==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-AUG-10 3OPE . COMPND 2 MOLECULE: PROBABLE HISTONE-LYSINE N-METHYLTRANSFERASE ASH1L . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.AN,J.SONG . 408 5 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21403.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 239 58.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 17.2 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 . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 55 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 23 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.7 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 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 6 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 1 4 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 3 2 2 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 2068 A S 0 0 170 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 53.4 -0.8 9.7 22.1 2 2069 A Y - 0 0 50 141,-0.0 2,-0.5 140,-0.0 140,-0.2 -0.741 360.0-108.2-119.3 166.6 -3.0 9.6 19.0 3 2070 A K E -a 142 0A 124 138,-3.3 140,-1.4 -2,-0.2 2,-0.5 -0.844 31.9-128.7 -98.7 127.3 -2.7 10.7 15.4 4 2071 A K E +a 143 0A 113 -2,-0.5 2,-0.3 138,-0.2 140,-0.2 -0.596 33.0 174.0 -77.9 118.8 -4.7 13.8 14.3 5 2072 A I - 0 0 14 138,-1.2 98,-0.1 -2,-0.5 3,-0.1 -0.869 30.5-153.6-121.6 158.6 -6.8 13.3 11.2 6 2073 A R S S+ 0 0 132 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.379 81.6 26.6-108.7 -1.0 -9.4 15.5 9.6 7 2074 A S S S- 0 0 54 136,-0.0 -1,-0.1 97,-0.0 136,-0.1 -0.983 93.6 -80.2-156.0 159.9 -11.4 12.7 8.0 8 2075 A N - 0 0 16 -2,-0.3 2,-0.6 95,-0.1 97,-0.2 -0.294 34.8-139.9 -64.9 149.2 -12.2 9.1 8.5 9 2076 A V E -b 105 0B 52 95,-2.3 97,-1.1 133,-0.0 2,-0.9 -0.950 13.8-146.0-112.9 107.8 -9.7 6.5 7.3 10 2077 A Y E +b 106 0B 93 -2,-0.6 97,-0.1 95,-0.2 95,-0.1 -0.678 24.6 171.4 -84.0 106.3 -11.5 3.6 5.7 11 2078 A V - 0 0 62 95,-1.7 96,-0.2 -2,-0.9 -1,-0.2 0.979 69.8 -18.5 -75.8 -84.3 -9.6 0.4 6.5 12 2079 A D S S+ 0 0 71 94,-0.4 2,-0.3 96,-0.0 95,-0.1 0.285 119.1 54.1-114.2 11.1 -11.4 -2.7 5.4 13 2080 A V - 0 0 25 93,-0.6 93,-0.1 95,-0.1 95,-0.0 -0.804 57.0-141.3-140.3 179.7 -15.0 -1.6 5.0 14 2081 A K - 0 0 163 -2,-0.3 2,-0.7 2,-0.1 121,-0.1 -0.937 10.0-152.4-147.3 117.9 -17.5 0.8 3.5 15 2082 A P + 0 0 3 0, 0.0 153,-2.9 0, 0.0 2,-0.4 -0.182 28.1 172.7 -82.7 39.6 -20.5 2.3 5.3 16 2083 A L B -F 167 0C 113 -2,-0.7 151,-0.3 151,-0.2 -2,-0.1 -0.343 21.7-158.9 -56.0 109.1 -22.7 2.7 2.2 17 2084 A S - 0 0 15 149,-1.2 -1,-0.2 -2,-0.4 150,-0.1 0.805 23.9-137.8 -60.8 -32.2 -26.1 3.8 3.5 18 2085 A G + 0 0 72 148,-0.7 2,-0.4 1,-0.1 -1,-0.1 0.675 66.4 104.1 82.8 16.7 -27.6 2.7 0.3 19 2086 A Y - 0 0 40 147,-0.0 2,-1.4 2,-0.0 147,-0.2 -0.865 60.9-145.6-141.6 109.6 -30.0 5.6 -0.1 20 2087 A E - 0 0 187 -2,-0.4 2,-0.7 145,-0.1 28,-0.0 -0.521 17.7-160.1 -69.3 87.5 -29.5 8.5 -2.6 21 2088 A A + 0 0 15 -2,-1.4 30,-0.5 28,-0.1 2,-0.3 -0.616 28.2 156.7 -74.5 111.0 -31.0 11.5 -0.7 22 2089 A T + 0 0 63 -2,-0.7 28,-0.0 1,-0.2 26,-0.0 -0.895 38.3 28.8-136.8 164.6 -31.7 14.1 -3.3 23 2090 A T - 0 0 92 -2,-0.3 -1,-0.2 28,-0.2 19,-0.1 0.920 53.5-169.7 52.9 58.3 -33.9 17.2 -4.1 24 2091 A C - 0 0 1 1,-0.2 2,-3.6 -3,-0.1 18,-0.6 0.570 15.2-160.8 -53.0 -8.1 -34.3 18.4 -0.5 25 2092 A N + 0 0 96 16,-0.2 -1,-0.2 1,-0.1 3,-0.1 0.093 40.9 135.8 52.2 -29.9 -36.9 20.7 -2.0 26 2093 A b - 0 0 15 -2,-3.6 31,-0.1 1,-0.1 -1,-0.1 -0.263 63.0-107.5 -49.6 130.0 -36.9 23.2 1.0 27 2094 A K - 0 0 159 1,-0.1 30,-0.1 29,-0.1 -1,-0.1 -0.240 27.2-105.4 -67.1 151.8 -36.8 26.6 -0.7 28 2095 A K - 0 0 149 28,-0.2 -1,-0.1 1,-0.1 29,-0.1 -0.482 33.1-122.0 -77.5 142.2 -33.9 29.0 -0.9 29 2096 A P - 0 0 56 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.648 7.2-135.2 -54.3-141.7 -33.8 32.2 1.2 30 2097 A D S S+ 0 0 144 1,-0.3 2,-0.5 4,-0.0 3,-0.1 0.248 82.2 65.5-159.4 -24.2 -33.4 35.7 -0.1 31 2098 A D - 0 0 97 1,-0.2 -1,-0.3 4,-0.1 3,-0.1 -0.953 67.4-145.9-117.1 126.7 -30.8 37.2 2.2 32 2099 A D S S+ 0 0 130 -2,-0.5 -1,-0.2 1,-0.2 0, 0.0 0.911 100.9 69.1 -50.7 -40.3 -27.2 36.0 2.3 33 2100 A T S S+ 0 0 131 -3,-0.1 -1,-0.2 2,-0.0 0, 0.0 0.913 95.9 49.7 -41.7 -69.7 -27.7 36.8 6.0 34 2101 A R S S- 0 0 165 -3,-0.1 2,-0.1 1,-0.1 -4,-0.0 -0.056 89.3-104.8 -70.9 174.8 -30.1 34.1 6.9 35 2102 A K - 0 0 110 1,-0.1 -4,-0.1 -6,-0.0 3,-0.1 -0.401 15.0-134.4 -97.0 175.4 -29.8 30.3 6.2 36 2103 A G S S+ 0 0 7 1,-0.2 2,-1.0 -2,-0.1 25,-0.2 0.898 82.3 52.3 -99.4 -51.4 -31.5 28.1 3.7 37 2104 A a S S- 0 0 1 3,-0.1 -1,-0.2 20,-0.1 -9,-0.1 -0.721 71.2-165.3 -97.8 92.0 -32.8 24.7 5.1 38 2105 A V - 0 0 87 -2,-1.0 -2,-0.1 1,-0.2 24,-0.1 0.431 55.5 -57.9 -51.1-162.2 -34.9 25.4 8.2 39 2106 A D S S+ 0 0 93 6,-0.0 -1,-0.2 5,-0.0 -2,-0.0 0.241 130.6 50.0 -70.6 19.1 -35.9 22.8 10.7 40 2107 A D + 0 0 90 5,-0.0 4,-0.3 4,-0.0 5,-0.1 0.354 47.2 136.6-120.4-112.7 -37.4 21.1 7.7 41 2108 A b >> - 0 0 2 1,-0.1 3,-1.3 2,-0.1 4,-0.7 0.933 65.0-112.6 51.7 96.8 -36.1 20.2 4.2 42 2109 A L T 34 S+ 0 0 116 -18,-0.6 3,-0.4 1,-0.3 4,-0.4 0.628 112.5 61.0 -24.7 -37.0 -37.3 16.6 3.5 43 2110 A N T >4>S+ 0 0 7 1,-0.2 3,-2.8 -19,-0.2 5,-1.6 0.972 96.2 54.1 -64.7 -56.7 -33.7 15.3 3.6 44 2111 A R G X45S+ 0 0 33 -3,-1.3 3,-1.0 1,-0.3 -1,-0.2 0.684 98.7 70.5 -53.0 -14.6 -32.8 16.3 7.2 45 2112 A M G 3<5S+ 0 0 25 -4,-0.7 175,-2.8 -3,-0.4 176,-0.5 0.750 104.6 36.7 -75.4 -24.9 -36.0 14.3 8.0 46 2113 A I G < 5S- 0 0 29 -3,-2.8 117,-0.3 -4,-0.4 -1,-0.3 -0.178 119.5-107.7-117.2 36.2 -34.3 11.0 7.1 47 2114 A F T < 5S+ 0 0 15 -3,-1.0 116,-2.0 1,-0.2 2,-0.6 0.786 77.3 135.9 40.9 41.3 -30.9 12.1 8.5 48 2115 A A B < -g 163 0C 0 -5,-1.6 -2,-0.2 114,-0.2 -1,-0.2 -0.896 50.0-138.9-121.4 102.8 -29.5 12.5 5.0 49 2116 A E - 0 0 4 114,-0.6 116,-0.3 -2,-0.6 2,-0.2 -0.084 34.9 -94.3 -51.4 158.1 -27.5 15.7 4.3 50 2117 A C - 0 0 1 13,-2.3 -1,-0.1 114,-0.1 -28,-0.1 -0.539 28.1-118.4 -82.4 142.8 -28.1 17.3 0.9 51 2118 A S >> - 0 0 19 -30,-0.5 4,-1.1 -2,-0.2 3,-0.9 -0.714 24.9-137.1 -79.9 108.4 -26.0 16.5 -2.1 52 2119 A P T 34 S+ 0 0 69 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 0.763 95.9 70.9 -31.9 -44.6 -24.5 20.0 -2.9 53 2120 A N T 34 S+ 0 0 133 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.045 114.4 18.2 -71.3 30.0 -25.2 19.4 -6.6 54 2121 A T T <4 S+ 0 0 64 -2,-0.9 -1,-0.2 -3,-0.9 -32,-0.1 0.348 81.2 128.4-167.8 -22.7 -29.0 19.7 -6.3 55 2122 A C >< - 0 0 10 -4,-1.1 3,-2.2 1,-0.2 -1,-0.1 -0.289 55.5-138.5 -55.4 122.0 -29.9 21.4 -3.1 56 2123 A P T 3 S+ 0 0 42 0, 0.0 -28,-0.2 0, 0.0 -1,-0.2 0.733 99.1 62.3 -52.7 -26.0 -32.3 24.3 -3.9 57 2124 A C T > S- 0 0 10 -31,-0.1 3,-1.0 1,-0.1 -2,-0.1 0.427 90.2-158.4 -86.1 2.5 -30.5 26.5 -1.3 58 2125 A G T < - 0 0 34 -3,-2.2 -1,-0.1 1,-0.2 -22,-0.1 0.193 60.4 -18.3 47.2-173.3 -27.2 26.5 -3.1 59 2126 A E T 3 S+ 0 0 168 1,-0.2 2,-0.9 3,-0.0 -1,-0.2 0.653 133.1 67.0 -34.4 -25.6 -23.9 27.2 -1.3 60 2127 A Q S < S+ 0 0 85 -3,-1.0 -1,-0.2 -25,-0.1 2,-0.2 -0.642 74.2 112.0-106.7 77.9 -26.0 28.8 1.5 61 2128 A C - 0 0 3 -2,-0.9 -25,-0.1 -25,-0.2 -2,-0.0 -0.286 55.6-146.3-118.5-158.9 -27.8 25.8 2.9 62 2129 A C S S+ 0 0 18 -2,-0.2 3,-0.3 -27,-0.1 -3,-0.0 0.262 77.4 82.5-163.8 9.6 -27.4 24.3 6.3 63 2130 A N S S+ 0 0 0 1,-0.2 -13,-2.3 2,-0.1 -25,-0.0 -0.199 78.9 68.4-115.5 39.6 -27.9 20.6 5.8 64 2131 A Q >> + 0 0 5 -15,-0.2 4,-2.0 -13,-0.1 3,-0.7 0.083 58.6 130.1-136.5 13.0 -24.4 19.7 4.6 65 2132 A R T 34>S+ 0 0 31 -3,-0.3 5,-2.4 1,-0.3 -2,-0.1 0.767 72.7 47.3 -40.7 -44.2 -22.7 20.4 7.9 66 2133 A I T >45S+ 0 0 0 3,-0.2 3,-0.8 2,-0.2 -1,-0.3 0.887 114.6 46.8 -70.8 -39.5 -20.8 17.2 8.0 67 2134 A Q T <45S+ 0 0 38 -3,-0.7 2,-0.2 1,-0.2 -2,-0.2 1.000 111.8 47.4 -62.9 -69.0 -19.6 17.5 4.4 68 2135 A R T 3<5S- 0 0 89 -4,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.330 108.7-125.8 -58.3 12.9 -18.4 21.1 4.7 69 2136 A H T < 5 + 0 0 55 -3,-0.8 2,-1.1 -5,-0.2 -3,-0.2 0.887 43.4 172.8 39.8 53.9 -16.6 20.2 7.9 70 2137 A E < + 0 0 75 -5,-2.4 -1,-0.2 -6,-0.1 -4,-0.1 -0.282 11.2 166.1 -88.0 51.9 -18.5 23.0 9.7 71 2138 A W - 0 0 28 -2,-1.1 2,-0.3 1,-0.1 29,-0.2 -0.270 45.0 -96.6 -66.9 154.3 -17.3 22.0 13.2 72 2139 A V - 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