.B.PERLER, . 186 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10647.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 112 60.2 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 . 54 29.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 13 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 1 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 . 7 1 2 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 0 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 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 0 240 0, 0.0 3,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 120.0 -5.1 -4.3 20.2 2 2 A N - 0 0 140 2,-0.2 3,-0.0 1,-0.1 0, 0.0 -0.211 360.0-130.0 -83.3 173.7 -7.8 -4.7 17.6 3 3 A T S S+ 0 0 156 -2,-0.0 -1,-0.1 0, 0.0 0, 0.0 0.904 97.3 27.9 -81.2 -63.0 -9.3 -7.8 16.0 4 4 A G S S+ 0 0 20 -3,-0.0 -2,-0.2 97,-0.0 99,-0.1 0.306 88.4 81.1 -74.0-150.4 -9.0 -6.5 12.4 5 5 A H + 0 0 54 97,-0.5 97,-0.1 1,-0.1 98,-0.1 -0.116 49.3 98.2 61.0-174.2 -6.4 -4.0 11.2 6 6 A D + 0 0 125 98,-0.0 96,-0.1 173,-0.0 -1,-0.1 0.994 57.8 179.9 58.4 84.5 -2.8 -5.2 10.4 7 7 A G - 0 0 17 93,-0.1 2,-0.2 94,-0.0 96,-0.1 0.006 18.3-175.4 -93.0-169.0 -2.9 -5.6 6.6 8 8 A A - 0 0 5 146,-0.1 92,-0.6 71,-0.0 2,-0.2 -0.817 22.5-114.0-177.4 170.8 -0.5 -6.6 3.7 9 9 A L E -AB 99 153A 8 144,-2.9 144,-1.8 -2,-0.2 90,-0.2 -0.716 34.7 -95.9-110.3 156.8 -0.6 -6.8 -0.1 10 10 A A E > - B 0 152A 0 88,-1.7 3,-1.3 -2,-0.2 15,-0.3 -0.349 39.9-105.7 -66.1 158.9 -0.4 -9.8 -2.5 11 11 A Y T 3 S+ 0 0 70 140,-0.9 15,-2.4 1,-0.3 16,-0.5 0.750 116.3 48.9 -53.2 -37.0 3.0 -10.8 -4.0 12 12 A D T 3 S+ 0 0 59 12,-0.2 -1,-0.3 13,-0.2 -2,-0.1 -0.220 77.1 120.0-111.5 33.9 2.2 -9.4 -7.5 13 13 A E < - 0 0 0 -3,-1.3 12,-2.2 85,-0.1 154,-0.2 -0.912 64.3-126.1 -86.4 124.2 0.9 -5.9 -6.5 14 14 A P B -H 24 0B 21 0, 0.0 152,-2.3 0, 0.0 10,-0.2 -0.373 15.5-160.6 -61.2 156.8 3.1 -3.1 -8.1 15 15 A I - 0 0 5 8,-0.8 45,-0.3 150,-0.2 149,-0.2 0.395 25.1-134.5-126.6 -5.0 4.6 -0.5 -5.7 16 16 A Y - 0 0 21 7,-0.2 44,-2.3 150,-0.1 148,-0.1 0.928 17.6-146.7 47.6 76.9 5.5 2.4 -8.2 17 17 A L B > -I 59 0C 11 42,-0.3 3,-1.3 1,-0.1 42,-0.3 -0.241 33.0-101.3 -52.7 160.2 8.9 3.6 -7.3 18 18 A S T 3 S+ 0 0 47 40,-2.1 41,-0.2 1,-0.3 -1,-0.1 0.388 131.7 48.2 -61.6 0.3 9.7 7.3 -7.8 19 19 A D T 3 S- 0 0 133 39,-0.3 -1,-0.3 41,-0.0 40,-0.1 0.459 115.6-118.9-118.1 -16.8 11.3 5.9 -11.0 20 20 A G < + 0 0 43 -3,-1.3 -2,-0.1 1,-0.0 -4,-0.1 0.842 48.6 164.3 88.2 38.3 8.4 3.7 -12.1 21 21 A N - 0 0 100 1,-0.1 -3,-0.0 2,-0.0 -1,-0.0 0.616 32.1-148.4 -67.2 -16.4 10.0 0.3 -12.0 22 22 A I + 0 0 93 1,-0.2 2,-0.3 -5,-0.1 -1,-0.1 0.906 39.1 158.6 35.9 66.9 6.6 -1.6 -12.0 23 23 A I - 0 0 60 -10,-0.1 -8,-0.8 1,-0.0 2,-0.2 -0.820 48.6 -96.6-109.4 151.8 8.1 -4.5 -10.0 24 24 A N B > -H 14 0B 64 -2,-0.3 4,-2.5 -10,-0.2 -12,-0.2 -0.484 26.0-135.6 -64.9 127.0 6.3 -7.1 -7.8 25 25 A I H > S+ 0 0 2 -12,-2.2 4,-2.6 -15,-0.3 5,-0.2 0.877 106.4 53.3 -51.2 -41.4 6.2 -6.1 -4.1 26 26 A G H > S+ 0 0 0 -15,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.905 110.4 44.4 -68.4 -41.4 7.1 -9.7 -3.3 27 27 A E H > S+ 0 0 97 -16,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.883 112.4 53.9 -65.7 -41.0 10.2 -9.7 -5.5 28 28 A F H X S+ 0 0 16 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.969 115.2 38.9 -57.3 -57.2 11.2 -6.2 -4.3 29 29 A V H >X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 3,-0.9 0.929 114.1 54.6 -56.2 -50.9 11.1 -7.4 -0.7 30 30 A D H 3X S+ 0 0 50 -4,-2.8 4,-2.0 1,-0.3 5,-0.2 0.853 97.0 63.3 -66.4 -32.4 12.6 -10.8 -1.4 31 31 A K H 3X S+ 0 0 111 -4,-2.5 4,-1.3 2,-0.2 3,-0.3 0.916 109.0 43.4 -48.2 -47.1 15.7 -9.3 -3.2 32 32 A F H XX S+ 0 0 1 -4,-1.0 4,-2.9 -3,-0.9 3,-0.6 0.931 111.9 52.1 -68.6 -43.7 16.5 -7.8 0.2 33 33 A F H 3< S+ 0 0 9 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.730 112.4 48.1 -63.9 -22.0 15.7 -11.0 2.1 34 34 A K H 3< S+ 0 0 144 -4,-2.0 -1,-0.2 -3,-0.3 -2,-0.2 0.665 122.7 31.2 -93.9 -20.0 18.1 -12.9 -0.3 35 35 A K H << S+ 0 0 153 -4,-1.3 2,-0.8 -3,-0.6 3,-0.4 0.850 125.1 43.4 -94.5 -52.6 21.0 -10.4 0.1 36 36 A Y S X S+ 0 0 54 -4,-2.9 4,-0.6 1,-0.2 3,-0.5 -0.256 71.7 138.6 -90.1 43.0 20.4 -9.3 3.6 37 37 A K T >4 S+ 0 0 146 -2,-0.8 3,-1.1 1,-0.3 -1,-0.2 0.904 75.5 51.2 -54.2 -42.2 19.7 -13.0 4.7 38 38 A N T 34 S+ 0 0 154 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.823 106.3 55.8 -65.2 -27.9 21.7 -12.2 7.8 39 39 A S T 34 S+ 0 0 51 -3,-0.5 2,-1.1 -7,-0.2 -1,-0.2 0.472 72.8 121.8 -88.9 -5.2 19.5 -9.1 8.4 40 40 A I << - 0 0 51 -3,-1.1 2,-0.3 -4,-0.6 10,-0.2 -0.455 45.6-169.8 -59.5 95.9 16.1 -11.1 8.3 41 41 A K B -C 49 0A 119 8,-1.9 8,-2.3 -2,-1.1 2,-0.4 -0.724 6.3-153.4 -81.0 142.9 14.8 -10.2 11.8 42 42 A K - 0 0 103 -2,-0.3 2,-0.1 6,-0.2 3,-0.0 -0.897 12.1-128.9-107.5 150.3 11.8 -12.1 13.0 43 43 A E > - 0 0 90 -2,-0.4 3,-1.3 1,-0.1 -1,-0.0 -0.355 28.0-106.7 -79.4 170.6 9.3 -10.7 15.4 44 44 A D T 3 S+ 0 0 164 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.917 127.2 58.0 -61.2 -42.7 8.1 -12.5 18.6 45 45 A N T 3 S- 0 0 128 1,-0.1 -1,-0.3 -3,-0.0 -2,-0.0 0.367 124.0-113.6 -68.9 2.6 4.9 -13.0 16.7 46 46 A G S < S+ 0 0 47 -3,-1.3 -2,-0.1 34,-0.0 -1,-0.1 0.911 71.7 136.4 69.6 46.5 7.2 -14.8 14.1 47 47 A F - 0 0 44 33,-0.1 2,-0.1 2,-0.0 -5,-0.1 0.772 49.1-129.4 -86.6-100.3 6.7 -12.3 11.3 48 48 A G + 0 0 0 29,-0.1 31,-2.2 32,-0.0 2,-0.3 -0.067 30.2 167.2 138.4 112.4 9.9 -11.3 9.4 49 49 A W E -CD 41 78A 49 -8,-2.3 -8,-1.9 29,-0.2 2,-0.3 -0.923 13.4-165.1-137.0 159.3 11.1 -7.7 8.6 50 50 A I E - D 0 77A 0 27,-1.3 27,-2.3 -2,-0.3 2,-0.4 -0.975 24.8-121.0-142.5 142.2 14.3 -6.1 7.3 51 51 A D E + D 0 76A 53 -2,-0.3 25,-0.3 25,-0.3 24,-0.1 -0.715 31.1 169.7 -73.7 133.4 15.4 -2.4 7.3 52 52 A I >> + 0 0 2 23,-1.9 3,-2.0 -2,-0.4 4,-0.7 0.246 46.1 109.5-130.0 12.2 16.1 -1.1 3.8 53 53 A G T 34 S+ 0 0 15 22,-1.7 3,-0.4 1,-0.3 23,-0.1 0.737 74.6 67.6 -53.6 -22.3 16.4 2.6 4.7 54 54 A N T 34 S+ 0 0 128 1,-0.2 -1,-0.3 21,-0.2 -2,-0.1 0.758 90.7 57.5 -74.0 -25.4 20.1 1.9 3.8 55 55 A E T <4 S- 0 0 59 -3,-2.0 -1,-0.2 20,-0.1 -2,-0.2 0.724 91.1-158.2 -68.4 -23.0 19.1 1.4 0.1 56 56 A N < + 0 0 85 -4,-0.7 -3,-0.1 -3,-0.4 -2,-0.1 0.353 29.8 164.1 61.6 -6.4 17.7 5.0 0.4 57 57 A I - 0 0 46 -5,-0.3 17,-0.7 1,-0.1 2,-0.4 -0.022 33.2-125.4 -45.8 143.8 15.5 4.0 -2.7 58 58 A Y E - J 0 73C 97 15,-0.2 -40,-2.1 13,-0.0 -39,-0.3 -0.775 20.7-166.9-102.9 134.8 12.5 6.4 -3.4 59 59 A I E -IJ 17 72C 1 13,-2.8 13,-1.4 -2,-0.4 2,-0.8 -0.807 35.4-106.1-104.3 148.4 8.9 5.3 -3.7 60 60 A K E + J 0 71C 100 -44,-2.3 104,-0.8 -2,-0.3 11,-0.2 -0.733 57.1 166.0 -70.0 112.8 6.1 7.5 -5.1 61 61 A S - 0 0 0 9,-2.0 9,-0.5 -2,-0.8 2,-0.3 -0.291 25.7-139.3-107.4-166.4 4.3 8.3 -1.9 62 62 A F - 0 0 5 100,-0.4 2,-0.5 7,-0.2 7,-0.2 -0.946 12.0-126.0-151.0 159.6 1.7 11.0 -1.1 63 63 A N B >>> -K 68 0D 23 5,-2.7 5,-1.6 -2,-0.3 3,-1.5 -0.951 5.4-156.8-113.9 116.8 1.2 13.3 1.9 64 64 A K T 345S+ 0 0 102 -2,-0.5 -1,-0.1 96,-0.3 97,-0.0 0.731 84.5 81.8 -57.3 -26.8 -2.3 13.3 3.6 65 65 A L T 345S- 0 0 150 1,-0.2 -1,-0.3 3,-0.1 95,-0.0 0.684 122.9 -3.4 -61.2 -22.2 -1.6 16.8 4.9 66 66 A S T <45S- 0 0 84 -3,-1.5 -1,-0.2 2,-0.1 -2,-0.2 0.209 98.5-108.2-149.1 10.5 -2.7 18.3 1.5 67 67 A L T <5 + 0 0 44 -4,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.948 69.7 153.6 54.3 49.4 -3.4 15.1 -0.6 68 68 A I B < -K 63 0D 62 -5,-1.6 -5,-2.7 66,-0.1 2,-0.5 -0.801 46.8-123.7-108.4 151.7 -0.2 15.9 -2.6 69 69 A I + 0 0 39 64,-1.0 2,-0.2 -2,-0.3 -7,-0.2 -0.876 47.8 140.5 -98.0 124.2 2.0 13.5 -4.5 70 70 A E - 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