==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIBIOTIC 20-DEC-07 2ZF4 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN VIOE; . SOURCE 2 ORGANISM_SCIENTIFIC: CHROMOBACTERIUM VIOLACEUM; . AUTHOR S.HIRANO,Y.SHIRO,S.NAGANO . 1087 14 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 50027.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 753 69.3 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 . 515 47.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 11 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 107 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 50 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 1.7 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 12 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 . 6 0 0 7 14 12 13 12 2 5 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 0 0 0 0 0 0 1 5 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 E 0 0 148 0, 0.0 111,-0.1 0, 0.0 116,-0.1 0.000 360.0 360.0 360.0 137.7 -26.1 44.4 -26.5 2 6 A P - 0 0 9 0, 0.0 2,-0.1 0, 0.0 113,-0.0 -0.205 360.0-116.7 -70.1 156.7 -25.2 41.9 -23.7 3 7 A P - 0 0 46 0, 0.0 108,-0.3 0, 0.0 2,-0.2 -0.302 23.5-105.9 -83.8 169.8 -24.2 42.9 -20.1 4 8 A L - 0 0 66 1,-0.1 105,-0.2 107,-0.1 3,-0.1 -0.621 42.9-104.3 -81.4 154.3 -20.9 42.4 -18.3 5 9 A L - 0 0 2 103,-2.0 147,-0.1 -2,-0.2 -1,-0.1 -0.283 56.5 -72.1 -66.4 167.0 -21.0 39.7 -15.6 6 10 A P - 0 0 12 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.347 45.7-117.2 -59.6 148.4 -21.1 41.1 -12.0 7 11 A A S S+ 0 0 31 1,-0.2 28,-2.3 -3,-0.1 29,-0.6 0.800 99.2 6.2 -58.1 -30.0 -17.7 42.6 -11.0 8 12 A R E S+A 34 0A 72 26,-0.2 2,-0.3 27,-0.1 26,-0.2 -0.967 75.3 163.7-152.5 135.6 -17.4 39.9 -8.3 9 13 A W E -A 33 0A 1 24,-2.4 24,-2.5 -2,-0.3 2,-0.3 -0.985 10.8-174.6-153.1 147.3 -19.6 36.9 -7.6 10 14 A S E +AB 32 174A 8 164,-1.7 164,-3.0 -2,-0.3 2,-0.3 -0.988 15.8 154.4-142.9 151.8 -19.4 33.6 -5.6 11 15 A S E -A 31 0A 0 20,-2.4 20,-2.4 -2,-0.3 2,-0.2 -0.992 45.6 -97.8-166.2 154.7 -21.9 30.7 -5.3 12 16 A A E -A 30 0A 0 -2,-0.3 160,-0.5 18,-0.2 2,-0.4 -0.559 47.7-155.3 -68.8 150.9 -22.5 27.0 -4.6 13 17 A Y E -A 29 0A 20 16,-1.8 16,-1.7 -2,-0.2 2,-0.4 -0.982 18.1-156.2-132.4 151.6 -22.7 25.2 -7.9 14 18 A V E -AC 28 169A 0 155,-1.8 155,-2.8 -2,-0.4 2,-0.4 -0.995 19.8-160.2-121.9 131.5 -24.3 22.0 -9.1 15 19 A S E +AC 27 168A 4 12,-2.6 12,-2.3 -2,-0.4 153,-0.2 -0.942 25.5 130.5-124.2 133.1 -22.7 20.5 -12.2 16 20 A Y E - C 0 167A 3 151,-2.9 151,-2.8 -2,-0.4 2,-0.3 -0.819 39.9 -98.9-161.0-164.8 -24.3 17.9 -14.6 17 21 A W E - C 0 166A 37 149,-0.3 257,-0.4 -2,-0.2 149,-0.2 -0.945 22.0-113.5-138.6 151.3 -25.0 17.1 -18.2 18 22 A S E S+ C 0 165A 3 147,-3.2 147,-2.8 -2,-0.3 145,-0.2 -0.994 106.7 21.0-126.4 122.9 -27.7 17.2 -20.9 19 23 A P S S- 0 0 31 0, 0.0 2,-0.8 0, 0.0 254,-0.3 0.746 95.3-131.2 -70.9 161.1 -28.6 14.5 -21.8 20 24 A M - 0 0 10 252,-3.0 -2,-0.1 -2,-0.1 144,-0.0 -0.749 28.0-166.1 -78.3 110.9 -27.5 12.4 -18.7 21 25 A L > - 0 0 20 -2,-0.8 3,-2.4 4,-0.1 -4,-0.1 -0.615 37.1 -90.9 -92.9 160.8 -25.6 9.4 -20.2 22 26 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 0.765 124.7 39.8 -41.3 -49.5 -24.8 6.4 -18.0 23 27 A D T 3 S+ 0 0 150 2,-0.1 2,-0.1 27,-0.0 -3,-0.0 0.465 89.3 119.9 -82.3 -4.4 -21.3 7.5 -16.8 24 28 A D < - 0 0 23 -3,-2.4 2,-0.3 24,-0.1 -4,-0.0 -0.409 51.4-149.1 -67.5 136.2 -22.4 11.1 -16.3 25 29 A Q - 0 0 81 -2,-0.1 2,-0.6 -9,-0.0 -2,-0.1 -0.801 12.4-143.2-109.2 145.7 -22.1 12.5 -12.7 26 30 A L + 0 0 19 -2,-0.3 2,-0.3 -10,-0.1 -10,-0.2 -0.956 37.3 169.4-100.4 119.8 -24.1 15.0 -10.7 27 31 A T E -A 15 0A 11 -12,-2.3 -12,-2.6 -2,-0.6 2,-0.3 -0.791 19.2-160.6-128.8 166.2 -21.7 16.9 -8.5 28 32 A S E +A 14 0A 0 -2,-0.3 17,-0.8 -14,-0.2 2,-0.3 -0.939 22.8 132.4-145.0 166.3 -21.6 20.0 -6.3 29 33 A G E -AD 13 44A 1 -16,-1.7 -16,-1.8 -2,-0.3 2,-0.3 -0.903 46.7 -84.9 179.3-155.9 -19.1 22.3 -4.8 30 34 A Y E -AD 12 43A 7 13,-2.4 13,-3.2 -18,-0.3 2,-0.3 -0.974 30.8-167.4-142.4 151.3 -18.4 26.1 -4.4 31 35 A C E -AD 11 42A 3 -20,-2.4 -20,-2.4 -2,-0.3 2,-0.4 -0.993 6.9-159.2-144.2 147.8 -16.8 28.7 -6.6 32 36 A W E -AD 10 41A 18 9,-3.0 9,-2.4 -2,-0.3 2,-0.4 -0.988 7.3-170.7-128.0 135.3 -15.5 32.3 -6.3 33 37 A F E +AD 9 40A 9 -24,-2.5 -24,-2.4 -2,-0.4 2,-0.5 -0.977 8.4 176.1-132.0 122.7 -15.0 34.8 -9.1 34 38 A D E >> -AD 8 39A 17 5,-2.4 5,-2.2 -2,-0.4 4,-1.0 -0.964 3.8-177.2-124.3 111.3 -13.2 38.2 -8.8 35 39 A Y T 45S+ 0 0 21 -28,-2.3 -27,-0.1 -2,-0.5 -1,-0.1 0.809 82.5 55.2 -83.3 -30.7 -12.8 40.1 -12.1 36 40 A E T 45S+ 0 0 141 -29,-0.6 -1,-0.2 1,-0.2 -28,-0.1 0.881 115.3 40.9 -65.7 -38.6 -10.9 43.1 -10.8 37 41 A R T 45S- 0 0 83 2,-0.2 30,-0.3 30,-0.0 -2,-0.2 0.734 105.4-135.2 -77.1 -21.7 -8.4 40.7 -9.4 38 42 A D T <5 + 0 0 62 -4,-1.0 28,-2.2 1,-0.3 29,-1.2 0.876 64.7 119.4 66.3 41.9 -8.6 38.5 -12.6 39 43 A I E < -DE 34 65A 13 -5,-2.2 -5,-2.4 26,-0.2 2,-0.3 -0.933 41.8-172.0-136.4 153.5 -8.7 35.4 -10.4 40 44 A C E -DE 33 64A 1 24,-1.4 24,-2.4 -2,-0.3 2,-0.4 -0.989 6.3-160.2-145.3 151.0 -11.2 32.5 -9.7 41 45 A R E -DE 32 63A 26 -9,-2.4 -9,-3.0 -2,-0.3 2,-0.4 -0.999 7.8-178.4-130.6 136.7 -11.5 29.6 -7.2 42 46 A I E -DE 31 62A 43 20,-2.0 20,-2.2 -2,-0.4 2,-0.5 -0.989 3.8-171.6-136.0 125.9 -13.5 26.4 -7.6 43 47 A D E +DE 30 61A 0 -13,-3.2 -13,-2.4 -2,-0.4 2,-0.3 -0.983 37.1 93.7-115.6 123.1 -13.8 23.5 -5.0 44 48 A G E S-DE 29 60A 4 16,-2.2 16,-2.6 -2,-0.5 2,-0.6 -0.962 79.2 -62.6 176.8 171.0 -15.5 20.3 -5.9 45 49 A L E S- E 0 59A 10 -17,-0.8 14,-0.3 -2,-0.3 170,-0.1 -0.647 71.0-106.2 -67.0 117.4 -15.4 16.7 -7.2 46 50 A F - 0 0 65 12,-2.0 12,-0.2 -2,-0.6 3,-0.1 -0.257 36.4-134.1 -55.4 134.9 -14.1 17.3 -10.7 47 51 A N S S+ 0 0 14 1,-0.3 2,-0.1 -20,-0.0 -31,-0.1 -0.987 85.0 29.1-137.2 118.9 -16.8 16.8 -13.4 48 52 A P S S+ 0 0 62 0, 0.0 2,-0.4 0, 0.0 -1,-0.3 0.521 81.6 154.6 -88.2 154.0 -16.2 15.2 -15.9 49 53 A W - 0 0 48 -3,-0.1 2,-1.1 -2,-0.1 3,-0.1 -0.950 38.3-137.1-148.7 120.8 -13.6 12.7 -14.6 50 54 A S > + 0 0 28 -2,-0.4 4,-1.4 1,-0.2 6,-0.3 -0.701 22.1 174.9 -80.4 97.3 -12.9 9.3 -16.0 51 55 A E H > S+ 0 0 41 -2,-1.1 4,-2.5 2,-0.2 -1,-0.2 0.841 81.5 60.6 -65.4 -34.9 -12.5 6.9 -13.1 52 56 A R H 4 S+ 0 0 239 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.893 111.8 36.7 -56.5 -41.5 -12.1 4.1 -15.6 53 57 A D H 4 S+ 0 0 27 1,-0.1 -1,-0.2 3,-0.1 -2,-0.2 0.727 127.7 33.2 -88.5 -23.3 -9.0 5.6 -17.2 54 58 A T H < S- 0 0 33 -4,-1.4 -3,-0.2 2,-0.2 -2,-0.2 0.729 98.5-120.5-106.3 -28.5 -7.4 7.1 -14.1 55 59 A G S < S+ 0 0 49 -4,-2.5 25,-0.5 -5,-0.2 2,-0.3 0.305 81.3 45.9 104.7 -6.4 -8.3 4.6 -11.3 56 60 A Y E S- F 0 79A 32 -6,-0.3 2,-0.4 23,-0.2 23,-0.2 -0.960 78.5-103.9-159.5 166.2 -10.1 7.2 -9.1 57 61 A R E - F 0 78A 44 21,-2.4 21,-2.8 -2,-0.3 2,-0.5 -0.888 42.8-136.3-100.3 131.7 -12.5 10.0 -8.6 58 62 A L E - F 0 77A 5 -2,-0.4 -12,-2.0 -12,-0.2 2,-0.4 -0.792 16.9-167.4 -98.2 130.0 -10.8 13.4 -8.2 59 63 A W E +EF 45 76A 0 17,-2.5 17,-2.5 -2,-0.5 2,-0.3 -0.929 24.7 179.2-101.6 139.9 -11.7 16.1 -5.7 60 64 A M E -EF 44 75A 16 -16,-2.6 -16,-2.2 -2,-0.4 2,-0.5 -0.998 31.9-161.3-142.7 145.6 -9.9 19.3 -6.6 61 65 A S E -EF 43 74A 1 13,-2.1 13,-3.1 -2,-0.3 2,-0.4 -0.990 25.4-173.5-116.6 120.3 -9.5 22.9 -5.4 62 66 A E E -EF 42 73A 17 -20,-2.2 -20,-2.0 -2,-0.5 2,-0.5 -0.927 16.2-165.6-116.7 135.7 -8.1 25.1 -8.2 63 67 A V E -EF 41 72A 7 9,-2.6 9,-2.0 -2,-0.4 2,-0.6 -0.983 13.4-168.6-117.7 112.5 -7.1 28.8 -8.0 64 68 A G E -EF 40 71A 0 -24,-2.4 -24,-1.4 -2,-0.5 2,-0.8 -0.916 5.8-169.1-112.3 109.8 -6.7 30.2 -11.5 65 69 A N E >> -EF 39 70A 41 5,-2.6 5,-1.5 -2,-0.6 4,-1.0 -0.856 8.6-179.4-102.9 102.2 -5.0 33.6 -11.8 66 70 A A T 45S+ 0 0 19 -28,-2.2 -27,-0.2 -2,-0.8 -1,-0.2 0.783 82.8 58.7 -71.7 -25.6 -5.5 35.0 -15.3 67 71 A A T 45S+ 0 0 70 -29,-1.2 -1,-0.2 -30,-0.3 -29,-0.1 0.914 117.0 29.7 -68.2 -47.5 -3.4 38.1 -14.3 68 72 A S T 45S- 0 0 69 -30,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.520 105.5-128.9 -88.5 -8.2 -0.3 36.2 -13.3 69 73 A G T <5 + 0 0 29 -4,-1.0 32,-1.2 1,-0.2 2,-0.4 0.801 67.9 119.2 65.9 32.4 -1.1 33.5 -15.9 70 74 A R E < -FG 65 100A 127 -5,-1.5 -5,-2.6 30,-0.3 2,-0.3 -0.975 46.2-159.4-134.8 140.8 -0.7 30.7 -13.3 71 75 A T E -FG 64 99A 8 28,-3.2 28,-1.4 -2,-0.4 2,-0.4 -0.868 2.1-159.9-114.7 154.1 -2.9 28.1 -11.8 72 76 A W E -FG 63 98A 30 -9,-2.0 -9,-2.6 -2,-0.3 2,-0.5 -0.992 10.2-168.8-132.5 125.7 -2.6 26.1 -8.5 73 77 A K E -FG 62 97A 52 24,-3.8 24,-2.8 -2,-0.4 2,-0.5 -0.961 11.1-161.3-119.2 125.0 -4.5 22.8 -8.0 74 78 A Q E -F 61 0A 2 -13,-3.1 -13,-2.1 -2,-0.5 2,-0.4 -0.899 24.6-165.4 -97.1 132.8 -4.9 20.9 -4.7 75 79 A K E -F 60 0A 36 -2,-0.5 19,-2.5 19,-0.4 2,-0.4 -0.960 21.3-178.4-131.3 134.4 -5.9 17.3 -5.5 76 80 A V E -FH 59 93A 1 -17,-2.5 -17,-2.5 -2,-0.4 2,-0.4 -0.985 17.9-147.4-128.4 124.1 -7.3 14.3 -3.6 77 81 A A E -FH 58 92A 1 15,-3.2 15,-2.0 -2,-0.4 2,-0.6 -0.747 4.6-161.7 -88.9 130.9 -7.8 10.9 -5.2 78 82 A Y E -FH 57 91A 0 -21,-2.8 -21,-2.4 -2,-0.4 2,-0.3 -0.930 18.7-175.9-108.8 107.6 -10.7 8.6 -4.1 79 83 A G E -FH 56 90A 15 11,-2.7 11,-3.0 -2,-0.6 2,-0.3 -0.780 25.1-120.8-105.9 147.3 -10.0 5.1 -5.2 80 84 A R E - H 0 89A 135 -25,-0.5 2,-0.4 -2,-0.3 9,-0.2 -0.645 30.1-169.6 -81.6 140.3 -12.1 2.0 -4.9 81 85 A E E - H 0 88A 106 7,-1.9 7,-2.3 -2,-0.3 2,-0.2 -0.985 21.6-130.4-137.9 124.1 -10.6 -0.9 -3.0 82 86 A R E + H 0 87A 214 -2,-0.4 5,-0.3 5,-0.2 2,-0.3 -0.534 42.0 166.2 -68.4 133.9 -11.8 -4.5 -2.7 83 87 A T E > - H 0 86A 50 3,-3.3 3,-1.5 -2,-0.2 -1,-0.0 -0.835 56.3 -96.1-141.3 170.3 -11.9 -5.4 1.0 84 88 A A T 3 S+ 0 0 114 1,-0.3 3,-0.1 -2,-0.3 -1,-0.1 0.863 126.5 59.6 -55.6 -35.6 -13.3 -8.1 3.3 85 89 A L T 3 S- 0 0 47 1,-0.1 2,-0.9 -3,-0.0 -1,-0.3 0.237 125.9-104.4 -77.8 14.7 -16.1 -5.6 3.8 86 90 A G E < S-H 83 0A 41 -3,-1.5 -3,-3.3 120,-0.1 2,-0.3 -0.845 82.1 -19.2 97.1-101.1 -16.9 -5.7 0.1 87 91 A E E -H 82 0A 47 -2,-0.9 120,-2.3 -5,-0.3 2,-0.3 -1.000 58.7-175.2-149.2 158.2 -15.4 -2.5 -1.0 88 92 A Q E -H 81 0A 34 -7,-2.3 -7,-1.9 -2,-0.3 2,-0.4 -0.893 29.1-105.6-140.9 157.2 -14.3 0.9 0.4 89 93 A L E -H 80 0A 15 115,-0.4 2,-0.6 -2,-0.3 -9,-0.2 -0.754 26.0-158.1 -93.9 136.1 -13.0 4.2 -0.7 90 94 A C E -H 79 0A 37 -11,-3.0 -11,-2.7 -2,-0.4 2,-0.3 -0.957 7.6-148.0-117.5 117.9 -9.4 5.1 -0.2 91 95 A E E +H 78 0A 31 -2,-0.6 -13,-0.2 -13,-0.2 220,-0.2 -0.601 18.8 176.2 -82.4 142.0 -8.4 8.8 -0.1 92 96 A R E -H 77 0A 138 -15,-2.0 -15,-3.2 -2,-0.3 2,-0.1 -0.846 23.3-139.2-149.5 106.0 -4.9 9.6 -1.4 93 97 A P E -H 76 0A 37 0, 0.0 -17,-0.3 0, 0.0 2,-0.2 -0.433 20.1-150.5 -60.3 139.6 -3.7 13.2 -1.7 94 98 A L - 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