==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 18-JAN-07 2OL7 . COMPND 2 MOLECULE: OUTER SURFACE PROTEIN A; . SOURCE 2 ORGANISM_SCIENTIFIC: BORRELIA BURGDORFERI; . AUTHOR K.MAKABE,V.TERECHKO,S.KOIDE . 496 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26851.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 337 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 243 49.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 14 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 14 2.8 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 . 35 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 1 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 . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 4 2 3 6 12 7 2 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 1 1 0 0 0 0 0 0 0 0 0 2 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 24 A S 0 0 63 0, 0.0 2,-0.3 0, 0.0 33,-0.1 0.000 360.0 360.0 360.0 160.1 -0.7 -9.0 -37.4 2 25 A H + 0 0 172 31,-0.1 2,-0.3 16,-0.1 16,-0.1 -0.990 360.0 177.0-137.8 147.8 2.2 -9.9 -39.7 3 26 A M > - 0 0 36 -2,-0.3 3,-0.5 16,-0.1 2,-0.1 -0.941 29.2-123.4-148.6 128.6 3.8 -8.1 -42.6 4 27 A K T 3 S+ 0 0 175 -2,-0.3 17,-0.2 1,-0.2 3,-0.1 -0.448 95.2 12.6 -68.0 144.8 6.8 -9.3 -44.7 5 28 A N T 3 S+ 0 0 102 1,-0.2 16,-2.9 -2,-0.1 17,-0.4 0.948 103.1 132.5 52.4 58.6 9.7 -6.9 -44.8 6 29 A S E < -A 20 0A 32 -3,-0.5 2,-0.4 14,-0.3 14,-0.2 -0.827 51.0-135.0-134.3 167.7 8.4 -4.8 -41.9 7 30 A V E -A 19 0A 70 12,-2.4 12,-2.3 -2,-0.3 2,-0.4 -0.980 20.4-129.7-126.5 136.0 9.4 -3.1 -38.7 8 31 A S E -A 18 0A 74 -2,-0.4 2,-0.5 10,-0.2 10,-0.2 -0.751 24.0-162.2 -85.4 132.0 7.4 -3.2 -35.4 9 32 A V E -A 17 0A 21 8,-2.8 8,-2.3 -2,-0.4 2,-0.2 -0.970 14.7-130.1-122.5 121.3 7.0 0.3 -33.9 10 33 A D E -A 16 0A 84 -2,-0.5 6,-0.2 6,-0.2 4,-0.1 -0.516 26.9-167.3 -71.9 138.1 6.0 0.8 -30.3 11 34 A L - 0 0 1 4,-2.2 61,-0.1 -2,-0.2 63,-0.0 -0.741 35.3 -69.8-117.9 167.7 3.1 3.2 -29.7 12 35 A P S > S- 0 0 1 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 -0.235 102.4 -5.4 -55.2 147.1 1.7 4.9 -26.6 13 36 A G T 3 S- 0 0 12 1,-0.2 -2,-0.2 80,-0.1 440,-0.1 -0.336 128.7 -24.3 65.2-145.0 -0.0 2.5 -24.2 14 37 A S T 3 S+ 0 0 32 439,-0.2 -1,-0.2 -4,-0.1 2,-0.1 0.501 108.4 102.7 -82.2 -4.9 -0.5 -1.2 -25.1 15 38 A M < + 0 0 32 -3,-1.1 -4,-2.2 -5,-0.0 2,-0.3 -0.334 39.4 176.0 -92.1 159.8 -0.4 -0.7 -28.9 16 39 A K E -A 10 0A 95 18,-0.2 2,-0.3 -6,-0.2 18,-0.3 -0.950 13.1-151.2-144.0 163.2 2.2 -1.3 -31.6 17 40 A V E -A 9 0A 0 -8,-2.3 -8,-2.8 -2,-0.3 2,-0.5 -0.981 11.4-133.5-134.1 150.1 2.1 -0.9 -35.5 18 41 A L E -AB 8 32A 27 14,-3.0 14,-2.0 -2,-0.3 2,-0.4 -0.913 22.9-171.6-101.1 132.7 3.9 -2.6 -38.3 19 42 A V E -AB 7 31A 6 -12,-2.3 -12,-2.4 -2,-0.5 12,-0.2 -0.954 28.8-108.0-122.0 138.9 5.3 -0.5 -41.1 20 43 A S E -A 6 0A 13 10,-2.1 -14,-0.3 -2,-0.4 -15,-0.1 -0.349 20.1-133.9 -59.7 144.9 6.8 -1.6 -44.3 21 44 A K S S+ 0 0 125 -16,-2.9 2,-0.3 -17,-0.2 -15,-0.1 0.823 89.6 29.9 -67.4 -32.6 10.6 -1.2 -44.6 22 45 A S S S- 0 0 89 -17,-0.4 8,-0.4 6,-0.1 2,-0.2 -0.852 83.0-115.3-127.0 159.7 10.3 0.3 -48.0 23 46 A S - 0 0 55 -2,-0.3 6,-0.2 1,-0.1 22,-0.1 -0.485 30.8-113.0 -86.7 165.5 7.7 2.3 -49.9 24 47 A N > - 0 0 71 4,-2.4 3,-2.3 -2,-0.2 -1,-0.1 -0.120 48.7 -76.2 -84.9-173.6 5.7 1.2 -53.0 25 48 A A T 3 S+ 0 0 106 1,-0.3 -2,-0.0 2,-0.1 -1,-0.0 0.798 134.5 49.4 -58.5 -29.9 6.0 2.6 -56.5 26 49 A D T 3 S- 0 0 135 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.326 121.4-107.0 -93.3 9.8 4.0 5.6 -55.5 27 50 A G S < S+ 0 0 35 -3,-2.3 2,-0.3 1,-0.3 -2,-0.1 0.566 74.1 135.6 81.4 11.8 6.2 6.2 -52.5 28 51 A K - 0 0 86 15,-0.0 -4,-2.4 19,-0.0 2,-0.3 -0.674 45.9-136.9 -98.9 145.3 3.7 5.1 -49.8 29 52 A Y E - C 0 44A 41 15,-3.2 15,-2.0 -2,-0.3 2,-0.3 -0.742 16.6-126.2 -95.1 146.7 4.3 2.9 -46.8 30 53 A D E - C 0 43A 73 -8,-0.4 -10,-2.1 -2,-0.3 2,-0.4 -0.726 23.8-165.2 -90.8 144.3 2.0 0.1 -45.7 31 54 A L E +BC 19 42A 0 11,-2.4 11,-1.9 -2,-0.3 2,-0.3 -0.985 9.9 175.0-130.3 138.4 0.7 -0.0 -42.1 32 55 A I E +BC 18 41A 30 -14,-2.0 -14,-3.0 -2,-0.4 2,-0.3 -0.997 5.1 162.5-143.1 141.7 -1.0 -2.9 -40.2 33 56 A A E - C 0 40A 3 7,-2.0 7,-3.2 -2,-0.3 2,-0.5 -0.979 28.9-135.8-150.2 151.9 -2.1 -3.2 -36.5 34 57 A T E - C 0 39A 65 -18,-0.3 2,-0.5 -2,-0.3 -18,-0.2 -0.983 22.8-179.9-111.9 128.8 -4.4 -5.4 -34.5 35 58 A V E > S- C 0 38A 20 3,-2.4 3,-1.8 -2,-0.5 -2,-0.0 -0.991 72.5 -18.2-130.0 117.4 -6.6 -3.6 -32.0 36 59 A D T 3 S- 0 0 111 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.908 128.4 -51.9 53.6 48.5 -8.9 -5.6 -29.8 37 60 A A T 3 S+ 0 0 101 1,-0.2 2,-0.5 -3,-0.0 -1,-0.3 0.555 115.3 113.3 64.7 14.0 -8.7 -8.6 -32.2 38 61 A L E < -C 35 0A 41 -3,-1.8 -3,-2.4 17,-0.0 2,-0.4 -0.960 63.5-133.7-115.5 129.8 -9.5 -6.5 -35.3 39 62 A E E -C 34 0A 105 -2,-0.5 2,-0.3 -5,-0.2 17,-0.3 -0.667 22.3-168.1 -81.4 127.6 -6.9 -6.0 -38.0 40 63 A L E -C 33 0A 0 -7,-3.2 -7,-2.0 -2,-0.4 2,-0.3 -0.864 6.5-176.6-112.6 147.5 -6.6 -2.4 -39.2 41 64 A S E +CD 32 54A 62 13,-2.3 13,-2.8 -2,-0.3 2,-0.3 -0.974 11.1 144.0-142.8 157.9 -4.6 -1.3 -42.3 42 65 A G E -C 31 0A 19 -11,-1.9 -11,-2.4 -2,-0.3 2,-0.3 -0.964 34.9-111.7-168.4-175.5 -3.6 1.8 -44.2 43 66 A T E -C 30 0A 79 9,-0.3 9,-0.5 -2,-0.3 2,-0.3 -0.928 27.5-173.3-131.6 157.8 -1.0 3.6 -46.2 44 67 A S E -C 29 0A 11 -15,-2.0 -15,-3.2 -2,-0.3 7,-0.1 -0.997 35.3-136.9-149.7 150.3 1.1 6.6 -45.4 45 68 A D S S+ 0 0 120 -2,-0.3 2,-0.3 -17,-0.2 6,-0.1 0.420 88.1 84.1 -84.6 2.3 3.6 9.1 -46.9 46 69 A K - 0 0 95 4,-0.4 3,-0.3 -17,-0.1 -17,-0.2 -0.772 68.2-150.2-104.3 154.3 5.6 8.8 -43.7 47 70 A N S S+ 0 0 106 -2,-0.3 -28,-0.1 1,-0.2 -1,-0.1 0.374 79.9 70.5-100.9 2.9 8.1 6.0 -43.0 48 71 A N S S- 0 0 49 21,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.412 114.6 -84.6-112.4 0.2 7.9 5.7 -39.3 49 72 A G S S+ 0 0 0 1,-0.4 2,-0.1 -3,-0.3 18,-0.1 0.213 86.7 128.0 111.4 -11.2 4.6 4.1 -38.4 50 73 A S + 0 0 1 19,-0.2 -1,-0.4 16,-0.1 -4,-0.4 -0.465 36.2 68.9 -81.4 151.0 2.6 7.4 -38.4 51 74 A G E S- E 0 67A 14 16,-1.6 16,-2.9 -2,-0.1 2,-0.4 -0.935 81.1 -51.1 140.7-160.7 -0.6 7.7 -40.4 52 75 A V E - E 0 66A 57 -9,-0.5 2,-0.4 -2,-0.3 -9,-0.3 -0.926 40.0-174.2-120.5 131.5 -4.2 6.4 -40.5 53 76 A L E - E 0 65A 0 12,-2.7 12,-2.8 -2,-0.4 2,-0.3 -0.961 7.8-168.9-124.7 146.2 -5.3 2.7 -40.4 54 77 A E E +DE 41 64A 108 -13,-2.8 -13,-2.3 -2,-0.4 2,-0.3 -0.960 11.1 168.3-134.0 156.0 -8.9 1.5 -40.8 55 78 A G E - E 0 63A 12 8,-2.2 8,-2.5 -2,-0.3 2,-0.4 -0.928 25.3-126.7-153.3 169.3 -10.9 -1.7 -40.3 56 79 A V E - E 0 62A 73 -2,-0.3 6,-0.2 -17,-0.3 -17,-0.1 -0.988 19.2-135.8-125.2 131.9 -14.5 -2.8 -40.2 57 80 A K > - 0 0 83 4,-3.1 3,-2.2 -2,-0.4 -19,-0.0 -0.332 29.1-109.0 -79.7 164.0 -16.3 -4.8 -37.5 58 81 A A T 3 S+ 0 0 118 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.886 122.9 57.1 -53.6 -38.6 -18.7 -7.7 -38.0 59 82 A D T 3 S- 0 0 112 1,-0.1 -1,-0.3 2,-0.1 22,-0.1 0.308 123.0-108.4 -78.6 5.4 -21.5 -5.3 -36.9 60 83 A A S < S+ 0 0 42 -3,-2.2 -2,-0.1 1,-0.3 -1,-0.1 0.264 71.9 142.0 90.2 -13.4 -20.4 -2.9 -39.7 61 84 A S - 0 0 17 -5,-0.1 -4,-3.1 1,-0.1 2,-0.5 -0.340 48.5-127.1 -58.2 143.7 -18.9 -0.2 -37.4 62 85 A K E -EF 56 79A 77 17,-1.5 17,-3.4 18,-0.6 2,-0.4 -0.814 18.0-158.7 -98.1 138.4 -15.7 1.5 -38.7 63 86 A V E -EF 55 78A 10 -8,-2.5 -8,-2.2 -2,-0.5 2,-0.4 -0.952 9.3-174.2-115.2 131.0 -12.6 1.6 -36.7 64 87 A K E -EF 54 77A 55 13,-2.6 13,-3.0 -2,-0.4 2,-0.5 -0.997 9.2-166.2-132.5 128.3 -9.9 4.2 -37.3 65 88 A L E -EF 53 76A 0 -12,-2.8 -12,-2.7 -2,-0.4 2,-0.5 -0.969 6.4-168.1-112.2 121.7 -6.5 4.5 -35.7 66 89 A T E -EF 52 75A 45 9,-2.6 9,-2.3 -2,-0.5 2,-0.5 -0.962 2.9-163.7-113.5 124.5 -4.6 7.7 -36.2 67 90 A I E -EF 51 74A 3 -16,-2.9 -16,-1.6 -2,-0.5 7,-0.2 -0.942 22.9-121.6-112.6 119.7 -1.0 7.8 -35.2 68 91 A S > - 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