==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 02-OCT-02 1MXI . COMPND 2 MOLECULE: HYPOTHETICAL TRNA/RRNA METHYLTRANSFERASE HI0766; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR K.LIM,H.ZHANG,A.TEMPCZYK,N.BONANDER,J.TOEDT,A.HOWARD, . 157 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8800.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 95 60.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 15.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 8 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 22.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 0 0 0 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 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 0 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 42 0, 0.0 93,-0.4 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 -27.9 -12.6 -16.0 15.2 2 2 A L - 0 0 0 91,-0.1 26,-2.3 92,-0.1 2,-0.4 -0.625 360.0-103.3-118.5-179.7 -9.5 -17.6 13.9 3 3 A D E -ab 28 96A 8 92,-1.7 94,-2.6 -2,-0.2 2,-0.4 -0.910 25.2-156.6-110.2 135.7 -5.7 -16.9 14.2 4 4 A I E -ab 29 97A 0 24,-3.3 26,-2.8 -2,-0.4 2,-0.4 -0.920 9.0-161.9-112.3 135.8 -3.7 -15.4 11.3 5 5 A V E -ab 30 98A 0 92,-3.0 94,-2.6 -2,-0.4 2,-0.6 -0.974 6.9-160.0-125.4 124.0 0.1 -16.0 11.2 6 6 A L E -ab 31 99A 2 24,-2.5 26,-3.0 -2,-0.4 2,-0.7 -0.942 14.1-146.7-105.2 118.2 2.5 -13.9 9.1 7 7 A Y E S-a 32 0A 29 92,-2.8 26,-0.1 -2,-0.6 98,-0.1 -0.773 73.5 -32.1 -85.9 112.8 5.8 -15.7 8.6 8 8 A E S S- 0 0 35 24,-1.6 -1,-0.2 -2,-0.7 25,-0.1 0.841 80.0-159.4 44.5 51.1 8.6 -13.2 8.5 9 9 A P - 0 0 1 0, 0.0 27,-2.4 0, 0.0 28,-0.3 -0.289 9.3-169.1 -59.4 145.1 6.6 -10.4 7.0 10 10 A E + 0 0 48 25,-0.2 -2,-0.1 1,-0.2 25,-0.0 0.853 57.5 62.0-105.7 -42.0 8.8 -7.7 5.3 11 11 A I >> - 0 0 75 1,-0.1 4,-1.5 26,-0.0 3,-0.8 -0.824 62.4-149.8 -99.8 117.6 6.9 -4.6 4.3 12 12 A P H 3> S+ 0 0 9 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.821 93.1 60.9 -51.3 -39.2 5.3 -2.5 7.1 13 13 A Q H 3> S+ 0 0 116 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.879 105.0 48.7 -59.8 -42.4 2.4 -1.2 4.9 14 14 A N H <> S+ 0 0 11 -3,-0.8 4,-2.2 1,-0.2 -1,-0.2 0.931 112.3 47.3 -63.9 -43.4 1.1 -4.7 4.3 15 15 A T H X S+ 0 0 0 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.866 109.0 56.2 -65.9 -33.5 1.2 -5.6 7.9 16 16 A G H X S+ 0 0 3 -4,-2.5 4,-1.8 27,-0.3 -1,-0.2 0.895 108.2 46.7 -64.3 -43.3 -0.5 -2.3 8.7 17 17 A N H X S+ 0 0 80 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.882 112.3 52.5 -65.4 -36.9 -3.4 -3.2 6.4 18 18 A I H X S+ 0 0 0 -4,-2.2 4,-3.1 2,-0.2 -2,-0.2 0.888 106.3 51.3 -69.3 -34.4 -3.4 -6.7 8.1 19 19 A I H X S+ 0 0 3 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.926 111.4 48.0 -65.8 -40.7 -3.6 -5.3 11.6 20 20 A R H X S+ 0 0 105 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.907 112.5 51.4 -64.6 -40.7 -6.6 -3.1 10.5 21 21 A L H X S+ 0 0 17 -4,-2.4 4,-0.9 2,-0.2 6,-0.3 0.947 109.6 47.3 -61.1 -50.7 -8.1 -6.2 8.9 22 22 A C H >X>S+ 0 0 3 -4,-3.1 4,-1.9 1,-0.2 5,-0.9 0.919 112.9 49.3 -62.1 -37.5 -7.8 -8.3 12.0 23 23 A A H 3<5S+ 0 0 50 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.911 110.7 51.1 -67.8 -35.2 -9.3 -5.6 14.2 24 24 A N H 3<5S+ 0 0 100 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.598 121.4 33.2 -73.9 -13.9 -12.2 -5.2 11.7 25 25 A T H <<5S- 0 0 7 -4,-0.9 -2,-0.2 -3,-0.8 -1,-0.2 0.510 102.8-118.0-119.6 -12.3 -12.9 -8.9 11.8 26 26 A G T <5 + 0 0 39 -4,-1.9 2,-0.2 1,-0.3 -3,-0.2 0.593 65.2 142.2 82.2 8.9 -12.0 -10.1 15.3 27 27 A F < - 0 0 0 -5,-0.9 2,-0.4 -6,-0.3 -1,-0.3 -0.605 50.5-123.5 -83.3 151.1 -9.3 -12.4 14.0 28 28 A R E -a 3 0A 89 -26,-2.3 -24,-3.3 -2,-0.2 2,-0.4 -0.783 21.4-140.6 -97.1 140.3 -6.1 -12.6 16.1 29 29 A L E -a 4 0A 2 27,-0.4 29,-2.5 -2,-0.4 2,-0.4 -0.821 15.7-174.0-108.5 135.0 -2.7 -11.8 14.5 30 30 A H E -ac 5 58A 3 -26,-2.8 -24,-2.5 -2,-0.4 2,-0.4 -0.965 7.3-160.6-120.2 138.9 0.6 -13.6 15.1 31 31 A L E -ac 6 59A 0 27,-2.9 29,-3.1 -2,-0.4 2,-0.6 -0.978 7.1-150.2-120.0 132.2 3.9 -12.4 13.6 32 32 A I E -ac 7 60A 0 -26,-3.0 -24,-1.6 -2,-0.4 29,-0.2 -0.886 37.4 -95.0-105.9 121.5 6.9 -14.7 13.3 33 33 A E S S+ 0 0 45 27,-3.5 30,-0.1 -2,-0.6 2,-0.1 -0.327 93.5 63.6 -74.7 160.1 10.3 -13.0 13.6 34 34 A P S S- 0 0 85 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.424 70.2-171.0 -76.5 141.1 12.5 -11.7 12.1 35 35 A L - 0 0 32 2,-0.2 -25,-0.2 -2,-0.1 -2,-0.1 -0.604 31.3-123.4 -93.0 165.5 10.3 -9.0 10.6 36 36 A G S S+ 0 0 52 -27,-2.4 2,-0.3 -2,-0.2 -26,-0.2 0.433 91.6 42.5 -86.8 1.6 11.4 -6.6 7.9 37 37 A F S S- 0 0 19 -28,-0.3 -2,-0.2 -26,-0.1 2,-0.2 -0.943 91.6 -94.1-143.7 161.4 10.7 -3.6 10.1 38 38 A T > - 0 0 81 -2,-0.3 3,-1.9 1,-0.2 -2,-0.1 -0.523 30.7-131.0 -73.3 146.3 11.0 -2.3 13.7 39 39 A W T 3 S+ 0 0 62 1,-0.3 -1,-0.2 -2,-0.2 5,-0.0 0.812 115.4 53.5 -66.9 -26.7 7.9 -3.0 15.7 40 40 A D T 3 S+ 0 0 101 4,-0.0 -1,-0.3 3,-0.0 2,-0.1 0.127 87.0 139.2 -90.7 18.9 8.2 0.6 16.7 41 41 A D X> - 0 0 8 -3,-1.9 3,-1.0 1,-0.1 4,-0.6 -0.408 58.2-134.1 -70.7 140.2 8.3 1.5 13.0 42 42 A K H >>>S+ 0 0 125 1,-0.3 4,-1.9 2,-0.2 3,-1.6 0.864 96.3 77.7 -59.2 -39.8 6.5 4.6 11.7 43 43 A R H 345S+ 0 0 149 1,-0.3 -1,-0.3 2,-0.2 -27,-0.3 0.287 103.6 36.7 -59.1 12.8 5.0 2.7 8.8 44 44 A L H <45S+ 0 0 0 -3,-1.0 5,-0.3 -2,-0.3 -1,-0.3 0.392 126.1 38.4-134.3 -19.7 2.4 1.1 11.2 45 45 A R H X<5S+ 0 0 102 -3,-1.6 3,-1.4 -4,-0.6 4,-0.3 0.885 119.5 37.8 -99.1 -59.4 1.9 4.2 13.4 46 46 A R T 3<5S+ 0 0 224 -4,-1.9 -3,-0.2 1,-0.3 -4,-0.1 0.674 101.3 89.4 -66.1 -15.0 1.9 7.4 11.3 47 47 A S T 3 - 0 0 86 -2,-0.2 3,-2.0 1,-0.1 4,-0.3 -0.816 15.6-128.9 -97.1 135.4 -5.0 3.2 16.2 51 51 A Y G > S+ 0 0 147 -2,-0.4 3,-1.1 1,-0.3 -1,-0.1 0.717 108.4 63.1 -59.4 -20.2 -2.9 1.9 19.1 52 52 A H G 3 S+ 0 0 162 1,-0.3 -1,-0.3 3,-0.1 4,-0.1 0.750 89.9 67.7 -75.9 -22.5 -5.9 -0.2 20.3 53 53 A E G < S+ 0 0 31 -3,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.584 103.5 55.8 -71.7 -8.7 -5.6 -2.1 17.0 54 54 A F S < S+ 0 0 26 -3,-1.1 2,-0.2 -4,-0.3 -3,-0.0 -0.240 78.3 59.0-104.5-162.8 -2.3 -3.4 18.4 55 55 A A S S+ 0 0 98 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.1 0.239 91.0 78.3 63.3 -16.3 -1.4 -5.3 21.6 56 56 A E S S+ 0 0 102 -2,-0.2 -27,-0.4 -4,-0.1 2,-0.4 0.321 78.9 99.8 -95.9 4.2 -3.7 -8.2 20.7 57 57 A I - 0 0 23 -29,-0.1 2,-0.5 -27,-0.0 -27,-0.2 -0.742 65.3-151.1 -93.0 133.2 -0.9 -9.1 18.3 58 58 A K E -c 30 0A 102 -29,-2.5 -27,-2.9 -2,-0.4 2,-0.4 -0.909 3.7-156.3-108.3 133.4 1.5 -11.8 19.4 59 59 A R E -c 31 0A 117 -2,-0.5 2,-0.4 -29,-0.2 -27,-0.2 -0.893 6.8-162.0-106.4 136.1 5.1 -11.8 18.2 60 60 A H E -c 32 0A 13 -29,-3.1 -27,-3.5 -2,-0.4 3,-0.1 -0.964 16.5-145.4-118.5 132.5 7.0 -15.1 18.1 61 61 A K S S+ 0 0 161 -2,-0.4 2,-0.3 -29,-0.2 -1,-0.1 0.840 82.5 3.2 -65.0 -32.5 10.9 -15.3 17.9 62 62 A T S > S- 0 0 71 1,-0.1 4,-1.9 -30,-0.0 -1,-0.1 -0.952 72.6-109.5-147.8 165.6 10.9 -18.4 15.7 63 63 A F H > S+ 0 0 22 -2,-0.3 4,-2.4 2,-0.2 5,-0.2 0.886 119.2 54.2 -63.1 -41.6 8.5 -20.7 14.0 64 64 A E H > S+ 0 0 96 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.921 106.8 50.6 -59.4 -43.9 9.3 -23.5 16.5 65 65 A A H > S+ 0 0 37 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.890 108.7 53.3 -60.8 -41.0 8.5 -21.1 19.4 66 66 A F H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 5,-0.5 0.934 110.1 46.0 -60.8 -48.1 5.2 -20.4 17.7 67 67 A L H X S+ 0 0 45 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.912 114.2 48.7 -62.3 -42.1 4.2 -24.1 17.4 68 68 A E H < S+ 0 0 128 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.841 118.2 38.3 -68.7 -35.5 5.2 -24.8 21.0 69 69 A S H < S+ 0 0 75 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.860 127.0 33.0 -86.6 -33.1 3.3 -21.9 22.5 70 70 A E H < S- 0 0 27 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.782 76.7-163.4 -92.5 -27.7 0.2 -22.0 20.3 71 71 A K < - 0 0 155 -4,-2.0 -4,-0.1 -5,-0.5 -3,-0.1 0.936 24.0-143.7 43.2 58.9 -0.2 -25.7 19.6 72 72 A P - 0 0 26 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 -0.236 10.8-142.5 -55.8 134.8 -2.5 -25.0 16.7 73 73 A K S S+ 0 0 159 21,-0.8 2,-0.4 1,-0.3 22,-0.2 0.931 91.3 1.3 -59.9 -44.7 -5.3 -27.6 16.3 74 74 A R E S-d 95 0A 56 20,-1.0 22,-2.2 18,-0.1 2,-0.5 -0.987 71.7-157.6-142.8 136.5 -4.9 -27.3 12.6 75 75 A L E -d 96 0A 20 -2,-0.4 2,-0.3 20,-0.2 22,-0.2 -0.977 8.0-165.8-119.4 124.3 -2.4 -25.1 10.7 76 76 A F E -d 97 0A 2 20,-3.1 22,-3.0 -2,-0.5 2,-0.5 -0.848 7.1-151.7-107.1 145.1 -3.1 -24.1 7.1 77 77 A A E -de 98 119A 0 41,-2.6 43,-2.1 -2,-0.3 2,-0.7 -0.986 9.6-143.5-118.3 123.0 -0.4 -22.6 4.8 78 78 A L E + e 0 120A 0 20,-3.0 22,-0.5 -2,-0.5 28,-0.4 -0.766 39.3 152.4 -83.7 118.3 -1.6 -20.2 2.1 79 79 A T > - 0 0 9 41,-2.4 3,-2.4 -2,-0.7 -2,-0.1 -0.993 57.3-130.9-148.9 138.3 0.7 -20.9 -0.9 80 80 A T T 3 S+ 0 0 64 -2,-0.3 41,-0.1 1,-0.3 44,-0.1 0.674 111.7 66.2 -62.2 -9.7 0.3 -20.6 -4.6 81 81 A K T 3 S+ 0 0 137 39,-0.1 -1,-0.3 -3,-0.0 40,-0.1 0.483 80.0 110.2 -86.2 -3.1 1.7 -24.2 -4.5 82 82 A G < - 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