==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-APR-07 2YX1 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN MJ0883; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR S.GOTO-ITO,T.ITO,R.ISHII,Y.BESSHO,S.YOKOYAMA . 635 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32924.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 445 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 125 19.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.3 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 . 1 0.2 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 . 60 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 19.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 0.8 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 2 2 0 4 1 0 6 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 4 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 PARALLEL BRIDGES PER LADDER . 4 0 4 2 4 2 0 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 4 0 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 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 2 A P 0 0 46 0, 0.0 61,-1.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-141.7 35.9 53.8 19.9 2 3 A L E +A 61 0A 57 39,-0.3 39,-1.8 59,-0.2 2,-0.3 -0.626 360.0 179.7 -77.0 131.3 39.5 54.2 21.0 3 4 A C E -AB 60 40A 0 57,-2.9 57,-2.4 -2,-0.3 2,-0.7 -0.954 31.5-128.2-133.9 152.3 40.8 57.7 19.9 4 5 A L E -AB 59 39A 0 35,-2.7 35,-2.2 -2,-0.3 2,-0.5 -0.913 28.1-153.1-101.0 117.5 44.0 59.6 20.2 5 6 A K E +AB 58 38A 64 53,-4.1 53,-1.9 -2,-0.7 2,-0.3 -0.821 27.1 154.0 -96.8 126.6 43.2 63.1 21.5 6 7 A I E - B 0 37A 3 31,-1.9 31,-2.8 -2,-0.5 2,-0.3 -0.953 52.7 -86.4-144.7 161.4 45.6 65.9 20.5 7 8 A N E > - B 0 36A 47 49,-0.4 3,-2.1 -2,-0.3 29,-0.3 -0.571 44.4-125.8 -70.1 132.4 45.5 69.7 20.1 8 9 A K G > S+ 0 0 110 27,-1.8 3,-0.8 -2,-0.3 4,-0.2 0.511 100.4 79.5 -63.1 -4.0 44.4 70.2 16.5 9 10 A K G 3 S+ 0 0 160 26,-0.3 -1,-0.3 1,-0.2 3,-0.2 0.788 97.2 47.3 -71.9 -22.9 47.4 72.3 15.6 10 11 A H G <> S+ 0 0 60 -3,-2.1 4,-2.5 1,-0.1 3,-0.5 0.398 83.5 117.6 -94.8 0.8 49.3 69.0 15.2 11 12 A G H <> S+ 0 0 10 -3,-0.8 4,-2.4 1,-0.2 5,-0.2 0.804 73.7 35.2 -31.4 -75.0 46.5 67.4 13.2 12 13 A E H > S+ 0 0 177 -4,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.785 118.1 53.7 -59.8 -32.8 48.1 66.6 9.8 13 14 A Q H > S+ 0 0 109 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.935 111.8 43.7 -69.9 -45.8 51.4 65.7 11.2 14 15 A T H X S+ 0 0 3 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.878 111.1 54.9 -66.0 -41.1 50.0 63.2 13.7 15 16 A R H X S+ 0 0 106 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 0.938 108.8 48.3 -58.2 -47.9 47.7 61.7 11.1 16 17 A R H X S+ 0 0 105 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.918 111.0 50.2 -58.9 -47.2 50.7 61.0 8.8 17 18 A I H X S+ 0 0 28 -4,-2.0 4,-1.0 1,-0.2 -1,-0.2 0.847 111.7 48.8 -63.7 -31.3 52.7 59.5 11.7 18 19 A L H <>S+ 0 0 0 -4,-2.2 5,-3.1 2,-0.2 6,-0.8 0.880 110.2 51.3 -75.6 -36.8 49.7 57.2 12.5 19 20 A I H ><5S+ 0 0 57 -4,-2.6 3,-2.3 1,-0.2 -2,-0.2 0.962 107.3 51.4 -64.8 -49.0 49.3 56.1 9.0 20 21 A E H 3<5S+ 0 0 62 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.824 111.8 48.9 -60.4 -25.3 52.9 55.2 8.5 21 22 A N T 3<5S- 0 0 3 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.205 112.8-117.3 -97.6 17.8 52.7 53.1 11.6 22 23 A N T < 5S+ 0 0 69 -3,-2.3 -3,-0.2 1,-0.1 -2,-0.1 0.855 82.6 118.6 53.2 39.4 49.5 51.3 10.6 23 24 A L < + 0 0 4 -5,-3.1 19,-2.7 -6,-0.1 2,-0.4 0.619 35.4 102.5-109.2 -17.9 47.7 52.8 13.6 24 25 A L B -D 41 0B 6 -6,-0.8 2,-1.2 17,-0.2 17,-0.2 -0.570 65.8-142.5 -73.2 121.1 44.9 54.9 11.9 25 26 A N > - 0 0 32 15,-2.8 3,-1.0 -2,-0.4 -1,-0.1 -0.755 15.9-167.8 -84.9 98.3 41.6 53.1 12.2 26 27 A K T 3 S+ 0 0 105 -2,-1.2 41,-0.2 1,-0.3 -1,-0.1 0.353 71.2 81.1 -72.0 5.6 40.3 54.1 8.7 27 28 A D T 3 S+ 0 0 88 39,-0.1 2,-0.3 2,-0.0 -1,-0.3 0.307 91.5 54.8 -94.8 9.8 36.7 52.9 9.5 28 29 A Y S < S- 0 0 57 -3,-1.0 2,-0.6 38,-0.3 38,-0.3 -0.873 86.8-104.5-136.0 168.4 35.9 56.1 11.4 29 30 A K - 0 0 101 36,-2.3 36,-0.2 -2,-0.3 2,-0.2 -0.862 29.0-126.6-101.3 119.8 36.0 59.8 10.7 30 31 A I - 0 0 52 -2,-0.6 2,-0.4 9,-0.1 9,-0.2 -0.480 40.5-156.5 -56.7 125.0 38.7 61.8 12.3 31 32 A T E -C 38 0A 31 7,-1.9 7,-2.6 -2,-0.2 2,-0.5 -0.922 15.6-149.7-119.9 141.6 36.6 64.4 14.1 32 33 A S E +C 37 0A 82 -2,-0.4 2,-0.4 5,-0.2 5,-0.2 -0.916 18.0 173.0-109.5 124.2 37.4 67.9 15.3 33 34 A E E > -C 36 0A 95 3,-2.3 3,-1.3 -2,-0.5 2,-0.3 -0.971 63.6 -35.6-133.5 117.6 35.6 69.3 18.3 34 35 A G T 3 S- 0 0 67 -2,-0.4 -2,-0.0 1,-0.2 0, 0.0 -0.571 123.7 -30.8 71.1-132.5 36.6 72.6 19.8 35 36 A N T 3 S+ 0 0 74 -2,-0.3 -27,-1.8 -3,-0.1 2,-0.4 -0.097 120.6 95.8-109.8 34.1 40.4 72.9 19.4 36 37 A Y E < -BC 7 33A 91 -3,-1.3 -3,-2.3 -29,-0.3 2,-0.4 -0.944 59.7-148.7-125.9 146.4 40.9 69.1 19.7 37 38 A L E -BC 6 32A 21 -31,-2.8 -31,-1.9 -2,-0.4 2,-0.6 -0.924 8.1-156.0-112.4 138.4 41.3 66.5 17.1 38 39 A Y E -BC 5 31A 29 -7,-2.6 -7,-1.9 -2,-0.4 -33,-0.2 -0.948 8.9-170.5-119.2 111.9 40.1 62.9 17.7 39 40 A L E -B 4 0A 0 -35,-2.2 -35,-2.7 -2,-0.6 2,-0.3 -0.888 23.2-129.2-107.6 121.5 41.8 60.2 15.6 40 41 A P E -B 3 0A 0 0, 0.0 -15,-2.8 0, 0.0 2,-0.3 -0.534 36.9-168.8 -66.9 124.9 40.4 56.7 15.8 41 42 A I B -D 24 0B 5 -39,-1.8 -39,-0.3 -2,-0.3 -17,-0.2 -0.864 19.2-118.1-123.3 151.3 43.3 54.4 16.5 42 43 A K - 0 0 77 -19,-2.7 2,-0.2 -2,-0.3 -17,-0.1 -0.207 63.8 -52.8 -76.3 173.8 44.0 50.7 16.5 43 44 A D S S+ 0 0 130 -2,-0.0 2,-0.3 265,-0.0 -1,-0.2 -0.284 83.8 135.8 -52.0 114.0 45.0 48.7 19.6 44 45 A V - 0 0 19 -2,-0.2 2,-0.3 -3,-0.1 -3,-0.1 -0.984 44.9-126.2-161.8 152.3 48.0 50.5 21.1 45 46 A D > - 0 0 14 -2,-0.3 4,-1.3 238,-0.1 3,-0.2 -0.693 24.1-118.9-104.5 158.0 49.3 51.7 24.4 46 47 A E H > S+ 0 0 83 -2,-0.3 4,-1.3 1,-0.2 -1,-0.1 0.810 105.3 63.7 -62.2 -33.1 50.5 55.1 25.5 47 48 A D H 4 S+ 0 0 80 1,-0.2 3,-0.5 2,-0.2 4,-0.4 0.945 105.2 41.0 -62.5 -49.3 54.0 54.0 26.3 48 49 A I H >4 S+ 0 0 0 1,-0.2 3,-1.6 2,-0.2 4,-0.2 0.835 107.0 63.6 -68.9 -31.1 55.0 53.0 22.8 49 50 A L H >X S+ 0 0 0 -4,-1.3 3,-2.2 1,-0.3 4,-0.9 0.866 93.2 64.5 -59.1 -34.4 53.3 56.1 21.3 50 51 A K T 3< S+ 0 0 121 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.749 95.0 59.3 -60.7 -22.9 55.7 58.2 23.2 51 52 A S T <4 S+ 0 0 36 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.473 115.3 33.2 -86.1 -1.4 58.5 56.7 21.1 52 53 A I T <4 S+ 0 0 26 -3,-2.2 2,-0.3 -4,-0.2 -2,-0.2 0.331 118.6 52.5-129.7 3.4 56.9 58.1 17.9 53 54 A L < - 0 0 10 -4,-0.9 -1,-0.2 -3,-0.1 4,-0.1 -0.999 45.6-176.6-141.9 140.9 55.3 61.3 19.2 54 55 A N + 0 0 170 -2,-0.3 2,-0.1 -3,-0.1 -1,-0.1 0.445 65.6 86.9-112.1 -8.3 56.8 64.3 21.1 55 56 A I S S- 0 0 41 1,-0.1 2,-0.3 -45,-0.1 -2,-0.1 -0.397 89.1 -95.4 -86.2 167.9 53.6 66.2 21.5 56 57 A E + 0 0 181 -2,-0.1 -49,-0.4 2,-0.0 2,-0.3 -0.653 51.4 167.2 -87.7 144.2 51.2 65.6 24.4 57 58 A F - 0 0 43 -2,-0.3 2,-0.4 -51,-0.1 -51,-0.2 -0.954 26.9-145.8-149.9 171.0 48.2 63.3 23.9 58 59 A E E -A 5 0A 109 -53,-1.9 -53,-4.1 -2,-0.3 2,-0.4 -0.999 13.4-141.9-143.4 132.7 45.4 61.3 25.5 59 60 A L E +A 4 0A 36 -2,-0.4 2,-0.3 -55,-0.2 -55,-0.2 -0.823 38.9 160.2 -93.5 134.5 43.9 58.0 24.5 60 61 A V E -A 3 0A 37 -57,-2.4 -57,-2.9 -2,-0.4 2,-0.3 -0.949 40.4-107.6-151.0 169.8 40.1 58.0 25.1 61 62 A D E +A 2 0A 79 -2,-0.3 2,-0.2 -59,-0.2 -59,-0.2 -0.791 44.8 152.3-100.7 143.1 36.8 56.3 24.2 62 63 A K - 0 0 47 -61,-1.6 2,-0.1 -2,-0.3 -2,-0.1 -0.834 44.8-113.0-174.2 134.9 34.3 58.1 22.0 63 64 A E + 0 0 180 -2,-0.2 2,-0.3 0, 0.0 -2,-0.0 -0.432 42.5 170.1 -67.5 142.2 31.5 57.5 19.5 64 65 A L - 0 0 25 -2,-0.1 2,-0.1 -34,-0.0 -34,-0.1 -0.967 32.0-111.2-149.4 154.5 32.4 58.6 16.0 65 66 A E - 0 0 133 -2,-0.3 -36,-2.3 -36,-0.2 2,-0.2 -0.437 38.3-102.2 -86.1 166.8 30.8 58.1 12.6 66 67 A E 0 0 141 -38,-0.3 -38,-0.3 -2,-0.1 -39,-0.1 -0.494 360.0 360.0 -90.3 158.3 32.2 55.9 9.9 67 68 A K 0 0 139 -41,-0.2 -1,-0.1 -2,-0.2 -38,-0.1 -0.364 360.0 360.0 -69.6 360.0 34.1 56.9 6.7 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 74 A P 0 0 150 0, 0.0 53,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 174.6 25.5 43.7 3.8 70 75 A S - 0 0 35 1,-0.0 2,-0.1 2,-0.0 0, 0.0 -0.063 360.0-132.1-175.0 -76.0 29.1 43.0 5.1 71 76 A F S > S+ 0 0 9 52,-0.0 4,-3.4 50,-0.0 5,-0.4 -0.562 104.4 55.8 130.8 -62.2 30.1 40.0 7.2 72 77 A R H > S+ 0 0 114 2,-0.2 4,-1.5 3,-0.2 5,-0.1 0.845 109.4 54.0 -62.0 -36.2 32.0 41.6 10.0 73 78 A E H > S+ 0 0 112 2,-0.2 4,-0.7 3,-0.1 -1,-0.2 0.990 116.5 33.9 -60.1 -64.4 28.8 43.5 10.4 74 79 A I H >> S+ 0 0 23 1,-0.2 4,-2.1 2,-0.2 3,-1.3 0.929 117.6 49.6 -62.2 -53.9 26.6 40.3 10.7 75 80 A I H 3X S+ 0 0 4 -4,-3.4 4,-2.2 1,-0.3 5,-0.3 0.908 102.1 66.5 -55.3 -40.5 28.9 37.9 12.4 76 81 A S H 3< S+ 0 0 31 -4,-1.5 -1,-0.3 -5,-0.4 -2,-0.2 0.770 112.8 29.3 -52.0 -33.0 29.6 40.6 15.0 77 82 A K H X< S+ 0 0 151 -3,-1.3 3,-0.6 -4,-0.7 4,-0.3 0.899 119.5 50.5 -94.2 -53.2 26.1 40.5 16.3 78 83 A K H 3< S+ 0 0 121 -4,-2.1 3,-0.3 1,-0.2 -3,-0.2 0.911 127.9 22.7 -51.5 -52.3 25.0 36.9 15.7 79 84 A Y T 3X S+ 0 0 28 -4,-2.2 4,-3.1 -5,-0.3 3,-0.5 0.298 82.2 121.3-102.7 10.3 28.0 35.3 17.3 80 85 A R H <> + 0 0 96 -3,-0.6 4,-2.2 -5,-0.3 -1,-0.2 0.758 69.1 69.6 -43.0 -27.4 29.0 38.2 19.5 81 86 A K H 4 S+ 0 0 151 -3,-0.3 4,-0.3 -4,-0.3 -1,-0.2 0.992 114.8 19.4 -54.4 -69.9 28.5 35.6 22.3 82 87 A E H >4 S+ 0 0 51 -3,-0.5 3,-1.5 2,-0.2 6,-0.5 0.855 123.4 58.1 -71.2 -38.8 31.6 33.5 21.4 83 88 A I H >< S+ 0 0 16 -4,-3.1 3,-2.6 1,-0.3 -3,-0.2 0.973 100.6 59.7 -52.9 -52.4 33.3 36.2 19.4 84 89 A D T 3< S+ 0 0 117 -4,-2.2 -1,-0.3 -5,-0.4 -2,-0.2 0.692 112.6 40.0 -48.4 -22.1 33.2 38.3 22.5 85 90 A E T < S- 0 0 134 -3,-1.5 2,-0.9 -4,-0.3 -1,-0.3 0.054 121.1 -94.6-122.4 27.9 35.2 35.5 24.2 86 91 A G S < S+ 0 0 45 -3,-2.6 18,-0.3 2,-0.4 -4,-0.1 -0.618 93.2 106.9 104.2 -77.3 37.7 34.4 21.6 87 92 A L S S+ 0 0 20 -2,-0.9 17,-1.5 16,-0.1 2,-0.4 0.546 92.4 29.9 -5.7 -49.3 36.3 31.4 19.7 88 93 A I B S-E 103 0C 5 -6,-0.5 -2,-0.4 15,-0.2 2,-0.3 -0.962 72.8-157.5-126.9 143.6 35.7 33.7 16.7 89 94 A S - 0 0 41 13,-1.8 13,-0.4 -2,-0.4 -6,-0.1 -0.874 18.6-141.6-116.4 151.3 37.7 36.7 15.6 90 95 A L S S+ 0 0 62 -2,-0.3 2,-0.3 -7,-0.1 -1,-0.1 0.641 80.3 91.6 -85.3 -13.7 36.4 39.5 13.4 91 96 A S + 0 0 62 11,-0.1 11,-0.4 -19,-0.0 2,-0.3 -0.634 51.0 162.1 -86.3 136.4 39.8 39.6 11.7 92 97 A Y - 0 0 54 -2,-0.3 2,-0.3 9,-0.1 9,-0.2 -0.952 28.2-125.6-145.6 163.4 40.5 37.6 8.6 93 98 A D E -F 100 0D 20 7,-1.9 7,-2.7 -2,-0.3 2,-0.5 -0.872 5.7-155.1-115.6 148.7 43.0 37.5 5.7 94 99 A V E -F 99 0D 56 -2,-0.3 2,-0.7 5,-0.2 5,-0.2 -0.968 12.1-176.2-122.0 109.8 42.5 37.4 2.0 95 100 A V E > -F 98 0D 2 3,-1.9 3,-2.7 -2,-0.5 2,-0.1 -0.949 61.8 -63.6-107.0 114.7 45.4 35.9 0.1 96 101 A G T 3 S- 0 0 29 -2,-0.7 55,-0.2 1,-0.3 63,-0.0 -0.220 122.9 -5.4 50.3-108.9 44.8 36.2 -3.6 97 102 A D T 3 S+ 0 0 45 -2,-0.1 29,-2.5 28,-0.1 30,-1.0 0.506 121.0 77.4 -93.0 -14.0 41.6 34.2 -4.2 98 103 A L E < -Fg 95 127D 0 -3,-2.7 -3,-1.9 27,-0.2 2,-0.4 -0.747 60.9-146.3-110.8 155.1 41.1 32.6 -0.8 99 104 A V E -Fg 94 128D 0 28,-2.2 30,-2.2 -2,-0.3 2,-0.5 -0.910 8.7-161.8-114.7 139.9 39.8 33.8 2.5 100 105 A I E -Fg 93 129D 3 -7,-2.7 -7,-1.9 -2,-0.4 30,-0.3 -0.927 9.6-159.7-126.9 107.6 41.1 32.6 5.9 101 106 A L E - 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