==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 16-JAN-05 1YK3 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN RV1347C/MT1389; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR G.L.CARD,N.A.PETERSON,C.A.SMITH,B.RUPP,B.M.SCHICK,E.N.BAKER, . 1586 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 74231.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1061 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 331 20.9 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 . 16 1.0 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 0.1 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 . 123 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 196 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 355 22.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 22 1.4 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 11 4 1 6 8 7 1 0 3 5 0 2 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 8 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 . 20 0 0 8 13 3 8 8 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 0 0 8 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 10 A A 0 0 52 0, 0.0 2,-1.8 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 19.9 -8.9 41.6 41.2 2 11 A D - 0 0 89 1,-0.2 855,-0.0 0, 0.0 0, 0.0 -0.337 360.0 -56.7 -59.2 83.9 -7.3 44.4 39.3 3 12 A D S S- 0 0 62 -2,-1.8 -1,-0.2 1,-0.1 3,-0.1 0.902 74.5-151.9 38.4 70.8 -6.5 42.5 36.1 4 13 A A - 0 0 13 -3,-0.5 2,-0.5 1,-0.1 -1,-0.1 -0.253 27.9 -88.6 -64.9 155.9 -4.4 39.7 37.7 5 14 A L - 0 0 66 795,-0.2 795,-3.1 69,-0.1 2,-0.2 -0.546 47.1-154.3 -72.0 117.6 -1.7 38.0 35.5 6 15 A V B -A 799 0A 8 -2,-0.5 2,-0.5 65,-0.3 793,-0.3 -0.510 15.1-114.6 -91.3 163.4 -3.2 35.1 33.7 7 16 A R - 0 0 80 791,-2.9 2,-0.5 -2,-0.2 791,-0.2 -0.848 23.3-126.9-100.9 125.4 -1.4 32.0 32.4 8 17 A L > - 0 0 14 -2,-0.5 3,-1.4 1,-0.2 791,-0.0 -0.591 16.0-142.0 -71.9 120.3 -1.2 31.5 28.7 9 18 A A T 3 S+ 0 0 93 -2,-0.5 -1,-0.2 1,-0.3 176,-0.1 0.842 97.2 46.3 -49.8 -42.3 -2.4 27.9 28.0 10 19 A R T 3 S+ 0 0 33 2,-0.1 96,-1.3 95,-0.0 -1,-0.3 0.535 83.9 115.0 -83.9 -7.1 0.2 27.2 25.3 11 20 A E B < -B 105 0B 31 -3,-1.4 2,-0.4 94,-0.2 94,-0.2 -0.449 53.3-149.9 -71.3 132.6 3.2 28.6 27.1 12 21 A R + 0 0 56 92,-3.0 3,-0.1 -2,-0.2 -2,-0.1 -0.846 17.7 178.0-102.6 135.3 5.9 26.0 28.0 13 22 A F + 0 0 25 -2,-0.4 2,-2.1 1,-0.1 -1,-0.1 0.557 60.9 88.1-112.5 -13.8 8.1 26.5 31.1 14 23 A D + 0 0 63 793,-0.1 -1,-0.1 799,-0.0 793,-0.1 -0.480 68.6 159.4 -85.2 68.6 10.4 23.4 31.2 15 24 A L - 0 0 14 -2,-2.1 89,-0.1 -3,-0.1 -2,-0.0 -0.663 44.2-116.8-100.4 147.9 12.9 25.2 28.9 16 25 A P > - 0 0 84 0, 0.0 4,-3.0 0, 0.0 5,-0.3 -0.340 37.8-106.3 -71.2 160.7 16.6 24.6 28.3 17 26 A D H > S+ 0 0 122 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.896 120.0 54.5 -57.5 -43.0 18.9 27.5 29.3 18 27 A Q H 4 S+ 0 0 86 2,-0.2 -1,-0.2 1,-0.2 4,-0.1 0.914 115.6 39.1 -58.0 -42.9 19.5 28.6 25.7 19 28 A V H >4 S+ 0 0 5 1,-0.2 3,-2.6 2,-0.2 -2,-0.2 0.953 112.3 52.7 -72.7 -52.8 15.8 28.9 25.1 20 29 A R H 3< S+ 0 0 51 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.844 103.8 61.7 -52.5 -33.0 14.7 30.4 28.4 21 30 A R T 3< S+ 0 0 157 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.562 79.1 115.0 -71.6 -9.7 17.4 33.0 27.9 22 31 A L < - 0 0 16 -3,-2.6 2,-0.1 -4,-0.1 79,-0.1 -0.414 61.8-137.0 -67.4 132.6 15.6 34.3 24.7 23 32 A A - 0 0 65 1,-0.2 57,-0.1 -2,-0.2 -1,-0.1 -0.300 46.9 -64.4 -78.4 172.9 14.3 37.8 24.8 24 33 A R S S- 0 0 82 1,-0.1 -1,-0.2 55,-0.1 56,-0.1 -0.250 70.4 -85.0 -58.5 144.7 10.8 38.5 23.4 25 34 A P - 0 0 3 0, 0.0 -1,-0.1 0, 0.0 74,-0.1 -0.219 52.3-100.3 -55.1 137.1 10.5 38.0 19.6 26 35 A P - 0 0 40 0, 0.0 57,-0.1 0, 0.0 123,-0.1 -0.162 34.9-109.6 -55.9 145.7 11.6 40.9 17.4 27 36 A V - 0 0 57 -3,-0.1 9,-0.0 122,-0.1 11,-0.0 -0.695 35.5-141.7 -80.3 120.7 8.9 43.2 15.9 28 37 A P - 0 0 3 0, 0.0 2,-0.4 0, 0.0 8,-0.1 -0.259 15.1-133.5 -74.4 174.2 8.8 42.5 12.2 29 38 A S - 0 0 75 112,-0.2 2,-0.4 113,-0.2 116,-0.1 -0.969 13.5-161.1-134.5 148.6 8.2 45.4 9.8 30 39 A L - 0 0 21 -2,-0.4 6,-0.3 6,-0.2 112,-0.0 -0.985 26.4-121.4-125.3 135.8 6.0 46.1 6.8 31 40 A E > - 0 0 145 -2,-0.4 3,-2.0 1,-0.1 110,-0.0 -0.385 54.3 -53.4 -73.2 152.7 6.8 48.9 4.3 32 41 A P T 3 S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.291 124.4 39.0 -61.2 153.7 4.1 51.5 3.7 33 42 A P T 3 S+ 0 0 69 0, 0.0 57,-1.0 0, 0.0 2,-0.3 -0.982 121.1 63.4 -71.2 4.1 1.2 51.6 3.0 34 43 A Y E < -C 89 0C 33 -3,-2.0 2,-0.3 55,-0.2 55,-0.2 -0.731 63.9-179.4 -98.4 141.1 1.4 48.6 5.4 35 44 A G E -C 88 0C 13 53,-2.3 53,-3.0 -2,-0.3 2,-0.4 -0.976 15.6-164.6-139.3 152.2 2.4 48.7 9.0 36 45 A L E +C 87 0C 26 -2,-0.3 2,-0.3 -6,-0.3 51,-0.2 -0.995 17.1 170.3-132.4 136.2 2.9 46.4 12.0 37 46 A R E -C 86 0C 21 49,-1.7 49,-2.9 -2,-0.4 2,-0.1 -0.974 41.7 -90.6-144.8 155.6 3.1 47.5 15.6 38 47 A V E -C 85 0C 12 -2,-0.3 47,-0.3 47,-0.2 668,-0.1 -0.413 51.1-111.4 -65.6 139.2 3.1 45.9 19.0 39 48 A A - 0 0 0 45,-2.5 2,-0.3 -2,-0.1 -1,-0.1 -0.321 29.2-143.0 -69.8 158.3 -0.4 45.5 20.4 40 49 A Q > - 0 0 23 1,-0.1 3,-3.1 664,-0.1 4,-0.3 -0.897 25.0-114.0-122.2 152.3 -1.4 47.6 23.4 41 50 A L G > S+ 0 0 47 -2,-0.3 3,-1.4 1,-0.3 4,-0.2 0.806 118.7 64.0 -54.1 -27.4 -3.6 46.7 26.3 42 51 A T G 3 S+ 0 0 27 1,-0.3 3,-0.4 2,-0.1 4,-0.4 0.581 86.5 69.8 -73.6 -10.2 -6.0 49.3 24.9 43 52 A D G <> S+ 0 0 2 -3,-3.1 4,-2.9 1,-0.2 -1,-0.3 0.554 74.0 95.5 -81.3 -7.8 -6.4 47.3 21.8 44 53 A A H <> S+ 0 0 0 -3,-1.4 4,-3.0 -4,-0.3 5,-0.2 0.884 80.5 48.1 -48.8 -51.4 -8.3 44.8 23.9 45 54 A E H > S+ 0 0 88 -3,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.923 114.6 45.9 -59.7 -46.0 -11.8 46.2 23.0 46 55 A M H > S+ 0 0 36 -4,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.929 115.2 46.6 -63.3 -46.0 -11.1 46.2 19.3 47 56 A L H X S+ 0 0 0 -4,-2.9 4,-3.5 2,-0.2 5,-0.3 0.923 108.6 53.9 -63.5 -45.8 -9.6 42.7 19.4 48 57 A A H X S+ 0 0 7 -4,-3.0 4,-0.8 -5,-0.2 -1,-0.2 0.899 111.8 47.2 -55.9 -39.7 -12.4 41.3 21.4 49 58 A E H >< S+ 0 0 119 -4,-1.8 3,-0.5 -5,-0.2 -1,-0.2 0.936 113.9 46.8 -66.7 -46.3 -14.8 42.7 18.8 50 59 A W H >< S+ 0 0 13 -4,-2.4 3,-1.6 1,-0.2 6,-0.3 0.940 112.6 48.3 -59.3 -52.0 -12.7 41.3 15.9 51 60 A M H 3< S+ 0 0 0 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.606 103.4 62.5 -68.1 -12.9 -12.3 37.8 17.5 52 61 A N T << S+ 0 0 84 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.340 83.7 107.5 -93.3 6.3 -16.1 37.6 18.2 53 62 A R S X> S- 0 0 73 -3,-1.6 4,-3.0 -4,-0.1 3,-0.5 -0.542 85.9-102.6 -84.8 152.0 -16.8 37.8 14.5 54 63 A P H 3> S+ 0 0 97 0, 0.0 4,-1.2 0, 0.0 5,-0.2 0.851 116.0 39.3 -33.4 -70.1 -18.0 34.8 12.5 55 64 A H H 3> S+ 0 0 48 1,-0.2 4,-0.9 2,-0.2 5,-0.1 0.795 122.3 40.8 -59.6 -35.0 -14.7 33.8 10.7 56 65 A L H <>>S+ 0 0 10 -3,-0.5 4,-2.9 -6,-0.3 5,-0.7 0.818 106.2 60.4 -87.0 -31.9 -12.4 34.5 13.6 57 66 A A H X5S+ 0 0 21 -4,-3.0 4,-0.5 1,-0.2 6,-0.3 0.825 111.3 43.0 -63.8 -31.4 -14.5 33.1 16.5 58 67 A A H <5S+ 0 0 75 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.809 119.9 40.2 -84.1 -33.2 -14.4 29.7 14.8 59 68 A A H <5S+ 0 0 49 -4,-0.9 -2,-0.2 -5,-0.2 -3,-0.1 0.792 130.0 25.7 -87.4 -30.9 -10.7 29.7 13.8 60 69 A W H <5S- 0 0 34 -4,-2.9 -3,-0.2 -9,-0.2 -2,-0.1 0.714 79.4-153.5-103.3 -27.6 -9.2 31.2 17.0 61 70 A E << + 0 0 79 -5,-0.7 -4,-0.1 -4,-0.5 -3,-0.1 0.710 60.5 121.4 59.5 18.1 -11.9 30.2 19.5 62 71 A Y + 0 0 54 -6,-0.4 2,-1.6 -11,-0.2 -1,-0.1 -0.298 22.9 143.0-105.4 45.8 -10.7 33.3 21.4 63 72 A D + 0 0 78 -6,-0.3 -11,-0.1 -11,-0.1 -15,-0.1 -0.582 28.9 139.9 -87.4 75.3 -14.1 35.0 21.4 64 73 A W - 0 0 39 -2,-1.6 2,-0.1 1,-0.1 -13,-0.1 -0.553 56.8 -85.3-110.3 175.9 -13.9 36.5 24.9 65 74 A P >> - 0 0 86 0, 0.0 4,-2.0 0, 0.0 3,-1.4 -0.458 46.3-102.0 -79.7 156.3 -14.9 39.9 26.5 66 75 A A H 3> S+ 0 0 29 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.876 122.1 60.8 -42.9 -47.8 -12.5 42.8 26.2 67 76 A S H 3> S+ 0 0 72 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.857 108.2 43.1 -49.5 -43.3 -11.5 42.2 29.9 68 77 A R H <> S+ 0 0 59 -3,-1.4 4,-2.7 2,-0.2 3,-0.5 0.940 110.7 52.1 -71.6 -49.4 -10.2 38.8 29.0 69 78 A W H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.3 -2,-0.2 0.826 106.3 58.7 -55.5 -29.3 -8.4 39.8 25.7 70 79 A R H X S+ 0 0 82 -4,-2.3 4,-2.8 -5,-0.3 -1,-0.3 0.915 106.9 45.7 -65.2 -43.0 -6.8 42.4 27.9 71 80 A Q H X S+ 0 0 31 -4,-1.2 4,-2.9 -3,-0.5 -65,-0.3 0.909 112.0 50.8 -66.8 -43.0 -5.4 39.6 30.1 72 81 A H H X S+ 0 0 11 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.935 113.3 45.9 -60.6 -46.4 -4.3 37.6 27.1 73 82 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 -5,-0.2 3,-0.2 0.958 114.4 47.1 -62.1 -49.9 -2.5 40.7 25.7 74 83 A N H X S+ 0 0 34 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.908 107.9 55.7 -59.6 -43.5 -0.9 41.5 29.0 75 84 A A H < S+ 0 0 10 -4,-2.9 4,-0.3 1,-0.2 -1,-0.2 0.875 113.4 41.9 -56.6 -40.4 0.2 38.0 29.6 76 85 A Q H >< S+ 0 0 1 -4,-1.6 3,-1.7 -3,-0.2 5,-0.4 0.955 113.6 50.9 -70.3 -52.5 2.1 38.0 26.3 77 86 A L H 3< S+ 0 0 27 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.801 107.6 54.7 -56.6 -33.1 3.5 41.5 26.6 78 87 A E T 3< S+ 0 0 128 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.552 108.4 54.1 -81.4 -7.4 4.9 40.7 30.1 79 88 A G S < S- 0 0 22 -3,-1.7 -55,-0.1 -4,-0.3 -3,-0.0 -0.391 80.4-120.4-113.2-167.3 6.8 37.7 29.0 80 89 A T S S+ 0 0 57 -2,-0.1 3,-0.1 -57,-0.1 21,-0.1 -0.199 93.5 74.7-126.7 37.5 9.4 36.7 26.4 81 90 A Y S S+ 0 0 10 -5,-0.4 20,-1.9 1,-0.3 2,-0.4 0.777 92.5 26.7-114.0 -61.5 7.3 34.1 24.6 82 91 A S E - 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