==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-SEP-99 1CZB . COMPND 2 MOLECULE: AVIAN SARCOMA VIRUS INTEGRASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AVIAN SARCOMA VIRUS; . AUTHOR J.LUBKOWSKI,Z.DAUTER,F.YANG,J.ALEXANDRATOS,G.MERKEL, . 141 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7749.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 101 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 9 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 39.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 1 0 0 0 0 0 1 0 0 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 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 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 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 52 A G 0 0 133 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 139.0 23.2 32.2 46.5 2 53 A R > + 0 0 115 1,-0.2 3,-2.6 3,-0.1 2,-0.3 0.936 360.0 156.8 -74.6 -52.0 25.2 30.8 49.5 3 54 A G T 3 S- 0 0 59 1,-0.3 -1,-0.2 2,-0.0 0, 0.0 -0.466 82.3 -21.6 62.2-124.0 22.6 28.4 50.7 4 55 A L T 3 S+ 0 0 180 -2,-0.3 -1,-0.3 3,-0.0 3,-0.1 0.298 110.3 123.7 -98.8 8.2 24.4 25.8 52.7 5 56 A G S < S- 0 0 27 -3,-2.6 -3,-0.1 1,-0.2 28,-0.0 0.001 73.4 -62.4 -66.7 172.1 27.8 26.7 51.0 6 57 A P - 0 0 79 0, 0.0 -1,-0.2 0, 0.0 27,-0.1 -0.128 60.0 -99.7 -61.6 147.4 30.9 27.7 52.8 7 58 A L - 0 0 104 1,-0.1 2,-1.8 -3,-0.1 26,-0.1 -0.297 35.7-107.5 -67.2 148.4 30.9 31.0 54.8 8 59 A Q + 0 0 75 24,-0.1 57,-2.1 25,-0.1 58,-1.6 -0.534 65.6 143.4 -86.3 78.4 32.4 34.1 53.2 9 60 A I E -a 66 0A 54 -2,-1.8 23,-2.4 56,-0.2 24,-0.4 -0.974 30.0-163.7-124.0 127.5 35.6 34.3 55.2 10 61 A W E -aB 67 31A 7 56,-2.4 58,-2.8 -2,-0.4 2,-0.4 -0.767 10.7-148.4-103.8 157.7 39.0 35.3 54.0 11 62 A Q E -aB 68 30A 23 19,-2.3 19,-2.7 -2,-0.3 2,-0.4 -0.993 21.1-171.6-118.5 135.6 42.5 34.9 55.4 12 63 A T E + B 0 29A 1 56,-2.4 58,-0.4 -2,-0.4 2,-0.3 -0.979 12.4 154.7-128.9 142.1 45.0 37.7 54.6 13 64 A D E - B 0 28A 20 15,-2.4 15,-3.0 -2,-0.4 2,-0.4 -0.935 34.9-120.1-150.0 169.0 48.8 38.0 55.2 14 65 A F E - B 0 27A 18 -2,-0.3 2,-0.4 13,-0.2 13,-0.2 -0.934 25.4-174.4-109.0 142.4 51.9 39.7 53.9 15 66 A T E - B 0 26A 12 11,-2.6 11,-2.8 -2,-0.4 2,-0.5 -0.999 23.1-126.2-139.0 137.2 54.9 37.8 52.6 16 67 A L E + B 0 25A 83 -2,-0.4 9,-0.2 9,-0.2 8,-0.1 -0.700 27.3 176.6 -89.0 125.2 58.2 39.2 51.5 17 68 A E > - 0 0 10 7,-3.2 3,-2.5 -2,-0.5 4,-0.1 -0.840 13.6-169.7-131.9 90.9 59.4 38.2 48.0 18 69 A P G > S+ 0 0 83 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.695 82.8 74.5 -57.6 -18.4 62.6 39.9 46.8 19 70 A R G 3 S+ 0 0 59 1,-0.3 105,-2.5 104,-0.2 103,-0.1 0.753 99.6 47.9 -61.0 -21.6 62.1 38.7 43.3 20 71 A M G X S+ 0 0 0 -3,-2.5 3,-0.8 4,-0.2 -1,-0.3 0.194 97.0 172.2-102.6 10.7 59.5 41.4 43.2 21 72 A A T < + 0 0 25 -3,-1.7 22,-0.1 1,-0.3 103,-0.0 -0.364 56.2 34.2 -63.8 149.7 61.6 44.3 44.6 22 73 A P T 3 S+ 0 0 88 0, 0.0 2,-1.5 0, 0.0 -1,-0.3 -0.961 135.4 35.2 -76.2 -18.2 61.3 47.2 45.0 23 74 A R S < S+ 0 0 127 -3,-0.8 19,-0.2 1,-0.2 20,-0.2 -0.457 80.6 144.2 -89.9 64.6 57.6 46.3 45.5 24 75 A S + 0 0 18 -2,-1.5 -7,-3.2 19,-0.2 2,-0.8 0.531 33.3 98.1 -86.6 -7.7 58.6 43.1 47.3 25 76 A W E -BC 16 42A 65 17,-2.2 17,-2.1 -3,-0.2 2,-0.6 -0.753 59.5-161.4 -84.6 114.9 55.8 43.0 49.9 26 77 A L E -BC 15 41A 0 -11,-2.8 -11,-2.6 -2,-0.8 2,-0.5 -0.853 6.2-153.8 -97.1 123.8 53.1 40.7 48.6 27 78 A A E -BC 14 40A 0 13,-2.6 13,-2.0 -2,-0.6 2,-0.4 -0.873 20.2-167.7 -94.3 125.8 49.7 41.1 50.2 28 79 A V E -BC 13 39A 0 -15,-3.0 -15,-2.4 -2,-0.5 2,-0.4 -0.979 13.5-175.8-126.0 126.1 47.9 37.7 49.9 29 80 A T E -BC 12 38A 0 9,-2.6 9,-2.5 -2,-0.4 2,-0.5 -0.977 5.3-165.9-118.4 135.9 44.2 36.9 50.5 30 81 A V E -BC 11 37A 5 -19,-2.7 -19,-2.3 -2,-0.4 2,-0.8 -0.982 18.7-138.4-116.0 129.1 42.8 33.4 50.3 31 82 A D E > -B 10 0A 21 5,-2.8 4,-2.7 -2,-0.5 5,-0.2 -0.773 12.8-154.4 -79.8 114.7 39.0 33.0 50.1 32 83 A T T 4 S+ 0 0 40 -23,-2.4 -1,-0.2 -2,-0.8 -22,-0.1 0.743 88.2 59.6 -69.8 -21.2 38.5 30.1 52.4 33 84 A A T 4 S+ 0 0 33 -24,-0.4 -1,-0.2 1,-0.1 -25,-0.1 0.879 126.5 11.0 -67.9 -44.4 35.2 29.1 50.6 34 85 A S T 4 S- 0 0 69 -3,-0.2 -2,-0.2 2,-0.1 -1,-0.1 0.570 92.9-122.4-112.2 -14.0 36.7 28.6 47.2 35 86 A S < + 0 0 61 -4,-2.7 -3,-0.1 1,-0.3 -2,-0.0 0.440 57.3 155.3 71.3 8.8 40.5 28.6 47.8 36 87 A A - 0 0 20 -5,-0.2 -5,-2.8 -6,-0.1 2,-0.4 -0.340 31.0-146.6 -60.7 144.9 40.8 31.6 45.3 37 88 A I E -C 30 0A 7 -7,-0.2 2,-0.4 100,-0.2 -7,-0.2 -0.931 14.2-169.3-116.1 137.1 43.9 33.7 45.9 38 89 A V E -C 29 0A 2 -9,-2.5 -9,-2.6 -2,-0.4 2,-0.4 -0.997 12.9-177.2-120.2 132.7 44.3 37.5 45.3 39 90 A V E +C 28 0A 11 -2,-0.4 2,-0.3 -11,-0.2 -11,-0.2 -0.991 7.9 175.0-131.5 139.5 47.8 39.0 45.4 40 91 A T E -C 27 0A 22 -13,-2.0 -13,-2.6 -2,-0.4 2,-0.3 -0.941 24.1-128.4-131.9 156.3 49.0 42.5 45.1 41 92 A Q E -C 26 0A 13 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.817 24.5-176.6-113.7 151.9 52.5 44.0 45.5 42 93 A H E -C 25 0A 21 -17,-2.1 -17,-2.2 -2,-0.3 3,-0.1 -0.984 32.1-135.3-144.9 146.8 53.5 46.9 47.7 43 94 A G S S+ 0 0 38 -2,-0.3 2,-0.3 -20,-0.2 -19,-0.2 0.784 91.8 21.6 -73.4 -30.2 56.6 48.9 48.5 44 95 A R S S- 0 0 188 -19,-0.1 2,-0.9 -21,-0.1 -1,-0.2 -0.990 77.2-116.4-143.1 147.1 56.1 48.9 52.2 45 96 A V + 0 0 62 -2,-0.3 2,-0.3 -3,-0.1 3,-0.1 -0.773 62.8 137.9 -87.0 103.6 54.2 46.8 54.8 46 97 A T > - 0 0 60 -2,-0.9 4,-1.9 1,-0.1 5,-0.1 -0.934 68.5-104.0-143.8 164.5 51.7 49.3 56.1 47 98 A S H > S+ 0 0 24 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.907 121.9 50.7 -56.2 -48.0 48.1 49.7 57.1 48 99 A V H > S+ 0 0 71 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.893 106.3 55.5 -66.2 -33.5 47.3 51.6 53.9 49 100 A A H > S+ 0 0 6 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.927 107.4 49.6 -60.1 -43.6 49.0 48.8 51.9 50 101 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.912 112.0 48.8 -59.8 -41.7 46.6 46.3 53.5 51 102 A Q H X S+ 0 0 17 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.919 110.2 49.6 -66.0 -43.5 43.7 48.6 52.7 52 103 A H H X S+ 0 0 114 -4,-2.9 4,-1.8 2,-0.2 -1,-0.2 0.921 111.7 50.6 -60.4 -41.6 44.7 49.0 49.1 53 104 A H H X S+ 0 0 1 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.945 110.8 47.0 -60.9 -51.4 45.1 45.2 48.8 54 105 A W H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.860 106.2 58.7 -64.0 -35.0 41.6 44.5 50.3 55 106 A A H X S+ 0 0 44 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.931 110.9 43.4 -55.7 -46.9 40.1 47.1 48.0 56 107 A T H X S+ 0 0 64 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.932 112.2 52.4 -61.6 -47.0 41.5 45.1 45.1 57 108 A A H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.2 5,-0.4 0.879 107.8 51.6 -60.6 -38.6 40.4 41.8 46.6 58 109 A I H X S+ 0 0 16 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.905 108.0 52.6 -64.4 -41.5 36.8 43.1 47.1 59 110 A A H < S+ 0 0 89 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.874 118.4 37.3 -57.5 -40.4 36.7 44.1 43.4 60 111 A V H < S+ 0 0 80 -4,-1.9 -2,-0.2 2,-0.1 -1,-0.2 0.920 133.6 18.7 -79.1 -48.4 37.8 40.6 42.4 61 112 A L H < S- 0 0 58 -4,-3.3 -3,-0.2 1,-0.3 -2,-0.2 0.558 102.9-112.4-102.8 -16.5 35.9 38.4 44.9 62 113 A G < - 0 0 36 -4,-2.1 -1,-0.3 -5,-0.4 -2,-0.1 -0.382 54.1 -45.6 98.2 174.5 33.1 40.5 46.3 63 114 A R - 0 0 151 -2,-0.1 2,-0.1 -4,-0.1 -55,-0.1 -0.692 61.3-142.9 -83.4 122.6 32.7 41.8 49.9 64 115 A P - 0 0 2 0, 0.0 -55,-0.2 0, 0.0 3,-0.1 -0.421 12.9-132.6 -79.9 163.4 33.4 39.1 52.5 65 116 A K S S+ 0 0 131 -57,-2.1 25,-2.3 1,-0.3 2,-0.3 0.823 87.1 2.6 -76.5 -37.2 31.6 38.6 55.8 66 117 A A E -ad 9 90A 19 -58,-1.6 -56,-2.4 23,-0.2 2,-0.4 -0.994 57.9-150.3-151.7 154.3 34.9 38.4 57.7 67 118 A I E -ad 10 91A 0 23,-2.3 25,-2.3 -2,-0.3 2,-0.4 -0.998 10.2-153.4-129.9 131.8 38.6 38.5 57.4 68 119 A K E +ad 11 92A 28 -58,-2.8 -56,-2.4 -2,-0.4 2,-0.3 -0.887 27.0 155.1-101.0 128.6 41.2 36.6 59.5 69 120 A T - 0 0 0 23,-2.1 -56,-0.1 -2,-0.4 2,-0.1 -0.866 41.2 -99.5-135.3 176.6 44.7 38.1 59.9 70 121 A D - 0 0 65 -58,-0.4 24,-0.1 -2,-0.3 -1,-0.1 -0.219 46.7 -93.7 -84.3-175.7 47.5 38.0 62.4 71 122 A N S S+ 0 0 107 22,-0.1 5,-0.1 -2,-0.1 22,-0.1 0.160 71.0 143.2 -92.1 21.7 48.1 40.6 65.0 72 123 A G >> - 0 0 26 1,-0.1 3,-1.7 3,-0.1 4,-1.6 -0.197 63.9-112.5 -57.0 151.1 50.6 42.6 63.0 73 124 A S H 3> S+ 0 0 102 1,-0.3 4,-1.0 2,-0.2 -1,-0.1 0.740 114.8 62.8 -61.3 -31.8 50.4 46.4 63.3 74 125 A C H 34 S+ 0 0 11 1,-0.2 -1,-0.3 2,-0.2 -24,-0.1 0.715 113.1 37.8 -68.4 -18.5 49.2 46.9 59.7 75 126 A F H <4 S+ 0 0 1 -3,-1.7 -2,-0.2 1,-0.1 -1,-0.2 0.668 119.1 43.6-106.8 -21.7 46.1 44.9 60.7 76 127 A T H < S+ 0 0 57 -4,-1.6 -2,-0.2 -5,-0.1 -3,-0.2 0.467 84.1 118.1-106.2 4.7 45.4 46.1 64.2 77 128 A S S X S- 0 0 28 -4,-1.0 4,-2.7 -5,-0.2 5,-0.3 -0.242 76.4-115.5 -62.6 155.5 45.9 49.8 63.7 78 129 A K H > S+ 0 0 176 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.915 117.0 56.1 -54.4 -41.9 43.1 52.2 64.3 79 130 A S H > S+ 0 0 57 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.944 110.4 42.0 -60.0 -49.5 43.3 53.0 60.6 80 131 A T H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.913 112.8 52.7 -68.7 -42.5 42.8 49.4 59.4 81 132 A R H X S+ 0 0 168 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.915 111.8 47.5 -57.9 -40.5 40.1 48.7 62.0 82 133 A E H X S+ 0 0 112 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.889 109.2 53.2 -68.7 -37.3 38.2 51.8 60.9 83 134 A W H X S+ 0 0 16 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.916 110.6 46.8 -63.3 -45.4 38.6 50.8 57.2 84 135 A L H X>S+ 0 0 3 -4,-2.4 5,-2.4 1,-0.2 4,-0.5 0.914 111.6 51.6 -64.5 -37.8 37.1 47.4 57.8 85 136 A A H ><5S+ 0 0 64 -4,-2.1 3,-1.0 1,-0.2 -2,-0.2 0.890 104.7 56.6 -63.9 -40.2 34.3 48.9 59.8 86 137 A R H 3<5S+ 0 0 163 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.858 111.7 43.3 -55.6 -37.4 33.5 51.3 56.9 87 138 A W H 3<5S- 0 0 97 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.491 112.1-120.7 -85.9 -9.2 33.1 48.3 54.7 88 139 A G T <<5 + 0 0 61 -3,-1.0 2,-0.5 -4,-0.5 -3,-0.2 0.816 62.2 146.7 68.6 34.1 31.0 46.3 57.3 89 140 A I < - 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