==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 21-DEC-02 1NI7 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN YGDK; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR G.LIU,Y.CHIANG,T.ACTON,G.T.MONTELIONE,T.SZYPERSKI,NORTHEAST . 149 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9286.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 100 67.1 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 . 9 6.0 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 . 1 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 . 8 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 62 41.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.0 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 2 1 1 0 0 0 0 1 1 0 0 0 0 0 0 0 1 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 245 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 107.4 7.0 22.8 22.8 2 2 A T - 0 0 126 2,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.969 360.0-140.9-174.5 174.1 7.2 19.4 21.1 3 3 A N - 0 0 150 -2,-0.3 2,-0.1 2,-0.0 0, 0.0 -0.796 17.1-144.8-158.4 108.8 6.2 17.4 18.1 4 4 A P - 0 0 118 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.430 18.4-173.2 -75.0 148.7 5.3 13.7 18.2 5 5 A Q + 0 0 182 -2,-0.1 2,-0.3 3,-0.0 3,-0.1 -0.990 10.7 156.2-147.1 134.8 6.2 11.4 15.3 6 6 A F + 0 0 182 -2,-0.3 3,-0.1 1,-0.2 0, 0.0 -0.879 43.2 57.1-146.9 176.6 5.4 7.8 14.5 7 7 A A - 0 0 45 -2,-0.3 2,-0.9 1,-0.2 -1,-0.2 0.994 52.5-167.7 57.8 75.3 5.1 5.3 11.6 8 8 A G + 0 0 81 -3,-0.1 -1,-0.2 0, 0.0 -3,-0.0 -0.282 29.3 154.5 -88.7 48.3 8.5 5.7 10.1 9 9 A H - 0 0 33 -2,-0.9 4,-0.2 -3,-0.1 35,-0.1 -0.365 42.0-135.9 -75.5 157.0 7.5 3.8 7.0 10 10 A P > + 0 0 24 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.961 48.1 137.8 -75.0 -86.0 9.2 4.3 3.7 11 11 A F T 3 S- 0 0 13 1,-0.3 2,-0.9 2,-0.1 5,-0.2 0.863 94.2 -6.7 33.5 92.7 6.6 4.5 0.9 12 12 A G T 3 S+ 0 0 10 3,-2.1 -1,-0.3 1,-0.1 4,-0.3 -0.407 127.4 74.7 95.2 -55.8 8.0 7.3 -1.2 13 13 A T S < S- 0 0 116 -3,-1.7 3,-0.2 -2,-0.9 -2,-0.1 0.972 132.4 -17.7 -51.1 -67.9 10.8 8.2 1.2 14 14 A T S S+ 0 0 99 1,-0.1 2,-0.5 5,-0.0 -1,-0.2 0.464 139.4 63.2-117.9 -11.7 13.0 5.3 0.4 15 15 A V S S+ 0 0 13 4,-0.1 -3,-2.1 78,-0.1 2,-0.2 -0.634 70.9 161.6-116.4 70.4 10.3 3.1 -1.3 16 16 A T > - 0 0 39 -2,-0.5 4,-2.7 -4,-0.3 5,-0.3 -0.575 57.3-107.0 -90.5 154.3 9.3 5.2 -4.3 17 17 A A H > S+ 0 0 33 80,-0.3 4,-1.0 1,-0.2 -1,-0.1 0.785 125.5 50.2 -46.9 -29.1 7.5 3.9 -7.3 18 18 A E H >> S+ 0 0 111 2,-0.2 4,-2.1 1,-0.2 3,-0.9 0.967 105.1 51.4 -74.4 -57.6 10.9 4.3 -8.9 19 19 A T H 3> S+ 0 0 60 1,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.854 110.4 52.2 -47.1 -40.3 13.0 2.5 -6.4 20 20 A L H 3X S+ 0 0 8 -4,-2.7 4,-2.5 1,-0.2 -1,-0.3 0.859 108.0 50.9 -65.3 -36.4 10.6 -0.4 -6.7 21 21 A R H > S- 0 0 114 -3,-0.2 3,-1.6 1,-0.2 4,-1.5 -0.699 72.7-145.2 -84.5 125.7 10.3 -13.0 -13.3 30 30 A W H 3> S+ 0 0 78 -2,-0.5 4,-3.3 1,-0.3 5,-0.5 0.890 99.7 69.9 -53.4 -41.4 7.1 -12.6 -11.4 31 31 A E H 3> S+ 0 0 130 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.839 101.5 46.2 -44.1 -39.6 8.4 -15.3 -9.1 32 32 A D H <>>S+ 0 0 40 -3,-1.6 4,-4.1 2,-0.2 5,-0.5 0.965 111.0 49.7 -68.9 -55.0 10.9 -12.7 -8.0 33 33 A K H X5S+ 0 0 15 -4,-1.5 4,-2.9 1,-0.3 -2,-0.2 0.935 115.3 43.9 -47.8 -56.0 8.4 -9.9 -7.6 34 34 A Y H X5S+ 0 0 76 -4,-3.3 4,-0.8 2,-0.2 -1,-0.3 0.799 118.5 47.6 -60.2 -30.3 6.2 -12.2 -5.6 35 35 A R H >X5S+ 0 0 158 -4,-1.2 3,-1.2 -5,-0.5 4,-1.0 0.978 115.0 40.2 -74.2 -61.6 9.2 -13.3 -3.7 36 36 A Q H 3X5S+ 0 0 39 -4,-4.1 4,-1.9 1,-0.3 3,-0.3 0.831 106.4 68.5 -56.3 -34.0 10.8 -10.0 -2.9 37 37 A L H 3X - 0 0 67 0, 0.0 4,-2.0 0, 0.0 5,-0.1 -0.236 20.2-111.4 -75.0 167.1 0.7 -1.9 16.8 49 49 A D H > S+ 0 0 128 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.904 117.2 61.0 -64.4 -42.8 -2.8 -2.2 18.3 50 50 A E H > S+ 0 0 140 1,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.885 110.8 40.0 -50.3 -44.0 -2.8 1.5 19.0 51 51 A L H > S+ 0 0 38 2,-0.2 4,-1.7 1,-0.2 3,-0.3 0.840 106.2 65.3 -74.1 -35.1 -2.4 2.1 15.3 52 52 A K H < S+ 0 0 66 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.853 103.4 47.9 -54.5 -36.6 -4.8 -0.7 14.5 53 53 A A H < S+ 0 0 69 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.797 110.1 51.8 -73.8 -30.0 -7.5 1.5 16.2 54 54 A Q H < S+ 0 0 109 -4,-0.8 15,-0.2 -3,-0.3 -2,-0.2 0.682 112.2 56.5 -78.3 -19.5 -6.3 4.4 14.1 55 55 A A S < S- 0 0 12 -4,-1.7 13,-0.3 13,-0.2 2,-0.3 -0.490 90.3-105.4-104.9 176.7 -6.6 2.3 11.0 56 56 A K E -A 67 0A 164 11,-4.9 11,-1.9 -2,-0.2 2,-0.3 -0.762 30.9-112.2-105.2 151.6 -9.6 0.4 9.6 57 57 A E E -A 66 0A 136 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.653 29.2-172.0 -84.7 135.9 -10.1 -3.3 9.6 58 58 A I E +A 65 0A 30 7,-2.5 7,-1.3 -2,-0.3 3,-0.2 -0.936 19.3 161.3-133.3 109.0 -9.9 -5.2 6.3 59 59 A A + 0 0 85 -2,-0.4 5,-0.1 5,-0.2 -1,-0.1 -0.265 54.0 94.6-118.7 42.5 -10.8 -8.8 6.1 60 60 A G S S+ 0 0 51 3,-0.2 2,-0.2 5,-0.1 75,-0.2 -0.128 75.5 64.2-123.7 34.4 -11.4 -9.0 2.4 61 61 A C S S- 0 0 34 2,-0.2 4,-0.1 -3,-0.2 68,-0.0 -0.770 110.4 -61.7-141.6-175.6 -8.0 -10.2 1.3 62 62 A E S S- 0 0 117 -2,-0.2 2,-0.3 67,-0.1 3,-0.1 0.835 116.2 -25.7 -39.1 -42.4 -5.7 -13.2 1.7 63 63 A N S S- 0 0 75 1,-0.2 -2,-0.2 22,-0.1 -3,-0.2 -0.887 105.1 -24.5-158.3-175.1 -5.7 -12.4 5.4 64 64 A R - 0 0 124 -2,-0.3 20,-1.4 -5,-0.1 21,-0.5 0.031 57.1-166.7 -39.7 147.5 -6.3 -9.6 7.9 65 65 A V E -AB 58 83A 1 -7,-1.3 -7,-2.5 18,-0.2 2,-0.4 -0.951 9.0-168.2-148.8 123.7 -5.6 -6.2 6.6 66 66 A W E +AB 57 82A 29 16,-3.1 16,-2.5 -2,-0.3 2,-0.3 -0.943 16.1 161.9-115.7 133.7 -5.1 -2.9 8.5 67 67 A L E +AB 56 81A 7 -11,-1.9 -11,-4.9 -2,-0.4 2,-0.3 -0.989 4.5 166.1-151.7 142.5 -5.1 0.4 6.8 68 68 A G E + B 0 80A 5 12,-1.0 12,-2.5 -2,-0.3 2,-0.3 -0.988 1.2 165.1-157.1 150.7 -5.5 4.0 7.9 69 69 A Y - 0 0 66 -2,-0.3 2,-0.3 -15,-0.2 10,-0.2 -0.947 16.7-148.4-157.2 173.1 -5.0 7.6 6.7 70 70 A T - 0 0 91 8,-0.4 8,-1.2 -2,-0.3 2,-0.4 -0.979 22.4-118.5-154.4 139.4 -5.8 11.2 7.2 71 71 A V - 0 0 63 -2,-0.3 5,-0.2 6,-0.2 6,-0.2 -0.651 31.6-144.0 -81.3 129.6 -6.3 14.3 5.0 72 72 A A - 0 0 49 -2,-0.4 5,-0.1 4,-0.1 -1,-0.1 0.008 36.1 -84.1 -78.1-170.4 -3.8 17.0 5.8 73 73 A E S S+ 0 0 194 1,-0.2 -2,-0.1 3,-0.1 -1,-0.0 0.931 134.9 31.7 -63.1 -48.0 -4.5 20.8 5.7 74 74 A N S S- 0 0 118 2,-0.1 -1,-0.2 29,-0.0 3,-0.1 0.768 127.2 -98.7 -79.6 -28.2 -3.8 20.9 2.0 75 75 A G S S+ 0 0 10 1,-0.2 2,-0.7 28,-0.1 29,-0.3 0.112 70.1 151.4 129.8 -17.1 -5.1 17.4 1.5 76 76 A K - 0 0 108 -5,-0.2 -1,-0.2 27,-0.1 27,-0.2 -0.248 35.5-155.8 -48.9 95.2 -1.8 15.6 1.5 77 77 A M - 0 0 0 25,-1.5 2,-0.5 -2,-0.7 25,-0.3 -0.464 7.3-148.7 -79.2 150.5 -3.1 12.3 2.9 78 78 A H - 0 0 112 -8,-1.2 -8,-0.4 -2,-0.1 2,-0.2 -0.955 9.8-156.6-125.9 111.5 -0.8 9.9 4.7 79 79 A F + 0 0 7 -2,-0.5 2,-0.3 20,-0.3 -10,-0.2 -0.572 17.7 167.1 -86.5 149.0 -1.6 6.2 4.5 80 80 A F E +B 68 0A 32 -12,-2.5 -12,-1.0 -2,-0.2 2,-0.2 -0.838 17.2 106.7-165.6 123.3 -0.4 3.7 7.1 81 81 A G E -B 67 0A 8 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.3 -0.855 35.3-143.5-167.5-159.4 -1.3 0.1 7.8 82 82 A D E -B 66 0A 9 -16,-2.5 -16,-3.1 -2,-0.2 2,-0.3 -0.934 6.4-140.5-168.6-175.3 -0.1 -3.5 7.6 83 83 A S E -B 65 0A 3 -2,-0.3 -18,-0.2 -18,-0.2 -36,-0.1 -0.975 22.2-124.5-158.5 163.4 -1.2 -7.1 6.9 84 84 A E S S+ 0 0 120 -20,-1.4 2,-0.7 -2,-0.3 -1,-0.1 0.924 93.2 75.5 -78.1 -49.0 -0.7 -10.7 8.1 85 85 A G S > S- 0 0 19 -21,-0.5 4,-3.4 1,-0.2 3,-0.2 -0.557 76.1-146.5 -70.4 110.4 0.2 -12.1 4.7 86 86 A R H > S+ 0 0 163 -2,-0.7 4,-3.0 1,-0.3 5,-0.2 0.875 100.5 54.9 -40.8 -49.7 3.7 -11.0 4.0 87 87 A I H > S+ 0 0 25 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.948 111.6 42.3 -50.1 -57.3 2.8 -10.8 0.3 88 88 A V H > S+ 0 0 5 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.919 110.5 58.3 -56.0 -46.8 -0.1 -8.5 1.1 89 89 A R H X S+ 0 0 42 -4,-3.4 4,-1.2 1,-0.2 -1,-0.2 0.913 108.9 44.5 -48.5 -50.7 2.1 -6.6 3.5 90 90 A G H X S+ 0 0 0 -4,-3.0 4,-1.3 1,-0.2 3,-0.5 0.916 105.8 60.7 -61.1 -46.2 4.5 -5.9 0.7 91 91 A L H X S+ 0 0 16 -4,-2.5 4,-2.3 1,-0.3 -1,-0.2 0.894 98.5 59.3 -47.2 -46.5 1.7 -5.0 -1.7 92 92 A L H X S+ 0 0 3 -4,-2.3 4,-4.2 1,-0.2 5,-0.4 0.922 98.3 59.5 -48.4 -51.8 0.7 -2.2 0.7 93 93 A A H X S+ 0 0 0 -4,-1.2 4,-2.9 -3,-0.5 5,-0.2 0.926 106.0 45.5 -40.8 -66.8 4.2 -0.7 0.2 94 94 A V H X S+ 0 0 0 -4,-1.3 4,-2.7 1,-0.2 -1,-0.3 0.886 117.7 46.8 -44.7 -46.8 3.7 -0.3 -3.5 95 95 A L H X S+ 0 0 5 -4,-2.3 4,-2.5 2,-0.3 3,-0.3 0.985 110.5 48.5 -59.9 -62.1 0.3 1.1 -2.7 96 96 A L H < S+ 0 0 5 -4,-4.2 -1,-0.2 1,-0.3 5,-0.2 0.799 114.8 50.4 -48.1 -30.7 1.5 3.4 0.0 97 97 A T H >< S+ 0 0 4 -4,-2.9 3,-1.9 -5,-0.4 -80,-0.3 0.898 106.0 51.9 -74.9 -43.5 4.1 4.4 -2.6 98 98 A A H 3< S+ 0 0 9 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.807 112.4 48.1 -62.1 -30.1 1.5 5.0 -5.3 99 99 A V T >< S+ 0 0 4 -4,-2.5 3,-1.6 -5,-0.2 2,-0.8 -0.039 80.1 161.9 -99.5 28.7 -0.3 7.2 -2.8 100 100 A E T < S- 0 0 94 -3,-1.9 -3,-0.1 1,-0.3 -22,-0.1 -0.333 83.9 -38.5 -54.6 97.6 2.9 9.0 -2.0 101 101 A G T 3 S+ 0 0 21 -2,-0.8 -1,-0.3 -24,-0.3 2,-0.2 0.883 101.0 163.4 45.1 47.9 1.5 12.1 -0.4 102 102 A K < - 0 0 52 -3,-1.6 -25,-1.5 -25,-0.3 2,-0.3 -0.594 36.1-118.4 -94.8 157.9 -1.2 12.1 -3.0 103 103 A T > - 0 0 51 -2,-0.2 4,-2.7 -27,-0.2 5,-0.2 -0.702 24.5-112.4 -97.4 148.8 -4.5 14.0 -2.8 104 104 A A H > S+ 0 0 3 -29,-0.3 4,-2.1 -2,-0.3 5,-0.2 0.898 121.7 47.6 -39.4 -57.0 -7.9 12.4 -2.7 105 105 A A H > S+ 0 0 55 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.947 108.6 54.4 -50.5 -56.7 -8.6 14.0 -6.1 106 106 A E H > S+ 0 0 75 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.903 105.1 53.9 -43.0 -54.0 -5.2 12.8 -7.4 107 107 A L H >< S+ 0 0 3 -4,-2.7 3,-1.0 1,-0.3 -1,-0.3 0.921 112.1 43.6 -47.3 -52.6 -6.1 9.2 -6.3 108 108 A Q H 3< S+ 0 0 95 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.795 111.1 55.7 -64.0 -29.2 -9.3 9.5 -8.4 109 109 A A H 3< S+ 0 0 81 -4,-2.5 -1,-0.3 1,-0.3 2,-0.3 0.670 127.9 14.0 -76.0 -17.8 -7.3 11.1 -11.1 110 110 A Q S << S- 0 0 112 -4,-1.5 -1,-0.3 -3,-1.0 0, 0.0 -0.809 80.3-130.9-162.5 115.5 -5.1 8.0 -11.0 111 111 A S > - 0 0 60 -2,-0.3 3,-1.4 -3,-0.2 4,-0.3 -0.326 18.7-128.4 -66.6 148.7 -5.7 4.7 -9.4 112 112 A P T 3> S+ 0 0 4 0, 0.0 4,-1.0 0, 0.0 3,-0.2 0.505 103.1 78.6 -75.1 -4.3 -2.9 3.2 -7.2 113 113 A L H 3> S+ 0 0 24 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.668 74.4 78.9 -75.8 -17.7 -3.3 0.0 -9.2 114 114 A A H <> S+ 0 0 35 -3,-1.4 4,-4.5 2,-0.2 -1,-0.2 0.959 95.6 42.9 -53.0 -57.8 -1.2 1.8 -11.9 115 115 A L H >>S+ 0 0 26 -4,-0.3 4,-4.1 -3,-0.2 5,-0.5 0.953 114.0 51.4 -53.0 -56.3 2.0 1.1 -10.1 116 116 A F H X>S+ 0 0 2 -4,-1.0 5,-2.8 1,-0.2 4,-1.5 0.895 117.1 40.0 -47.4 -48.4 1.0 -2.4 -9.2 117 117 A D H <5S+ 0 0 85 -4,-3.4 -2,-0.2 3,-0.3 -1,-0.2 0.936 115.0 52.4 -67.5 -48.3 0.1 -3.0 -12.9 118 118 A E H <5S+ 0 0 141 -4,-4.5 -2,-0.2 -5,-0.3 -3,-0.2 0.930 119.7 34.4 -52.3 -51.8 3.2 -1.1 -14.1 119 119 A L H <5S- 0 0 14 -4,-4.1 -1,-0.3 -5,-0.2 -2,-0.2 0.727 111.9-125.7 -75.5 -23.1 5.4 -3.2 -11.8 120 120 A G T << + 0 0 5 -4,-1.5 4,-0.4 -5,-0.5 -3,-0.3 0.736 68.3 136.3 82.5 25.7 3.2 -6.1 -12.5 121 121 A L S - 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