==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 16-OCT-12 2YNK . COMPND 2 MOLECULE: WZI; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.R.BUSHELL,I.L.MAINPRIZE,M.A.WEAR,H.LOU,L.KONG,B.DAVIS,H.BA . 441 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18589.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 301 68.3 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 . 195 44.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 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 . 22 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 1 0 0 0 0 1 0 0 1 0 0 0 0 1 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 . 1 4 0 1 0 2 2 3 1 5 2 2 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 0 0 0 0 0 0 0 0 0 0 0 1 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 24 A A 0 0 26 0, 0.0 2,-0.2 0, 0.0 101,-0.1 0.000 360.0 360.0 360.0 163.6 101.0 72.4 14.0 2 25 A G + 0 0 0 103,-0.1 32,-2.9 106,-0.1 33,-0.2 -0.588 360.0 9.7 95.1-145.4 104.1 70.5 12.9 3 26 A L E -A 33 0A 0 -2,-0.2 2,-0.4 30,-0.2 30,-0.2 -0.388 50.1-160.1 -75.6 151.2 107.1 69.2 14.8 4 27 A V E -A 32 0A 5 28,-1.3 28,-2.3 -2,-0.1 3,-0.2 -0.893 18.1-156.5-132.5 97.3 107.3 69.4 18.6 5 28 A V - 0 0 43 -2,-0.4 145,-0.1 26,-0.2 143,-0.0 -0.165 45.8 -47.8 -73.0 169.0 110.9 69.2 19.8 6 29 A N + 0 0 22 143,-0.2 2,-0.4 4,-0.1 -1,-0.2 -0.103 64.3 165.6 -43.3 106.0 112.2 68.0 23.2 7 30 A D > - 0 0 18 -3,-0.2 4,-1.4 1,-0.1 5,-0.1 -0.990 24.4-157.1-120.1 137.5 110.1 69.7 25.9 8 31 A N H > S+ 0 0 29 -2,-0.4 4,-2.0 79,-0.2 5,-0.2 0.895 90.1 49.5 -86.1 -41.1 110.4 68.2 29.3 9 32 A D H > S+ 0 0 10 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.920 114.2 47.0 -60.2 -46.1 107.1 69.5 30.8 10 33 A L H > S+ 0 0 1 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.930 111.1 51.1 -60.4 -49.9 105.2 68.3 27.8 11 34 A R H X S+ 0 0 4 -4,-1.4 4,-2.7 1,-0.2 -1,-0.2 0.876 110.2 47.8 -58.4 -44.8 106.8 64.9 27.8 12 35 A N H X S+ 0 0 10 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.894 113.3 48.7 -67.5 -38.8 106.2 64.1 31.4 13 36 A D H X S+ 0 0 4 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.912 114.9 44.5 -64.4 -44.8 102.5 65.2 31.1 14 37 A L H X S+ 0 0 1 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.914 113.2 51.4 -64.3 -43.0 102.0 63.0 28.0 15 38 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.838 108.4 52.4 -64.9 -34.6 103.9 60.1 29.6 16 39 A W H X S+ 0 0 1 -4,-1.9 4,-1.2 2,-0.2 6,-0.2 0.963 113.1 43.5 -62.8 -52.1 101.6 60.4 32.7 17 40 A L H <>S+ 0 0 0 -4,-2.0 5,-1.6 1,-0.2 6,-1.2 0.865 115.5 49.4 -62.3 -38.2 98.5 60.3 30.5 18 41 A S H ><5S+ 0 0 4 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.910 109.9 47.7 -71.7 -44.1 99.9 57.4 28.4 19 42 A D H 3<5S+ 0 0 0 -4,-2.2 247,-0.4 1,-0.3 254,-0.2 0.699 110.0 54.0 -74.9 -19.9 101.0 55.1 31.2 20 43 A R T 3<5S- 0 0 44 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.336 115.2-117.7 -89.4 2.4 97.7 55.5 33.0 21 44 A G T < 5S+ 0 0 19 -3,-1.4 24,-0.2 2,-0.3 -3,-0.2 0.502 82.4 121.3 75.4 4.7 95.9 54.5 29.8 22 45 A V S > -A 3 0A 0 -2,-0.4 4,-1.2 -30,-0.2 3,-0.8 -0.629 17.0-145.0 -69.3 128.2 104.2 65.3 15.2 34 57 A Q H 3> S+ 0 0 39 -32,-2.9 4,-2.8 -2,-0.4 3,-0.5 0.905 99.0 63.6 -63.4 -39.1 101.6 67.6 16.8 35 58 A E H 3> S+ 0 0 29 1,-0.3 4,-1.4 -33,-0.2 -1,-0.2 0.780 102.3 51.2 -55.6 -29.8 98.9 66.0 14.5 36 59 A E H <> S+ 0 0 7 -3,-0.8 4,-1.8 141,-0.3 -1,-0.3 0.813 108.4 49.8 -77.6 -34.9 99.7 62.7 16.4 37 60 A I H X S+ 0 0 2 -4,-1.2 4,-2.0 -3,-0.5 -2,-0.2 0.931 110.5 52.2 -64.4 -43.7 99.3 64.4 19.8 38 61 A A H X S+ 0 0 32 -4,-2.8 4,-1.3 2,-0.2 -2,-0.2 0.874 108.1 50.6 -59.4 -42.6 95.9 65.8 18.6 39 62 A R H >X S+ 0 0 67 -4,-1.4 4,-0.8 2,-0.2 3,-0.7 0.951 110.1 47.8 -64.2 -52.9 94.6 62.4 17.5 40 63 A A H >< S+ 0 0 7 -4,-1.8 3,-0.8 1,-0.2 -1,-0.2 0.873 109.7 55.6 -56.8 -36.9 95.4 60.7 20.8 41 64 A L H >< S+ 0 0 31 -4,-2.0 3,-1.1 1,-0.2 -1,-0.2 0.809 100.1 59.1 -65.8 -30.6 93.8 63.6 22.6 42 65 A K H << S+ 0 0 174 -4,-1.3 -1,-0.2 -3,-0.7 -2,-0.2 0.686 109.7 42.6 -75.6 -17.9 90.5 63.1 20.7 43 66 A K T << S+ 0 0 179 -3,-0.8 2,-0.4 -4,-0.8 -1,-0.3 -0.153 85.4 144.1-116.0 36.4 90.1 59.6 21.9 44 67 A A < - 0 0 26 -3,-1.1 -21,-0.2 -21,-0.1 -22,-0.1 -0.619 34.3-162.5 -82.8 130.1 91.1 60.4 25.5 45 68 A K + 0 0 174 -23,-1.9 2,-0.2 -2,-0.4 -22,-0.1 -0.799 15.8 173.6-116.0 84.5 89.4 58.5 28.3 46 69 A P + 0 0 45 0, 0.0 3,-0.1 0, 0.0 -25,-0.0 -0.600 14.0 170.6 -81.7 153.2 89.8 60.3 31.6 47 70 A S + 0 0 93 -2,-0.2 2,-0.3 1,-0.1 3,-0.0 0.366 60.9 59.4-138.4 -7.0 88.0 59.1 34.7 48 71 A Y S > S- 0 0 144 1,-0.1 4,-0.8 258,-0.0 -1,-0.1 -0.841 78.2-124.2-120.8 162.3 89.6 61.2 37.5 49 72 A S H >> S+ 0 0 63 -2,-0.3 4,-2.3 1,-0.2 3,-0.6 0.871 112.9 60.2 -73.7 -37.5 89.8 64.9 38.0 50 73 A S H 3> S+ 0 0 7 255,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.894 103.5 53.9 -51.0 -39.8 93.6 64.7 38.2 51 74 A E H 3> S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.789 105.7 50.0 -70.3 -28.3 93.4 63.3 34.7 52 75 A Q H X S+ 0 0 2 -4,-2.0 3,-1.1 1,-0.2 4,-1.1 0.968 112.4 54.3 -61.2 -52.0 96.8 67.0 33.0 55 78 A L H >X S+ 0 0 31 -4,-2.1 3,-0.7 1,-0.3 4,-0.7 0.876 105.3 51.9 -45.6 -48.6 94.8 66.7 29.8 56 79 A A H 3X S+ 0 0 70 -4,-2.3 4,-1.1 1,-0.2 -1,-0.3 0.796 103.3 61.6 -64.8 -26.5 93.9 70.5 29.7 57 80 A R H < S+ 0 0 16 -4,-1.7 3,-1.3 -3,-0.2 -2,-0.2 0.973 115.3 46.0 -62.6 -55.3 103.1 78.2 24.9 65 88 A L H 3< S+ 0 0 27 -4,-3.3 -2,-0.2 1,-0.3 -3,-0.2 0.879 121.3 37.0 -55.0 -44.9 105.8 76.3 22.8 66 89 A K T 3< S+ 0 0 31 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.181 82.5 146.1-102.7 18.2 104.4 77.5 19.4 67 90 A A < - 0 0 15 -3,-1.3 34,-0.3 -4,-0.3 374,-0.1 -0.151 64.8-106.1 -50.6 146.9 103.4 81.1 20.4 68 91 A D S S+ 0 0 60 1,-0.2 33,-2.7 32,-0.1 2,-0.4 0.847 105.9 12.8 -45.3 -46.3 103.8 83.6 17.6 69 92 A F E S-CD 100 440C 64 371,-2.1 371,-3.2 31,-0.2 2,-0.4 -0.999 74.6-173.7-138.1 135.0 106.8 85.1 19.4 70 93 A R E -CD 99 439C 28 29,-2.3 29,-2.1 -2,-0.4 2,-0.5 -0.978 10.2-163.3-140.0 123.0 108.7 83.6 22.3 71 94 A V E -CD 98 438C 27 367,-2.6 367,-2.7 -2,-0.4 2,-0.3 -0.909 15.3-177.0-104.7 129.9 111.6 84.8 24.4 72 95 A T E -CD 97 437C 37 25,-2.8 25,-3.5 -2,-0.5 2,-0.3 -0.934 2.5-175.5-128.0 151.9 113.6 82.4 26.5 73 96 A G E -CD 96 436C 17 363,-1.9 363,-2.3 -2,-0.3 2,-0.3 -0.988 8.6-175.2-147.0 146.5 116.4 82.8 29.0 74 97 A Y E +CD 95 435C 27 21,-2.0 21,-2.9 -2,-0.3 2,-0.3 -0.986 8.1 171.4-142.6 138.7 118.8 80.7 31.1 75 98 A T E +CD 94 434C 76 359,-2.0 359,-2.0 -2,-0.3 2,-0.3 -0.989 7.3 168.9-144.6 150.0 121.3 81.8 33.6 76 99 A S E - D 0 433C 17 17,-0.7 357,-0.2 -2,-0.3 3,-0.1 -0.983 43.9-125.3-157.2 164.4 123.5 79.9 36.1 77 100 A T S S- 0 0 87 355,-1.8 2,-0.3 1,-0.3 356,-0.1 0.818 90.4 -34.6 -79.6 -33.6 126.3 79.9 38.6 78 101 A D S S- 0 0 27 354,-0.3 -1,-0.3 15,-0.1 349,-0.1 -0.968 78.1 -62.3-171.8 174.3 128.1 77.0 36.8 79 102 A Q - 0 0 52 -2,-0.3 14,-0.0 347,-0.2 349,-0.0 -0.541 61.2-103.6 -69.2 135.7 127.6 73.8 34.8 80 103 A P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.291 21.6-136.4 -55.1 150.7 125.9 71.0 36.7 81 104 A G S S+ 0 0 2 348,-0.1 345,-0.1 347,-0.1 348,-0.1 0.861 87.1 57.0 -80.6 -39.1 128.2 68.3 37.9 82 105 A T S S- 0 0 8 1,-0.1 2,-0.1 317,-0.1 315,-0.0 -0.569 98.9 -98.7 -87.0 156.1 126.0 65.4 37.0 83 106 A P - 0 0 9 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.367 41.8-125.3 -68.4 158.0 124.7 64.9 33.4 84 107 A Q - 0 0 21 1,-0.1 264,-0.2 -4,-0.1 5,-0.2 -0.745 17.3-121.7-114.7 157.4 121.2 66.1 32.6 85 108 A G > - 0 0 1 -2,-0.3 3,-2.8 1,-0.2 4,-0.4 0.095 55.5 -31.2 -86.0-170.5 118.1 64.4 31.2 86 109 A F T 3 S- 0 0 0 70,-2.7 -1,-0.2 1,-0.3 65,-0.1 -0.185 130.7 -1.4 -40.8 121.6 115.7 64.8 28.3 87 110 A G T 3 S+ 0 0 37 -3,-0.1 -1,-0.3 1,-0.1 -79,-0.2 0.559 112.1 95.9 70.3 13.4 115.5 68.5 27.4 88 111 A Q < + 0 0 53 -3,-2.8 2,-0.9 -4,-0.1 -3,-0.2 0.418 43.5 104.1-121.2 3.9 117.8 69.6 30.2 89 112 A T - 0 0 37 -4,-0.4 77,-0.2 75,-0.2 -2,-0.1 -0.772 51.5-163.4 -89.0 105.7 121.4 70.0 28.7 90 113 A Q - 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