==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHORISMATE MUTASE 08-APR-94 1COM . COMPND 2 MOLECULE: CHORISMATE MUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR Y.M.CHOOK,H.KE,W.N.LIPSCOMB . 1386 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 57712.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 948 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 108 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 228 16.5 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 . 0 0.0 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 . 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 . 124 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 219 15.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 220 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 0.9 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 12 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 12 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 12 0 12 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 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 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 M 0 0 58 0, 0.0 95,-1.9 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 157.7 46.0 39.2 24.4 2 3 A I E -A 95 0A 6 93,-0.3 2,-0.3 95,-0.1 93,-0.3 -0.935 360.0-166.3-124.6 145.0 46.8 36.5 26.9 3 4 A R E -A 94 0A 22 91,-3.1 91,-2.8 -2,-0.3 2,-0.4 -0.958 19.7-115.4-140.6 155.4 45.9 33.0 25.9 4 5 A G E -A 93 0A 0 272,-2.0 2,-0.6 -2,-0.3 89,-0.2 -0.794 20.3-160.8 -90.9 133.0 45.5 29.6 27.5 5 6 A I E -A 92 0A 2 87,-2.5 87,-2.4 -2,-0.4 2,-0.2 -0.968 13.5-150.6-119.4 110.2 47.8 26.6 26.4 6 7 A R E +A 91 0A 22 -2,-0.6 100,-1.3 85,-0.2 2,-0.3 -0.558 17.7 173.5 -76.5 149.9 46.5 23.2 27.3 7 8 A G E +Ab 90 106A 0 83,-1.4 83,-2.4 98,-0.2 2,-0.3 -0.961 5.2 179.9-155.1 156.5 48.5 20.1 28.0 8 9 A A E +Ab 89 107A 0 98,-1.6 100,-2.7 81,-0.3 2,-0.3 -0.973 6.5 162.7-164.8 144.4 47.8 16.5 29.3 9 10 A T E -A 88 0A 0 79,-1.5 79,-2.8 -2,-0.3 2,-0.3 -0.966 25.1-134.9-160.9 159.0 49.9 13.3 30.0 10 11 A T E -A 87 0A 4 -2,-0.3 77,-0.2 77,-0.2 2,-0.2 -0.956 12.4-144.3-124.7 151.8 49.4 10.1 31.9 11 12 A V - 0 0 3 75,-2.1 3,-0.1 -2,-0.3 8,-0.1 -0.555 7.9-143.0-103.3 166.8 51.8 8.3 34.4 12 13 A E S S+ 0 0 85 1,-0.4 2,-0.3 -2,-0.2 -1,-0.1 0.794 84.1 19.3 -98.8 -40.7 52.2 4.6 34.8 13 14 A R S S- 0 0 138 2,-0.1 2,-1.4 73,-0.0 -1,-0.4 -0.878 82.7-113.3-122.8 159.3 52.7 4.3 38.5 14 15 A D + 0 0 55 -2,-0.3 2,-0.3 -3,-0.1 3,-0.1 -0.634 65.9 132.8 -91.1 78.2 51.9 6.8 41.2 15 16 A T > - 0 0 58 -2,-1.4 4,-2.6 1,-0.1 5,-0.3 -0.894 65.4-121.1-124.1 161.3 55.4 7.8 42.3 16 17 A E H > S+ 0 0 98 -2,-0.3 4,-2.9 2,-0.2 5,-0.3 0.952 115.6 48.2 -59.1 -47.1 57.1 11.1 43.0 17 18 A E H > S+ 0 0 138 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.887 115.0 44.1 -61.8 -46.5 59.7 10.4 40.4 18 19 A E H > S+ 0 0 6 2,-0.2 4,-2.2 3,-0.2 5,-0.3 0.899 115.5 46.7 -68.8 -43.5 57.2 9.2 37.7 19 20 A I H X S+ 0 0 1 -4,-2.6 4,-2.0 2,-0.2 5,-0.2 0.943 117.6 42.1 -67.6 -47.5 54.8 12.1 38.3 20 21 A L H X S+ 0 0 19 -4,-2.9 4,-2.7 -5,-0.3 5,-0.2 0.935 114.2 53.3 -66.6 -39.9 57.5 14.8 38.3 21 22 A Q H X S+ 0 0 78 -4,-2.5 4,-2.3 -5,-0.3 -2,-0.2 0.954 114.3 38.8 -57.3 -54.9 59.3 13.1 35.3 22 23 A K H X S+ 0 0 17 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.829 115.7 53.1 -71.3 -29.6 56.3 13.0 33.0 23 24 A T H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.936 110.4 46.9 -70.7 -40.8 55.0 16.4 34.1 24 25 A K H X S+ 0 0 32 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.936 110.5 54.3 -65.4 -38.0 58.4 18.1 33.4 25 26 A Q H X S+ 0 0 60 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.910 108.8 49.4 -57.2 -42.6 58.3 16.2 30.0 26 27 A L H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.942 112.4 44.7 -66.5 -43.7 55.0 17.8 29.3 27 28 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.937 110.2 53.8 -71.1 -41.8 55.9 21.3 30.1 28 29 A E H X S+ 0 0 87 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.923 110.0 50.4 -54.4 -38.4 59.2 21.2 28.2 29 30 A K H X S+ 0 0 64 -4,-1.8 4,-2.6 -5,-0.3 -1,-0.2 0.938 109.9 47.4 -70.7 -45.3 57.3 20.1 25.3 30 31 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 6,-0.3 0.905 112.9 50.6 -58.6 -45.2 54.7 23.0 25.5 31 32 A I H X>S+ 0 0 35 -4,-2.7 4,-2.4 2,-0.2 5,-0.8 0.961 111.6 47.3 -58.2 -51.6 57.5 25.5 25.9 32 33 A E H <5S+ 0 0 105 -4,-2.8 3,-0.4 1,-0.2 -2,-0.2 0.948 113.8 46.7 -55.9 -55.7 59.3 24.2 22.9 33 34 A E H <5S+ 0 0 54 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.786 125.7 28.8 -57.5 -37.5 56.2 24.1 20.7 34 35 A N H <5S- 0 0 38 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.507 98.6-127.4-111.5 -1.4 55.0 27.6 21.6 35 36 A H T <5 - 0 0 153 -4,-2.4 -3,-0.2 -3,-0.4 -4,-0.1 0.744 39.7-173.3 60.3 35.5 58.3 29.2 22.5 36 37 A T < - 0 0 18 -5,-0.8 -1,-0.2 -6,-0.3 3,-0.1 -0.292 15.7-151.4 -63.1 129.2 57.1 30.4 25.8 37 38 A K > - 0 0 122 1,-0.1 3,-2.5 -2,-0.1 4,-0.3 -0.880 22.1-124.4-100.8 136.0 59.3 32.7 27.9 38 39 A P G > S+ 0 0 23 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.890 109.0 56.7 -46.0 -48.0 58.8 32.4 31.7 39 40 A E G 3 S+ 0 0 89 1,-0.3 176,-0.2 -3,-0.1 28,-0.0 0.481 99.7 59.0 -67.9 1.4 58.1 36.1 32.1 40 41 A D G < S+ 0 0 47 -3,-2.5 55,-2.5 76,-0.0 2,-0.7 0.363 82.6 100.2-103.8 4.9 55.2 36.0 29.6 41 42 A V E < -C 94 0A 0 -3,-2.2 53,-0.3 -4,-0.3 78,-0.2 -0.837 50.8-171.5 -99.4 117.3 53.4 33.4 31.7 42 43 A V E - 0 0 1 51,-2.3 77,-1.7 -2,-0.7 2,-0.3 0.918 67.3 -46.2 -63.7 -51.4 50.7 35.1 33.8 43 44 A Q E -C 93 0A 2 50,-1.2 50,-2.9 75,-0.1 2,-0.3 -0.963 49.1-132.1-176.4 167.9 50.1 31.8 35.7 44 45 A M E -Cd 92 72A 1 27,-2.3 29,-1.4 -2,-0.3 2,-0.4 -0.989 7.7-162.5-142.1 141.2 49.7 28.0 35.4 45 46 A L E -Cd 91 73A 1 46,-2.5 46,-2.5 -2,-0.3 2,-0.4 -0.963 8.3-167.7-119.6 139.2 47.2 25.5 36.9 46 47 A L E -Cd 90 74A 0 27,-1.6 29,-1.6 -2,-0.4 2,-0.3 -1.000 3.9-167.0-129.8 128.5 47.9 21.8 37.0 47 48 A S E -Cd 89 75A 0 42,-1.9 42,-2.3 -2,-0.4 2,-0.3 -0.919 1.9-161.3-114.8 150.8 45.3 19.2 37.8 48 49 A A E -Cd 88 76A 0 27,-1.4 29,-2.5 -2,-0.3 40,-0.2 -0.931 27.7-108.1-128.7 149.5 45.7 15.4 38.7 49 50 A T > - 0 0 11 38,-1.7 3,-2.1 -2,-0.3 29,-0.1 -0.427 41.6-104.0 -70.3 155.3 43.1 12.7 38.6 50 51 A P T 3 S+ 0 0 36 0, 0.0 -1,-0.1 0, 0.0 29,-0.1 0.539 115.7 65.8 -68.0 -5.2 42.0 11.4 42.1 51 52 A D T 3 S+ 0 0 57 2,-0.0 2,-0.6 0, 0.0 -37,-0.1 0.490 83.2 87.8 -84.9 -15.3 44.1 8.3 42.0 52 53 A L < + 0 0 3 -3,-2.1 142,-0.2 1,-0.1 -4,-0.1 -0.845 42.0 141.9 -95.1 124.8 47.4 10.2 41.9 53 54 A H + 0 0 53 -2,-0.6 143,-1.8 142,-0.1 -1,-0.1 0.572 38.0 90.9-132.0 -22.5 48.8 11.0 45.4 54 55 A A S S- 0 0 35 141,-0.2 2,-0.3 1,-0.1 -38,-0.2 0.750 98.2 -9.8 -60.8 -30.6 52.5 10.8 45.8 55 56 A V S S- 0 0 9 -40,-0.1 -1,-0.1 -39,-0.1 141,-0.1 -0.972 73.9 -94.6-162.6 156.1 53.6 14.4 44.9 56 57 A F > - 0 0 39 -2,-0.3 3,-1.5 1,-0.1 4,-0.3 -0.664 28.5-136.6 -72.7 130.5 52.1 17.7 43.6 57 58 A P G > S+ 0 0 0 0, 0.0 3,-2.2 0, 0.0 4,-0.3 0.877 99.2 70.5 -52.7 -39.0 52.6 18.1 39.7 58 59 A A G >> S+ 0 0 15 1,-0.3 3,-1.1 2,-0.2 4,-0.7 0.729 79.5 72.2 -53.5 -23.4 53.6 21.8 40.4 59 60 A K G <4 S+ 0 0 103 -3,-1.5 3,-0.5 1,-0.3 -1,-0.3 0.803 88.3 66.3 -69.0 -19.8 56.9 20.8 42.0 60 61 A A G X4 S+ 0 0 0 -3,-2.2 3,-1.6 -4,-0.3 4,-0.4 0.810 88.1 66.2 -68.3 -32.1 58.0 19.9 38.4 61 62 A V G X4 S+ 0 0 3 -3,-1.1 3,-1.2 -4,-0.3 6,-0.2 0.832 93.6 58.9 -59.2 -33.0 57.8 23.6 37.3 62 63 A R G 3< S+ 0 0 114 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.528 92.4 68.6 -78.7 -2.7 60.7 24.5 39.6 63 64 A E G < S+ 0 0 31 -3,-1.6 2,-0.4 -4,-0.1 -1,-0.3 0.705 83.9 85.7 -80.2 -21.7 63.0 22.0 37.8 64 65 A L S X S- 0 0 19 -3,-1.2 3,-1.4 -4,-0.4 4,-0.2 -0.658 90.8-115.4 -78.2 127.8 62.8 24.3 34.8 65 66 A S T 3 S+ 0 0 46 -2,-0.4 -2,-0.1 1,-0.2 -1,-0.1 -0.450 97.3 16.8 -67.0 135.2 65.5 27.1 34.8 66 67 A G T 3 S+ 0 0 53 631,-0.2 3,-0.3 -2,-0.2 -1,-0.2 0.454 96.4 100.4 85.3 4.8 64.0 30.5 35.1 67 68 A W X + 0 0 12 -3,-1.4 3,-1.7 -6,-0.2 -2,-0.1 0.281 41.8 111.1-104.2 14.1 60.5 29.4 36.2 68 69 A Q T 3 S+ 0 0 53 1,-0.3 -1,-0.2 -4,-0.2 -6,-0.1 0.696 83.7 40.9 -53.4 -29.2 61.0 30.2 39.9 69 70 A Y T 3 S+ 0 0 86 -3,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.343 80.2 113.3-111.9 9.0 58.5 33.1 39.7 70 71 A V S < S- 0 0 4 -3,-1.7 2,-0.3 -9,-0.1 -27,-0.1 -0.699 72.2-122.2 -83.3 124.4 55.8 31.7 37.5 71 72 A P + 0 0 9 0, 0.0 -27,-2.3 0, 0.0 2,-0.3 -0.556 41.3 172.1 -70.1 126.4 52.7 31.5 39.8 72 73 A V E +d 44 0A 17 -2,-0.3 2,-0.3 -29,-0.2 -27,-0.2 -0.991 12.9 168.3-136.0 144.1 51.4 27.9 39.9 73 74 A T E -d 45 0A 7 -29,-1.4 -27,-1.6 -2,-0.3 2,-0.2 -0.974 21.9-135.2-153.3 149.5 48.8 26.0 41.9 74 75 A C E -d 46 0A 4 -2,-0.3 2,-0.3 -29,-0.2 -27,-0.2 -0.620 17.8-179.8-101.2 164.2 47.2 22.6 41.5 75 76 A M E -d 47 0A 1 -29,-1.6 -27,-1.4 -2,-0.2 2,-0.5 -0.868 33.1 -94.5-151.5 172.2 43.6 21.4 41.7 76 77 A Q E -d 48 0A 17 115,-1.7 234,-2.3 234,-0.3 115,-0.2 -0.857 30.3-129.0-104.1 136.4 41.9 18.1 41.4 77 78 A E - 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