==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIBIOTIC 30-JUL-01 1J48 . COMPND 2 MOLECULE: APOPROTEIN OF C1027; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES GLOBISPORUS; . AUTHOR Y.CHEN,J.LI,Y.LIU,M.BARTLAM,Y.GAO,L.JIN,H.TANG,Y.SHAO, . 218 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11017.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 136 62.4 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 . 90 41.3 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 . 4 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 . 16 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 1.8 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+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 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 0 1 3 7 3 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 2 0 0 0 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 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 A 0 0 147 0, 0.0 2,-0.1 0, 0.0 101,-0.1 0.000 360.0 360.0 360.0 -36.1 10.7 5.9 -11.6 2 2 A P - 0 0 35 0, 0.0 2,-0.4 0, 0.0 22,-0.3 -0.467 360.0-126.4 -79.9 165.2 10.0 4.8 -8.0 3 3 A A E -A 23 0A 58 20,-3.7 20,-2.2 -2,-0.1 2,-0.4 -0.912 25.6-177.5-112.1 145.9 10.7 1.1 -7.2 4 4 A F E -A 22 0A 31 -2,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.965 4.3-179.9-144.4 116.1 8.0 -1.1 -5.6 5 5 A S E -A 21 0A 59 16,-2.9 16,-2.2 -2,-0.4 2,-0.4 -0.928 13.0-172.9-121.9 152.8 8.6 -4.8 -4.6 6 6 A V E -A 20 0A 10 -2,-0.3 14,-0.2 14,-0.2 87,-0.0 -0.967 24.7-145.2-139.0 118.5 6.5 -7.5 -3.0 7 7 A S E S+A 19 0A 78 12,-2.2 12,-3.4 -2,-0.4 2,-0.2 -0.992 73.5 25.1-150.4 136.9 8.1 -10.8 -2.1 8 8 A P + 0 0 52 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.599 69.1 164.8 -72.5 162.4 7.4 -13.5 -2.0 9 9 A A + 0 0 28 -2,-0.2 99,-1.7 98,-0.1 2,-0.3 0.330 59.0 42.7-124.5 3.6 4.7 -13.1 -4.7 10 10 A S S S+ 0 0 82 97,-0.2 99,-0.2 1,-0.1 3,-0.1 -0.918 95.7 39.6-143.4 167.8 4.0 -16.8 -5.7 11 11 A G S S+ 0 0 62 -2,-0.3 98,-0.2 1,-0.2 -1,-0.1 0.792 85.8 169.0 58.6 31.0 3.6 -20.2 -4.0 12 12 A L - 0 0 4 96,-2.2 2,-0.3 -3,-0.1 -1,-0.2 -0.367 28.4-150.8 -82.3 154.8 1.6 -18.3 -1.4 13 13 A S > - 0 0 72 -3,-0.1 3,-2.1 -2,-0.1 54,-0.2 -0.860 35.8 -88.8-118.1 151.3 -0.6 -19.5 1.5 14 14 A D T 3 S+ 0 0 70 -2,-0.3 54,-0.2 1,-0.3 3,-0.1 -0.373 115.4 15.5 -59.3 133.3 -3.6 -17.9 3.1 15 15 A G T 3 S+ 0 0 41 52,-2.2 -1,-0.3 1,-0.3 53,-0.2 0.480 90.1 150.3 80.2 5.4 -2.4 -15.6 5.9 16 16 A Q < - 0 0 58 -3,-2.1 51,-2.7 51,-0.4 2,-0.4 -0.427 43.6-131.0 -71.8 141.0 1.2 -15.6 4.8 17 17 A S E - B 0 66A 66 49,-0.2 2,-0.3 -2,-0.1 49,-0.2 -0.808 28.3-177.2 -94.2 132.7 3.2 -12.5 5.5 18 18 A V E - B 0 65A 3 47,-2.8 47,-2.2 -2,-0.4 2,-0.4 -0.770 25.6-107.4-121.3 168.0 5.2 -11.0 2.6 19 19 A S E -AB 7 64A 51 -12,-3.4 -12,-2.2 -2,-0.3 2,-0.5 -0.835 23.5-161.7-104.6 139.5 7.6 -8.0 2.4 20 20 A V E -AB 6 63A 0 43,-2.8 43,-1.8 -2,-0.4 2,-0.4 -0.956 10.4-178.8-117.5 129.6 6.8 -4.7 0.8 21 21 A S E -AB 5 62A 42 -16,-2.2 -16,-2.9 -2,-0.5 2,-0.4 -0.995 5.4-176.3-133.2 134.6 9.5 -2.3 -0.2 22 22 A V E +AB 4 61A 5 39,-3.3 39,-2.0 -2,-0.4 2,-0.3 -0.960 7.9 169.4-127.4 141.8 9.2 1.1 -1.8 23 23 A S E +A 3 0A 65 -20,-2.2 -20,-3.7 -2,-0.4 37,-0.2 -0.995 58.7 24.3-149.5 149.2 12.1 3.4 -2.9 24 24 A G S S+ 0 0 43 34,-0.9 35,-0.2 -2,-0.3 36,-0.2 0.672 82.9 135.1 72.6 16.6 12.4 6.6 -5.0 25 25 A A S S- 0 0 11 34,-2.6 -1,-0.2 1,-0.2 3,-0.1 -0.182 73.0 -57.0 -83.5-175.5 8.9 7.7 -4.2 26 26 A A > - 0 0 30 1,-0.1 3,-0.8 -3,-0.1 -1,-0.2 -0.397 69.1-108.6 -63.3 137.2 8.0 11.2 -3.2 27 26AA A T 3 S+ 0 0 58 1,-0.2 30,-0.2 30,-0.1 -1,-0.1 -0.451 91.2 1.1 -71.7 143.8 10.1 12.0 -0.1 28 26BA G T 3 S+ 0 0 57 28,-1.9 2,-0.3 1,-0.2 -1,-0.2 0.858 99.1 131.3 49.8 46.7 8.2 12.3 3.2 29 27 A E < - 0 0 89 -3,-0.8 26,-2.1 27,-0.2 2,-0.5 -0.798 57.5-113.3-125.1 166.6 4.7 11.5 1.9 30 28 A T E -C 54 0B 59 -2,-0.3 2,-0.3 24,-0.2 24,-0.2 -0.857 34.4-178.1 -98.6 130.8 1.9 9.1 2.8 31 29 A Y E -C 53 0B 0 22,-3.1 22,-2.2 -2,-0.5 2,-0.3 -0.829 17.3-132.4-121.8 166.7 1.0 6.3 0.4 32 30 A Y E -CD 52 96B 137 64,-3.1 64,-2.3 -2,-0.3 2,-0.3 -0.876 18.4-171.9-120.6 150.2 -1.7 3.6 0.5 33 31 A I E +CD 51 95B 5 18,-2.7 18,-2.4 -2,-0.3 2,-0.3 -0.998 10.9 155.2-141.3 146.3 -1.4 -0.1 -0.1 34 32 A A E - D 0 94B 15 60,-1.9 60,-2.6 -2,-0.3 2,-0.6 -0.990 41.5-114.7-165.8 158.4 -3.9 -3.0 -0.4 35 33 A Q E + D 0 93B 0 -2,-0.3 11,-1.9 11,-0.3 2,-0.3 -0.861 50.4 163.3 -95.1 124.1 -4.5 -6.5 -1.8 36 34 A a E -ED 45 92B 9 56,-2.4 56,-2.2 -2,-0.6 9,-0.3 -0.953 32.6-150.7-142.8 160.1 -7.2 -6.3 -4.5 37 35 A A E -E 44 0B 0 7,-2.2 7,-2.9 -2,-0.3 2,-0.4 -0.985 33.7-112.6-128.4 138.7 -8.7 -8.2 -7.4 38 36 A P E +E 43 0B 77 0, 0.0 2,-0.3 0, 0.0 52,-0.2 -0.627 44.0 165.6 -75.4 127.0 -10.3 -6.4 -10.4 39 37 A V E > -E 42 0B 66 3,-3.0 3,-1.4 -2,-0.4 -2,-0.0 -0.928 63.1 -16.8-145.8 117.8 -14.1 -6.9 -10.6 40 38 A G T 3 S- 0 0 90 -2,-0.3 3,-0.1 1,-0.3 0, 0.0 0.701 124.8 -51.4 66.7 20.9 -16.6 -4.9 -12.7 41 39 A G T 3 S+ 0 0 85 1,-0.4 2,-0.3 0, 0.0 -1,-0.3 0.233 124.8 80.5 102.2 -17.3 -14.4 -2.0 -13.3 42 40 A Q E < S-E 39 0B 99 -3,-1.4 -3,-3.0 -5,-0.1 2,-0.4 -0.792 82.3-107.9-118.8 163.9 -13.4 -1.4 -9.7 43 41 A D E -E 38 0B 60 -2,-0.3 2,-0.7 -5,-0.2 -7,-0.0 -0.778 19.7-151.2 -92.7 132.0 -10.9 -3.1 -7.3 44 42 A A E -E 37 0B 0 -7,-2.9 -7,-2.2 -2,-0.4 2,-0.3 -0.934 28.4-178.8-103.6 111.5 -12.3 -5.3 -4.6 45 43 A a E -EF 36 74B 18 29,-2.5 29,-2.5 -2,-0.7 -9,-0.2 -0.726 36.0 -99.7-110.4 157.8 -9.7 -5.0 -1.9 46 44 A N >> - 0 0 10 -11,-1.9 4,-1.3 -2,-0.3 3,-1.0 -0.680 28.4-160.0 -78.2 113.7 -9.4 -6.7 1.6 47 45 A P T 34 S+ 0 0 76 0, 0.0 -1,-0.2 0, 0.0 26,-0.1 0.769 84.9 64.7 -70.5 -16.9 -10.6 -4.0 4.0 48 46 A A T 34 S+ 0 0 90 1,-0.2 -2,-0.0 -3,-0.0 -3,-0.0 0.691 115.7 26.7 -77.8 -18.5 -8.9 -5.7 7.0 49 47 A T T <4 S+ 0 0 30 -3,-1.0 2,-0.2 -14,-0.1 -1,-0.2 0.482 87.3 117.5-120.5 -7.5 -5.4 -5.2 5.6 50 48 A A < + 0 0 47 -4,-1.3 2,-0.2 -15,-0.1 -16,-0.2 -0.433 46.9 137.9 -62.6 125.8 -5.8 -2.1 3.4 51 49 A T E -C 33 0B 77 -18,-2.4 -18,-2.7 -2,-0.2 2,-0.3 -0.803 43.3-105.4-154.0-164.9 -3.6 0.5 5.0 52 50 A S E -C 32 0B 65 -20,-0.2 2,-0.3 -2,-0.2 -20,-0.2 -0.868 18.3-175.4-133.2 165.4 -1.1 3.4 4.7 53 51 A F E -C 31 0B 19 -22,-2.2 -22,-3.1 -2,-0.3 2,-0.3 -0.956 19.5-128.9-154.9 159.1 2.6 4.2 5.3 54 52 A T E -C 30 0B 98 -2,-0.3 2,-0.2 -24,-0.2 -24,-0.2 -0.829 20.6-132.1-110.4 155.4 4.9 7.2 5.2 55 53 A T - 0 0 8 -26,-2.1 6,-0.2 -2,-0.3 2,-0.1 -0.707 17.0-126.1-104.1 161.0 8.2 7.5 3.2 56 54 A D > - 0 0 82 4,-2.4 3,-2.3 -2,-0.2 -28,-1.9 -0.201 47.8 -74.6 -90.3-173.0 11.5 8.8 4.6 57 55 A A T 3 S+ 0 0 96 1,-0.3 -30,-0.1 -30,-0.2 -1,-0.0 0.671 133.3 53.1 -58.3 -18.9 13.7 11.6 3.1 58 56 A S T 3 S- 0 0 74 2,-0.2 -34,-0.9 -32,-0.1 -1,-0.3 0.347 120.3-107.1 -98.2 6.3 14.8 9.3 0.3 59 57 A G S < S+ 0 0 0 -3,-2.3 -34,-2.6 1,-0.3 2,-0.3 0.806 78.1 132.0 74.7 29.5 11.2 8.4 -0.7 60 58 A A + 0 0 20 -37,-0.2 -4,-2.4 -36,-0.2 2,-0.3 -0.824 26.2 161.6-119.4 155.1 11.6 4.9 0.8 61 59 A A E -B 22 0A 21 -39,-2.0 -39,-3.3 -2,-0.3 2,-0.3 -0.957 10.0-171.9-161.9 153.5 9.6 2.7 3.1 62 60 A S E +B 21 0A 76 -2,-0.3 2,-0.3 -41,-0.2 -41,-0.2 -0.978 17.7 142.7-152.1 143.4 9.4 -1.1 4.0 63 61 A F E -B 20 0A 51 -43,-1.8 -43,-2.8 -2,-0.3 2,-0.2 -0.957 44.6 -91.2-168.9 170.5 7.0 -3.1 6.1 64 62 A S E -B 19 0A 87 -2,-0.3 2,-0.3 -45,-0.2 -45,-0.2 -0.638 32.5-166.3 -95.7 155.6 5.3 -6.5 6.2 65 63 A F E -B 18 0A 10 -47,-2.2 -47,-2.8 -2,-0.2 2,-0.6 -0.996 16.2-134.2-145.6 132.6 1.8 -7.4 4.8 66 63AA V E -B 17 0A 60 -2,-0.3 2,-0.3 -49,-0.2 -49,-0.2 -0.794 22.1-155.3 -92.2 122.2 -0.5 -10.3 5.3 67 64 A V - 0 0 0 -51,-2.7 -52,-2.2 -2,-0.6 2,-0.4 -0.655 0.7-149.5 -95.8 152.0 -2.0 -11.8 2.1 68 65 A R - 0 0 92 -2,-0.3 -54,-0.1 -54,-0.2 3,-0.1 -0.974 13.2-149.9-123.5 131.0 -5.3 -13.8 1.9 69 66 A K S S+ 0 0 89 -2,-0.4 17,-2.8 1,-0.2 18,-0.3 0.822 91.9 3.5 -66.9 -33.5 -6.0 -16.5 -0.6 70 67 A S E S+ G 0 85B 53 15,-0.2 2,-0.3 16,-0.1 -1,-0.2 -0.977 77.8 162.1-147.5 154.1 -9.7 -15.5 -0.4 71 68 A Y E - G 0 84B 15 13,-1.9 13,-2.7 -2,-0.3 2,-0.6 -0.993 46.0 -92.2-165.9 164.6 -11.5 -12.7 1.4 72 69 A T E - G 0 83B 104 -2,-0.3 11,-0.3 11,-0.2 2,-0.3 -0.731 56.5-155.2 -83.0 125.8 -14.6 -10.6 1.8 73 70 A G E - G 0 82B 1 9,-2.4 8,-2.4 -2,-0.6 9,-0.6 -0.736 18.7-166.9-115.1 157.4 -13.9 -7.6 -0.4 74 71 A S E -FG 45 80B 19 -29,-2.5 -29,-2.5 -2,-0.3 5,-0.0 -0.956 22.9-116.9-135.0 154.8 -14.9 -3.9 -0.7 75 72 A T > - 0 0 12 4,-2.4 3,-2.3 -2,-0.3 -31,-0.1 -0.282 48.6 -87.0 -83.3 173.2 -14.5 -1.1 -3.2 76 73 A P T 3 S+ 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -32,-0.0 0.824 127.0 54.1 -50.6 -36.8 -12.5 2.1 -2.5 77 74 A E T 3 S- 0 0 122 2,-0.1 -2,-0.0 1,-0.1 0, 0.0 0.477 124.6 -98.1 -81.3 1.7 -15.5 3.8 -0.9 78 75 A G S < S+ 0 0 51 -3,-2.3 -1,-0.1 1,-0.3 0, 0.0 0.484 72.5 146.9 100.2 4.8 -16.2 1.0 1.5 79 76 A T - 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