==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NUCLEOTIDE-BINDING PROTEIN 27-FEB-97 6RHN . COMPND 2 MOLECULE: HISTIDINE TRIAD NUCLEOTIDE-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR C.BRENNER,P.GARRISON,J.GILMOUR,D.PEISACH,D.RINGE,G.A.PETSKO, . 115 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6822.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 64 55.7 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 . 23 20.0 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 0.9 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 . 6 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 18.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.6 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 1 0 0 0 0 0 0 0 0 0 0 1 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 . 0 0 1 0 3 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 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 12 A R > 0 0 93 0, 0.0 3,-0.9 0, 0.0 8,-0.0 0.000 360.0 360.0 360.0 123.1 25.1 16.7 46.9 2 13 A P T 3 + 0 0 103 0, 0.0 11,-0.2 0, 0.0 45,-0.1 -0.295 360.0 40.2 -67.8 157.4 24.2 18.8 50.0 3 14 A G T 3 S- 0 0 8 43,-0.3 3,-0.3 9,-0.1 9,-0.2 0.446 116.8 -96.2 81.3 -3.1 21.5 17.6 52.4 4 15 A G < - 0 0 5 -3,-0.9 2,-0.1 1,-0.2 8,-0.1 -0.124 41.6 -75.5 84.0 179.4 22.7 14.0 52.0 5 16 A D S S+ 0 0 128 4,-0.1 2,-0.2 3,-0.0 -1,-0.2 -0.327 91.8 94.6-118.1 53.3 21.5 11.3 49.6 6 17 A T S > S- 0 0 32 -3,-0.3 4,-1.2 -2,-0.1 3,-0.4 -0.584 95.8 -84.8-122.0-174.8 18.3 10.1 51.2 7 18 A I H > S+ 0 0 99 1,-0.2 4,-1.1 -2,-0.2 5,-0.1 0.849 130.5 57.1 -63.7 -35.0 14.7 11.1 50.5 8 19 A F H > S+ 0 0 18 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.827 97.4 60.9 -64.8 -32.7 15.2 13.9 52.9 9 20 A G H > S+ 0 0 0 -3,-0.4 4,-2.5 1,-0.2 6,-0.2 0.918 103.1 51.2 -61.0 -41.0 18.2 15.2 50.8 10 21 A K H <>S+ 0 0 88 -4,-1.2 5,-2.3 1,-0.2 6,-1.3 0.823 110.0 49.1 -65.1 -34.3 15.8 15.7 47.9 11 22 A I H ><5S+ 0 0 15 -4,-1.1 3,-0.9 3,-0.2 -1,-0.2 0.888 110.4 51.4 -70.9 -41.0 13.4 17.7 50.1 12 23 A I H 3<5S+ 0 0 15 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.918 113.6 42.2 -62.0 -47.8 16.2 19.8 51.4 13 24 A R T 3<5S- 0 0 55 -4,-2.5 -1,-0.3 -11,-0.2 -2,-0.2 0.319 114.0-122.2 -80.2 3.3 17.5 20.7 47.8 14 25 A K T < 5S+ 0 0 117 -3,-0.9 -3,-0.2 2,-0.2 -4,-0.1 0.673 72.1 135.8 62.8 23.0 13.8 21.1 46.9 15 26 A E S - 0 0 43 47,-0.2 3,-1.4 1,-0.1 -1,-0.2 -0.977 66.8-104.6-165.0 160.8 21.7 8.9 62.9 52 63 A I G > S+ 0 0 64 -2,-0.3 3,-2.0 1,-0.3 -1,-0.1 0.875 116.5 61.6 -60.7 -37.0 21.9 10.2 66.4 53 64 A S G 3 S+ 0 0 87 1,-0.3 -1,-0.3 -3,-0.1 36,-0.0 0.642 105.3 51.3 -65.4 -11.5 24.6 7.6 67.4 54 65 A A G < S+ 0 0 54 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.335 82.4 115.4-105.2 2.0 26.7 9.3 64.7 55 66 A A < - 0 0 28 -3,-2.0 2,-0.2 -4,-0.1 -6,-0.0 -0.469 59.6-135.9 -72.9 144.5 26.3 12.9 65.9 56 67 A E > - 0 0 128 -2,-0.1 3,-1.7 1,-0.1 4,-0.1 -0.584 25.0-106.2 -95.0 166.9 29.5 14.6 67.2 57 68 A D G > S+ 0 0 142 1,-0.3 3,-1.7 -2,-0.2 -1,-0.1 0.827 121.4 62.8 -60.6 -32.9 29.8 16.7 70.3 58 69 A A G 3 S+ 0 0 82 1,-0.3 3,-0.4 2,-0.1 4,-0.3 0.676 91.8 68.2 -65.4 -18.7 30.0 19.7 68.0 59 70 A D G <> S+ 0 0 8 -3,-1.7 4,-2.4 1,-0.2 -1,-0.3 0.461 70.2 100.2 -81.6 -0.6 26.5 18.8 66.9 60 71 A E H <> S+ 0 0 141 -3,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.876 81.3 45.0 -49.4 -57.1 24.9 19.7 70.3 61 72 A S H > S+ 0 0 104 -3,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.868 114.0 50.4 -56.7 -45.0 23.6 23.1 69.4 62 73 A L H > S+ 0 0 22 -4,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.891 111.6 47.3 -62.3 -42.1 22.1 21.9 66.1 63 74 A L H X S+ 0 0 44 -4,-2.4 4,-1.0 1,-0.2 3,-0.3 0.893 113.5 48.9 -67.4 -38.2 20.4 18.9 67.8 64 75 A G H X S+ 0 0 32 -4,-2.5 4,-1.6 -5,-0.2 -1,-0.2 0.821 104.4 60.9 -69.3 -29.9 19.1 21.3 70.5 65 76 A H H X S+ 0 0 40 -4,-1.8 4,-2.5 1,-0.2 5,-0.2 0.852 97.6 57.8 -64.3 -35.7 18.0 23.6 67.7 66 77 A L H X S+ 0 0 7 -4,-1.3 4,-2.1 -3,-0.3 -1,-0.2 0.861 107.5 46.9 -63.3 -39.9 15.6 20.9 66.3 67 78 A M H X S+ 0 0 104 -4,-1.0 4,-2.5 2,-0.2 -1,-0.2 0.868 112.5 49.8 -70.8 -36.1 13.8 20.7 69.6 68 79 A I H X S+ 0 0 71 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.883 114.4 44.0 -67.9 -42.9 13.5 24.5 69.8 69 80 A V H X S+ 0 0 1 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.890 112.6 54.3 -69.0 -38.4 12.1 24.7 66.3 70 81 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.934 108.9 46.8 -61.8 -45.0 9.9 21.8 67.0 71 82 A K H X S+ 0 0 95 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.856 113.6 49.9 -68.6 -30.0 8.4 23.5 70.1 72 83 A K H X S+ 0 0 114 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.931 111.7 45.9 -71.9 -46.1 7.9 26.7 68.1 73 84 A C H X S+ 0 0 2 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.894 109.4 56.6 -63.5 -37.9 6.1 25.0 65.2 74 85 A A H <>S+ 0 0 0 -4,-2.2 5,-2.6 -5,-0.3 -1,-0.2 0.877 106.6 50.3 -60.3 -37.8 4.0 23.1 67.6 75 86 A A H ><5S+ 0 0 63 -4,-1.3 3,-1.9 3,-0.2 -2,-0.2 0.946 109.1 50.2 -66.6 -46.9 2.9 26.4 69.1 76 87 A D H 3<5S+ 0 0 139 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.863 108.1 53.4 -57.7 -37.9 2.0 27.8 65.6 77 88 A L T 3<5S- 0 0 64 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.427 118.7-116.5 -77.9 0.4 -0.0 24.7 64.9 78 89 A G T < 5 + 0 0 28 -3,-1.9 2,-2.4 1,-0.2 3,-0.3 0.801 52.5 164.6 71.8 30.5 -1.9 25.3 68.2 79 90 A L > < + 0 0 20 -5,-2.6 3,-0.7 1,-0.2 -1,-0.2 -0.503 10.9 157.9 -79.9 75.3 -0.9 22.2 70.1 80 91 A K T 3 + 0 0 181 -2,-2.4 -1,-0.2 1,-0.2 3,-0.1 0.843 65.4 53.2 -68.8 -36.7 -2.0 23.8 73.4 81 92 A K T 3 S- 0 0 218 -3,-0.3 -1,-0.2 1,-0.3 2,-0.2 0.448 115.9 -98.7 -83.9 4.4 -2.5 20.6 75.2 82 93 A G < - 0 0 34 -3,-0.7 25,-0.5 -8,-0.1 2,-0.3 -0.624 33.5-137.5 115.8-175.4 1.0 19.2 74.6 83 94 A Y E -D 106 0A 92 -2,-0.2 2,-0.4 23,-0.2 23,-0.2 -0.968 15.5-111.1-172.6 173.9 2.9 16.8 72.3 84 95 A R E -D 105 0A 57 21,-2.3 21,-2.6 -2,-0.3 2,-0.4 -0.988 18.9-154.4-126.7 134.6 5.5 14.1 72.1 85 96 A M E -D 104 0A 51 -2,-0.4 2,-0.4 19,-0.2 19,-0.2 -0.928 17.9-174.4-106.1 136.0 8.9 14.4 70.4 86 97 A V E -D 103 0A 43 17,-2.0 17,-3.2 -2,-0.4 2,-0.5 -0.996 17.8-173.6-138.6 133.1 10.6 11.2 69.2 87 98 A V E -D 102 0A 67 -2,-0.4 2,-0.5 15,-0.2 15,-0.1 -0.994 17.3-154.9-122.8 121.7 14.0 10.4 67.6 88 99 A N - 0 0 43 13,-0.5 2,-0.5 -2,-0.5 -36,-0.2 -0.860 7.2-166.3-100.7 136.6 14.4 6.8 66.4 89 100 A E > - 0 0 55 -2,-0.5 4,-1.2 -38,-0.1 5,-0.2 -0.972 47.0 -34.7-125.4 125.1 17.8 5.3 66.2 90 101 A G H >>S- 0 0 14 -2,-0.5 5,-2.7 3,-0.2 4,-1.3 0.058 96.2 -43.6 65.6-169.7 18.6 2.1 64.3 91 102 A S H 45S+ 0 0 110 1,-0.2 -1,-0.2 2,-0.2 3,-0.1 0.886 137.5 45.7 -66.3 -43.4 16.4 -1.1 63.8 92 103 A D H 45S+ 0 0 167 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.2 0.866 113.4 52.1 -68.1 -33.9 15.1 -1.4 67.3 93 104 A G H <5S- 0 0 31 -4,-1.2 -1,-0.2 2,-0.1 -2,-0.2 0.765 116.2-116.9 -72.5 -23.9 14.4 2.3 67.4 94 105 A G T <5 + 0 0 43 -4,-1.3 2,-0.5 1,-0.3 -3,-0.2 0.690 54.7 160.6 97.0 19.2 12.4 2.0 64.1 95 106 A Q < + 0 0 10 -5,-2.7 -1,-0.3 1,-0.2 3,-0.1 -0.663 9.2 161.2 -79.2 122.3 14.7 4.2 61.9 96 107 A S + 0 0 110 -2,-0.5 2,-0.6 1,-0.2 -1,-0.2 0.673 64.3 58.7-107.2 -34.4 14.1 3.5 58.2 97 108 A V S S- 0 0 31 2,-0.1 2,-1.9 -91,-0.0 -1,-0.2 -0.916 78.4-141.4-103.0 117.6 15.6 6.7 56.7 98 109 A Y S S+ 0 0 90 -2,-0.6 2,-0.3 -3,-0.1 -47,-0.2 -0.405 73.0 88.8 -83.4 67.1 19.2 7.3 57.6 99 110 A H S S- 0 0 0 -2,-1.9 -49,-0.3 -49,-0.1 -2,-0.1 -0.885 90.0-100.4-156.0 119.3 19.2 11.1 58.1 100 111 A V + 0 0 5 -51,-3.1 2,-0.3 -2,-0.3 -51,-0.1 -0.206 48.4 172.5 -49.7 133.2 18.3 12.3 61.6 101 112 A H - 0 0 15 -13,-0.2 -13,-0.5 -57,-0.2 2,-0.5 -0.991 24.4-145.2-147.3 140.3 14.7 13.4 62.1 102 113 A L E -CD 43 87A 6 -59,-2.2 -59,-1.7 -2,-0.3 2,-0.3 -0.927 16.1-145.8-107.1 128.0 12.7 14.5 65.1 103 114 A H E -CD 42 86A 24 -17,-3.2 -17,-2.0 -2,-0.5 2,-0.4 -0.751 10.0-167.7 -92.7 140.7 9.0 13.6 65.2 104 115 A V E +CD 41 85A 0 -63,-2.3 -63,-2.0 -2,-0.3 2,-0.4 -0.982 13.1 179.7-127.4 113.3 6.6 16.0 66.8 105 116 A L E +CD 40 84A 16 -21,-2.6 -21,-2.3 -2,-0.4 2,-0.3 -0.953 13.8 133.0-117.8 141.4 3.1 14.4 67.4 106 117 A G E +CD 39 83A 0 -67,-2.6 -67,-2.4 -2,-0.4 -23,-0.2 -0.942 26.7 91.6-166.4-176.0 0.0 16.0 69.0 107 118 A G S S+ 0 0 51 -25,-0.5 2,-0.3 -2,-0.3 -24,-0.1 0.481 94.4 52.1 92.3 0.7 -3.7 16.8 68.8 108 119 A R S S- 0 0 117 -26,-0.1 2,-0.4 -69,-0.1 -1,-0.2 -0.968 100.2 -79.1-158.5 161.9 -4.6 13.6 70.8 109 120 A Q - 0 0 168 -2,-0.3 2,-0.4 -3,-0.1 -3,-0.1 -0.529 45.5-141.8 -70.0 120.4 -3.7 11.9 74.0 110 121 A M - 0 0 25 -2,-0.4 2,-0.1 -5,-0.1 -1,-0.0 -0.713 20.4-140.1 -82.8 141.9 -0.4 10.1 73.5 111 122 A N - 0 0 122 -2,-0.4 -1,-0.1 2,-0.1 0, 0.0 -0.346 17.7 -85.9 -97.8 179.3 -0.2 6.8 75.2 112 123 A W S S+ 0 0 183 -2,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.986 98.3 42.5-136.2 140.8 2.4 4.8 77.2 113 124 A P S S- 0 0 92 0, 0.0 2,-2.4 0, 0.0 -2,-0.1 0.574 84.8-130.4 -69.7 162.0 4.6 2.9 76.5 114 125 A P 0 0 77 0, 0.0 -2,-0.1 0, 0.0 -4,-0.0 -0.278 360.0 360.0 -80.2 60.9 5.8 5.0 73.5 115 126 A G 0 0 126 -2,-2.4 0, 0.0 0, 0.0 0, 0.0 -0.511 360.0 360.0 91.9 360.0 5.8 1.9 71.3