==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NUCLEIC ACID BINDING PROTEIN 22-JUN-10 3NM7 . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BORRELIA BURGDORFERI; . AUTHOR A.GRAEBSCH,S.ROCHE,D.KOSTREWA,D.NIESSING . 309 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17750.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 237 76.7 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 . 110 35.6 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 . 8 2.6 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 . 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 . 38 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 21.0 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 1 1 2 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 . 0 0 0 0 1 3 0 0 8 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 4 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 8 A E > 0 0 124 0, 0.0 3,-1.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 121.2 7.3 -14.9 20.8 2 9 A R T 3 + 0 0 51 1,-0.2 3,-0.1 206,-0.0 209,-0.0 -0.527 360.0 22.6 -70.4 126.7 7.3 -15.9 17.1 3 10 A G T 3 S+ 0 0 21 -2,-0.3 21,-2.1 1,-0.2 2,-0.6 0.223 103.7 98.8 98.0 -12.2 4.7 -14.0 15.1 4 11 A E E < +A 23 0A 46 -3,-1.6 19,-0.2 19,-0.2 -1,-0.2 -0.946 41.2 170.1-109.8 108.9 4.6 -11.2 17.8 5 12 A V E + 0 0 51 17,-2.7 2,-0.3 -2,-0.6 18,-0.2 0.849 68.8 0.5 -85.8 -39.7 6.7 -8.2 16.8 6 13 A Y E +A 22 0A 48 16,-1.7 16,-2.8 2,-0.0 -1,-0.3 -0.986 58.3 177.5-153.0 143.0 5.6 -5.8 19.5 7 14 A S E +A 21 0A 69 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.924 5.3 172.1-153.2 123.5 3.3 -5.8 22.5 8 15 A E E -A 20 0A 86 12,-2.0 12,-2.7 -2,-0.3 2,-0.4 -0.985 16.8-150.2-134.4 143.2 2.7 -3.1 25.1 9 16 A K E -A 19 0A 100 -2,-0.4 2,-0.5 10,-0.2 10,-0.2 -0.939 5.5-161.6-113.6 136.8 0.1 -2.9 27.9 10 17 A L E -A 18 0A 25 8,-3.2 8,-2.3 -2,-0.4 2,-0.2 -0.958 4.0-162.2-122.7 114.4 -1.4 0.3 29.2 11 18 A F - 0 0 141 -2,-0.5 2,-0.3 6,-0.2 6,-0.2 -0.608 10.2-168.0 -85.7 150.9 -3.1 0.3 32.6 12 19 A T - 0 0 25 4,-0.5 127,-0.0 2,-0.5 -2,-0.0 -0.826 38.3-108.1-128.3 173.4 -5.5 3.2 33.4 13 20 A E S S+ 0 0 210 -2,-0.3 2,-0.2 2,-0.0 -2,-0.0 0.391 103.0 70.9 -82.5 5.3 -7.1 4.4 36.7 14 21 A S S S- 0 0 24 2,-0.4 -2,-0.5 122,-0.0 0, 0.0 -0.595 106.4 -92.5-112.3 175.8 -10.4 3.0 35.2 15 22 A E S S+ 0 0 77 -2,-0.2 24,-2.0 24,-0.1 2,-0.5 0.350 98.1 98.9 -72.2 6.8 -11.6 -0.5 34.5 16 23 A R E + B 0 38A 28 22,-0.2 -4,-0.5 20,-0.1 -2,-0.4 -0.857 48.0 177.7-103.8 128.6 -10.2 -0.2 31.0 17 24 A T E - B 0 37A 27 20,-2.2 20,-3.6 -2,-0.5 2,-0.3 -0.966 15.0-153.1-123.5 138.5 -6.7 -1.8 30.2 18 25 A Y E -AB 10 36A 0 -8,-2.3 -8,-3.2 -2,-0.4 2,-0.4 -0.884 8.9-159.8-120.5 148.0 -5.3 -1.6 26.6 19 26 A F E -AB 9 35A 38 16,-2.3 16,-2.5 -2,-0.3 2,-0.5 -0.979 3.8-160.3-125.1 137.9 -2.9 -3.7 24.6 20 27 A F E +AB 8 34A 0 -12,-2.7 -12,-2.0 -2,-0.4 2,-0.4 -0.977 22.4 179.6-124.2 106.9 -1.0 -2.4 21.5 21 28 A N E -AB 7 33A 10 12,-2.8 12,-2.7 -2,-0.5 2,-0.5 -0.932 24.5-164.6-120.3 142.2 0.2 -5.3 19.4 22 29 A V E -AB 6 32A 0 -16,-2.8 -17,-2.7 -2,-0.4 -16,-1.7 -0.984 22.2-177.2-120.7 118.1 2.1 -5.6 16.2 23 30 A K E -AB 4 31A 20 8,-2.3 8,-1.8 -2,-0.5 2,-0.4 -0.796 20.9-135.9-115.3 158.3 1.9 -9.1 14.7 24 31 A E E - B 0 30A 86 -21,-2.1 6,-0.2 -2,-0.3 2,-0.1 -0.929 19.1-147.6-111.7 131.4 3.4 -10.8 11.6 25 32 A N > - 0 0 52 4,-2.4 3,-1.2 -2,-0.4 -22,-0.1 -0.210 41.9 -80.3 -86.8-172.6 1.3 -13.0 9.3 26 33 A R T 3 S+ 0 0 59 1,-0.3 -1,-0.0 2,-0.1 186,-0.0 0.858 130.1 49.1 -56.7 -39.9 2.5 -16.0 7.3 27 34 A K T 3 S- 0 0 158 2,-0.0 -1,-0.3 1,-0.0 3,-0.1 0.535 121.1-102.5 -79.5 -10.6 4.0 -13.8 4.5 28 35 A G S < S+ 0 0 16 -3,-1.2 2,-0.2 1,-0.3 -2,-0.1 0.582 74.4 141.2 97.6 11.4 5.9 -11.5 6.9 29 36 A D - 0 0 48 1,-0.0 -4,-2.4 129,-0.0 -1,-0.3 -0.594 45.3-130.2 -83.2 148.9 3.4 -8.6 6.7 30 37 A Y E -B 24 0A 43 -6,-0.2 24,-0.8 -2,-0.2 2,-0.3 -0.693 24.2-179.7 -99.0 155.1 2.7 -6.7 9.8 31 38 A F E -BC 23 53A 28 -8,-1.8 -8,-2.3 -2,-0.3 2,-0.3 -0.975 23.5-122.2-148.4 152.3 -0.7 -5.7 11.2 32 39 A L E -BC 22 52A 0 20,-3.0 20,-2.1 -2,-0.3 2,-0.4 -0.773 18.1-168.5 -99.1 144.8 -1.8 -3.8 14.2 33 40 A N E -BC 21 51A 0 -12,-2.7 -12,-2.8 -2,-0.3 2,-0.5 -0.983 1.8-170.6-134.2 116.2 -4.1 -5.2 16.9 34 41 A I E -BC 20 50A 0 16,-2.5 16,-2.8 -2,-0.4 2,-0.4 -0.955 9.8-172.0-106.6 127.5 -5.6 -2.8 19.5 35 42 A V E -BC 19 49A 0 -16,-2.5 -16,-2.3 -2,-0.5 2,-0.5 -0.981 14.3-164.8-123.2 133.7 -7.3 -4.5 22.4 36 43 A E E -BC 18 48A 0 12,-2.7 12,-3.0 -2,-0.4 2,-0.6 -0.975 9.3-163.8-108.9 131.1 -9.4 -2.9 25.1 37 44 A S E -BC 17 47A 10 -20,-3.6 -20,-2.2 -2,-0.5 2,-0.5 -0.981 9.0-168.9-118.5 111.2 -10.0 -5.2 28.1 38 45 A K E -BC 16 46A 51 8,-2.9 8,-2.7 -2,-0.6 2,-0.7 -0.913 16.4-142.0-107.1 130.0 -12.8 -3.9 30.3 39 46 A R E - C 0 45A 125 -24,-2.0 6,-0.2 -2,-0.5 -24,-0.1 -0.850 22.5-140.2 -91.1 116.8 -13.5 -5.4 33.7 40 47 A S > - 0 0 17 4,-3.2 3,-2.0 -2,-0.7 4,-0.0 -0.334 26.9-104.6 -71.3 155.1 -17.3 -5.5 34.2 41 48 A P T 3 S+ 0 0 132 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.879 123.7 57.4 -48.8 -38.6 -18.8 -4.5 37.7 42 49 A S T 3 S- 0 0 88 1,-0.1 -3,-0.0 2,-0.0 -2,-0.0 0.670 123.9-105.5 -62.2 -25.1 -19.4 -8.3 38.3 43 50 A G S < S+ 0 0 20 -3,-2.0 2,-0.2 1,-0.4 -1,-0.1 0.433 76.2 134.3 106.9 6.6 -15.7 -9.0 37.7 44 51 A D - 0 0 110 -5,-0.0 -4,-3.2 1,-0.0 2,-0.6 -0.572 53.2-123.7 -84.9 150.4 -15.9 -10.6 34.3 45 52 A F E -C 39 0A 140 -6,-0.2 2,-0.5 -2,-0.2 -6,-0.2 -0.900 19.1-165.5-106.0 120.1 -13.5 -9.5 31.5 46 53 A E E -C 38 0A 91 -8,-2.7 -8,-2.9 -2,-0.6 2,-0.5 -0.873 8.3-158.4 -98.4 123.7 -14.8 -8.1 28.1 47 54 A R E -C 37 0A 126 -2,-0.5 2,-0.5 -10,-0.2 -10,-0.2 -0.943 7.2-171.0-111.8 121.6 -12.2 -7.9 25.3 48 55 A H E -C 36 0A 54 -12,-3.0 -12,-2.7 -2,-0.5 2,-0.4 -0.957 13.2-171.0-112.7 121.4 -12.7 -5.6 22.3 49 56 A S E -C 35 0A 4 -2,-0.5 2,-0.4 -14,-0.2 -14,-0.2 -0.977 12.3-171.4-128.4 128.8 -10.3 -6.1 19.5 50 57 A I E -C 34 0A 0 -16,-2.8 -16,-2.5 -2,-0.4 2,-0.4 -0.948 8.2-157.7-120.0 134.4 -9.5 -4.1 16.3 51 58 A F E -C 33 0A 15 -2,-0.4 2,-0.4 -18,-0.2 -18,-0.2 -0.903 6.9-173.6-113.1 139.4 -7.2 -5.2 13.5 52 59 A V E -C 32 0A 0 -20,-2.1 -20,-3.0 -2,-0.4 2,-0.1 -0.978 17.6-138.8-136.2 121.3 -5.6 -2.8 11.0 53 60 A Y E > -C 31 0A 16 -2,-0.4 3,-1.6 -22,-0.2 4,-0.3 -0.312 26.3-107.3 -83.0 155.1 -3.6 -4.2 8.0 54 61 A E G > S+ 0 0 41 -24,-0.8 3,-1.3 1,-0.3 4,-0.4 0.862 116.0 59.4 -46.3 -43.1 -0.4 -2.8 6.7 55 62 A E G 3 S+ 0 0 110 1,-0.3 -1,-0.3 2,-0.1 4,-0.2 0.689 111.5 38.6 -65.1 -21.6 -2.1 -1.3 3.6 56 63 A N G <> S+ 0 0 12 -3,-1.6 4,-2.1 1,-0.1 -1,-0.3 0.213 85.2 101.7-113.9 12.3 -4.4 0.9 5.7 57 64 A I H <> S+ 0 0 3 -3,-1.3 4,-3.0 -4,-0.3 5,-0.2 0.918 79.1 51.4 -65.8 -44.6 -2.1 2.0 8.4 58 65 A N H > S+ 0 0 100 -4,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.900 114.6 42.2 -59.3 -45.1 -1.3 5.5 7.1 59 66 A E H > S+ 0 0 100 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.859 114.0 52.2 -70.7 -38.0 -4.9 6.4 6.7 60 67 A F H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.950 111.8 47.5 -61.3 -49.1 -5.8 4.8 10.1 61 68 A E H X S+ 0 0 29 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.913 112.7 46.2 -59.6 -52.0 -3.0 6.8 11.8 62 69 A S H X S+ 0 0 50 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.889 114.6 48.8 -62.8 -36.4 -4.0 10.2 10.2 63 70 A N H X S+ 0 0 17 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.852 111.4 50.0 -69.8 -35.0 -7.7 9.6 11.0 64 71 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.960 110.8 48.7 -65.5 -50.7 -6.8 8.7 14.6 65 72 A L H X S+ 0 0 65 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.835 111.9 50.6 -55.9 -37.1 -4.6 11.9 15.0 66 73 A K H X S+ 0 0 127 -4,-1.8 4,-0.9 2,-0.2 -1,-0.2 0.874 112.8 44.8 -71.3 -39.4 -7.6 14.0 13.5 67 74 A A H X S+ 0 0 0 -4,-1.9 4,-1.0 2,-0.2 3,-0.3 0.869 113.0 50.4 -70.1 -41.7 -10.2 12.5 16.0 68 75 A I H >X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 3,-0.6 0.890 102.3 62.1 -66.0 -35.9 -7.8 12.8 18.9 69 76 A A H 3X S+ 0 0 35 -4,-1.7 4,-2.5 1,-0.3 -1,-0.2 0.849 97.5 58.1 -56.9 -35.7 -7.2 16.5 18.0 70 77 A V H 3X S+ 0 0 23 -4,-0.9 4,-1.4 -3,-0.3 -1,-0.3 0.885 111.4 41.5 -62.2 -38.0 -10.8 17.2 18.6 71 78 A I H - 0 0 61 4,-2.4 3,-0.9 -2,-0.4 6,-0.0 -0.182 40.6 -81.4 -88.1-172.8 -21.1 12.0 28.2 109 33 B R T 3 S+ 0 0 262 1,-0.2 -1,-0.0 2,-0.1 -2,-0.0 0.912 130.7 49.1 -51.5 -51.7 -23.6 13.4 30.8 110 34 B K T 3 S- 0 0 175 1,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.541 121.1-105.9 -66.1 -17.9 -20.8 15.4 32.6 111 35 B G S < S+ 0 0 16 -3,-0.9 2,-0.3 1,-0.3 -2,-0.1 0.572 72.1 145.7 95.8 9.8 -19.5 16.9 29.4 112 36 B D - 0 0 43 1,-0.0 -4,-2.4 -37,-0.0 -1,-0.3 -0.646 44.2-131.5 -79.7 135.8 -16.4 14.7 29.2 113 37 B Y E -E 107 0B 44 -2,-0.3 24,-1.7 -6,-0.2 2,-0.3 -0.529 24.5-174.6 -86.9 153.4 -15.3 13.7 25.8 114 38 B F E -EF 106 136B 42 -8,-1.9 -8,-2.2 22,-0.2 2,-0.3 -0.982 19.6-127.9-145.5 149.3 -14.4 10.1 24.8 115 39 B L E -EF 105 135B 0 20,-2.9 20,-2.2 -2,-0.3 2,-0.4 -0.783 17.6-168.0 -96.6 146.6 -13.0 8.4 21.7 116 40 B N E -EF 104 134B 1 -12,-2.4 -12,-2.8 -2,-0.3 2,-0.5 -0.990 1.6-169.0-136.9 117.2 -14.7 5.5 20.1 117 41 B I E -EF 103 133B 0 16,-2.5 16,-2.8 -2,-0.4 2,-0.4 -0.964 12.6-171.5-105.9 125.0 -12.9 3.5 17.4 118 42 B V E -EF 102 132B 0 -16,-2.4 -16,-2.1 -2,-0.5 2,-0.5 -0.964 14.1-160.0-121.0 138.4 -15.1 1.1 15.6 119 43 B E E -EF 101 131B 0 12,-2.9 12,-3.0 -2,-0.4 2,-0.6 -0.986 7.4-161.0-115.4 125.3 -14.2 -1.7 13.1 120 44 B S E -EF 100 130B 17 -20,-3.5 -20,-2.3 -2,-0.5 2,-0.5 -0.968 8.5-164.3-109.4 112.2 -17.0 -2.9 10.8 121 45 B K E -EF 99 129B 29 8,-2.9 8,-3.0 -2,-0.6 2,-0.6 -0.915 10.7-142.8-103.8 125.6 -16.2 -6.3 9.3 122 46 B R E - 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