==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 10-JUL-12 3VV0 . COMPND 2 MOLECULE: HISTONE-LYSINE N-METHYLTRANSFERASE SETD7; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.NIWA,N.HANDA,Y.TOMABECHI,K.HONDA,M.TOYAMA,N.OHSAWA,M.SHIRO . 236 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12251.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 144 61.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 30.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.7 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 . 17 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 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 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 3 2 1 3 1 0 2 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 2 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 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 1 116 A H 0 0 241 0, 0.0 3,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -24.9 8.5 3.8 -9.3 2 117 A G - 0 0 41 1,-0.3 16,-0.6 14,-0.1 2,-0.2 0.018 360.0 -10.8-110.1-133.1 7.6 5.7 -12.4 3 118 A V E -A 17 0A 46 14,-0.2 2,-0.4 -2,-0.1 -1,-0.3 -0.467 65.7-157.6 -72.3 135.9 4.2 5.8 -14.1 4 119 A C E -A 16 0A 44 12,-3.0 12,-1.8 -2,-0.2 2,-0.4 -0.938 4.3-160.1-116.1 137.2 1.7 3.3 -12.7 5 120 A W E -A 15 0A 62 -2,-0.4 2,-0.6 10,-0.2 10,-0.2 -0.971 3.0-168.9-115.2 132.8 -1.4 2.0 -14.6 6 121 A I E -A 14 0A 71 8,-3.0 8,-2.2 -2,-0.4 2,-0.3 -0.930 12.6-163.8-119.8 104.4 -4.3 0.4 -12.8 7 122 A Y E -A 13 0A 120 -2,-0.6 6,-0.3 6,-0.2 5,-0.1 -0.647 8.3-143.4 -87.5 145.4 -6.7 -1.3 -15.2 8 123 A Y > - 0 0 62 4,-3.0 3,-2.3 -2,-0.3 -2,-0.0 -0.714 28.6-112.6 -97.7 155.2 -10.3 -2.3 -14.2 9 124 A P T 3 S+ 0 0 140 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.806 117.4 64.1 -58.2 -23.4 -11.8 -5.5 -15.6 10 125 A D T 3 S- 0 0 11 1,-0.1 116,-0.1 2,-0.1 3,-0.1 0.530 120.8-106.1 -76.8 -6.4 -14.2 -3.2 -17.6 11 126 A G S < S+ 0 0 27 -3,-2.3 25,-0.1 1,-0.4 -1,-0.1 0.195 83.2 116.8 102.8 -18.1 -11.3 -1.8 -19.6 12 127 A G - 0 0 0 182,-0.1 -4,-3.0 -5,-0.1 -1,-0.4 -0.333 44.3-169.1 -73.6 167.2 -11.1 1.7 -18.0 13 128 A S E -AB 7 32A 2 19,-2.0 19,-2.9 -6,-0.3 2,-0.4 -0.993 25.7-132.4-155.7 159.0 -7.9 2.6 -16.1 14 129 A L E -AB 6 31A 9 -8,-2.2 -8,-3.0 -2,-0.3 2,-0.4 -0.956 30.4-176.2-109.9 138.8 -6.1 5.1 -13.7 15 130 A V E +AB 5 30A 1 15,-2.4 15,-2.2 -2,-0.4 2,-0.3 -0.999 24.6 86.8-141.2 137.7 -2.7 6.3 -14.7 16 131 A G E S-A 4 0A 6 -12,-1.8 -12,-3.0 -2,-0.4 2,-0.4 -0.926 72.6 -60.0 163.3 178.4 -0.1 8.5 -13.1 17 132 A E E -A 3 0A 125 -2,-0.3 8,-0.3 -14,-0.2 -14,-0.2 -0.727 52.7-137.4 -86.4 139.3 2.9 8.6 -10.7 18 133 A V - 0 0 51 -16,-0.6 6,-0.2 -2,-0.4 2,-0.1 -0.473 12.7-114.5 -92.7 163.8 2.1 7.5 -7.2 19 134 A N > - 0 0 56 4,-2.0 3,-3.0 -2,-0.1 -1,-0.1 -0.310 46.1 -82.0 -86.2-179.4 3.2 9.0 -3.8 20 135 A E T 3 S+ 0 0 196 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.701 132.7 53.7 -57.9 -22.0 5.5 7.4 -1.2 21 136 A D T 3 S- 0 0 131 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.318 121.8-108.8 -93.0 5.9 2.5 5.4 0.1 22 137 A G S < S+ 0 0 54 -3,-3.0 2,-0.4 1,-0.2 -2,-0.2 0.824 70.5 147.2 71.1 32.8 1.8 4.1 -3.4 23 138 A E - 0 0 66 -4,-0.1 2,-2.2 2,-0.1 -4,-2.0 -0.820 60.1-118.6-105.3 140.7 -1.3 6.2 -3.8 24 139 A M + 0 0 5 -2,-0.4 23,-2.8 -6,-0.2 2,-0.4 -0.494 63.7 143.7 -70.1 75.9 -2.7 7.7 -7.0 25 140 A T + 0 0 44 -2,-2.2 2,-0.3 -8,-0.3 20,-0.2 -0.979 21.8 70.0-128.5 127.2 -2.4 11.3 -5.6 26 141 A G E S- C 0 44A 27 18,-2.5 18,-2.4 -2,-0.4 3,-0.3 -0.964 79.4 -82.8 159.2-171.8 -1.4 14.4 -7.5 27 142 A E E S+ 0 0 122 -2,-0.3 -1,-0.1 16,-0.2 16,-0.1 0.442 115.7 55.7-105.6 -3.6 -2.3 17.0 -10.2 28 143 A K E S+ 0 0 142 -11,-0.1 2,-0.3 16,-0.1 -11,-0.2 -0.227 76.8 122.5-124.0 40.6 -1.3 14.9 -13.2 29 144 A I E - C 0 42A 4 13,-2.4 13,-2.9 -3,-0.3 2,-0.4 -0.714 40.7-163.6 -98.0 152.9 -3.4 11.8 -12.6 30 145 A A E -BC 15 41A 0 -15,-2.2 -15,-2.4 -2,-0.3 2,-0.5 -0.999 22.2-147.5-139.2 142.7 -5.9 10.5 -15.2 31 146 A Y E -BC 14 40A 1 9,-2.2 9,-2.6 -2,-0.4 2,-0.5 -0.919 24.3-158.9 -94.4 134.4 -8.8 8.2 -15.7 32 147 A V E -BC 13 39A 1 -19,-2.9 -19,-2.0 -2,-0.5 7,-0.2 -0.965 11.9-131.6-117.4 124.5 -8.8 6.7 -19.2 33 148 A Y > - 0 0 1 5,-2.9 3,-2.3 -2,-0.5 4,-0.2 -0.082 36.7 -91.3 -64.8 170.7 -12.1 5.3 -20.6 34 149 A P T 3 S+ 0 0 27 0, 0.0 -1,-0.1 0, 0.0 -22,-0.0 0.622 121.7 70.6 -65.5 -10.6 -12.2 1.9 -22.2 35 150 A D T 3 S- 0 0 29 3,-0.1 -23,-0.1 1,-0.0 -2,-0.1 0.584 101.5-133.4 -75.5 -5.9 -11.5 3.4 -25.7 36 151 A E S < S+ 0 0 115 -3,-2.3 3,-0.1 2,-0.2 -24,-0.0 0.789 92.4 67.2 57.6 30.5 -8.0 4.0 -24.4 37 152 A R S S+ 0 0 120 1,-0.3 20,-3.1 -4,-0.2 2,-0.4 0.508 74.8 78.0-140.3 -47.9 -8.3 7.5 -25.8 38 153 A T E + D 0 56A 10 18,-0.2 -5,-2.9 16,-0.0 2,-0.3 -0.611 64.2 175.5 -77.5 129.8 -10.9 9.5 -23.9 39 154 A A E -CD 32 55A 0 16,-2.6 16,-3.2 -2,-0.4 2,-0.6 -0.973 38.4-144.4-142.2 149.6 -9.6 10.8 -20.5 40 155 A L E -CD 31 54A 0 -9,-2.6 -9,-2.2 -2,-0.3 2,-0.4 -0.956 36.0-172.1-109.5 112.4 -10.3 12.9 -17.5 41 156 A Y E +CD 30 53A 52 12,-3.3 12,-3.0 -2,-0.6 2,-0.3 -0.882 33.0 49.5-118.2 134.9 -7.0 14.5 -16.5 42 157 A G E S+CD 29 52A 9 -13,-2.9 -13,-2.4 -2,-0.4 2,-0.6 -0.956 82.5 21.9 152.9-127.7 -6.1 16.5 -13.4 43 158 A K E + D 0 51A 76 8,-2.4 7,-2.9 -2,-0.3 8,-2.3 -0.693 54.4 164.9 -95.5 116.5 -6.3 16.3 -9.7 44 159 A F E -CD 26 49A 2 -18,-2.4 -18,-2.5 -2,-0.6 2,-0.5 -0.956 22.6-155.8-124.4 145.0 -6.8 12.9 -7.9 45 160 A I E > S- D 0 48A 87 3,-2.5 3,-1.9 -2,-0.4 -20,-0.2 -0.967 82.1 -23.7-121.1 115.7 -6.5 11.9 -4.3 46 161 A D T 3 S- 0 0 97 -2,-0.5 -21,-0.2 1,-0.3 -1,-0.1 0.874 129.3 -47.6 51.4 44.1 -5.8 8.1 -3.7 47 162 A G T 3 S+ 0 0 20 -23,-2.8 2,-0.5 1,-0.2 -1,-0.3 0.284 112.5 123.6 86.6 -10.3 -7.3 7.3 -7.1 48 163 A E E < -D 45 0A 94 -3,-1.9 -3,-2.5 -24,-0.2 2,-0.5 -0.732 65.5-120.7 -90.9 127.6 -10.4 9.5 -6.4 49 164 A M E +D 44 0A 2 -2,-0.5 29,-3.2 147,-0.4 -5,-0.2 -0.505 39.4 162.9 -70.2 116.4 -11.2 12.2 -9.0 50 165 A I E S+ 0 0 62 -7,-2.9 2,-0.3 -2,-0.5 -6,-0.2 0.818 80.4 1.0 -95.3 -46.9 -11.2 15.7 -7.5 51 166 A E E S+D 43 0A 88 -8,-2.3 -8,-2.4 26,-0.1 2,-0.6 -0.775 71.0 176.5-147.4 98.9 -10.9 17.6 -10.7 52 167 A G E -DE 42 76A 0 24,-3.2 24,-2.9 -2,-0.3 2,-0.3 -0.922 12.8-158.9-105.7 118.5 -10.7 15.8 -14.0 53 168 A K E -DE 41 75A 73 -12,-3.0 -12,-3.3 -2,-0.6 22,-0.2 -0.755 33.2 -98.2 -95.0 143.0 -10.6 17.9 -17.2 54 169 A L E +D 40 0A 28 20,-2.0 16,-2.7 -2,-0.3 2,-0.3 -0.376 59.4 158.7 -64.1 130.7 -11.7 16.3 -20.5 55 170 A A E -DF 39 69A 1 -16,-3.2 -16,-2.6 14,-0.3 2,-0.4 -0.904 37.2-123.5-145.8 169.7 -8.6 15.2 -22.4 56 171 A T E -DF 38 68A 36 12,-2.4 12,-1.8 -2,-0.3 2,-1.1 -0.991 20.6-130.5-123.3 130.3 -7.3 12.9 -25.1 57 172 A L E + F 0 67A 21 -20,-3.1 10,-0.2 -2,-0.4 3,-0.1 -0.668 31.2 178.2 -75.9 100.5 -4.6 10.3 -24.6 58 173 A M E - 0 0 93 8,-2.3 2,-0.3 -2,-1.1 -1,-0.2 0.902 56.9 -23.5 -76.6 -41.9 -2.4 11.2 -27.7 59 174 A S E - F 0 66A 68 7,-1.0 7,-3.3 -3,-0.1 2,-0.4 -0.982 49.7-137.7-162.1 165.7 0.4 8.7 -27.2 60 175 A T E - F 0 65A 68 -2,-0.3 2,-0.5 5,-0.3 -3,-0.0 -1.000 13.1-168.0-131.9 133.8 2.2 6.5 -24.7 61 176 A E E > S- F 0 64A 127 3,-2.4 3,-2.0 -2,-0.4 -2,-0.0 -0.955 76.1 -24.9-127.1 115.5 6.0 6.1 -24.6 62 177 A E T 3 S- 0 0 161 -2,-0.5 -1,-0.1 1,-0.3 0, 0.0 0.903 129.7 -47.3 49.1 45.4 7.4 3.3 -22.4 63 178 A G T 3 S+ 0 0 30 1,-0.2 -1,-0.3 -61,-0.1 -61,-0.0 0.394 112.8 123.9 82.8 -4.5 4.3 3.5 -20.3 64 179 A R E < -F 61 0A 112 -3,-2.0 -3,-2.4 -49,-0.0 -1,-0.2 -0.820 53.6-144.1 -96.2 111.5 4.4 7.3 -20.1 65 180 A P E -F 60 0A 33 0, 0.0 2,-0.6 0, 0.0 -5,-0.3 -0.416 4.1-149.1 -78.1 145.0 1.1 8.8 -21.3 66 181 A H E -F 59 0A 98 -7,-3.3 -8,-2.3 -2,-0.1 -7,-1.0 -0.955 18.6-167.4-112.3 115.5 0.9 12.1 -23.2 67 182 A F E -F 57 0A 31 -2,-0.6 2,-0.4 -10,-0.2 -10,-0.2 -0.784 11.0-167.4-102.8 145.3 -2.4 13.9 -22.6 68 183 A E E -F 56 0A 105 -12,-1.8 -12,-2.4 -2,-0.3 2,-0.0 -0.994 27.1-123.2-129.4 121.5 -3.7 16.9 -24.5 69 184 A L E -F 55 0A 90 -2,-0.4 -14,-0.3 -14,-0.2 -15,-0.1 -0.354 22.6-122.7 -67.4 141.8 -6.6 18.7 -22.9 70 185 A M - 0 0 84 -16,-2.7 -1,-0.1 4,-0.1 4,-0.1 -0.472 38.0 -91.9 -75.3 154.2 -9.9 19.1 -24.9 71 186 A P S S+ 0 0 114 0, 0.0 3,-0.3 0, 0.0 2,-0.1 -0.320 86.8 34.2 -64.0 152.5 -11.2 22.6 -25.6 72 187 A G S S- 0 0 64 1,-0.1 -2,-0.0 -3,-0.1 -3,-0.0 -0.462 94.9 -72.4 104.6-172.6 -13.6 24.0 -23.2 73 188 A N + 0 0 157 -2,-0.1 2,-0.8 2,-0.1 -1,-0.1 0.016 64.9 148.2-117.4 24.9 -14.3 23.9 -19.4 74 189 A S + 0 0 49 -3,-0.3 -20,-2.0 -4,-0.1 2,-0.4 -0.513 20.6 167.6 -62.9 105.4 -15.7 20.4 -19.1 75 190 A V E -E 53 0A 64 -2,-0.8 2,-0.3 -22,-0.2 -22,-0.2 -0.962 13.7-168.7-121.1 147.9 -14.5 19.3 -15.6 76 191 A Y E -E 52 0A 11 -24,-2.9 -24,-3.2 -2,-0.4 2,-0.3 -0.888 3.3-170.6-130.7 157.0 -15.7 16.3 -13.7 77 192 A H - 0 0 78 -2,-0.3 2,-0.3 -26,-0.2 -27,-0.2 -0.964 44.3 -83.4-142.4 157.2 -15.3 15.0 -10.1 78 193 A F + 0 0 67 -29,-3.2 119,-0.2 -2,-0.3 120,-0.2 -0.526 55.7 166.2 -57.9 123.0 -16.1 11.8 -8.1 79 194 A D - 0 0 18 118,-3.4 9,-0.2 -2,-0.3 10,-0.1 -0.401 13.4-171.8-146.8 53.8 -19.8 12.5 -7.4 80 195 A K - 0 0 97 116,-0.1 119,-0.1 1,-0.1 118,-0.1 -0.247 25.1-115.1 -62.5 137.9 -21.2 9.1 -6.2 81 196 A S - 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