==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE (PHOSPHORYL) 06-APR-82 3PGM . COMPND 2 MOLECULE: PHOSPHOGLYCERATE MUTASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.W.CAMPBELL,G.I.HODGSON,J.WARWICKER,S.I.WINN,H.C.WATSON . 460 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22310.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 238 51.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 2.2 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 . 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 . 2 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 . 40 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 23.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 3.5 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 4 4 0 0 0 2 0 2 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 4 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 . 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A P 0 0 48 0, 0.0 2,-0.3 0, 0.0 212,-0.2 0.000 360.0 360.0 360.0 -69.5 -19.5 -8.9 -8.9 2 2 A K + 0 0 42 170,-0.4 2,-0.5 168,-0.4 172,-0.5 -0.853 360.0 172.6-158.1 123.9 -16.8 -9.2 -11.5 3 3 A L - 0 0 3 -2,-0.3 2,-0.7 170,-0.1 208,-0.6 -0.987 14.7-165.0-126.3 120.6 -14.2 -11.5 -12.6 4 4 A V E -aB 175 210A 4 170,-0.8 172,-1.3 -2,-0.5 2,-0.6 -0.946 8.0-173.5-111.9 110.6 -12.4 -10.6 -15.7 5 5 A L E + B 0 209A 0 204,-3.2 204,-1.2 -2,-0.7 2,-0.4 -0.949 8.4 174.5-113.4 108.7 -10.6 -13.6 -17.0 6 6 A V - 0 0 9 -2,-0.6 2,-0.7 171,-0.6 202,-0.1 -0.977 22.5-157.1-126.1 127.0 -8.4 -12.8 -19.9 7 7 A R B -f 205 0B 38 197,-0.6 199,-0.6 -2,-0.4 172,-0.2 -0.913 28.9-129.3-106.0 106.3 -5.9 -15.1 -21.7 8 8 A H - 0 0 5 170,-1.4 198,-3.9 -2,-0.7 -1,-0.3 0.677 34.1 -91.6 -16.9-132.7 -3.4 -12.9 -23.5 9 9 A G - 0 0 1 196,-0.3 3,-0.1 197,-0.1 51,-0.0 0.335 58.9 -68.0-122.0-106.9 -2.8 -13.7 -27.2 10 10 A Q - 0 0 37 1,-0.2 2,-0.5 49,-0.1 6,-0.4 0.005 54.4-136.2-152.3 28.6 -0.1 -16.1 -28.4 11 11 A S - 0 0 3 1,-0.2 17,-5.4 16,-0.1 20,-0.2 -0.304 31.6-102.9 55.0-102.4 3.1 -14.2 -27.6 12 12 A E S S+ 0 0 69 -2,-0.5 5,-0.2 15,-0.4 -1,-0.2 0.188 99.7 69.8 161.2 -0.1 5.3 -14.6 -30.6 13 13 A W S > S+ 0 0 51 13,-0.3 4,-0.9 -3,-0.2 5,-0.3 0.491 106.8 13.6-100.2-113.6 7.8 -17.2 -29.4 14 14 A N H > S+ 0 0 17 4,-0.2 4,-2.1 3,-0.2 6,-0.1 0.804 124.5 59.9 -25.6 -79.0 6.6 -20.8 -28.8 15 15 A E H >4 S+ 0 0 49 2,-0.2 3,-3.6 1,-0.2 -4,-0.1 0.640 106.0 37.0 -18.7-120.4 3.3 -20.2 -30.7 16 16 A K H 34 S+ 0 0 164 -6,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.540 142.8 8.8 -2.5 -79.6 4.3 -19.2 -34.2 17 17 A N H 3< S- 0 0 81 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 -0.076 112.1 -97.6-114.7 36.5 7.3 -21.5 -34.4 18 18 A L S << S+ 0 0 51 -3,-3.6 2,-0.2 -4,-2.1 -4,-0.2 0.806 86.0 76.6 58.6 121.6 7.0 -23.8 -31.2 19 19 A F + 0 0 53 77,-0.1 74,-0.2 76,-0.1 -1,-0.1 -0.733 44.1 137.0 160.1-105.8 9.1 -23.0 -28.1 20 20 A T + 0 0 18 -2,-0.2 2,-0.3 -6,-0.1 74,-0.3 0.355 24.2 174.2 52.9-178.7 8.1 -20.2 -25.7 21 21 A G > - 0 0 9 72,-0.1 3,-1.1 68,-0.1 4,-0.3 -0.970 52.7 -61.2 168.0-179.1 8.1 -20.2 -21.9 22 22 A W T 3 S+ 0 0 8 -2,-0.3 66,-0.1 1,-0.3 64,-0.1 0.408 102.3 103.2 -64.0 -5.3 7.7 -18.6 -18.4 23 23 A V T 3 S- 0 0 32 106,-0.1 -1,-0.3 2,-0.1 107,-0.1 0.826 86.1-125.6 -51.8 -51.7 10.6 -16.6 -19.8 24 24 A D < + 0 0 30 -3,-1.1 -2,-0.1 1,-0.1 2,-0.1 0.825 43.8 159.6 95.2 87.2 8.7 -13.5 -20.7 25 25 A V - 0 0 26 1,-0.4 -1,-0.1 -4,-0.3 -12,-0.1 -0.522 43.7-111.5-144.6 70.4 9.0 -12.4 -24.4 26 26 A K - 0 0 39 -2,-0.1 -1,-0.4 1,-0.1 2,-0.3 0.230 37.3-105.2 33.2-158.7 6.3 -10.1 -25.7 27 27 A L - 0 0 14 1,-0.2 -15,-0.4 -15,-0.1 5,-0.1 -0.967 22.8-105.3-160.7 154.2 3.8 -11.2 -28.2 28 28 A S > - 0 0 22 -17,-5.4 4,-0.8 -2,-0.3 -1,-0.2 0.465 54.2 -72.3 -64.0-154.5 3.0 -10.8 -32.0 29 29 A A H > S+ 0 0 52 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.863 121.8 67.2 -78.1 -43.8 0.3 -8.8 -33.7 30 30 A K H >>S+ 0 0 106 1,-0.2 4,-3.8 2,-0.2 5,-0.5 0.857 97.6 60.9 -47.1 -37.9 -2.7 -11.0 -32.8 31 31 A G H >5S+ 0 0 0 -20,-0.2 4,-4.5 2,-0.2 5,-0.5 0.982 106.5 39.4 -50.9 -76.1 -2.1 -9.9 -29.2 32 32 A Q H X5S+ 0 0 112 -4,-0.8 4,-3.8 3,-0.2 5,-0.2 0.897 125.1 42.8 -39.7 -54.7 -2.5 -6.1 -29.7 33 33 A Q H X5S+ 0 0 142 -4,-2.5 4,-3.7 2,-0.2 -2,-0.2 0.993 119.3 38.4 -57.3 -75.7 -5.4 -7.0 -32.0 34 34 A E H X5S+ 0 0 58 -4,-3.8 4,-2.8 1,-0.2 -3,-0.2 0.858 121.7 48.5 -44.1 -44.0 -7.2 -9.8 -30.1 35 35 A A H XS+ 0 0 96 -4,-2.7 4,-1.7 -5,-0.3 5,-0.6 0.875 109.9 54.8 -60.4 -43.1 -13.2 -3.6 -27.1 41 41 A L H X>S+ 0 0 12 -4,-2.2 4,-1.2 3,-0.2 5,-0.6 0.942 104.2 46.4 -63.0 -60.6 -15.3 -6.4 -25.7 42 42 A L H X5S+ 0 0 6 -4,-2.6 4,-1.5 3,-0.2 -1,-0.2 0.959 125.2 32.1 -50.6 -56.3 -15.6 -5.5 -22.0 43 43 A K H <5S+ 0 0 80 -4,-1.3 -2,-0.2 -5,-0.2 -3,-0.1 0.996 121.2 44.2 -63.0 -73.9 -16.4 -1.8 -22.7 44 44 A E H <5S+ 0 0 127 -4,-1.7 -3,-0.2 -5,-0.3 -2,-0.1 0.917 119.0 43.8 -41.2 -65.7 -18.3 -1.9 -26.0 45 45 A K H < - 0 0 14 248,-0.1 4,-1.6 1,-0.1 121,-0.1 -0.994 63.7-142.4-150.9 140.3 5.4 -9.9 -17.3 58 58 A S H > S+ 0 0 0 -2,-0.3 4,-2.7 246,-0.3 5,-0.2 0.855 96.6 62.9 -63.5 -44.1 5.4 -7.8 -20.5 59 59 A R H > S+ 0 0 21 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.935 111.2 33.8 -45.3 -67.7 3.6 -10.5 -22.7 60 60 A A H > S+ 0 0 10 1,-0.2 4,-2.4 2,-0.2 3,-0.4 0.873 114.3 60.9 -58.4 -46.0 0.3 -10.5 -20.7 61 61 A I H X S+ 0 0 1 -4,-1.6 4,-4.4 1,-0.3 5,-0.4 0.887 97.2 58.3 -50.6 -49.6 0.6 -6.8 -19.9 62 62 A Q H X S+ 0 0 13 -4,-2.7 4,-1.9 1,-0.2 -1,-0.3 0.913 109.3 45.7 -47.0 -49.5 0.5 -6.0 -23.6 63 63 A T H X S+ 0 0 1 -4,-1.1 4,-1.8 -3,-0.4 -2,-0.2 0.943 118.5 41.4 -58.4 -53.5 -2.8 -7.7 -23.8 64 64 A A H X S+ 0 0 2 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.925 113.1 51.5 -62.6 -52.0 -4.2 -6.1 -20.7 65 65 A N H X S+ 0 0 25 -4,-4.4 4,-1.5 1,-0.2 -1,-0.2 0.883 110.3 50.8 -55.8 -42.3 -2.8 -2.6 -21.3 66 66 A I H X S+ 0 0 15 -4,-1.9 4,-1.8 -5,-0.4 3,-0.4 0.949 102.5 55.5 -64.4 -54.9 -4.3 -2.5 -24.8 67 67 A A H X S+ 0 0 7 -4,-1.8 4,-2.5 1,-0.3 5,-0.2 0.899 108.7 52.3 -44.3 -46.6 -7.9 -3.5 -24.0 68 68 A L H X>S+ 0 0 16 -4,-1.5 5,-2.1 1,-0.2 4,-1.7 0.884 102.8 55.6 -60.3 -45.3 -8.0 -0.6 -21.6 69 69 A E H <5S+ 0 0 56 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.911 114.7 39.2 -59.2 -40.7 -6.8 2.0 -24.1 70 70 A K H <5S+ 0 0 103 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.930 106.5 59.0 -79.8 -47.6 -9.7 1.2 -26.5 71 71 A A H <5S- 0 0 9 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.926 121.9-109.0 -44.7 -43.4 -12.6 0.6 -24.1 72 72 A D T <5S+ 0 0 97 -4,-1.7 -3,-0.2 -5,-0.2 -2,-0.1 0.724 89.2 84.6 116.1 47.8 -11.7 4.2 -23.1 73 73 A R < + 0 0 16 -5,-2.1 2,-0.8 216,-0.1 216,-0.3 0.406 22.8 154.1-129.7 -89.5 -10.1 4.1 -19.6 74 74 A L + 0 0 10 1,-0.2 2,-0.5 214,-0.1 214,-0.1 -0.034 56.7 105.6 76.8 -34.4 -6.4 3.5 -19.2 75 75 A W + 0 0 8 -2,-0.8 -1,-0.2 212,-0.2 214,-0.1 -0.672 48.1 90.7 -83.5 121.9 -6.8 5.5 -15.9 76 76 A I S S- 0 0 12 -2,-0.5 -25,-0.1 1,-0.1 212,-0.1 -0.751 78.1 -86.8 159.1 157.5 -6.7 3.4 -12.7 77 77 A P - 0 0 56 0, 0.0 234,-0.2 0, 0.0 -1,-0.1 0.854 49.9-169.6 -53.4 -56.5 -4.4 2.0 -9.9 78 78 A V - 0 0 7 -28,-0.2 2,-0.4 1,-0.1 -25,-0.2 0.463 11.4-137.9 70.6 140.3 -3.3 -1.4 -11.3 79 79 A N E -d 53 0A 71 -27,-3.6 -25,-1.1 231,-0.1 2,-0.5 -0.988 10.2-160.9-140.4 126.3 -1.4 -4.1 -9.2 80 80 A R E +d 54 0A 28 -2,-0.4 2,-0.2 -27,-0.2 -25,-0.2 -0.915 21.5 156.0-110.4 127.2 1.6 -6.1 -10.4 81 81 A S E -d 55 0A 13 -27,-2.1 -25,-1.8 -2,-0.5 3,-0.1 -0.714 48.6-121.7-135.6-174.4 2.6 -9.4 -8.6 82 82 A W S S+ 0 0 34 -2,-0.2 2,-0.4 -27,-0.2 -27,-0.1 0.084 91.2 89.7-121.3 16.9 4.5 -12.6 -9.4 83 83 A R S S+ 0 0 74 1,-0.2 -1,-0.1 -29,-0.2 -28,-0.1 -0.618 78.3 63.0-110.4 63.2 1.5 -14.8 -8.5 84 84 A L S S+ 0 0 13 -2,-0.4 -29,-0.5 -3,-0.1 2,-0.2 -0.141 70.6 119.4 175.2 70.6 0.1 -14.9 -12.0 85 85 A N - 0 0 8 -3,-0.1 2,-0.4 -31,-0.1 97,-0.2 -0.793 64.1 -80.0-138.5 178.5 2.2 -16.5 -14.7 86 86 A E - 0 0 44 -2,-0.2 3,-0.1 -31,-0.1 94,-0.1 -0.717 63.9 -90.2 -84.2 132.3 2.4 -19.2 -17.3 87 87 A R - 0 0 3 -2,-0.4 -1,-0.1 1,-0.1 62,-0.1 -0.212 51.5-110.0 -46.6 108.0 3.4 -22.5 -15.8 88 88 A H - 0 0 4 62,-0.2 61,-1.1 59,-0.1 -1,-0.1 -0.054 32.8-127.7 -36.6 124.4 7.1 -22.5 -16.1 89 89 A Y - 0 0 41 59,-0.2 60,-0.1 -3,-0.1 58,-0.1 -0.020 26.2-121.4 -64.8-163.2 8.0 -25.0 -18.7 90 90 A G - 0 0 6 58,-0.2 -1,-0.1 -3,-0.1 58,-0.0 0.558 60.5 -38.8-105.2-108.9 10.6 -27.5 -17.5 91 91 A D S S+ 0 0 84 32,-0.1 32,-0.1 56,-0.0 33,-0.1 0.149 114.5 81.3-111.0 11.5 14.0 -28.2 -19.0 92 92 A L + 0 0 29 29,-0.2 37,-0.1 30,-0.2 3,-0.1 0.680 48.2 154.5 -84.9-113.9 12.9 -27.9 -22.6 93 93 A Q + 0 0 17 -74,-0.2 2,-2.6 1,-0.2 -72,-0.1 -0.019 65.7 22.0 95.9 155.2 12.6 -24.5 -24.2 94 94 A G S S+ 0 0 10 -74,-0.3 2,-0.6 1,-0.1 -1,-0.2 -0.285 78.9 135.4 53.8 -80.5 12.9 -23.7 -27.9 95 95 A K - 0 0 77 -2,-2.6 4,-0.3 1,-0.2 -1,-0.1 -0.232 62.6-130.3 48.1 -95.1 12.1 -27.3 -28.8 96 96 A D - 0 0 42 -2,-0.6 -1,-0.2 2,-0.1 -77,-0.1 0.312 37.0 -98.7 129.3 5.8 9.7 -26.5 -31.5 97 97 A K S S+ 0 0 46 1,-0.1 -2,-0.1 -3,-0.1 -79,-0.1 0.917 116.7 67.3 46.8 48.9 6.9 -28.8 -30.3 98 98 A A S > S+ 0 0 25 -80,-0.1 4,-9.1 7,-0.0 5,-0.2 0.178 94.8 38.5-152.9 -72.7 8.3 -31.2 -32.9 99 99 A Q H > S+ 0 0 91 2,-0.3 4,-5.7 -4,-0.3 5,-0.1 0.936 122.1 48.6 -58.6 -45.5 11.7 -32.7 -32.2 100 100 A T H >>S+ 0 0 10 2,-0.2 4,-1.8 1,-0.2 5,-1.1 0.975 121.9 34.6 -52.7 -57.1 10.7 -32.8 -28.5 101 101 A L H 45S+ 0 0 84 1,-0.2 -2,-0.3 2,-0.2 -1,-0.2 0.912 119.2 51.9 -61.0 -47.3 7.5 -34.4 -29.7 102 102 A K H <5S+ 0 0 156 -4,-9.1 -2,-0.2 2,-0.1 -3,-0.2 0.897 114.1 46.5 -54.8 -45.2 9.5 -36.2 -32.4 103 103 A K H <5S+ 0 0 154 -4,-5.7 -2,-0.2 -5,-0.2 -3,-0.2 0.994 136.8 0.7 -61.9 -84.7 11.9 -37.4 -29.7 104 104 A F T <5S+ 0 0 103 -4,-1.8 -3,-0.2 -5,-0.1 4,-0.1 0.914 87.0 170.2 -73.8 -45.3 9.8 -38.7 -26.8 105 105 A G < + 0 0 7 -5,-1.1 3,-0.5 1,-0.1 4,-0.2 0.037 32.0 81.7 51.4-174.3 6.5 -38.1 -28.3 106 106 A E S >> S- 0 0 131 1,-0.2 4,-1.7 2,-0.2 3,-1.5 -0.217 110.2 -36.3 81.8-174.3 3.5 -39.7 -26.5 107 107 A E H 3>>S+ 0 0 98 1,-0.3 4,-9.1 2,-0.2 5,-0.7 0.712 128.7 78.4 -52.8 -23.9 1.7 -38.5 -23.4 108 108 A K H 3>5S+ 0 0 96 -3,-0.5 4,-1.4 3,-0.2 -1,-0.3 0.939 100.6 35.1 -52.9 -53.0 5.1 -37.3 -22.5 109 109 A F H <45S+ 0 0 46 -3,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.964 131.0 35.2 -65.3 -49.1 4.8 -34.4 -24.8 110 110 A N H <5S+ 0 0 97 -4,-1.7 -2,-0.2 1,-0.1 -3,-0.2 0.949 125.4 40.1 -67.0 -53.6 1.1 -34.1 -24.0 111 111 A T H <5S+ 0 0 14 -4,-9.1 4,-0.4 -5,-0.1 -3,-0.2 0.945 84.2 97.9 -67.2 -54.9 1.2 -35.1 -20.3 112 112 A Y S >< S+ 0 0 90 -2,-1.8 3,-1.2 1,-0.2 4,-0.1 -0.184 131.2 52.8 35.1-142.6 15.7 -7.2 -10.7 136 136 A R T 3 S+ 0 0 22 1,-0.3 2,-0.5 2,-0.1 -1,-0.2 0.008 96.7 64.0 32.3-105.9 12.1 -7.5 -9.6 137 137 A Y T > S+ 0 0 6 -3,-0.5 3,-0.5 1,-0.3 -1,-0.3 0.481 89.3 72.3 -15.6 -25.5 12.1 -11.2 -8.7 138 138 A K T < S+ 0 0 148 -3,-1.2 -1,-0.3 -2,-0.5 -2,-0.1 -0.149 75.7 77.2 -98.7 42.6 14.6 -10.6 -5.9 139 139 A Y T 3 S+ 0 0 171 -2,-0.2 2,-0.3 -4,-0.1 -1,-0.2 -0.188 90.5 72.3-132.0 29.7 12.0 -8.8 -3.7 140 140 A V S < S- 0 0 18 -3,-0.5 4,-0.2 -4,-0.1 0, 0.0 -0.981 112.4 -77.5-146.7 135.3 10.8 -12.2 -2.9 141 141 A D - 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