==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 27-APR-11 2YH9 . COMPND 2 MOLECULE: SMALL PROTEIN A; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.ZETH,R.ALBRECHT . 201 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13179.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 108 53.7 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 . 50 24.9 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 . 3 1.5 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 . 1 0.5 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 . 12 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.5 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 0 0 0 0 3 0 0 0 0 0 0 0 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 2 0 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 5 A V > 0 0 34 0, 0.0 3,-1.0 0, 0.0 16,-0.1 0.000 360.0 360.0 360.0 -37.2 -21.5 51.5 -0.2 2 6 A S T 3 + 0 0 95 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.538 360.0 79.2 -74.3 -6.1 -25.3 52.1 -0.5 3 7 A K T 3 S+ 0 0 128 13,-0.1 2,-0.3 10,-0.0 -1,-0.2 0.435 87.5 67.3 -82.4 -0.2 -25.0 48.5 -1.5 4 8 A I < - 0 0 5 -3,-1.0 2,-0.3 12,-0.1 9,-0.0 -0.911 57.9-173.6-124.4 155.5 -24.8 47.4 2.1 5 9 A R > - 0 0 155 -2,-0.3 3,-1.6 192,-0.0 190,-0.2 -0.999 36.9 -93.4-143.2 140.9 -27.0 47.4 5.2 6 10 A V T 3 S+ 0 0 91 -2,-0.3 190,-0.2 1,-0.2 3,-0.1 -0.168 110.3 42.5 -42.2 135.5 -26.7 46.6 9.0 7 11 A G T 3 S+ 0 0 45 188,-2.9 -1,-0.2 1,-0.4 2,-0.1 0.261 81.7 129.5 100.6 -11.6 -27.7 43.0 9.6 8 12 A X < - 0 0 45 -3,-1.6 187,-3.8 187,-0.1 -1,-0.4 -0.482 57.0-123.6 -75.4 150.6 -25.8 41.6 6.6 9 13 A T B > -A 194 0A 49 185,-0.3 4,-2.3 -2,-0.1 185,-0.2 -0.364 31.1-101.1 -79.7 165.4 -23.4 38.6 7.2 10 14 A Q H > S+ 0 0 8 183,-1.1 4,-2.7 1,-0.2 5,-0.2 0.869 125.5 56.0 -56.2 -34.9 -19.8 38.8 6.2 11 15 A Q H > S+ 0 0 123 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.893 107.6 47.8 -64.1 -41.7 -20.7 36.8 3.1 12 16 A Q H > S+ 0 0 96 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.894 114.2 45.3 -65.8 -45.1 -23.4 39.3 2.0 13 17 A V H X>S+ 0 0 0 -4,-2.3 4,-3.2 2,-0.2 5,-0.6 0.928 112.7 50.0 -61.6 -48.6 -21.0 42.3 2.5 14 18 A A H X5S+ 0 0 19 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.852 109.2 53.4 -61.2 -33.1 -18.1 40.6 0.7 15 19 A Y H <5S+ 0 0 216 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.930 115.9 39.8 -65.3 -39.9 -20.6 39.8 -2.2 16 20 A A H <5S+ 0 0 37 -4,-1.9 -2,-0.2 1,-0.1 -3,-0.1 0.905 137.5 9.7 -74.3 -43.7 -21.5 43.5 -2.4 17 21 A L H <5S- 0 0 34 -4,-3.2 -3,-0.2 1,-0.3 -2,-0.2 0.544 101.6-114.4-115.0 -15.8 -18.2 45.2 -1.9 18 22 A G << - 0 0 29 -4,-1.3 -1,-0.3 -5,-0.6 -3,-0.1 -0.294 54.9 -51.0 93.9 172.6 -15.6 42.5 -2.1 19 23 A T S S- 0 0 80 -2,-0.1 2,-0.1 1,-0.1 148,-0.0 -0.372 74.7 -95.0 -73.2 161.3 -13.4 41.5 1.0 20 24 A P - 0 0 15 0, 0.0 149,-0.2 0, 0.0 -1,-0.1 -0.345 18.9-120.0 -82.3 163.7 -11.7 44.5 2.6 21 25 A L S S+ 0 0 89 147,-0.8 2,-0.3 1,-0.2 148,-0.2 0.878 98.9 11.2 -65.5 -40.0 -8.2 45.8 2.0 22 26 A X E +B 168 0B 42 146,-2.3 146,-2.7 136,-0.1 2,-0.3 -0.971 63.7 177.6-137.1 157.6 -7.5 45.2 5.7 23 27 A S E -B 167 0B 23 -2,-0.3 144,-0.2 144,-0.2 139,-0.1 -0.968 44.6 -86.1-154.9 164.1 -9.1 43.5 8.7 24 28 A D - 0 0 23 142,-2.0 142,-0.2 -2,-0.3 141,-0.1 -0.625 32.2-149.9 -80.3 133.8 -8.1 42.9 12.3 25 29 A P > + 0 0 4 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 0.728 66.9 99.2 -77.1 -20.4 -5.9 39.7 12.5 26 30 A F T 3 S+ 0 0 15 1,-0.2 139,-0.3 85,-0.1 3,-0.1 -0.446 88.2 19.4 -72.7 134.9 -7.0 38.8 16.1 27 31 A G T 3 S+ 0 0 52 1,-0.3 -1,-0.2 -2,-0.1 2,-0.1 0.185 99.3 114.0 91.5 -12.0 -9.7 36.1 16.2 28 32 A T < - 0 0 2 -3,-1.4 -1,-0.3 -4,-0.1 135,-0.1 -0.486 65.5-132.2 -92.4 163.9 -9.1 34.8 12.7 29 33 A N S S+ 0 0 82 133,-0.4 24,-2.7 1,-0.1 2,-0.4 0.673 82.5 47.8 -90.2 -19.5 -7.8 31.4 11.7 30 34 A T E -E 52 0C 52 22,-0.2 130,-2.1 130,-0.1 2,-0.4 -0.988 54.6-176.1-134.3 128.8 -5.0 32.1 9.1 31 35 A W E -EF 51 159C 0 20,-2.1 20,-3.2 -2,-0.4 2,-0.5 -0.974 10.1-162.3-118.7 133.4 -2.2 34.6 9.3 32 36 A F E -EF 50 158C 66 126,-2.6 126,-2.2 -2,-0.4 125,-1.0 -0.977 3.2-167.7-126.1 123.9 0.2 35.1 6.3 33 37 A Y E -E 49 0C 0 16,-2.9 16,-1.9 -2,-0.5 2,-0.4 -0.873 8.9-174.2-109.0 141.0 3.6 36.8 6.5 34 38 A V E -E 48 0C 17 -2,-0.4 2,-1.7 14,-0.2 14,-0.2 -0.944 21.1-145.0-130.3 111.5 5.7 37.9 3.6 35 39 A F + 0 0 21 12,-1.6 3,-0.3 -2,-0.4 2,-0.3 -0.567 36.3 160.2 -86.7 86.8 9.1 39.1 4.9 36 40 A R + 0 0 137 -2,-1.7 -2,-0.1 1,-0.2 10,-0.0 -0.792 55.8 11.3-111.0 156.6 9.9 41.9 2.5 37 41 A Q S S+ 0 0 203 -2,-0.3 -1,-0.2 1,-0.2 -2,-0.0 0.766 91.4 126.9 43.2 38.7 12.3 44.8 2.8 38 42 A Q > - 0 0 70 -3,-0.3 3,-0.7 0, 0.0 -1,-0.2 -0.981 61.1-126.2-117.8 113.6 13.8 43.1 5.9 39 43 A P T 3 S+ 0 0 133 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 -0.120 90.1 51.7 -51.9 155.8 17.6 42.7 5.8 40 44 A G T 3 S+ 0 0 61 1,-0.3 2,-0.1 0, 0.0 0, 0.0 0.443 70.1 155.1 93.9 1.2 18.9 39.1 6.4 41 45 A H < - 0 0 76 -3,-0.7 2,-0.3 6,-0.0 -1,-0.3 -0.365 21.1-169.9 -62.9 140.4 16.7 37.5 3.8 42 46 A E + 0 0 167 3,-0.1 3,-0.2 -2,-0.1 2,-0.1 -0.935 31.3 40.5-134.1 151.1 18.1 34.1 2.5 43 47 A G S S- 0 0 70 -2,-0.3 4,-0.1 1,-0.1 3,-0.0 -0.447 82.6 -76.8 112.0-179.4 17.2 31.7 -0.4 44 48 A V S S+ 0 0 156 -2,-0.1 2,-0.3 2,-0.1 -1,-0.1 0.272 107.6 47.8-108.8 9.8 16.1 31.6 -4.0 45 49 A T S S- 0 0 75 -3,-0.2 2,-0.2 21,-0.0 -3,-0.1 -0.986 99.2 -81.4-145.2 161.1 12.6 32.4 -3.3 46 50 A Q - 0 0 76 -2,-0.3 2,-0.2 1,-0.1 -10,-0.1 -0.357 48.9-125.1 -59.2 123.5 10.6 35.0 -1.2 47 51 A Q + 0 0 55 -12,-0.3 -12,-1.6 -2,-0.2 2,-0.3 -0.496 41.6 165.2 -67.7 135.5 10.4 33.8 2.4 48 52 A T E -EG 34 65C 22 17,-2.3 17,-1.4 -14,-0.2 2,-0.3 -0.907 23.2-152.1-142.6 173.8 6.8 33.5 3.7 49 53 A L E -EG 33 64C 7 -16,-1.9 -16,-2.9 -2,-0.3 2,-0.5 -0.960 0.9-162.7-153.4 126.3 5.0 32.0 6.7 50 54 A T E -EG 32 63C 33 13,-2.8 13,-2.1 -2,-0.3 2,-0.4 -0.978 12.5-166.7-112.2 123.4 1.4 30.7 7.0 51 55 A L E -EG 31 62C 0 -20,-3.2 -20,-2.1 -2,-0.5 2,-0.5 -0.888 5.8-156.4-111.6 133.5 0.0 30.2 10.5 52 56 A T E -EG 30 61C 52 9,-2.0 8,-3.0 -2,-0.4 9,-1.5 -0.931 10.6-171.6-108.7 131.9 -3.1 28.3 11.4 53 57 A F E - G 0 59C 3 -24,-2.7 6,-0.2 -2,-0.5 92,-0.1 -0.923 18.0-128.3-118.2 145.2 -5.0 29.0 14.6 54 58 A N > - 0 0 62 4,-2.3 3,-2.4 -2,-0.4 4,-0.1 -0.261 44.8 -85.7 -80.3-179.7 -7.9 27.2 16.1 55 59 A S T 3 S+ 0 0 123 1,-0.3 -1,-0.1 2,-0.1 -26,-0.0 0.668 128.5 58.6 -66.9 -12.2 -11.1 28.9 17.2 56 60 A S T 3 S- 0 0 103 2,-0.1 -1,-0.3 89,-0.0 -2,-0.0 0.356 119.5-106.2 -92.3 1.9 -9.5 29.6 20.6 57 61 A G S < S+ 0 0 14 -3,-2.4 89,-1.0 1,-0.3 2,-0.5 0.733 73.2 140.7 84.7 18.7 -6.6 31.6 19.0 58 62 A V B -H 145 0D 42 87,-0.2 -4,-2.3 -4,-0.1 2,-0.4 -0.846 58.1-112.3-100.2 134.4 -4.0 28.9 19.6 59 63 A L E +G 53 0C 1 85,-3.3 84,-3.4 -2,-0.5 -6,-0.3 -0.452 41.8 164.3 -64.6 117.3 -1.4 28.2 17.0 60 64 A T E + 0 0 67 -8,-3.0 2,-0.3 -2,-0.4 -7,-0.2 0.632 60.5 27.8-108.7 -18.8 -1.9 24.7 15.5 61 65 A N E -G 52 0C 82 -9,-1.5 -9,-2.0 80,-0.1 2,-0.5 -0.988 53.7-161.3-148.6 139.3 0.3 24.7 12.3 62 66 A I E -G 51 0C 55 -2,-0.3 2,-0.6 -11,-0.2 -11,-0.2 -0.966 14.0-174.2-117.2 115.2 3.4 26.4 11.2 63 67 A D E -G 50 0C 60 -13,-2.1 -13,-2.8 -2,-0.5 2,-0.3 -0.890 0.8-172.9-120.5 102.6 4.0 26.4 7.5 64 68 A N E -G 49 0C 82 -2,-0.6 -15,-0.2 -15,-0.2 -17,-0.0 -0.602 20.2-127.3 -86.5 151.5 7.2 27.8 6.2 65 69 A K E G 48 0C 121 -17,-1.4 -17,-2.3 1,-0.6 -2,-0.0 -0.963 360.0 360.0-153.0 118.0 7.8 28.2 2.5 66 70 A P 0 0 124 0, 0.0 -1,-0.6 0, 0.0 -18,-0.1 0.730 360.0 360.0 -74.1 360.0 10.1 27.1 1.5 67 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 68 5 B V > 0 0 122 0, 0.0 3,-0.9 0, 0.0 16,-0.0 0.000 360.0 360.0 360.0 174.2 -5.5 56.1 -19.5 69 6 B S T 3 + 0 0 122 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.456 360.0 82.9 -68.1 -4.0 -6.5 58.5 -22.3 70 7 B K T 3 S+ 0 0 113 13,-0.1 2,-0.4 10,-0.0 -1,-0.2 0.257 78.8 77.8 -88.9 9.3 -9.2 60.0 -20.0 71 8 B I < - 0 0 69 -3,-0.9 2,-0.4 12,-0.1 9,-0.0 -0.940 58.9-170.6-119.2 151.4 -6.7 62.3 -18.2 72 9 B R > - 0 0 175 -2,-0.4 3,-2.0 0, 0.0 8,-0.0 -0.997 33.9-100.1-137.4 138.5 -5.3 65.6 -19.4 73 10 B V T 3 S+ 0 0 155 -2,-0.4 3,-0.1 1,-0.3 0, 0.0 -0.238 110.6 44.0 -46.7 140.1 -2.7 68.0 -18.3 74 11 B G T 3 S+ 0 0 75 1,-0.3 -1,-0.3 -3,-0.0 2,-0.1 0.201 83.3 132.7 97.3 -10.7 -4.4 70.8 -16.4 75 12 B X < - 0 0 51 -3,-2.0 -1,-0.3 1,-0.1 2,-0.1 -0.368 55.0-125.2 -72.2 151.2 -6.7 68.5 -14.5 76 13 B T > - 0 0 70 -3,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.410 31.2-102.8 -83.9 164.3 -7.2 69.0 -10.8 77 14 B Q H > S+ 0 0 171 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.871 123.5 55.9 -57.2 -34.7 -6.7 66.0 -8.4 78 15 B Q H > S+ 0 0 88 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.908 107.7 46.4 -62.1 -47.0 -10.5 65.7 -8.2 79 16 B Q H > S+ 0 0 101 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.867 115.0 47.2 -61.1 -42.5 -10.9 65.3 -12.0 80 17 B V H X>S+ 0 0 48 -4,-2.2 4,-3.0 2,-0.2 5,-0.5 0.946 112.6 48.9 -64.6 -45.4 -8.0 62.8 -12.1 81 18 B A H X5S+ 0 0 13 -4,-2.7 4,-1.5 -5,-0.2 96,-1.0 0.840 110.1 52.0 -63.6 -32.3 -9.4 60.8 -9.2 82 19 B Y H <5S+ 0 0 124 -4,-2.0 94,-2.8 94,-0.2 -1,-0.2 0.928 115.7 41.5 -69.8 -39.3 -12.9 60.8 -10.8 83 20 B A H <5S+ 0 0 8 -4,-2.0 -2,-0.2 92,-0.2 -1,-0.1 0.896 137.2 10.1 -69.9 -44.1 -11.3 59.5 -14.1 84 21 B L H <5S- 0 0 55 -4,-3.0 -3,-0.2 1,-0.3 -2,-0.2 0.512 100.5-116.6-115.3 -15.0 -8.9 56.9 -12.7 85 22 B G << - 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