==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOSYNTHETIC PROTEIN 28-MAY-12 4FDF . COMPND 2 MOLECULE: MOLYBDENUM COFACTOR BIOSYNTHESIS PROTEIN C 2; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR V.K.SRIVASTAVA,S.SRIVASTAVA,A.ARORA,J.V.PRATAP . 273 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11554.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 200 73.3 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 . 78 28.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 23 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 28.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 0 0 0 0 2 0 0 0 0 1 0 0 0 0 3 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 . 4 1 0 0 0 0 2 0 2 0 1 1 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 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 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 22 A G 0 0 108 0, 0.0 2,-0.0 0, 0.0 172,-0.0 0.000 360.0 360.0 360.0 106.6 18.5 -3.1 -19.7 2 23 A A - 0 0 47 180,-0.0 177,-3.7 1,-0.0 2,-0.3 0.016 360.0-110.3-129.2-131.6 14.9 -3.4 -18.6 3 24 A A B -A 178 0A 53 175,-0.3 2,-0.2 180,-0.0 175,-0.2 -0.932 10.3-166.0-165.2 172.7 11.9 -5.7 -18.2 4 25 A H - 0 0 114 173,-1.2 2,-0.1 -2,-0.3 57,-0.1 -0.753 21.4-129.2-177.0 136.1 8.4 -6.8 -19.2 5 26 A M - 0 0 85 -2,-0.2 57,-0.1 1,-0.1 2,-0.1 -0.403 31.7 -99.8 -85.0 166.4 5.7 -9.1 -17.7 6 27 A V - 0 0 44 55,-0.3 -1,-0.1 1,-0.1 2,-0.1 -0.254 37.7-124.6 -77.3 173.7 3.9 -12.0 -19.4 7 28 A D 0 0 163 1,-0.1 -1,-0.1 -2,-0.1 0, 0.0 -0.245 360.0 360.0-108.2-173.9 0.3 -11.8 -20.8 8 29 A I 0 0 118 -2,-0.1 -1,-0.1 85,-0.0 -2,-0.0 -0.036 360.0 360.0-175.2 360.0 -3.1 -13.5 -20.7 9 ! 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 10 35 A T 0 0 65 0, 0.0 81,-1.1 0, 0.0 83,-0.1 0.000 360.0 360.0 360.0-159.1 -8.8 -22.4 -13.7 11 36 A K E -B 90 0B 87 79,-0.2 2,-0.3 77,-0.0 79,-0.2 -0.358 360.0-178.3 -65.0 133.4 -8.4 -23.6 -10.1 12 37 A R E -B 89 0B 60 77,-3.0 77,-1.9 -2,-0.1 2,-0.3 -0.938 16.8-170.3-137.4 156.4 -4.7 -23.5 -8.8 13 38 A T E -B 88 0B 43 -2,-0.3 119,-1.2 75,-0.2 2,-0.4 -0.998 2.5-176.6-144.9 141.4 -2.6 -24.3 -5.8 14 39 A A E -BC 87 131B 1 73,-2.3 73,-3.0 -2,-0.3 2,-0.4 -0.998 5.9-164.3-139.7 142.1 1.0 -23.7 -4.7 15 40 A V E +BC 86 130B 28 115,-2.2 114,-3.1 -2,-0.4 115,-1.8 -0.994 11.9 173.9-124.8 128.5 2.9 -24.8 -1.7 16 41 A A E -BC 85 128B 0 69,-2.5 69,-3.1 -2,-0.4 2,-0.3 -0.907 6.0-170.7-125.9 159.9 6.2 -23.2 -0.6 17 42 A A E +BC 84 127B 0 110,-2.1 110,-2.0 -2,-0.3 2,-0.3 -0.875 8.2 170.7-139.3 175.5 8.3 -23.8 2.5 18 43 A G E -B 83 0B 0 65,-1.3 65,-3.5 -2,-0.3 2,-0.4 -0.930 23.4-121.7-179.2 164.8 11.4 -22.3 4.3 19 44 A I E -BC 82 124B 11 105,-2.8 105,-3.4 -2,-0.3 2,-0.6 -0.978 1.4-152.8-132.0 129.2 13.2 -22.6 7.6 20 45 A L E -BC 81 123B 0 61,-2.6 61,-2.2 -2,-0.4 2,-0.5 -0.903 21.4-158.5 -90.4 123.4 14.2 -20.3 10.4 21 46 A R E +BC 80 122B 89 101,-3.2 101,-2.3 -2,-0.6 59,-0.2 -0.915 31.8 132.7-107.3 121.9 17.4 -21.7 12.1 22 47 A T - 0 0 15 57,-2.8 2,-0.1 -2,-0.5 96,-0.0 -0.689 53.6 -56.1-149.2-166.4 17.9 -20.6 15.7 23 48 A S > - 0 0 34 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.487 41.8-117.6 -85.1 157.3 18.8 -21.7 19.2 24 49 A A H > S+ 0 0 47 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.872 117.7 56.1 -56.7 -40.0 17.0 -24.4 21.2 25 50 A Q H > S+ 0 0 123 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.883 109.5 45.4 -54.9 -43.9 16.2 -21.6 23.7 26 51 A V H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.948 109.7 51.9 -73.6 -48.2 14.6 -19.5 21.0 27 52 A V H X S+ 0 0 5 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.888 111.7 49.9 -50.9 -42.1 12.5 -22.2 19.5 28 53 A A H X S+ 0 0 50 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.843 108.7 50.4 -68.7 -37.6 11.2 -23.0 23.0 29 54 A L H X>S+ 0 0 42 -4,-1.7 5,-1.7 2,-0.2 4,-1.5 0.892 109.4 52.0 -66.5 -41.7 10.3 -19.4 23.7 30 55 A I H <5S+ 0 0 2 -4,-2.5 11,-0.4 3,-0.2 10,-0.2 0.918 114.3 43.8 -58.1 -44.2 8.4 -19.2 20.4 31 56 A S H <5S+ 0 0 64 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.945 122.1 35.0 -67.6 -52.1 6.4 -22.4 21.3 32 57 A T H <5S- 0 0 120 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.543 108.6-121.7 -82.5 -8.7 5.6 -21.6 24.9 33 58 A G T <5 + 0 0 42 -4,-1.5 -3,-0.2 -5,-0.2 -4,-0.1 0.904 61.5 145.0 70.2 43.9 5.2 -17.8 24.2 34 59 A G < + 0 0 45 -5,-1.7 -4,-0.1 -6,-0.1 -5,-0.1 0.416 31.6 118.7 -89.7 0.8 7.9 -16.6 26.6 35 60 A L > - 0 0 11 -6,-0.6 3,-1.0 3,-0.3 79,-0.1 -0.470 64.2-138.5 -72.3 136.5 9.0 -13.7 24.3 36 61 A P T 3 S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.780 104.6 56.8 -58.0 -32.5 8.6 -10.1 25.5 37 62 A K T 3 S- 0 0 32 76,-0.3 103,-2.8 1,-0.3 2,-0.3 0.593 113.7-123.0 -79.7 -12.0 7.3 -9.0 22.1 38 63 A G B < +F 139 0C 17 -3,-1.0 2,-0.7 101,-0.3 -3,-0.3 -0.725 59.8 4.1 114.7-157.5 4.5 -11.5 22.3 39 64 A D > - 0 0 58 99,-4.8 4,-1.6 -2,-0.3 5,-0.1 -0.592 52.6-173.5 -75.6 110.7 3.3 -14.5 20.3 40 65 A A H > S+ 0 0 0 -2,-0.7 4,-2.9 -10,-0.2 5,-0.2 0.883 80.0 51.9 -74.4 -41.7 5.7 -15.0 17.4 41 66 A L H > S+ 0 0 33 -11,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.904 112.5 44.3 -65.7 -43.2 3.7 -17.7 15.6 42 67 A A H > S+ 0 0 34 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.912 116.5 47.1 -67.7 -43.1 0.4 -15.8 15.5 43 68 A T H X S+ 0 0 15 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.919 114.8 45.8 -65.2 -45.9 2.2 -12.6 14.5 44 69 A A H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.847 110.8 53.7 -63.2 -39.0 4.2 -14.3 11.8 45 70 A R H X S+ 0 0 93 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.941 112.0 44.2 -63.4 -45.5 1.1 -16.2 10.5 46 71 A V H X S+ 0 0 71 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.924 113.1 50.9 -66.0 -45.2 -0.8 -13.0 10.1 47 72 A A H X S+ 0 0 3 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.899 112.9 46.2 -57.8 -46.7 2.2 -11.2 8.5 48 73 A G H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.896 110.3 52.3 -63.8 -43.9 2.7 -14.0 5.9 49 74 A I H X S+ 0 0 50 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.933 114.0 43.7 -58.0 -46.8 -1.0 -14.2 5.1 50 75 A M H X S+ 0 0 84 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.863 109.8 56.9 -65.0 -37.6 -1.1 -10.5 4.4 51 76 A A H < S+ 0 0 1 -4,-2.2 3,-0.3 1,-0.2 4,-0.3 0.850 99.3 59.9 -64.9 -35.1 2.2 -10.7 2.5 52 77 A A H >< S+ 0 0 1 -4,-2.1 3,-1.3 1,-0.2 -1,-0.2 0.928 106.0 47.6 -54.5 -46.9 0.7 -13.2 0.1 53 78 A K H 3< S+ 0 0 140 -4,-1.1 3,-0.3 1,-0.2 -1,-0.2 0.734 111.0 52.4 -67.8 -22.7 -2.0 -10.7 -0.9 54 79 A R T >X S+ 0 0 107 -4,-1.0 3,-1.3 -3,-0.3 4,-1.1 0.318 73.5 111.7 -95.4 5.2 0.7 -8.0 -1.4 55 80 A T H X> S+ 0 0 0 -3,-1.3 4,-2.9 1,-0.3 3,-0.9 0.873 78.4 48.8 -51.5 -43.9 2.9 -10.0 -3.7 56 81 A S H 34 S+ 0 0 36 -3,-0.3 -1,-0.3 1,-0.3 6,-0.2 0.747 106.8 58.1 -72.1 -23.3 2.2 -7.9 -6.7 57 82 A D H <4 S+ 0 0 95 -3,-1.3 -1,-0.3 1,-0.1 -2,-0.2 0.758 117.9 32.0 -66.0 -29.7 3.0 -4.8 -4.6 58 83 A L H << S+ 0 0 17 -4,-1.1 -2,-0.2 -3,-0.9 -3,-0.1 0.834 110.0 59.6-101.5 -44.8 6.5 -6.2 -3.9 59 84 A I S >< S- 0 0 0 -4,-2.9 3,-2.1 -5,-0.2 -1,-0.2 -0.850 75.3-147.3-101.4 107.5 7.6 -8.1 -6.9 60 85 A P T 3 S+ 0 0 54 0, 0.0 -1,-0.2 0, 0.0 -55,-0.1 0.748 90.9 40.8 -49.1 -43.4 7.7 -5.7 -9.9 61 86 A L T 3 S+ 0 0 19 188,-0.1 -55,-0.3 -57,-0.1 2,-0.2 0.325 89.9 108.4 -96.3 7.9 6.7 -8.2 -12.7 62 87 A C < - 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