==== 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 2EJ2 . COMPND 2 MOLECULE: BRANCHED-CHAIN AMINO ACID AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR M.GOTO . 1793 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 52259.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1301 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 99 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 368 20.5 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 . 124 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 203 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 404 22.5 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 13 0 0 0 0 0 0 6 9 13 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 12 3 3 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 31 11 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 0 193 0, 0.0 2,-0.4 0, 0.0 1307,-0.2 0.000 360.0 360.0 360.0 158.7 -22.2 22.5 29.9 2 3 A I - 0 0 18 1305,-0.6 2,-1.6 1307,-0.1 3,-0.3 -0.808 360.0-139.2 -96.2 131.0 -19.4 23.4 27.5 3 4 A K + 0 0 77 -2,-0.4 121,-0.5 1,-0.2 -1,-0.0 -0.576 52.5 137.0 -89.7 75.3 -20.3 25.1 24.2 4 5 A A - 0 0 0 -2,-1.6 2,-0.4 1,-0.2 118,-0.3 0.831 32.1-175.9 -88.8 -37.9 -18.0 23.1 22.0 5 6 A G + 0 0 31 -3,-0.3 11,-0.6 116,-0.1 2,-0.4 -0.633 57.7 27.2 80.6-126.3 -20.2 22.4 19.0 6 7 A L E S-A 15 0A 59 -2,-0.4 2,-0.4 9,-0.2 116,-0.2 -0.619 73.4-163.5 -78.1 126.6 -18.7 20.3 16.3 7 8 A I E -A 14 0A 0 7,-3.1 7,-2.3 -2,-0.4 2,-0.6 -0.930 19.9-126.9-116.8 131.9 -16.0 17.9 17.6 8 9 A W E -AB 13 120A 10 112,-2.3 112,-1.8 -2,-0.4 2,-0.6 -0.654 30.7-172.6 -76.0 116.8 -13.4 16.1 15.5 9 10 A M E > -AB 12 119A 33 3,-3.4 3,-1.2 -2,-0.6 110,-0.2 -0.932 61.0 -40.9-119.1 108.9 -13.6 12.4 16.5 10 11 A N T 3 S- 0 0 64 108,-3.0 -1,-0.1 -2,-0.6 109,-0.1 0.857 130.8 -24.1 42.9 52.0 -11.0 10.1 15.1 11 12 A G T 3 S+ 0 0 44 107,-0.1 2,-0.3 1,-0.1 -1,-0.3 0.327 127.4 63.7 104.2 -9.6 -10.9 11.6 11.6 12 13 A A E < S-A 9 0A 53 -3,-1.2 -3,-3.4 -5,-0.1 2,-0.2 -0.998 75.1-113.0-152.0 146.6 -14.3 13.2 11.2 13 14 A F E +A 8 0A 31 -2,-0.3 -5,-0.2 -5,-0.3 -7,-0.1 -0.541 36.8 173.0 -79.0 139.4 -16.4 16.0 12.8 14 15 A V E -A 7 0A 32 -7,-2.3 -7,-3.1 -2,-0.2 5,-0.1 -0.962 40.2 -84.3-142.0 156.4 -19.5 15.1 14.7 15 16 A P E >> -A 6 0A 62 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.251 45.2-111.6 -58.8 151.7 -22.1 17.0 16.8 16 17 A Q G >4 S+ 0 0 34 -11,-0.6 3,-2.6 1,-0.3 -10,-0.1 0.921 115.8 59.6 -50.7 -52.8 -21.0 17.5 20.4 17 18 A E G 34 S+ 0 0 89 1,-0.3 -1,-0.3 1209,-0.1 0, 0.0 0.670 106.3 50.6 -53.1 -17.8 -23.7 15.2 21.8 18 19 A E G <4 S+ 0 0 127 -3,-1.8 2,-1.9 1,-0.1 -1,-0.3 0.547 81.8 97.1 -98.3 -9.1 -22.2 12.4 19.7 19 20 A A << + 0 0 0 -3,-2.6 1208,-2.2 -4,-0.6 1209,-0.3 -0.572 60.2 130.3 -81.4 80.2 -18.6 12.9 20.9 20 21 A K E -I 1226 0B 92 -2,-1.9 2,-0.3 1206,-0.3 1206,-0.2 -0.888 39.1-160.0-132.9 163.6 -18.6 10.2 23.5 21 22 A T E -I 1225 0B 5 1204,-2.5 1204,-2.7 -2,-0.3 4,-0.0 -0.960 36.9 -80.4-141.4 157.2 -16.5 7.2 24.6 22 23 A S E > -I 1224 0B 13 -2,-0.3 3,-1.8 1202,-0.2 1202,-0.3 -0.233 28.7-132.3 -58.6 141.8 -17.1 4.0 26.6 23 24 A V T 3 S+ 0 0 0 1200,-2.2 -1,-0.1 1,-0.3 1201,-0.1 0.471 108.0 65.9 -73.4 0.5 -17.0 4.3 30.4 24 25 A L T 3 S+ 0 0 0 1199,-0.3 -1,-0.3 1182,-0.0 81,-0.1 0.278 72.3 132.9-101.6 7.5 -14.7 1.3 30.2 25 26 A S X> - 0 0 0 -3,-1.8 3,-1.3 1,-0.1 4,-0.9 -0.401 63.6-128.9 -63.0 131.5 -12.0 3.4 28.4 26 27 A H H >> S+ 0 0 0 76,-2.7 4,-2.9 1,-0.3 3,-1.1 0.882 106.3 55.5 -46.8 -47.7 -8.6 2.8 30.0 27 28 A A H 3> S+ 0 0 0 74,-2.2 4,-1.4 5,-0.3 -1,-0.3 0.777 100.3 58.0 -61.3 -29.4 -8.0 6.6 30.3 28 29 A L H <4 S+ 0 0 0 -3,-1.3 -1,-0.3 73,-0.3 -2,-0.2 0.760 118.4 33.3 -72.8 -22.9 -11.2 7.1 32.3 29 30 A H H << S+ 0 0 0 -3,-1.1 -2,-0.2 -4,-0.9 1332,-0.2 0.760 132.1 25.3-101.2 -32.6 -9.9 4.6 34.9 30 31 A Y H < S- 0 0 11 -4,-2.9 -3,-0.2 -5,-0.2 1335,-0.2 0.242 97.1-112.6-123.5 16.2 -6.1 5.1 34.9 31 32 A G < + 0 0 0 -4,-1.4 120,-2.0 -5,-0.2 2,-1.9 0.653 61.1 153.3 63.3 17.8 -5.4 8.7 33.7 32 33 A T + 0 0 1 -6,-0.3 69,-1.8 118,-0.2 2,-0.3 -0.427 31.8 100.8 -82.4 68.3 -3.8 7.3 30.5 33 34 A S E -C 100 0A 0 -2,-1.9 117,-3.0 67,-0.2 2,-0.3 -0.930 51.9-151.6-142.5 163.3 -4.4 10.3 28.2 34 35 A V E +CD 99 149A 0 65,-2.4 65,-2.8 -2,-0.3 2,-0.3 -0.980 20.3 171.5-136.5 146.5 -2.5 13.2 26.7 35 36 A F E -C 98 0A 2 113,-1.7 2,-0.3 -2,-0.3 63,-0.2 -0.904 18.6-139.8-147.8 174.5 -3.8 16.6 25.7 36 37 A E - 0 0 0 61,-1.8 2,-0.4 -2,-0.3 20,-0.0 -0.898 8.5-141.4-135.8 166.0 -2.9 20.1 24.5 37 38 A G + 0 0 0 -2,-0.3 2,-0.4 59,-0.2 59,-0.2 -0.979 28.9 170.9-131.0 115.2 -4.0 23.6 25.1 38 39 A I E -E 95 0A 0 57,-2.5 57,-4.2 -2,-0.4 2,-0.3 -0.982 16.1-150.7-131.3 141.6 -3.9 25.9 22.1 39 40 A R E -E 94 0A 8 -2,-0.4 11,-2.7 11,-0.3 2,-0.4 -0.844 5.5-162.7-115.9 149.7 -5.3 29.4 21.5 40 41 A A E -EF 93 49A 0 53,-2.1 53,-1.5 -2,-0.3 2,-0.3 -0.980 14.4-165.5-123.9 135.2 -6.5 31.2 18.5 41 42 A Y E - F 0 48A 14 7,-2.4 7,-2.4 -2,-0.4 2,-0.2 -0.895 25.7-105.6-121.9 154.0 -6.8 35.0 18.6 42 43 A E + 0 0 81 -2,-0.3 2,-0.3 5,-0.2 49,-0.1 -0.535 44.3 173.1 -76.4 141.5 -8.6 37.5 16.3 43 44 A T > - 0 0 24 -2,-0.2 3,-2.0 239,-0.1 239,-0.1 -0.890 50.4 -96.4-140.6 171.8 -6.3 39.5 13.9 44 45 A A T 3 S+ 0 0 110 237,-0.5 238,-0.1 1,-0.3 -2,-0.0 0.763 127.8 47.3 -61.6 -24.1 -6.7 41.9 11.1 45 46 A K T 3 S- 0 0 135 1,-0.4 250,-0.3 237,-0.0 -1,-0.3 0.054 125.1 -93.3-105.9 24.3 -6.3 38.9 8.8 46 47 A G S < S- 0 0 18 -3,-2.0 -1,-0.4 249,-0.1 -5,-0.1 -0.298 75.2 -12.9 93.9 179.0 -8.8 36.6 10.6 47 48 A P - 0 0 12 0, 0.0 247,-2.6 0, 0.0 248,-0.5 -0.215 60.9-165.0 -55.4 138.0 -8.3 34.0 13.4 48 49 A A E -FG 41 293A 0 -7,-2.4 -7,-2.4 43,-0.3 2,-0.4 -0.990 12.9-142.1-132.7 125.4 -4.7 33.0 14.1 49 50 A I E > -FG 40 292A 0 243,-2.5 243,-1.7 -2,-0.4 2,-0.6 -0.724 27.1-122.5 -85.8 130.7 -3.6 29.9 16.1 50 51 A F E 3 S- G 0 291A 6 -11,-2.7 -11,-0.3 -2,-0.4 241,-0.2 -0.649 76.4 -25.7 -84.0 118.9 -0.5 30.6 18.2 51 52 A R T 3> S+ 0 0 15 239,-3.7 4,-1.7 -2,-0.6 -1,-0.2 0.909 73.6 171.8 46.7 56.1 2.5 28.4 17.6 52 53 A L H <> S+ 0 0 6 -3,-0.6 4,-2.3 238,-0.3 5,-0.2 0.888 71.5 57.4 -58.6 -44.0 0.4 25.5 16.3 53 54 A K H > S+ 0 0 80 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.912 107.2 47.1 -55.1 -48.7 3.5 23.5 15.2 54 55 A E H > S+ 0 0 46 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.878 111.2 50.1 -64.0 -41.4 5.0 23.5 18.7 55 56 A H H X S+ 0 0 2 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.904 112.3 47.4 -66.1 -39.9 1.8 22.5 20.5 56 57 A V H X S+ 0 0 5 -4,-2.3 4,-2.1 2,-0.2 5,-0.2 0.896 110.1 52.7 -68.6 -38.8 1.3 19.6 18.0 57 58 A K H X S+ 0 0 72 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.940 110.4 47.9 -61.1 -44.9 4.9 18.5 18.4 58 59 A R H X S+ 0 0 22 -4,-2.2 4,-2.8 1,-0.2 90,-0.2 0.862 106.1 59.4 -64.2 -33.9 4.5 18.4 22.2 59 60 A F H X S+ 0 0 3 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.959 110.5 40.3 -58.0 -52.2 1.2 16.5 21.7 60 61 A Y H X S+ 0 0 45 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.821 113.5 55.4 -67.4 -30.8 3.1 13.6 20.0 61 62 A N H X S+ 0 0 19 -4,-2.1 4,-1.2 -5,-0.2 -1,-0.2 0.883 106.0 51.9 -68.1 -37.9 6.0 13.9 22.5 62 63 A S H X S+ 0 0 0 -4,-2.8 4,-1.0 1,-0.2 3,-0.4 0.916 107.4 52.0 -64.7 -41.9 3.5 13.5 25.3 63 64 A A H ><>S+ 0 0 2 -4,-1.8 5,-3.3 1,-0.2 3,-0.6 0.879 102.7 59.8 -61.7 -37.9 2.1 10.3 23.7 64 65 A K H ><5S+ 0 0 43 -4,-1.6 3,-1.1 1,-0.2 -1,-0.2 0.870 97.4 59.6 -58.8 -37.5 5.6 8.9 23.4 65 66 A V H 3<5S+ 0 0 0 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.866 111.8 39.4 -59.9 -36.1 6.1 9.1 27.2 66 67 A L T <<5S- 0 0 5 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.408 113.9-118.9 -91.7 1.7 3.1 6.8 27.6 67 68 A R T < 5 + 0 0 58 -3,-1.1 2,-0.4 -4,-0.4 -3,-0.2 0.866 60.5 162.8 60.3 34.3 4.3 4.7 24.6 68 69 A M < - 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