==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-MAR-07 2EJ0 . COMPND 2 MOLECULE: BRANCHED-CHAIN AMINO ACID AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR M.GOTO . 1794 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53097.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1304 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 101 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 366 20.4 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 . 12 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 27 1.5 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 . 7 0.4 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 . 127 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 200 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 408 22.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 30 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 0 14 0 0 0 0 0 0 6 6 18 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 12 1 5 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 . 6 15 33 9 12 0 0 6 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 0 0 0 0 0 0 12 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 2 A Q 0 0 182 0, 0.0 2,-0.5 0, 0.0 1310,-0.2 0.000 360.0 360.0 360.0 161.8 -22.3 22.6 29.8 2 3 A I - 0 0 16 1308,-0.6 2,-1.4 1310,-0.1 3,-0.3 -0.790 360.0-143.4 -93.4 129.2 -19.5 23.2 27.3 3 4 A K + 0 0 171 -2,-0.5 121,-0.5 1,-0.2 -1,-0.0 -0.620 48.5 139.7 -92.0 77.5 -20.5 24.8 24.0 4 5 A A - 0 0 0 -2,-1.4 2,-0.4 1,-0.2 118,-0.3 0.839 30.7-174.9 -88.1 -38.9 -18.1 22.9 21.7 5 6 A G + 0 0 32 -3,-0.3 11,-0.5 116,-0.1 2,-0.4 -0.624 58.2 26.2 81.0-131.3 -20.4 22.3 18.8 6 7 A L S S- 0 0 60 -2,-0.4 2,-0.4 9,-0.2 116,-0.2 -0.545 73.4-164.9 -73.1 125.8 -18.8 20.1 16.0 7 8 A I E -A 14 0A 0 7,-2.8 7,-2.3 -2,-0.4 2,-0.5 -0.932 20.1-126.7-116.5 134.1 -16.1 17.8 17.4 8 9 A W E -AB 13 120A 12 112,-2.4 112,-2.0 -2,-0.4 2,-0.5 -0.676 29.7-171.9 -78.3 121.0 -13.6 15.9 15.3 9 10 A M E > -AB 12 119A 32 3,-3.4 3,-1.5 -2,-0.5 110,-0.2 -0.938 60.7 -43.7-121.8 109.5 -13.8 12.2 16.3 10 11 A N T 3 S- 0 0 61 108,-2.9 109,-0.1 -2,-0.5 -1,-0.1 0.838 130.8 -22.3 39.0 52.3 -11.1 9.9 14.9 11 12 A G T 3 S+ 0 0 44 107,-0.1 2,-0.3 1,-0.1 -1,-0.3 0.259 127.6 60.5 108.3 -14.4 -11.2 11.3 11.4 12 13 A A E < S-A 9 0A 54 -3,-1.5 -3,-3.4 -5,-0.1 2,-0.2 -1.000 74.7-112.5-150.1 148.5 -14.6 13.0 11.1 13 14 A F E +A 8 0A 41 -2,-0.3 -5,-0.2 -5,-0.3 -7,-0.1 -0.552 36.5 173.1 -80.5 141.9 -16.7 15.7 12.6 14 15 A V E -A 7 0A 32 -7,-2.3 -7,-2.8 -2,-0.2 5,-0.1 -0.955 40.5 -82.6-143.0 158.2 -19.8 14.9 14.6 15 16 A P >> - 0 0 46 0, 0.0 3,-2.3 0, 0.0 4,-0.6 -0.312 44.9-112.2 -61.4 148.6 -22.3 16.8 16.8 16 17 A Q G >4 S+ 0 0 21 -11,-0.5 3,-1.9 1,-0.3 1214,-0.2 0.887 117.4 60.0 -47.4 -47.2 -21.1 17.3 20.4 17 18 A E G 34 S+ 0 0 132 1,-0.3 -1,-0.3 1212,-0.1 0, 0.0 0.705 105.3 49.7 -56.9 -21.3 -23.9 15.0 21.6 18 19 A E G <4 S+ 0 0 126 -3,-2.3 2,-1.9 1,-0.1 -1,-0.3 0.530 83.3 96.2 -95.8 -8.3 -22.4 12.2 19.5 19 20 A A << + 0 0 0 -3,-1.9 1211,-2.4 -4,-0.6 1212,-0.3 -0.549 59.9 129.4 -83.7 76.1 -18.8 12.7 20.8 20 21 A K E -I 1229 0B 96 -2,-1.9 2,-0.3 1209,-0.3 1209,-0.2 -0.851 39.2-159.7-128.2 163.3 -18.9 10.0 23.4 21 22 A T E -I 1228 0B 5 1207,-2.7 1207,-2.7 -2,-0.3 4,-0.1 -0.976 36.1 -81.1-142.6 153.9 -16.8 7.1 24.5 22 23 A S E > -I 1227 0B 12 -2,-0.3 3,-1.6 1205,-0.2 1205,-0.3 -0.178 28.7-132.6 -54.1 142.7 -17.3 3.9 26.5 23 24 A V T 3 S+ 0 0 0 1203,-2.3 -1,-0.2 1,-0.3 1204,-0.1 0.467 107.8 67.3 -75.6 -0.0 -17.2 4.2 30.3 24 25 A L T 3 S+ 0 0 0 1202,-0.3 -1,-0.3 1185,-0.0 2,-0.2 0.265 72.0 133.2-100.0 8.7 -14.9 1.2 30.1 25 26 A S X> - 0 0 0 -3,-1.6 3,-1.6 1,-0.1 4,-0.9 -0.432 63.3-130.2 -64.4 129.6 -12.2 3.3 28.3 26 27 A H H >> S+ 0 0 0 76,-2.8 4,-2.7 1,-0.3 3,-1.1 0.863 106.2 56.5 -46.2 -46.1 -8.8 2.7 29.9 27 28 A A H 3> S+ 0 0 0 74,-2.3 4,-1.3 1,-0.3 -1,-0.3 0.765 99.8 58.0 -62.4 -27.6 -8.2 6.4 30.2 28 29 A L H <4 S+ 0 0 0 -3,-1.6 -1,-0.3 73,-0.3 -2,-0.2 0.738 117.9 33.1 -75.5 -20.8 -11.3 6.9 32.3 29 30 A H H << S+ 0 0 0 -3,-1.1 1331,-0.2 -4,-0.9 -2,-0.2 0.758 132.5 24.6-102.4 -32.3 -10.0 4.5 34.8 30 31 A Y H < S- 0 0 10 -4,-2.7 1334,-0.2 -5,-0.2 -3,-0.2 0.257 97.1-113.2-123.7 11.9 -6.2 5.0 34.7 31 32 A G < + 0 0 0 -4,-1.3 123,-2.1 -5,-0.2 2,-1.9 0.630 60.3 152.4 66.4 17.4 -5.6 8.5 33.5 32 33 A T + 0 0 1 -6,-0.3 69,-1.9 121,-0.2 2,-0.3 -0.418 32.0 103.5 -83.1 66.4 -4.0 7.2 30.3 33 34 A S E -C 100 0A 0 -2,-1.9 120,-2.7 67,-0.2 2,-0.3 -0.891 51.8-151.5-137.0 164.1 -4.7 10.1 28.0 34 35 A V E +CD 99 152A 0 65,-2.6 65,-2.8 -2,-0.3 2,-0.3 -0.979 20.2 171.9-136.5 148.0 -2.7 13.0 26.5 35 36 A F E -C 98 0A 3 116,-1.8 2,-0.3 -2,-0.3 63,-0.2 -0.918 18.7-141.9-148.8 174.0 -4.0 16.4 25.5 36 37 A E - 0 0 0 61,-1.7 2,-0.4 -2,-0.3 20,-0.0 -0.909 9.1-142.3-136.6 164.9 -3.0 19.9 24.4 37 38 A G + 0 0 0 -2,-0.3 2,-0.4 59,-0.2 59,-0.2 -0.976 29.9 169.9-130.5 113.9 -4.2 23.4 25.0 38 39 A I E -E 95 0A 0 57,-2.5 57,-3.8 -2,-0.4 2,-0.4 -0.968 17.1-149.8-129.8 144.0 -4.1 25.7 21.9 39 40 A R E -E 94 0A 7 -2,-0.4 11,-2.7 11,-0.4 2,-0.4 -0.878 5.3-160.8-118.3 149.1 -5.5 29.1 21.3 40 41 A A E -EF 93 49A 0 53,-2.3 53,-1.5 -2,-0.4 2,-0.3 -0.973 15.7-164.6-120.5 135.7 -6.7 30.9 18.2 41 42 A Y E - F 0 48A 14 7,-2.6 7,-2.5 -2,-0.4 2,-0.3 -0.886 24.2-107.9-121.3 154.4 -6.9 34.7 18.3 42 43 A E + 0 0 77 -2,-0.3 2,-0.3 5,-0.2 49,-0.1 -0.586 43.5 172.1 -79.2 139.7 -8.7 37.2 16.0 43 44 A T > - 0 0 25 -2,-0.3 3,-1.9 3,-0.2 242,-0.1 -0.869 51.7 -94.1-139.0 173.9 -6.5 39.2 13.7 44 45 A A T 3 S+ 0 0 111 240,-0.5 241,-0.1 1,-0.3 -2,-0.0 0.650 128.4 47.7 -64.7 -14.0 -6.9 41.6 10.8 45 46 A K T 3 S- 0 0 134 1,-0.5 253,-0.3 253,-0.0 -1,-0.3 -0.027 124.1 -93.7-116.3 28.8 -6.5 38.5 8.6 46 47 A G S < S- 0 0 17 -3,-1.9 -1,-0.5 252,-0.1 -3,-0.2 -0.258 75.9 -12.6 89.4-179.2 -8.9 36.3 10.4 47 48 A P - 0 0 12 0, 0.0 250,-2.4 0, 0.0 251,-0.6 -0.243 60.4-165.7 -57.6 138.1 -8.4 33.7 13.1 48 49 A A E -FG 41 296A 0 -7,-2.5 -7,-2.6 43,-0.3 2,-0.4 -0.992 12.9-141.7-131.9 124.2 -4.8 32.7 13.8 49 50 A I E > -FG 40 295A 0 246,-2.6 246,-1.7 -2,-0.4 2,-0.6 -0.705 26.0-123.3 -84.7 133.5 -3.8 29.7 15.8 50 51 A F E 3 S- G 0 294A 6 -11,-2.7 -11,-0.4 -2,-0.4 244,-0.2 -0.700 75.8 -25.1 -87.9 121.1 -0.7 30.4 18.0 51 52 A R T 3> S+ 0 0 16 242,-3.4 4,-1.8 -2,-0.6 -1,-0.2 0.888 73.8 169.9 45.8 53.7 2.3 28.1 17.5 52 53 A L H <> S+ 0 0 4 -3,-0.5 4,-2.7 241,-0.4 5,-0.2 0.902 70.9 57.4 -56.3 -46.3 0.3 25.2 16.2 53 54 A K H > S+ 0 0 80 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.915 106.8 46.6 -52.8 -51.9 3.4 23.3 15.2 54 55 A E H > S+ 0 0 40 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.878 112.8 49.9 -62.2 -39.8 4.9 23.3 18.7 55 56 A H H X S+ 0 0 2 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.925 112.1 47.0 -66.7 -43.0 1.6 22.2 20.3 56 57 A V H X S+ 0 0 6 -4,-2.7 4,-2.1 2,-0.2 5,-0.2 0.917 111.3 52.1 -65.2 -40.8 1.1 19.3 17.8 57 58 A K H X S+ 0 0 72 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.927 110.6 47.7 -60.2 -44.2 4.7 18.2 18.3 58 59 A R H X S+ 0 0 21 -4,-2.2 4,-2.8 2,-0.2 93,-0.3 0.853 106.2 59.0 -65.8 -33.4 4.3 18.2 22.1 59 60 A F H X S+ 0 0 4 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.952 110.7 40.8 -59.2 -50.2 1.0 16.2 21.7 60 61 A Y H X S+ 0 0 45 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.842 113.1 55.5 -68.1 -32.0 2.8 13.4 19.9 61 62 A N H X S+ 0 0 17 -4,-2.0 4,-1.4 -5,-0.2 -2,-0.2 0.898 106.4 50.4 -66.2 -40.7 5.7 13.7 22.3 62 63 A S H X S+ 0 0 0 -4,-2.8 4,-1.0 1,-0.2 3,-0.3 0.915 108.3 53.4 -63.0 -42.0 3.3 13.2 25.3 63 64 A A H ><>S+ 0 0 3 -4,-1.9 5,-2.9 1,-0.2 3,-0.7 0.903 103.3 56.9 -60.1 -40.7 1.9 10.2 23.5 64 65 A K H ><5S+ 0 0 46 -4,-1.9 3,-1.2 1,-0.2 -1,-0.2 0.858 98.4 61.1 -59.9 -35.2 5.4 8.7 23.2 65 66 A V H 3<5S+ 0 0 0 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.869 111.1 39.0 -59.7 -36.1 5.9 8.9 27.0 66 67 A L T <<5S- 0 0 3 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.374 113.1-118.5 -93.0 3.5 2.9 6.5 27.4 67 68 A R T < 5 + 0 0 58 -3,-1.2 2,-0.4 -4,-0.4 -3,-0.2 0.866 61.3 161.6 58.0 35.3 4.0 4.4 24.4 68 69 A M < - 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