==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 06-APR-10 3MGJ . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN MJ1480; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR S.VOROBIEV,H.NEELY,J.SEETHARAMAN,D.LEE,D.PATEL,C.CICCOSANTI, . 183 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10629.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 126 68.9 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 . 53 29.0 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 . 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 . 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 . 12 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 48 26.2 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+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 2 0 0 0 0 0 2 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 0 1 1 2 0 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 . 0 0 1 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 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 X 0 0 65 0, 0.0 91,-2.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 121.9 24.0 45.7 18.5 2 2 A F E -AB 55 91A 17 53,-1.6 53,-1.9 89,-0.2 2,-0.4 -0.767 360.0-168.0-111.3 154.4 25.1 47.6 21.6 3 3 A X E +A 54 0A 35 87,-1.2 2,-0.3 -2,-0.3 51,-0.2 -0.993 9.0 171.7-137.4 134.8 23.3 48.7 24.8 4 4 A R E -A 53 0A 46 49,-1.5 49,-2.7 -2,-0.4 2,-0.4 -0.971 26.1-131.5-131.5 156.1 24.1 51.0 27.6 5 5 A E E -AC 52 83A 41 78,-0.8 78,-3.0 -2,-0.3 2,-0.3 -0.860 23.9-175.4-106.9 134.5 21.8 52.1 30.4 6 6 A I E -AC 51 82A 0 45,-3.1 45,-2.1 -2,-0.4 2,-0.4 -0.798 11.7-146.1-121.0 169.3 21.5 55.8 31.5 7 7 A E E -AC 50 81A 36 74,-2.6 74,-1.7 -2,-0.3 2,-0.3 -0.995 0.4-155.6-138.3 130.1 19.7 57.6 34.2 8 8 A L E -AC 49 80A 1 41,-2.4 41,-2.0 -2,-0.4 2,-0.4 -0.803 18.2-168.1 -95.3 150.3 18.1 61.0 34.3 9 9 A R E +AC 48 79A 117 70,-1.8 70,-1.8 -2,-0.3 2,-0.5 -0.998 42.5 26.4-142.1 139.7 17.7 62.7 37.6 10 10 A G E S+AC 47 78A 7 37,-2.3 37,-3.2 -2,-0.4 2,-0.8 -0.948 110.0 7.6 124.8-123.1 15.8 65.7 38.8 11 11 A H + 0 0 69 66,-0.9 6,-0.2 -2,-0.5 67,-0.1 -0.535 63.0 156.0-103.4 66.6 12.6 67.2 37.4 12 12 A I > + 0 0 0 -2,-0.8 3,-0.8 2,-0.1 6,-0.5 0.881 59.5 65.3 -57.1 -44.0 11.7 64.7 34.8 13 13 A I T 3 S+ 0 0 21 1,-0.2 99,-0.2 -3,-0.2 98,-0.1 -0.691 102.9 26.1 -91.9 136.2 8.0 65.7 34.8 14 14 A D T 3 S+ 0 0 73 97,-2.7 2,-0.2 1,-0.5 -1,-0.2 0.448 107.2 102.4 84.6 8.2 6.9 69.2 33.6 15 15 A S S < S- 0 0 22 -3,-0.8 -1,-0.5 96,-0.3 3,-0.1 -0.654 73.7-141.6-103.1 167.5 10.1 69.1 31.5 16 16 A L S > S+ 0 0 78 -2,-0.2 4,-1.8 -3,-0.1 5,-0.2 0.249 76.5 108.9-101.1 6.2 10.4 68.4 27.8 17 17 A I H > S+ 0 0 1 1,-0.2 4,-3.1 -6,-0.2 5,-0.2 0.859 72.8 49.8 -50.5 -46.8 13.5 66.5 28.7 18 18 A L H > S+ 0 0 3 -6,-0.5 4,-2.8 1,-0.2 5,-0.2 0.940 111.2 45.4 -62.8 -51.5 12.1 63.0 28.0 19 19 A P H > S+ 0 0 33 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.784 115.0 52.1 -64.0 -25.0 10.7 63.7 24.6 20 20 A K H X S+ 0 0 103 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.950 109.5 46.0 -74.7 -51.8 13.9 65.4 23.8 21 21 A V H X S+ 0 0 2 -4,-3.1 4,-2.4 1,-0.2 5,-0.2 0.952 116.2 47.1 -50.9 -52.5 16.1 62.5 24.9 22 22 A F H X S+ 0 0 4 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.902 111.5 50.9 -55.8 -46.5 13.8 60.1 22.9 23 23 A D H X S+ 0 0 80 -4,-1.8 4,-3.2 -5,-0.2 -1,-0.2 0.897 110.2 49.1 -60.5 -41.8 13.9 62.3 19.9 24 24 A K H X S+ 0 0 81 -4,-2.5 4,-2.2 2,-0.2 6,-0.2 0.964 111.2 48.1 -67.5 -53.2 17.6 62.6 19.9 25 25 A I H <>S+ 0 0 0 -4,-2.4 5,-2.5 2,-0.2 4,-0.4 0.950 116.0 45.0 -45.4 -57.1 18.1 58.8 20.2 26 26 A L H ><5S+ 0 0 74 -4,-2.7 3,-2.5 1,-0.2 -2,-0.2 0.962 109.8 54.3 -57.7 -55.5 15.6 58.2 17.4 27 27 A D H 3<5S+ 0 0 130 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.869 109.2 50.0 -39.4 -45.1 17.0 60.9 15.1 28 28 A X T 3<5S- 0 0 41 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.457 124.9-100.9 -85.1 2.5 20.5 59.2 15.5 29 29 A G T < 5S+ 0 0 57 -3,-2.5 -3,-0.2 -4,-0.4 2,-0.1 0.590 82.8 116.8 94.0 10.6 19.2 55.8 14.6 30 30 A G < - 0 0 8 -5,-2.5 2,-0.3 -6,-0.2 -1,-0.3 -0.449 51.3-139.6 -96.9 176.5 18.9 54.2 18.0 31 31 A D E -D 54 0A 93 23,-2.2 23,-3.1 -2,-0.1 2,-0.3 -0.929 14.6-159.1-128.7 161.9 16.0 53.0 20.0 32 32 A Y E -D 53 0A 21 -2,-0.3 2,-0.3 21,-0.2 21,-0.2 -0.909 8.6-161.8-134.5 163.4 15.3 53.3 23.7 33 33 A K E -D 52 0A 133 19,-1.7 19,-2.8 -2,-0.3 2,-0.5 -0.944 23.2-129.6-146.7 125.1 13.3 51.6 26.4 34 34 A V E +D 51 0A 38 -2,-0.3 17,-0.3 17,-0.2 3,-0.1 -0.655 28.1 177.9 -74.9 122.1 12.3 53.1 29.7 35 35 A L E + 0 0 79 15,-3.0 2,-0.3 -2,-0.5 16,-0.2 0.877 59.7 6.7 -94.3 -48.7 13.3 50.6 32.3 36 36 A E E -D 50 0A 86 14,-1.2 14,-1.8 2,-0.0 2,-0.3 -0.944 52.0-170.9-135.1 157.1 12.4 52.3 35.6 37 37 A F E -D 49 0A 25 -2,-0.3 2,-0.5 12,-0.2 12,-0.2 -0.866 8.8-176.9-150.4 118.8 10.7 55.4 36.8 38 38 A E E -D 48 0A 98 10,-2.7 10,-2.4 -2,-0.3 2,-0.3 -0.964 11.2-152.6-122.5 123.6 10.7 56.6 40.4 39 39 A I - 0 0 41 -2,-0.5 8,-0.2 8,-0.2 93,-0.1 -0.706 22.3-116.7 -91.6 144.2 8.9 59.7 41.8 40 40 A G - 0 0 15 -2,-0.3 7,-0.1 5,-0.3 -1,-0.1 -0.299 27.1-108.3 -74.8 160.8 10.1 61.6 44.8 41 41 A K S S+ 0 0 123 5,-0.1 2,-0.3 1,-0.1 89,-0.2 0.809 105.3 20.6 -64.8 -31.8 8.1 61.9 48.0 42 42 A R S > S- 0 0 58 4,-0.1 3,-3.7 0, 0.0 -1,-0.1 -0.982 87.8-111.6-134.9 148.2 7.3 65.6 47.4 43 43 A K T 3 S+ 0 0 101 -2,-0.3 4,-0.1 1,-0.3 -2,-0.1 0.559 116.9 65.4 -56.6 -8.0 7.4 67.4 44.1 44 44 A T T 3 S+ 0 0 106 2,-0.1 -1,-0.3 -33,-0.0 -3,-0.0 0.597 91.7 78.2 -90.8 -16.0 10.4 69.3 45.5 45 45 A D S < S- 0 0 65 -3,-3.7 -5,-0.3 1,-0.1 2,-0.3 -0.494 92.1 -98.1 -87.2 165.1 12.4 66.1 45.6 46 46 A P - 0 0 54 0, 0.0 2,-0.2 0, 0.0 -35,-0.2 -0.592 27.3-154.3 -87.9 143.3 14.0 64.6 42.5 47 47 A S E -A 10 0A 12 -37,-3.2 -37,-2.3 -2,-0.3 2,-0.3 -0.577 13.0-149.5 -97.9 172.0 12.5 61.8 40.4 48 48 A Y E -AD 9 38A 66 -10,-2.4 -10,-2.7 -39,-0.2 2,-0.4 -0.999 9.8-163.6-143.8 150.3 14.6 59.5 38.3 49 49 A A E -AD 8 37A 1 -41,-2.0 -41,-2.4 -2,-0.3 2,-0.5 -0.997 8.5-153.1-128.0 134.7 14.3 57.5 35.1 50 50 A K E -AD 7 36A 37 -14,-1.8 -15,-3.0 -2,-0.4 -14,-1.2 -0.946 19.9-177.7-103.4 127.9 16.4 54.6 33.8 51 51 A I E -AD 6 34A 0 -45,-2.1 -45,-3.1 -2,-0.5 2,-0.4 -0.989 20.2-142.0-128.7 131.0 16.5 54.4 30.0 52 52 A L E -AD 5 33A 30 -19,-2.8 -19,-1.7 -2,-0.4 2,-0.4 -0.806 17.4-154.3 -89.2 130.5 18.2 51.7 28.0 53 53 A V E -AD 4 32A 0 -49,-2.7 -49,-1.5 -2,-0.4 2,-0.4 -0.909 9.2-166.1-110.6 133.3 19.8 53.1 24.8 54 54 A I E +AD 3 31A 36 -23,-3.1 -23,-2.2 -2,-0.4 2,-0.2 -0.971 13.9 160.4-128.4 127.1 20.3 50.8 21.8 55 55 A G E -A 2 0A 6 -53,-1.9 -53,-1.6 -2,-0.4 -25,-0.1 -0.762 53.0 -94.5-132.9-178.0 22.4 51.4 18.7 56 56 A R S S- 0 0 146 -2,-0.2 2,-0.3 -55,-0.2 3,-0.1 0.746 101.3 -10.8 -72.7 -25.3 24.0 49.4 15.9 57 57 A D S > S- 0 0 69 -56,-0.2 4,-2.6 -55,-0.1 5,-0.3 -0.982 74.0 -94.9-166.7 168.0 27.3 49.2 17.7 58 58 A E H > S+ 0 0 93 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.921 117.2 56.8 -62.2 -44.9 29.3 50.6 20.7 59 59 A R H > S+ 0 0 209 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.957 114.2 39.8 -44.5 -57.8 31.0 53.3 18.7 60 60 A H H > S+ 0 0 12 1,-0.2 4,-1.8 2,-0.2 3,-0.3 0.890 112.6 52.7 -66.5 -45.0 27.7 54.7 17.6 61 61 A V H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 -1,-0.2 0.872 106.5 56.7 -57.2 -35.8 25.8 54.3 20.9 62 62 A D H X S+ 0 0 44 -4,-2.6 4,-1.9 -5,-0.3 -1,-0.2 0.854 103.4 53.9 -64.2 -34.9 28.7 56.1 22.5 63 63 A E H X S+ 0 0 111 -4,-1.3 4,-1.8 -3,-0.3 -1,-0.2 0.908 110.9 45.8 -61.0 -44.4 28.0 59.0 20.1 64 64 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 5,-0.3 0.967 109.9 52.5 -66.5 -53.6 24.4 59.0 21.3 65 65 A L H X S+ 0 0 0 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.846 107.8 53.2 -50.0 -37.9 25.3 58.8 24.9 66 66 A N H X S+ 0 0 62 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.901 108.4 48.4 -68.9 -41.2 27.6 61.8 24.5 67 67 A E H X S+ 0 0 84 -4,-1.8 4,-1.6 -3,-0.3 -2,-0.2 0.887 113.3 48.6 -55.8 -43.1 24.9 63.9 22.9 68 68 A L H X S+ 0 0 2 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.807 107.8 55.6 -69.2 -30.7 22.6 62.9 25.8 69 69 A R H X S+ 0 0 114 -4,-1.8 4,-1.1 -5,-0.3 -1,-0.2 0.844 107.9 48.0 -69.7 -32.8 25.4 63.8 28.2 70 70 A D H X S+ 0 0 84 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.797 106.3 57.9 -78.5 -31.3 25.6 67.3 26.7 71 71 A L H X S+ 0 0 38 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.895 107.4 47.0 -58.5 -45.8 21.8 67.7 26.9 72 72 A G H < S+ 0 0 9 -4,-1.5 6,-0.2 1,-0.2 -2,-0.2 0.804 108.7 55.1 -71.4 -29.9 21.9 67.0 30.7 73 73 A A H < S+ 0 0 84 -4,-1.1 -1,-0.2 -5,-0.1 -2,-0.2 0.830 110.8 45.6 -72.2 -33.4 24.8 69.5 31.1 74 74 A E H < S+ 0 0 158 -4,-1.5 -2,-0.2 -5,-0.1 -3,-0.1 0.986 99.9 71.3 -71.5 -62.0 22.8 72.2 29.4 75 75 A I >< - 0 0 28 -4,-2.3 3,-0.7 1,-0.2 -1,-0.1 -0.404 68.0-161.4 -62.6 118.4 19.4 71.7 31.3 76 76 A P T 3 S+ 0 0 119 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.745 82.5 62.4 -73.3 -30.1 20.0 72.9 34.9 77 77 A E T 3 S+ 0 0 117 -66,-0.1 -66,-0.9 -67,-0.1 2,-0.4 0.673 107.8 45.4 -74.1 -12.8 17.0 71.1 36.4 78 78 A I E < -C 10 0A 4 -3,-0.7 2,-0.4 -6,-0.2 -68,-0.2 -0.956 59.2-157.0-135.8 147.1 18.4 67.7 35.5 79 79 A E E -C 9 0A 109 -70,-1.8 -70,-1.8 -2,-0.4 2,-0.3 -0.965 13.3-154.0-116.9 142.6 21.6 65.6 35.5 80 80 A E E +C 8 0A 23 -2,-0.4 2,-0.3 -11,-0.2 -72,-0.2 -0.853 17.7 171.9-108.9 143.6 22.3 62.7 33.2 81 81 A V E -C 7 0A 68 -74,-1.7 -74,-2.6 -2,-0.3 2,-0.3 -0.986 28.0-117.3-147.0 159.6 24.6 59.8 34.1 82 82 A E E -C 6 0A 84 -2,-0.3 2,-0.5 -76,-0.2 -76,-0.2 -0.662 21.4-141.6 -95.0 152.8 25.6 56.4 32.7 83 83 A L E -C 5 0A 39 -78,-3.0 -78,-0.8 -2,-0.3 -2,-0.0 -0.965 10.2-134.9-114.6 129.9 25.1 53.1 34.4 84 84 A Q - 0 0 184 -2,-0.5 2,-0.1 -80,-0.1 4,-0.1 -0.703 27.5-126.7 -76.3 128.0 27.6 50.3 34.3 85 85 A P - 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