==== 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 ISOMERASE 25-APR-03 1P5D . COMPND 2 MOLECULE: PHOSPHOMANNOMUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR C.REGNI,P.A.TIPTON,L.J.BEAMER . 455 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16699.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 335 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 9.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 58 12.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 25 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 135 29.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.8 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 1 0 1 3 1 2 1 2 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 1 2 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 PARALLEL BRIDGES PER LADDER . 3 3 2 3 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 9 X L 0 0 67 0, 0.0 2,-0.2 0, 0.0 18,-0.1 0.000 360.0 360.0 360.0 146.9 -50.0 8.0 9.0 2 10 X P > - 0 0 49 0, 0.0 3,-0.9 0, 0.0 4,-0.2 -0.445 360.0-143.4 -65.5 136.0 -49.3 6.5 12.5 3 11 X A G > S+ 0 0 57 1,-0.2 3,-1.8 -2,-0.2 124,-0.1 0.787 90.8 74.4 -67.7 -28.0 -46.0 4.6 12.7 4 12 X S G 3 S+ 0 0 87 1,-0.3 -1,-0.2 7,-0.0 8,-0.1 0.700 86.0 61.3 -66.3 -20.2 -47.5 2.0 15.1 5 13 X I G < S+ 0 0 1 -3,-0.9 7,-2.1 13,-0.1 2,-1.0 0.646 84.6 85.5 -79.2 -16.1 -49.5 0.2 12.3 6 14 X F B < +A 11 0A 8 -3,-1.8 5,-0.2 -4,-0.2 2,-0.1 -0.768 67.8 170.9 -89.7 99.3 -46.3 -0.7 10.5 7 15 X R - 0 0 42 3,-2.0 113,-0.1 -2,-1.0 116,-0.1 -0.417 46.7 -93.2-108.9 178.1 -45.3 -3.9 12.3 8 16 X A S S+ 0 0 13 408,-0.6 112,-2.8 1,-0.2 115,-0.2 0.854 119.8 26.6 -62.5 -40.7 -42.7 -6.6 11.8 9 17 X Y S S- 0 0 19 407,-0.4 2,-0.3 110,-0.2 -1,-0.2 0.681 130.6 -41.8-100.4 -17.0 -44.8 -9.0 9.7 10 18 X D S S- 0 0 1 100,-0.1 -3,-2.0 -5,-0.1 2,-0.4 -0.919 72.7 -62.4 173.5-170.9 -47.3 -6.7 8.1 11 19 X I E +AB 6 109A 0 98,-2.4 98,-2.2 -2,-0.3 2,-0.3 -0.910 50.0 163.8-109.1 135.2 -49.6 -3.6 8.7 12 20 X R E + B 0 108A 10 -7,-2.1 2,-0.3 -2,-0.4 96,-0.2 -0.975 3.5 142.2-154.5 140.0 -52.4 -3.7 11.2 13 21 X G E - B 0 107A 7 94,-2.4 94,-2.1 -2,-0.3 2,-0.5 -0.850 48.9 -84.5-154.3-171.4 -54.5 -1.1 13.0 14 22 X V E >>> - B 0 106A 36 -2,-0.3 5,-1.9 92,-0.2 3,-1.9 -0.951 44.1-119.4-113.4 123.6 -58.0 -0.3 14.2 15 23 X V B 345S+h 19 0B 30 90,-3.2 5,-0.2 -2,-0.5 3,-0.1 -0.421 99.9 20.6 -69.0 131.8 -60.5 1.2 11.7 16 24 X G T 345S+ 0 0 71 3,-2.0 -1,-0.3 1,-0.2 4,-0.1 0.143 130.7 48.8 94.1 -17.5 -61.7 4.6 12.7 17 25 X D T <45S- 0 0 121 -3,-1.9 -1,-0.2 2,-0.3 -2,-0.2 0.588 131.0 -3.8-113.5 -88.3 -58.6 5.0 15.0 18 26 X T T <5S+ 0 0 31 -4,-0.7 2,-0.4 1,-0.1 -3,-0.2 0.512 128.5 56.3 -93.0 -3.5 -55.2 4.2 13.5 19 27 X L B < +h 15 0B 0 -5,-1.9 -3,-2.0 -18,-0.1 -2,-0.3 -0.966 63.6 163.0-133.5 116.5 -56.6 3.0 10.1 20 28 X T > - 0 0 57 -2,-0.4 4,-2.0 -5,-0.2 5,-0.1 -0.753 52.6 -98.8-119.9 172.5 -58.7 5.1 7.8 21 29 X A H > S+ 0 0 24 -2,-0.2 4,-1.8 1,-0.2 -1,-0.1 0.885 122.5 53.2 -54.6 -43.5 -59.8 5.1 4.2 22 30 X E H > S+ 0 0 128 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.890 107.1 50.3 -65.5 -38.8 -57.2 7.7 3.3 23 31 X T H > S+ 0 0 6 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.872 107.2 55.0 -70.0 -33.7 -54.3 5.6 4.9 24 32 X A H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.911 107.2 51.8 -60.6 -40.5 -55.5 2.6 2.9 25 33 X Y H X S+ 0 0 27 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.960 112.2 43.4 -58.4 -53.9 -55.1 4.7 -0.2 26 34 X W H X S+ 0 0 69 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.844 110.8 55.0 -67.8 -31.4 -51.5 5.8 0.6 27 35 X I H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.935 108.0 50.7 -63.8 -42.8 -50.6 2.3 1.6 28 36 X G H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.930 109.7 50.3 -57.1 -46.1 -51.8 1.2 -1.9 29 37 X R H X S+ 0 0 27 -4,-2.4 4,-2.4 1,-0.2 107,-0.3 0.954 112.0 47.8 -55.6 -49.5 -49.6 4.0 -3.4 30 38 X A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.904 113.1 46.3 -62.2 -44.0 -46.6 2.8 -1.4 31 39 X I H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.909 112.7 50.6 -65.0 -41.7 -47.1 -0.9 -2.3 32 40 X G H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.2 -2,-0.2 0.913 110.5 49.8 -62.9 -38.8 -47.6 -0.1 -6.0 33 41 X S H X S+ 0 0 4 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.895 112.1 47.1 -67.7 -42.0 -44.5 2.0 -6.0 34 42 X E H X S+ 0 0 35 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.910 111.2 51.3 -67.2 -40.7 -42.4 -0.8 -4.4 35 43 X S H ><>S+ 0 0 0 -4,-2.7 5,-2.7 1,-0.2 3,-0.7 0.940 111.5 47.5 -61.9 -44.4 -43.8 -3.4 -6.8 36 44 X L H ><5S+ 0 0 60 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.862 106.4 57.7 -63.2 -35.6 -43.0 -1.2 -9.8 37 45 X A H 3<5S+ 0 0 69 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.742 107.6 48.8 -66.6 -25.0 -39.5 -0.6 -8.4 38 46 X R T <<5S- 0 0 81 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.234 126.1-103.5 -96.0 10.8 -39.0 -4.4 -8.4 39 47 X G T < 5S+ 0 0 62 -3,-1.6 -3,-0.2 1,-0.1 -2,-0.1 0.673 83.8 121.4 81.2 20.0 -40.3 -4.6 -12.0 40 48 X E < + 0 0 30 -5,-2.7 -2,-0.2 -6,-0.2 -1,-0.1 -0.892 26.1 167.7-123.2 98.0 -43.8 -5.9 -11.3 41 49 X P + 0 0 39 0, 0.0 29,-2.5 0, 0.0 2,-0.6 0.667 58.9 88.0 -78.8 -12.7 -46.8 -3.9 -12.5 42 50 X C E +c 70 0A 18 27,-0.2 51,-1.1 -7,-0.1 2,-0.4 -0.782 53.7 173.9-101.7 122.3 -49.3 -6.7 -11.8 43 51 X V E -cd 71 93A 1 27,-2.1 29,-2.5 -2,-0.6 2,-0.3 -0.983 20.9-147.2-133.4 125.9 -50.8 -6.9 -8.3 44 52 X A E -cd 72 94A 3 49,-2.4 51,-2.6 -2,-0.4 2,-0.4 -0.633 16.2-161.1 -87.4 146.0 -53.6 -9.1 -6.9 45 53 X V E +cd 73 95A 0 27,-2.7 29,-2.4 -2,-0.3 30,-0.5 -0.993 14.2 167.6-134.0 128.3 -55.9 -7.7 -4.2 46 54 X G E -cd 75 96A 0 49,-2.2 51,-2.6 -2,-0.4 2,-0.3 -0.875 13.2-160.1-128.4 163.6 -58.1 -9.6 -1.8 47 55 X R E -cd 76 97A 55 28,-1.8 30,-2.3 -2,-0.3 51,-0.2 -0.978 13.8-130.4-140.7 155.6 -60.1 -8.9 1.4 48 56 X D - 0 0 2 49,-1.9 188,-0.1 -2,-0.3 152,-0.1 -0.010 44.6 -82.8 -86.2-164.1 -61.5 -10.9 4.2 49 57 X G S S+ 0 0 12 186,-0.3 151,-0.3 27,-0.1 2,-0.1 0.060 77.6 133.7 -96.1 27.6 -65.1 -10.8 5.6 50 58 X R > - 0 0 5 1,-0.1 3,-1.7 149,-0.1 151,-0.1 -0.403 66.2-117.3 -80.8 156.4 -64.7 -7.8 7.9 51 59 X L T 3 S+ 0 0 96 53,-0.3 4,-0.3 149,-0.3 -1,-0.1 0.824 115.3 49.4 -59.2 -36.2 -67.2 -4.9 8.1 52 60 X S T 3> S+ 0 0 15 52,-0.4 4,-2.4 1,-0.2 5,-0.3 0.429 84.5 98.8 -85.9 -2.4 -64.6 -2.4 6.9 53 61 X G H <> S+ 0 0 0 -3,-1.7 4,-2.8 1,-0.2 5,-0.3 0.928 80.5 46.0 -52.7 -60.0 -63.5 -4.6 3.9 54 62 X P H > S+ 0 0 72 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.917 115.8 46.3 -54.4 -45.6 -65.5 -2.9 1.1 55 63 X E H > S+ 0 0 115 -4,-0.3 4,-1.0 1,-0.2 -2,-0.2 0.932 119.0 38.2 -65.1 -47.9 -64.5 0.7 2.2 56 64 X L H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 3,-0.2 0.881 110.9 58.8 -74.8 -36.1 -60.8 0.1 2.7 57 65 X V H X S+ 0 0 14 -4,-2.8 4,-2.7 -5,-0.3 5,-0.2 0.895 101.3 55.3 -65.3 -34.7 -60.3 -2.3 -0.3 58 66 X K H X S+ 0 0 53 -4,-1.5 4,-2.1 -5,-0.3 -1,-0.2 0.904 111.0 45.6 -62.7 -38.2 -61.6 0.3 -2.8 59 67 X Q H X S+ 0 0 68 -4,-1.0 4,-2.3 -3,-0.2 -1,-0.2 0.890 110.5 52.6 -70.6 -42.7 -59.0 2.8 -1.5 60 68 X L H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.935 111.5 47.5 -55.8 -48.6 -56.2 0.2 -1.6 61 69 X I H X S+ 0 0 16 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.912 110.5 51.0 -61.1 -43.8 -57.0 -0.6 -5.2 62 70 X Q H X S+ 0 0 92 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.884 107.2 54.5 -63.7 -36.9 -57.1 3.1 -6.2 63 71 X G H < S+ 0 0 0 -4,-2.3 4,-0.3 2,-0.2 -1,-0.2 0.921 111.5 44.4 -62.3 -42.4 -53.7 3.6 -4.6 64 72 X L H ><>S+ 0 0 0 -4,-1.9 5,-1.7 1,-0.2 3,-1.6 0.944 113.3 50.6 -64.8 -46.5 -52.3 0.8 -6.7 65 73 X V H ><5S+ 0 0 18 -4,-2.8 75,-2.0 1,-0.3 3,-1.8 0.885 102.7 60.8 -58.6 -39.7 -54.1 2.0 -9.8 66 74 X D T 3<5S+ 0 0 49 -4,-2.6 72,-1.9 1,-0.3 -1,-0.3 0.547 100.3 56.3 -71.3 -7.5 -52.7 5.5 -9.3 67 75 X C B < 5S-i 138 0C 4 -3,-1.6 -1,-0.3 -4,-0.3 72,-0.2 0.562 125.1-100.1 -85.6 -16.0 -49.2 4.2 -9.6 68 76 X G T < 5S+ 0 0 25 -3,-1.8 -3,-0.2 70,-0.6 71,-0.2 0.483 72.8 152.3 99.4 10.7 -49.8 2.7 -13.0 69 77 X C < - 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