==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-APR-10 3MHK . COMPND 2 MOLECULE: TANKYRASE-2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.KARLBERG,P.SCHUTZ,C.H.ARROWSMITH,H.BERGLUND,C.BOUNTRA,R.CO . 210 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10934.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 140 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 20.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 24 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 16.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 1 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 2 0 2 1 0 1 2 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 1 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 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 1 952 A G 0 0 104 0, 0.0 51,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -31.6 -10.7 8.6 -16.4 2 953 A T - 0 0 23 49,-0.2 2,-0.4 88,-0.1 49,-0.2 -0.682 360.0-174.9 -92.6 127.1 -11.6 11.3 -13.9 3 954 A I E -A 50 0A 101 47,-3.2 47,-2.6 -2,-0.4 2,-0.5 -0.949 14.1-148.0-116.4 132.5 -9.4 14.3 -13.2 4 955 A L E -A 49 0A 60 -2,-0.4 2,-0.6 45,-0.2 45,-0.2 -0.914 10.6-163.9-101.9 124.1 -10.2 16.9 -10.4 5 956 A I E -A 48 0A 90 43,-2.2 43,-3.2 -2,-0.5 2,-0.4 -0.958 16.9-133.9-111.3 115.6 -9.1 20.4 -11.1 6 957 A D E -A 47 0A 98 -2,-0.6 2,-0.3 41,-0.2 41,-0.2 -0.580 16.8-146.0 -69.7 122.7 -9.1 22.7 -8.1 7 958 A L - 0 0 22 39,-2.4 39,-0.4 -2,-0.4 -1,-0.0 -0.634 16.2-121.0 -86.0 147.3 -10.7 26.1 -8.7 8 959 A S > - 0 0 45 -2,-0.3 3,-2.5 1,-0.1 6,-0.4 -0.646 16.8-122.9 -87.6 142.2 -9.3 29.2 -7.0 9 960 A P T 3 S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.696 113.7 58.0 -55.5 -17.8 -11.5 31.3 -4.7 10 961 A D T 3 S+ 0 0 134 4,-0.1 2,-0.3 5,-0.0 -3,-0.0 0.477 82.6 105.0 -89.7 -3.9 -10.7 34.3 -6.9 11 962 A D S <> S- 0 0 68 -3,-2.5 4,-2.5 1,-0.1 3,-0.3 -0.605 73.5-135.0 -79.1 137.1 -12.0 32.6 -10.1 12 963 A K H > S+ 0 0 181 -2,-0.3 4,-1.8 1,-0.2 5,-0.2 0.850 107.7 57.1 -59.8 -30.8 -15.4 33.9 -11.3 13 964 A E H > S+ 0 0 52 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.901 106.5 46.7 -65.1 -45.2 -16.4 30.2 -11.8 14 965 A F H > S+ 0 0 5 -6,-0.4 4,-3.0 -3,-0.3 -2,-0.2 0.947 112.6 53.1 -57.2 -49.5 -15.7 29.3 -8.1 15 966 A Q H X S+ 0 0 94 -4,-2.5 4,-2.4 -7,-0.2 -2,-0.2 0.808 107.3 47.9 -57.7 -36.9 -17.6 32.5 -7.1 16 967 A S H X S+ 0 0 69 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.888 114.5 46.1 -81.6 -33.4 -20.8 31.7 -9.1 17 968 A V H X S+ 0 0 3 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.935 113.6 50.1 -64.2 -46.8 -20.9 28.1 -7.7 18 969 A E H X S+ 0 0 64 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.936 110.2 50.2 -56.0 -51.0 -20.2 29.4 -4.2 19 970 A E H X S+ 0 0 110 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.886 111.4 48.1 -56.4 -42.0 -23.0 32.0 -4.5 20 971 A E H X S+ 0 0 85 -4,-1.9 4,-1.5 2,-0.2 94,-0.4 0.927 112.2 49.5 -64.6 -45.1 -25.5 29.3 -5.7 21 972 A M H < S+ 0 0 0 -4,-2.7 93,-0.2 1,-0.2 -2,-0.2 0.960 119.9 36.3 -55.0 -50.8 -24.5 27.1 -2.9 22 973 A Q H >< S+ 0 0 20 -4,-2.8 3,-1.1 1,-0.2 -2,-0.2 0.896 117.6 49.3 -73.2 -42.8 -24.9 29.9 -0.3 23 974 A S H 3< S+ 0 0 50 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.650 104.0 58.2 -77.8 -17.3 -27.9 31.7 -1.8 24 975 A T T 3< S+ 0 0 14 -4,-1.5 91,-0.4 -5,-0.2 -1,-0.2 0.351 78.4 122.0 -95.6 8.3 -30.1 28.6 -2.3 25 976 A V < - 0 0 20 -3,-1.1 2,-0.3 88,-0.1 -3,-0.0 -0.436 38.5-179.7 -68.5 137.4 -30.0 27.7 1.4 26 977 A R - 0 0 114 -2,-0.1 2,-0.6 87,-0.0 -2,-0.1 -0.916 33.8-106.5-131.8 164.8 -33.4 27.4 3.2 27 978 A E - 0 0 171 -2,-0.3 2,-0.1 10,-0.0 12,-0.1 -0.832 40.6-137.2 -93.6 120.8 -34.5 26.6 6.7 28 979 A H > - 0 0 37 -2,-0.6 3,-1.3 1,-0.1 4,-0.1 -0.456 9.9-128.3 -84.9 150.4 -36.0 23.2 6.8 29 980 A R T 3 S+ 0 0 178 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.546 101.9 72.0 -75.3 -12.3 -39.2 22.2 8.7 30 981 A D T > S- 0 0 65 1,-0.0 3,-0.9 0, 0.0 -1,-0.3 0.419 110.7-115.9 -83.0 3.7 -37.5 19.3 10.5 31 982 A G T < - 0 0 53 -3,-1.3 -2,-0.1 1,-0.2 -4,-0.0 0.765 69.0 -56.9 70.2 25.6 -35.6 21.8 12.6 32 983 A G T 3> S+ 0 0 14 -4,-0.1 4,-2.1 5,-0.1 -1,-0.2 0.547 99.5 135.4 82.7 9.1 -32.2 20.7 11.2 33 984 A H T <4 S+ 0 0 112 -3,-0.9 103,-0.1 1,-0.2 -2,-0.1 0.932 77.5 30.9 -54.2 -52.2 -32.7 17.0 12.2 34 985 A A T 4 S+ 0 0 10 1,-0.1 -1,-0.2 2,-0.1 88,-0.2 0.939 136.9 19.4 -73.9 -50.6 -31.6 15.6 8.9 35 986 A G T 4 S- 0 0 4 1,-0.3 -2,-0.2 102,-0.1 2,-0.1 0.608 107.7-104.3-104.4 -15.7 -29.0 18.1 7.7 36 987 A G < - 0 0 6 -4,-2.1 2,-0.6 101,-0.1 -1,-0.3 -0.373 39.4 -69.3 111.4 168.2 -28.0 20.1 10.8 37 988 A I S S+ 0 0 97 100,-0.2 2,-0.3 -2,-0.1 -5,-0.1 -0.886 74.1 120.4-100.5 118.2 -28.7 23.6 12.1 38 989 A F - 0 0 18 -2,-0.6 170,-0.1 170,-0.1 3,-0.1 -0.959 50.5-153.7-167.0 157.3 -27.2 26.4 10.0 39 990 A N S S+ 0 0 111 168,-0.4 2,-0.3 -2,-0.3 -14,-0.1 0.491 85.7 5.2-106.2 -19.6 -27.9 29.5 7.9 40 991 A R - 0 0 130 167,-0.4 167,-2.4 75,-0.0 2,-0.3 -0.966 68.9-113.7-156.1 174.5 -24.8 29.2 5.8 41 992 A Y E - B 0 206A 5 -2,-0.3 2,-0.6 165,-0.2 165,-0.2 -0.743 16.4-129.3-110.5 160.1 -21.7 27.1 4.8 42 993 A N E - B 0 205A 68 163,-2.8 163,-2.0 -2,-0.3 2,-0.7 -0.953 31.4-152.2 -99.0 104.5 -18.0 27.4 5.1 43 994 A I E + B 0 204A 19 -2,-0.6 161,-0.2 161,-0.2 3,-0.1 -0.752 24.5 167.6 -86.4 115.7 -17.0 26.6 1.4 44 995 A L E + 0 0 66 159,-2.1 2,-0.3 -2,-0.7 160,-0.2 0.815 59.3 6.0 -95.4 -38.2 -13.5 25.1 1.5 45 996 A K E - B 0 203A 91 158,-1.9 158,-2.7 -37,-0.0 2,-0.4 -0.990 48.3-169.1-156.0 131.7 -12.9 23.6 -1.9 46 997 A I E - B 0 202A 2 -39,-0.4 -39,-2.4 -2,-0.3 2,-0.4 -0.997 18.1-172.9-125.8 124.5 -14.6 23.5 -5.3 47 998 A Q E -AB 6 201A 12 154,-2.3 154,-2.5 -2,-0.4 2,-0.4 -0.960 21.5-130.6-121.0 137.9 -13.2 21.1 -7.9 48 999 A K E -AB 5 200A 69 -43,-3.2 -43,-2.2 -2,-0.4 2,-0.6 -0.685 21.8-138.5 -83.9 131.7 -14.1 20.7 -11.5 49 1000 A V E -A 4 0A 3 150,-2.8 2,-0.6 -2,-0.4 -45,-0.2 -0.859 20.1-172.6 -96.7 122.3 -14.8 17.1 -12.5 50 1001 A C E +A 3 0A 65 -47,-2.6 -47,-3.2 -2,-0.6 2,-0.4 -0.956 20.8 148.2-121.1 105.5 -13.3 16.2 -15.8 51 1002 A N > - 0 0 8 -2,-0.6 4,-2.5 -49,-0.2 -49,-0.2 -0.918 25.8-165.5-137.5 109.6 -14.1 12.8 -17.2 52 1003 A K H > S+ 0 0 148 -51,-0.5 4,-2.8 -2,-0.4 5,-0.2 0.906 88.1 51.9 -66.7 -43.1 -14.3 12.7 -21.0 53 1004 A K H > S+ 0 0 158 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.934 115.1 42.4 -58.3 -48.2 -16.1 9.3 -21.3 54 1005 A L H > S+ 0 0 14 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.890 113.4 52.5 -66.3 -41.9 -18.8 10.5 -18.9 55 1006 A W H X S+ 0 0 82 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.938 109.2 49.5 -59.9 -47.0 -19.1 13.9 -20.5 56 1007 A E H X S+ 0 0 104 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.886 110.9 48.6 -64.1 -39.7 -19.5 12.4 -23.9 57 1008 A R H X S+ 0 0 108 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.887 113.1 50.0 -61.9 -40.9 -22.3 10.0 -22.7 58 1009 A Y H X S+ 0 0 1 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.918 113.5 43.7 -63.5 -44.9 -23.9 12.9 -21.1 59 1010 A T H X S+ 0 0 29 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.855 112.2 53.7 -72.6 -32.1 -23.7 15.1 -24.2 60 1011 A H H X S+ 0 0 111 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.929 113.0 42.8 -65.7 -45.7 -24.9 12.2 -26.4 61 1012 A R H X S+ 0 0 15 -4,-2.2 4,-2.5 133,-0.2 5,-0.2 0.878 111.3 55.7 -66.6 -37.2 -28.0 11.7 -24.2 62 1013 A R H X S+ 0 0 66 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.898 106.2 51.4 -61.4 -41.9 -28.5 15.5 -24.0 63 1014 A K H X S+ 0 0 122 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.948 109.9 49.2 -57.5 -50.0 -28.6 15.6 -27.8 64 1015 A E H X S+ 0 0 73 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.936 113.6 45.5 -56.4 -50.9 -31.2 12.8 -27.9 65 1016 A V H < S+ 0 0 0 -4,-2.5 7,-0.2 1,-0.2 -1,-0.2 0.892 111.7 52.8 -58.4 -44.0 -33.5 14.5 -25.3 66 1017 A S H ><>S+ 0 0 22 -4,-2.3 3,-1.6 1,-0.2 5,-1.6 0.922 108.5 48.4 -62.5 -45.1 -33.1 17.8 -27.1 67 1018 A E H ><5S+ 0 0 134 -4,-2.5 3,-0.6 1,-0.3 -1,-0.2 0.807 111.0 53.0 -65.2 -29.8 -34.2 16.4 -30.4 68 1019 A E T 3<5S+ 0 0 124 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.330 111.5 47.5 -82.4 5.9 -37.1 14.8 -28.7 69 1020 A N T X 5S- 0 0 23 -3,-1.6 3,-1.0 -5,-0.1 -1,-0.2 -0.163 127.7 -80.7-145.1 43.5 -38.2 18.2 -27.1 70 1021 A H T < 5S- 0 0 173 -3,-0.6 -3,-0.2 1,-0.3 -2,-0.1 0.906 90.7 -56.1 60.3 45.3 -38.1 20.8 -29.9 71 1022 A N T 3 - 0 0 11 62,-0.4 3,-1.1 -2,-0.4 39,-0.2 -0.941 60.1-120.6-171.6 144.6 -25.1 11.4 -1.2 83 1034 A P T 3 S+ 0 0 76 0, 0.0 3,-0.3 0, 0.0 38,-0.1 0.591 111.6 65.1 -64.3 -5.6 -22.8 9.1 0.7 84 1035 A F T >> + 0 0 100 1,-0.2 4,-2.4 2,-0.1 3,-0.6 0.146 57.9 120.4-107.8 18.9 -21.8 7.8 -2.8 85 1036 A V H <> S+ 0 0 8 -3,-1.1 4,-2.2 1,-0.2 -1,-0.2 0.806 73.8 56.6 -55.6 -32.6 -20.2 11.0 -4.2 86 1037 A N H 3> S+ 0 0 112 -3,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.892 109.3 43.2 -67.1 -44.3 -16.8 9.2 -4.7 87 1038 A A H <>>S+ 0 0 28 -3,-0.6 4,-2.4 2,-0.2 5,-0.5 0.884 112.9 56.3 -65.2 -38.2 -18.3 6.4 -6.9 88 1039 A I H X5S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.945 105.8 47.0 -62.3 -48.5 -20.3 9.1 -8.8 89 1040 A I H <5S+ 0 0 4 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.743 119.7 39.6 -72.0 -19.6 -17.4 11.3 -9.8 90 1041 A H H <5S+ 0 0 88 -4,-0.9 -1,-0.2 -3,-0.2 -2,-0.2 0.817 135.7 11.6 -92.9 -34.9 -15.3 8.3 -11.1 91 1042 A K H <5S- 0 0 146 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.396 102.8-119.9-127.5 -7.3 -18.0 6.1 -12.8 92 1043 A G << - 0 0 6 -4,-2.0 2,-0.4 -5,-0.5 -1,-0.2 -0.171 47.7 -37.5 95.1 175.5 -21.1 8.2 -13.1 93 1044 A F + 0 0 14 100,-0.5 2,-0.2 103,-0.3 103,-0.1 -0.620 67.8 158.5 -73.5 129.8 -24.6 8.0 -11.8 94 1045 A D > - 0 0 38 -2,-0.4 3,-1.8 98,-0.1 4,-0.1 -0.751 58.3 -75.4-141.1-171.2 -25.9 4.4 -11.9 95 1046 A E G > S+ 0 0 164 1,-0.3 3,-0.9 -2,-0.2 -2,-0.1 0.628 120.2 70.0 -77.5 -8.8 -28.7 2.6 -10.0 96 1047 A R G 3 S+ 0 0 137 1,-0.2 -1,-0.3 3,-0.0 -3,-0.1 0.714 98.7 54.4 -67.0 -21.2 -26.8 2.3 -6.7 97 1048 A H G < S+ 0 0 10 -3,-1.8 12,-0.3 2,-0.1 -1,-0.2 0.369 84.2 113.3 -97.2 1.4 -27.3 6.1 -6.5 98 1049 A A < - 0 0 24 -3,-0.9 2,-0.8 10,-0.1 10,-0.2 -0.425 68.1-130.0 -75.9 148.6 -31.1 5.9 -6.9 99 1050 A Y B > -F 107 0B 58 8,-2.8 3,-1.4 6,-0.2 8,-0.7 -0.865 24.2-173.9 -99.7 103.0 -33.4 6.9 -4.0 100 1051 A I T 3 S+ 0 0 116 -2,-0.8 -1,-0.2 1,-0.3 6,-0.1 0.879 81.4 48.5 -72.3 -38.6 -35.7 4.0 -3.9 101 1052 A G T 3 S+ 0 0 48 4,-0.1 -1,-0.3 3,-0.1 5,-0.1 0.289 84.1 132.2 -83.5 10.9 -38.1 5.4 -1.2 102 1053 A G S X S- 0 0 0 -3,-1.4 3,-1.7 3,-0.2 4,-0.0 -0.191 72.3-112.7 -61.1 156.5 -38.3 8.7 -3.1 103 1054 A M T 3 S+ 0 0 47 1,-0.3 59,-2.5 58,-0.1 -1,-0.1 0.684 118.7 42.1 -69.3 -16.8 -41.8 10.1 -3.6 104 1055 A F T 3 S- 0 0 0 1,-0.5 60,-1.0 57,-0.2 -1,-0.3 0.030 120.8-105.1-114.6 23.0 -41.5 9.6 -7.4 105 1056 A G < - 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