==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 15-APR-11 3RJW . COMPND 2 MOLECULE: HISTONE-LYSINE N-METHYLTRANSFERASE EHMT2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.DONG,G.A.WASNEY,W.TEMPEL,F.LIU,D.BARSYTE,A.ALLALI-HASSANI, . 540 6 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24507.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 283 52.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 15.2 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 . 5 0.9 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 . 2 0.4 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 . 44 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 7.2 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+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 2 2 1 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 10 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 . 7 0 1 3 5 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 2 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 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 1 918 A T 0 0 149 0, 0.0 2,-0.3 0, 0.0 21,-0.0 0.000 360.0 360.0 360.0 154.3 -24.2 -20.6 43.6 2 919 A E - 0 0 116 21,-0.1 2,-0.3 19,-0.1 21,-0.3 -0.635 360.0-173.6 -83.0 136.7 -20.9 -18.8 42.4 3 920 A K E -A 22 0A 62 19,-1.7 19,-1.6 -2,-0.3 2,-0.8 -0.892 30.7-112.7-129.1 156.2 -20.4 -18.1 38.7 4 921 A I E -A 21 0A 83 -2,-0.3 17,-0.3 17,-0.2 3,-0.2 -0.829 29.6-179.2 -89.8 108.6 -17.5 -16.7 36.6 5 922 A I E S+ 0 0 57 15,-2.5 2,-0.3 -2,-0.8 16,-0.2 0.831 72.3 6.6 -77.7 -34.1 -18.7 -13.4 35.2 6 923 A C E -A 20 0A 37 14,-1.3 14,-3.0 1,-0.1 -1,-0.3 -0.962 57.3-146.7-154.1 130.7 -15.5 -12.7 33.2 7 924 A R S S+ 0 0 131 -2,-0.3 2,-0.2 1,-0.3 -1,-0.1 0.770 95.0 7.7 -65.5 -33.6 -12.4 -14.8 32.6 8 925 A D > - 0 0 8 9,-0.1 3,-1.7 11,-0.1 -1,-0.3 -0.729 52.3-170.1-157.4 104.9 -10.1 -11.7 32.6 9 926 A V T 3 S+ 0 0 12 9,-3.3 26,-0.2 -3,-0.3 -1,-0.1 0.714 93.7 61.1 -65.1 -20.8 -11.2 -8.1 33.5 10 927 A A T > S- 0 0 0 8,-0.2 3,-2.2 6,-0.1 -1,-0.3 0.344 100.4-134.4 -88.6 2.1 -7.7 -7.0 32.2 11 928 A R T < S- 0 0 29 -3,-1.7 364,-2.6 1,-0.3 365,-0.3 0.818 71.5 -52.6 43.4 41.5 -8.4 -8.3 28.6 12 929 A G T 3 S+ 0 0 25 362,-0.2 -1,-0.3 363,-0.1 362,-0.1 0.535 110.5 118.9 76.4 10.0 -4.9 -9.9 28.5 13 930 A Y < + 0 0 36 -3,-2.2 2,-0.2 3,-0.0 -2,-0.1 0.626 63.1 68.9 -78.8 -17.5 -3.0 -6.7 29.5 14 931 A E S S- 0 0 31 2,-0.2 106,-0.0 1,-0.1 104,-0.0 -0.475 91.7-114.1 -97.4 172.1 -1.6 -8.3 32.7 15 932 A N S S+ 0 0 95 104,-0.2 -1,-0.1 -2,-0.2 105,-0.1 0.731 107.0 30.0 -72.4 -24.4 1.0 -11.1 33.2 16 933 A V S S- 0 0 25 105,-0.1 -2,-0.2 -6,-0.0 2,-0.1 -0.951 95.3-101.3-131.7 149.3 -1.9 -13.1 34.6 17 934 A P - 0 0 56 0, 0.0 106,-0.4 0, 0.0 -9,-0.1 -0.495 24.7-151.4 -70.0 144.6 -5.6 -13.2 34.0 18 935 A I - 0 0 0 -2,-0.1 -9,-3.3 104,-0.1 -8,-0.2 -0.873 21.5-163.5-114.7 89.3 -7.7 -11.4 36.6 19 936 A P - 0 0 24 0, 0.0 106,-2.7 0, 0.0 2,-0.4 -0.330 9.9-133.6 -75.0 163.3 -11.1 -13.2 36.6 20 937 A C E +Ab 6 125A 0 -14,-3.0 -15,-2.5 104,-0.2 -14,-1.3 -0.964 24.4 176.6-119.4 127.8 -14.5 -11.9 38.0 21 938 A V E -Ab 4 126A 9 104,-2.4 106,-0.9 -2,-0.4 2,-0.3 -0.933 12.2-170.0-130.6 154.1 -16.8 -14.0 40.2 22 939 A N E +A 3 0A 11 -19,-1.6 -19,-1.7 -2,-0.3 106,-0.1 -0.941 22.0 152.8-146.2 120.6 -20.1 -13.4 42.0 23 940 A G S S+ 0 0 44 104,-0.3 -21,-0.1 -2,-0.3 3,-0.1 0.024 72.8 61.6-129.2 20.5 -21.7 -15.8 44.5 24 941 A V S S- 0 0 85 1,-0.3 2,-0.2 3,-0.1 -2,-0.1 0.757 110.3 -7.7-113.8 -53.4 -23.6 -13.2 46.6 25 942 A D S S- 0 0 72 2,-0.2 -1,-0.3 3,-0.0 102,-0.1 -0.659 71.1 -94.3-136.5-170.1 -26.0 -11.4 44.3 26 943 A G S S+ 0 0 81 -2,-0.2 -4,-0.0 -3,-0.1 -3,-0.0 0.207 72.7 129.2 -96.9 13.0 -27.1 -11.0 40.6 27 944 A E - 0 0 100 1,-0.1 -2,-0.2 3,-0.0 -3,-0.1 -0.516 54.1-133.2 -69.1 126.1 -24.9 -7.9 39.9 28 945 A P - 0 0 80 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.243 39.6 -64.5 -76.9 175.5 -22.8 -8.5 36.7 29 946 A C - 0 0 14 1,-0.1 -7,-0.0 -9,-0.1 -9,-0.0 -0.313 69.8 -95.8 -54.2 128.0 -19.1 -7.8 36.2 30 947 A P + 0 0 24 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 -0.250 49.9 165.2 -55.6 138.1 -18.5 -4.0 36.5 31 948 A E + 0 0 167 -3,-0.1 -2,-0.1 3,-0.0 4,-0.0 0.276 45.7 102.7-136.1 11.3 -18.4 -2.1 33.2 32 949 A D S S+ 0 0 74 2,-0.0 2,-0.3 0, 0.0 -1,-0.0 0.029 84.2 43.5 -86.4 26.3 -18.8 1.5 34.4 33 950 A Y S S- 0 0 34 -3,-0.0 2,-0.6 155,-0.0 154,-0.2 -0.965 84.4-106.3-158.3 168.3 -15.0 2.2 33.8 34 951 A K E -e 187 0B 48 152,-2.7 154,-2.2 -2,-0.3 2,-0.3 -0.928 31.2-133.6-108.4 117.2 -12.1 1.5 31.3 35 952 A Y E +e 188 0B 7 -2,-0.6 2,-0.3 152,-0.2 154,-0.2 -0.554 31.8 173.7 -68.3 126.5 -9.6 -1.2 32.4 36 953 A I - 0 0 4 152,-1.9 115,-0.1 -2,-0.3 154,-0.1 -0.992 29.9-155.7-134.2 137.5 -6.0 0.1 31.8 37 954 A S S S+ 0 0 22 -2,-0.3 2,-0.3 1,-0.1 112,-0.1 0.727 83.6 39.4 -83.0 -22.0 -2.7 -1.6 32.9 38 955 A E S S- 0 0 124 150,-0.1 -1,-0.1 113,-0.1 113,-0.1 -0.972 97.9 -88.9-132.7 145.2 -0.7 1.7 32.9 39 956 A N - 0 0 38 -2,-0.3 2,-0.3 111,-0.1 114,-0.2 -0.066 45.4-159.1 -50.9 141.9 -1.5 5.2 34.0 40 957 A C E -f 153 0B 12 112,-1.8 114,-2.6 147,-0.1 2,-0.3 -0.794 8.8-134.1-123.1 168.0 -3.1 7.5 31.4 41 958 A E E -fg 154 317B 21 275,-0.6 277,-2.0 -2,-0.3 278,-0.4 -0.931 14.5-175.7-123.0 147.0 -3.5 11.3 30.8 42 959 A T S S+ 0 0 31 112,-0.7 2,-0.3 1,-0.4 275,-0.1 0.264 83.5 18.9-123.4 6.3 -6.6 13.2 29.7 43 960 A S S S- 0 0 58 111,-0.2 -1,-0.4 273,-0.0 2,-0.2 -0.893 106.8 -69.4-168.3 154.9 -4.7 16.6 29.5 44 961 A T + 0 0 120 -2,-0.3 271,-0.1 1,-0.1 -2,-0.0 -0.355 42.1 175.6 -59.0 118.5 -0.9 17.4 29.2 45 962 A M - 0 0 10 -2,-0.2 -1,-0.1 2,-0.0 110,-0.0 0.525 33.1-138.9-101.0 -7.5 0.9 16.6 32.4 46 963 A N - 0 0 76 1,-0.2 2,-0.1 3,-0.0 -2,-0.1 0.893 26.9-168.3 43.3 54.7 4.4 17.5 31.0 47 964 A I - 0 0 12 1,-0.1 2,-1.0 2,-0.0 266,-0.2 -0.442 28.1-113.4 -66.3 136.7 6.1 14.5 32.6 48 965 A D + 0 0 63 1,-0.2 164,-0.6 -2,-0.1 165,-0.3 -0.718 49.4 160.0 -81.2 101.7 9.9 14.8 32.5 49 966 A R + 0 0 114 -2,-1.0 259,-0.6 162,-0.1 2,-0.4 0.239 20.9 136.8-107.2 9.0 10.8 11.9 30.2 50 967 A N B > -j 308 0C 15 1,-0.2 3,-1.7 257,-0.1 259,-0.2 -0.466 47.5-150.6 -64.4 113.0 14.3 13.2 29.2 51 968 A I G > S+ 0 0 3 257,-2.0 3,-1.3 -2,-0.4 -1,-0.2 0.780 95.3 59.5 -55.9 -33.2 16.6 10.2 29.3 52 969 A T G 3 S+ 0 0 81 256,-0.4 -1,-0.3 1,-0.3 257,-0.1 0.638 97.7 61.0 -73.1 -15.5 19.6 12.5 30.2 53 970 A H G < S+ 0 0 106 -3,-1.7 2,-0.5 2,-0.1 -1,-0.3 0.408 83.5 108.5 -88.8 -2.3 17.7 13.6 33.4 54 971 A L < - 0 0 11 -3,-1.3 2,-0.4 -4,-0.2 156,-0.0 -0.682 65.1-142.5 -83.5 127.0 17.7 10.0 34.7 55 972 A Q + 0 0 106 -2,-0.5 2,-0.3 14,-0.0 48,-0.1 -0.700 37.1 167.5 -82.4 131.6 19.8 9.1 37.6 56 973 A H - 0 0 83 -2,-0.4 2,-0.2 47,-0.1 48,-0.1 -0.901 31.2-108.9-141.9 171.9 21.1 5.6 36.9 57 974 A C - 0 0 2 -2,-0.3 48,-1.2 44,-0.1 49,-0.2 -0.601 9.0-142.2-103.9 164.1 23.7 3.1 38.1 58 975 A T + 0 0 127 9,-0.3 2,-0.2 -2,-0.2 10,-0.1 -0.041 47.3 154.1-113.8 28.0 27.0 1.8 36.4 59 976 A C + 0 0 10 1,-0.2 -2,-0.1 6,-0.0 9,-0.0 -0.416 29.8 179.0 -70.4 126.2 26.5 -1.8 37.6 60 977 A V S S+ 0 0 111 -2,-0.2 -1,-0.2 46,-0.1 2,-0.0 0.422 74.5 63.0 -99.1 -6.1 28.0 -4.6 35.6 61 978 A D S S- 0 0 72 45,-0.0 46,-0.4 46,-0.0 49,-0.0 0.129 113.6 -79.5 -95.9-149.7 26.6 -7.1 38.2 62 979 A D - 0 0 75 44,-0.1 49,-3.4 48,-0.1 50,-0.2 0.067 68.5 -99.8-105.0 20.2 22.8 -7.8 39.0 63 980 A C S S+ 0 0 2 47,-0.2 14,-0.0 48,-0.1 5,-0.0 0.816 87.8 127.9 62.5 39.2 22.6 -4.6 41.2 64 981 A S + 0 0 80 3,-0.0 2,-0.2 48,-0.0 -1,-0.1 0.397 48.3 96.5 -95.6 -4.8 22.9 -6.7 44.5 65 982 A S S > S- 0 0 49 1,-0.1 3,-1.2 0, 0.0 6,-0.1 -0.486 83.7-120.7 -90.8 161.0 25.8 -4.4 45.8 66 983 A S T 3 S+ 0 0 91 1,-0.2 -1,-0.1 -2,-0.2 6,-0.1 0.610 109.4 69.2 -67.9 -17.2 25.8 -1.4 48.2 67 984 A N T 3 + 0 0 134 4,-0.1 2,-0.6 5,-0.0 -9,-0.3 0.425 63.7 117.8 -86.0 -3.9 27.4 0.5 45.2 68 985 A C <> - 0 0 3 -3,-1.2 4,-2.4 1,-0.2 3,-0.3 -0.586 55.9-153.7 -68.8 111.8 24.1 0.5 43.0 69 986 A L H > S+ 0 0 41 -2,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.864 95.8 54.5 -53.9 -39.2 23.4 4.3 42.7 70 987 A C H > S+ 0 0 0 2,-0.2 4,-0.8 1,-0.2 28,-0.4 0.877 108.3 47.6 -63.7 -40.1 19.7 3.4 42.2 71 988 A G H >4 S+ 0 0 4 -3,-0.3 3,-0.7 1,-0.2 -2,-0.2 0.911 111.3 52.0 -65.4 -42.0 19.7 1.4 45.5 72 989 A Q H >< S+ 0 0 106 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.843 103.2 56.7 -63.0 -37.7 21.4 4.3 47.2 73 990 A L H 3< S+ 0 0 50 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.771 108.2 48.7 -64.5 -27.7 18.7 6.8 45.9 74 991 A S T << S- 0 0 0 -4,-0.8 2,-1.6 -3,-0.7 -1,-0.3 0.068 123.9-109.8 -94.3 16.3 16.2 4.4 47.7 75 992 A I S < S- 0 0 126 -3,-1.9 2,-0.3 -5,-0.1 -4,-0.1 -0.448 94.3 -11.3 81.8 -56.8 18.5 4.6 50.9 76 993 A R S S- 0 0 46 -2,-1.6 2,-0.5 -6,-0.1 -10,-0.1 -0.900 93.2 -85.3-155.9 159.3 19.3 0.9 50.1 77 994 A C - 0 0 43 -2,-0.3 -6,-0.1 1,-0.1 -5,-0.0 -0.729 39.5-160.9 -76.2 122.3 17.7 -1.5 47.6 78 995 A W + 0 0 33 -2,-0.5 8,-2.2 5,-0.1 2,-0.3 0.291 56.1 100.5 -89.2 3.5 14.8 -2.9 49.7 79 996 A Y B -O 85 0D 18 6,-0.2 6,-0.2 32,-0.1 2,-0.1 -0.753 60.0-146.5 -95.9 140.6 14.3 -6.0 47.5 80 997 A D > - 0 0 63 4,-2.4 3,-1.4 -2,-0.3 -1,-0.1 -0.195 44.4 -79.1 -88.0-172.7 15.6 -9.5 48.5 81 998 A K T 3 S+ 0 0 81 1,-0.3 -2,-0.0 2,-0.1 -1,-0.0 0.808 134.6 44.9 -56.1 -34.8 16.8 -12.2 46.0 82 999 A D T 3 S- 0 0 123 2,-0.1 -1,-0.3 63,-0.0 -3,-0.0 0.370 122.8-103.2 -94.6 0.6 13.1 -13.1 45.3 83 1000 A G S < S+ 0 0 14 -3,-1.4 2,-0.3 1,-0.3 63,-0.3 0.509 76.2 135.1 89.0 9.0 11.9 -9.5 44.9 84 1001 A R - 0 0 78 61,-0.1 -4,-2.4 1,-0.1 -1,-0.3 -0.657 62.7-102.2 -89.2 144.4 10.2 -9.2 48.3 85 1002 A L B -O 79 0D 14 59,-2.3 -6,-0.2 -2,-0.3 -1,-0.1 -0.409 43.7-105.3 -63.4 139.8 10.7 -6.1 50.5 86 1003 A L > - 0 0 31 -8,-2.2 3,-1.8 1,-0.1 -1,-0.1 -0.280 23.1-118.8 -63.9 148.6 13.1 -6.7 53.4 87 1004 A Q T 3 S+ 0 0 93 1,-0.3 -1,-0.1 56,-0.1 -2,-0.1 0.897 114.5 62.8 -57.2 -39.8 11.5 -7.1 57.0 88 1005 A E T 3 S+ 0 0 166 2,-0.1 -1,-0.3 3,-0.0 2,-0.1 0.537 77.0 124.3 -61.7 -10.4 13.5 -3.9 58.1 89 1006 A F S < S- 0 0 9 -3,-1.8 2,-0.6 -11,-0.1 -4,-0.0 -0.340 73.5-115.7 -58.0 124.8 11.4 -1.9 55.5 90 1007 A N + 0 0 83 1,-0.2 -1,-0.1 3,-0.2 -2,-0.1 -0.573 36.8 178.3 -68.3 108.2 9.6 1.0 57.2 91 1008 A K S S+ 0 0 51 -2,-0.6 -1,-0.2 3,-0.1 -2,-0.1 0.680 77.8 49.1 -85.7 -23.7 5.9 0.1 56.7 92 1009 A I S S+ 0 0 99 1,-0.2 -1,-0.1 111,-0.1 -2,-0.1 0.954 130.4 16.0 -78.7 -57.0 4.6 3.2 58.6 93 1010 A E S S- 0 0 69 0, 0.0 -1,-0.2 0, 0.0 -3,-0.2 -0.811 89.4-166.1-118.5 81.6 6.7 5.9 56.8 94 1011 A P - 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