==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 06-OCT-08 3ESI . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PECTOBACTERIUM ATROSEPTICUM; . AUTHOR J.SEETHARAMAN,S.LEW,H.WANG,H.JANJUA,E.L.FOOTE,R.XIAO,R.NAIR, . 496 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23207.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 381 76.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 206 41.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 8 1.6 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 . 60 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 60 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.6 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 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 2 1 0 4 0 0 0 1 11 4 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 3 1 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 M 0 0 46 0, 0.0 29,-0.1 0, 0.0 174,-0.0 0.000 360.0 360.0 360.0 -39.7 17.6 24.1 -1.4 2 2 A L - 0 0 76 1,-0.1 25,-0.2 48,-0.0 2,-0.1 -0.583 360.0-109.5 -95.8 160.9 20.9 24.9 -3.2 3 3 A P - 0 0 11 0, 0.0 2,-0.5 0, 0.0 23,-0.2 -0.407 35.0-101.4 -82.3 162.5 23.4 27.7 -2.4 4 4 A V E -A 25 0A 70 21,-2.5 21,-2.6 -2,-0.1 2,-0.8 -0.733 35.5-132.2 -83.2 128.3 23.9 30.8 -4.6 5 5 A E E +A 24 0A 75 -2,-0.5 19,-0.2 19,-0.2 3,-0.1 -0.736 29.7 174.4 -85.6 110.2 27.1 30.3 -6.6 6 6 A L E - 0 0 74 17,-2.7 2,-0.3 -2,-0.8 -1,-0.2 0.963 66.9 -8.3 -78.7 -56.4 29.2 33.4 -6.4 7 7 A V E -A 23 0A 65 16,-1.2 16,-2.4 2,-0.0 2,-0.5 -0.991 54.0-159.4-144.0 146.3 32.3 32.3 -8.2 8 8 A R E -A 22 0A 112 -2,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.946 19.2-148.8-128.0 107.5 33.5 29.0 -9.6 9 9 A H - 0 0 97 12,-2.7 2,-0.1 -2,-0.5 3,-0.1 -0.223 29.6 -91.9 -70.8 166.2 37.2 28.8 -10.2 10 10 A D - 0 0 147 1,-0.1 2,-0.3 10,-0.1 11,-0.2 -0.420 50.0 -90.5 -75.3 156.4 38.7 26.7 -13.0 11 11 A V - 0 0 55 9,-0.1 2,-0.9 -2,-0.1 9,-0.2 -0.514 32.1-148.2 -71.5 130.2 39.7 23.1 -12.3 12 12 A K - 0 0 134 7,-2.0 2,-0.3 -2,-0.3 -1,-0.1 -0.784 18.0-166.6-100.4 88.7 43.3 22.8 -11.2 13 13 A K + 0 0 169 -2,-0.9 5,-0.2 5,-0.2 2,-0.1 -0.578 15.5 163.3 -78.7 135.3 44.4 19.4 -12.5 14 14 A T - 0 0 68 3,-1.5 -1,-0.1 -2,-0.3 4,-0.0 -0.151 61.5 -51.0-120.4-140.4 47.7 17.9 -11.1 15 15 A D S S- 0 0 145 -2,-0.1 3,-0.0 1,-0.1 -2,-0.0 0.999 120.5 -25.0 -64.6 -68.9 48.8 14.3 -11.4 16 16 A E S S+ 0 0 98 -3,-0.0 76,-1.0 2,-0.0 2,-0.4 0.596 119.8 85.0-119.1 -23.5 45.8 12.4 -10.0 17 17 A T E - B 0 91A 30 74,-0.2 -3,-1.5 75,-0.1 2,-0.3 -0.723 56.4-163.7 -91.2 131.2 44.0 15.0 -7.8 18 18 A S E - B 0 90A 20 72,-2.0 72,-2.2 -2,-0.4 2,-0.3 -0.739 7.1-161.8-106.0 156.5 41.6 17.6 -9.3 19 19 A Q E + B 0 89A 47 -2,-0.3 -7,-2.0 70,-0.2 2,-0.3 -0.998 14.4 177.3-144.4 145.3 40.5 20.8 -7.5 20 20 A V E - B 0 88A 2 68,-1.5 68,-2.2 -2,-0.3 2,-0.5 -0.989 12.6-157.3-145.4 135.5 37.7 23.3 -7.7 21 21 A E E - B 0 87A 55 -2,-0.3 -12,-2.7 -11,-0.2 2,-0.3 -0.971 12.2-173.3-118.3 128.8 37.1 26.2 -5.5 22 22 A L E -AB 8 86A 3 64,-2.6 64,-2.9 -2,-0.5 2,-0.6 -0.905 19.8-148.0-121.4 150.2 33.7 27.8 -5.1 23 23 A M E -AB 7 85A 64 -16,-2.4 -17,-2.7 -2,-0.3 -16,-1.2 -0.983 30.9-176.0-112.3 123.4 32.4 30.9 -3.4 24 24 A L E -AB 5 84A 0 60,-3.2 60,-3.5 -2,-0.6 2,-0.5 -0.902 21.5-143.3-124.6 152.7 28.9 30.3 -2.2 25 25 A Q E -AB 4 83A 50 -21,-2.6 -21,-2.5 -2,-0.3 2,-1.2 -0.967 15.6-137.6-117.6 127.1 26.2 32.3 -0.5 26 26 A V - 0 0 0 56,-2.9 55,-3.2 -2,-0.5 56,-0.2 -0.728 26.9-139.8 -85.4 98.2 23.9 30.7 2.1 27 27 A D > - 0 0 54 -2,-1.2 3,-2.2 -25,-0.2 -1,-0.0 -0.418 5.2-142.4 -65.2 121.0 20.6 32.2 1.1 28 28 A P T 3 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.652 99.5 62.9 -55.7 -18.2 18.4 33.2 4.2 29 29 A D T 3 S+ 0 0 136 5,-0.1 2,-0.1 3,-0.0 -2,-0.1 0.331 73.4 123.8 -93.4 7.6 15.4 32.0 2.2 30 30 A L S X S- 0 0 10 -3,-2.2 3,-2.8 1,-0.1 4,-0.3 -0.423 73.1-121.5 -68.9 142.2 16.5 28.3 1.9 31 31 A F G > S+ 0 0 28 1,-0.3 3,-1.2 2,-0.2 -1,-0.1 0.755 108.9 76.2 -54.6 -23.5 14.0 25.8 3.2 32 32 A W G 3 S+ 0 0 9 1,-0.3 10,-0.4 139,-0.1 -1,-0.3 0.717 101.7 39.1 -59.9 -22.0 16.8 24.7 5.6 33 33 A F G < S+ 0 0 17 -3,-2.8 -1,-0.3 8,-0.1 -2,-0.2 0.367 79.8 140.3-112.4 4.3 16.0 27.8 7.6 34 34 A N X> - 0 0 26 -3,-1.2 3,-3.3 -4,-0.3 4,-1.6 -0.263 54.5-133.6 -56.7 124.0 12.2 28.0 7.5 35 35 A G T 34 S+ 0 0 67 1,-0.3 -1,-0.2 2,-0.2 -4,-0.0 0.729 103.4 66.5 -47.3 -28.1 10.7 29.1 10.8 36 36 A H T 34 S+ 0 0 83 1,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.626 111.0 34.1 -71.5 -13.2 8.2 26.3 10.5 37 37 A F T <4 S+ 0 0 30 -3,-3.3 377,-0.6 1,-0.3 2,-0.3 0.743 125.9 9.9-111.7 -32.9 11.0 23.7 10.9 38 38 A T B < -F 413 0B 42 -4,-1.6 -1,-0.3 375,-0.1 375,-0.1 -0.998 37.4-162.1-153.3 146.1 13.6 25.2 13.2 39 39 A G S S+ 0 0 33 373,-0.7 285,-0.5 -2,-0.3 -1,-0.1 0.586 95.2 54.1 -99.6 -15.5 14.1 28.1 15.6 40 40 A Q S S- 0 0 29 372,-0.3 -1,-0.2 283,-0.1 2,-0.1 -0.670 85.9-159.9-116.6 73.7 17.9 27.8 15.7 41 41 A P + 0 0 38 0, 0.0 2,-0.3 0, 0.0 -8,-0.1 -0.312 27.3 142.0 -63.9 131.0 18.7 27.9 12.0 42 42 A L - 0 0 25 -10,-0.4 37,-0.2 37,-0.1 -2,-0.1 -0.949 60.0 -88.9-160.0 150.8 22.0 26.6 10.8 43 43 A L - 0 0 0 35,-2.6 35,-0.3 -2,-0.3 5,-0.1 -0.531 50.4-140.1 -69.0 104.6 23.1 24.6 7.7 44 44 A P > - 0 0 35 0, 0.0 4,-2.0 0, 0.0 3,-0.4 -0.103 20.5-105.6 -63.0 163.0 22.6 20.9 8.7 45 45 A G H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.828 116.2 59.9 -58.8 -35.8 25.0 18.2 7.8 46 46 A V H > S+ 0 0 13 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.920 108.2 45.2 -62.5 -39.5 22.8 16.7 5.1 47 47 A A H > S+ 0 0 0 -3,-0.4 4,-2.8 2,-0.2 5,-0.3 0.909 111.5 51.9 -68.7 -42.1 22.8 19.9 3.2 48 48 A Q H X S+ 0 0 5 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.929 114.8 42.7 -60.5 -42.7 26.5 20.4 3.6 49 49 A L H X S+ 0 0 5 -4,-2.6 4,-3.0 2,-0.2 -2,-0.2 0.938 112.5 53.7 -67.8 -46.9 27.1 16.8 2.2 50 50 A D H X S+ 0 0 29 -4,-2.8 4,-2.5 -5,-0.3 -2,-0.2 0.923 109.5 46.8 -53.3 -51.9 24.5 17.3 -0.5 51 51 A W H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 5,-0.3 0.906 111.5 52.7 -58.9 -42.2 26.1 20.4 -1.8 52 52 A V H X S+ 0 0 0 -4,-1.8 4,-2.6 -5,-0.3 -2,-0.2 0.949 111.8 46.1 -58.4 -46.6 29.5 18.7 -1.7 53 53 A M H X S+ 0 0 14 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.866 109.4 53.2 -66.1 -38.4 28.2 15.8 -3.7 54 54 A H H X S+ 0 0 74 -4,-2.5 4,-0.8 -5,-0.2 -1,-0.2 0.945 116.7 37.5 -64.1 -46.9 26.4 18.0 -6.4 55 55 A Y H X S+ 0 0 5 -4,-2.1 4,-1.6 1,-0.2 5,-0.5 0.907 114.0 56.0 -72.0 -40.3 29.5 20.0 -7.2 56 56 A A H X>S+ 0 0 0 -4,-2.6 5,-2.9 -5,-0.3 4,-1.3 0.850 113.7 38.9 -62.5 -35.1 31.9 17.1 -6.9 57 57 A T H <5S+ 0 0 36 -4,-1.8 -1,-0.2 3,-0.2 -2,-0.2 0.570 116.6 48.4 -94.3 -8.4 30.1 14.9 -9.4 58 58 A T H <5S+ 0 0 69 -4,-0.8 -2,-0.2 -3,-0.4 -1,-0.2 0.636 127.8 23.1-100.6 -15.3 29.2 17.6 -11.9 59 59 A V H <5S+ 0 0 23 -4,-1.6 -3,-0.2 -5,-0.1 -2,-0.2 0.642 135.8 15.0-122.0 -24.9 32.7 19.1 -12.0 60 60 A L T <5S+ 0 0 13 -4,-1.3 2,-0.4 -5,-0.5 -3,-0.2 0.763 128.1 27.6-119.3 -51.0 35.3 16.5 -10.9 61 61 A A > < + 0 0 2 -5,-2.9 3,-2.0 1,-0.2 -1,-0.1 -0.593 62.8 168.7-118.2 70.2 34.0 13.0 -10.9 62 62 A Q T 3 S+ 0 0 114 -2,-0.4 -1,-0.2 1,-0.3 -5,-0.1 0.823 77.4 44.1 -49.8 -42.1 31.2 12.9 -13.5 63 63 A G T 3 S+ 0 0 44 2,-0.0 59,-2.3 58,-0.0 -1,-0.3 0.089 103.2 85.1 -96.5 26.9 30.8 9.2 -13.6 64 64 A W E < -C 121 0A 46 -3,-2.0 2,-0.3 57,-0.2 -3,-0.1 -0.766 50.0-170.9-123.7 168.5 30.9 8.6 -9.9 65 65 A T E -C 120 0A 65 55,-1.7 55,-2.5 -2,-0.3 -2,-0.0 -0.959 38.1 -66.9-150.7 168.2 28.6 8.6 -6.9 66 66 A F E +C 119 0A 56 -2,-0.3 53,-0.2 53,-0.2 3,-0.1 -0.219 42.6 160.5 -59.0 140.6 28.5 8.4 -3.1 67 67 A L E - 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