==== 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 METAL BINDING PROTEIN 12-DEC-06 2O8Q . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA XENOVORANS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 244 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12525.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 150 61.5 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 . 102 41.8 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 . 2 0.8 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-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 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 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 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 . 4 0 6 0 4 6 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 0 0 2 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 0 A G 0 0 124 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -98.2 28.7 41.1 31.7 2 1 A X - 0 0 172 1,-0.1 2,-0.4 0, 0.0 0, 0.0 -0.202 360.0-143.0 -45.0 148.7 32.0 39.4 33.0 3 2 A K - 0 0 96 88,-0.0 -1,-0.1 91,-0.0 2,-0.0 -0.956 8.2-123.4-127.3 139.4 32.9 36.1 31.3 4 3 A L - 0 0 48 -2,-0.4 2,-0.4 88,-0.1 155,-0.1 -0.320 39.3-112.5 -65.2 162.8 34.5 32.8 32.5 5 4 A Q - 0 0 73 153,-0.3 2,-0.1 85,-0.1 84,-0.1 -0.843 22.4-105.9-110.4 137.6 37.6 31.8 30.8 6 5 A T - 0 0 8 -2,-0.4 2,-0.5 84,-0.1 84,-0.2 -0.445 43.2-155.3 -57.1 129.9 38.1 28.9 28.4 7 6 A T E -A 89 0A 32 82,-1.8 82,-2.7 -2,-0.1 2,-0.4 -0.957 13.0-173.5-129.6 116.2 40.2 26.5 30.5 8 7 A I E -A 88 0A 34 -2,-0.5 2,-0.3 80,-0.2 80,-0.2 -0.857 4.1-178.5-113.0 139.5 42.4 23.8 29.1 9 8 A Q E -A 87 0A 83 78,-2.0 78,-2.4 -2,-0.4 2,-0.3 -0.984 7.9-159.8-133.7 150.2 44.3 21.1 30.7 10 9 A H - 0 0 93 -2,-0.3 76,-0.2 76,-0.2 75,-0.1 -0.935 25.2-114.1-124.2 149.1 46.7 18.5 29.3 11 10 A E - 0 0 57 73,-0.3 6,-0.1 -2,-0.3 75,-0.1 -0.751 34.2-121.9 -81.7 119.5 47.8 15.1 30.8 12 11 A P > - 0 0 42 0, 0.0 3,-0.7 0, 0.0 -1,-0.0 -0.309 17.4-140.2 -60.9 150.2 51.5 15.1 31.6 13 12 A K T 3 S+ 0 0 155 1,-0.3 -2,-0.0 2,-0.1 0, 0.0 0.785 99.3 61.1 -86.6 -41.7 53.3 12.3 29.8 14 13 A D T 3 S- 0 0 150 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.118 118.6-110.4 75.7 -73.7 55.4 11.3 32.3 15 14 A G S < S+ 0 0 25 -3,-0.7 3,-0.2 1,-0.2 -2,-0.1 0.455 78.4 123.0 90.4 1.4 52.3 10.4 34.3 16 15 A S + 0 0 73 1,-0.2 -1,-0.2 -5,-0.0 3,-0.1 0.018 25.3 89.0 -72.8-169.1 52.8 13.2 36.8 17 16 A G + 0 0 44 1,-0.3 2,-0.4 -6,-0.1 135,-0.4 0.411 62.5 118.0 91.7 -1.2 50.1 15.9 37.5 18 17 A F - 0 0 24 -3,-0.2 2,-0.5 133,-0.1 -1,-0.3 -0.819 48.5-156.5-101.9 142.9 48.3 14.0 40.3 19 18 A D B G 150 0B 130 131,-2.8 131,-2.3 -2,-0.4 129,-0.0 -0.964 360.0 360.0-120.4 126.0 48.0 15.2 43.8 20 19 A R 0 0 218 -2,-0.5 129,-0.3 129,-0.2 127,-0.0 -0.405 360.0 360.0 -67.7 360.0 47.5 12.6 46.6 21 ! 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 22 22 A R > 0 0 147 0, 0.0 3,-1.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -70.6 27.6 17.0 13.8 23 23 A E T 3 + 0 0 152 1,-0.3 121,-0.0 121,-0.1 0, 0.0 0.722 360.0 54.5 -76.8 -21.0 27.2 15.0 10.4 24 24 A F T 3 S+ 0 0 50 23,-0.0 24,-1.9 2,-0.0 2,-0.3 0.206 109.2 63.8 -91.0 12.3 30.9 14.1 10.5 25 25 A F E < -B 47 0A 22 -3,-1.1 2,-0.3 22,-0.2 22,-0.2 -0.916 62.6-151.9-134.0 159.9 30.4 12.5 14.0 26 26 A E E -B 46 0A 43 20,-2.3 20,-2.8 -2,-0.3 2,-0.4 -0.929 17.9-144.1-130.4 159.3 28.5 9.8 15.8 27 27 A Y E -BC 45 143A 42 116,-2.8 116,-2.7 -2,-0.3 2,-0.5 -0.951 12.1-161.2-133.9 136.8 27.4 9.7 19.4 28 28 A R E -B 44 0A 5 16,-2.4 16,-2.6 -2,-0.4 2,-0.3 -0.983 27.3-137.3-118.0 120.0 27.0 7.2 22.3 29 29 A D E -B 43 0A 82 -2,-0.5 14,-0.2 112,-0.4 12,-0.0 -0.581 12.4-158.1 -84.2 133.6 24.7 8.3 25.0 30 30 A T - 0 0 1 12,-2.2 185,-0.2 -2,-0.3 13,-0.1 0.596 46.4-115.3 -76.1 -13.8 25.5 7.8 28.7 31 31 A G S > S+ 0 0 12 11,-0.4 4,-2.1 102,-0.0 5,-0.2 0.476 81.5 124.4 90.5 0.3 21.8 8.2 29.6 32 32 A V H > + 0 0 0 10,-0.5 4,-1.9 2,-0.2 6,-0.3 0.899 68.9 56.4 -65.3 -36.5 22.3 11.4 31.6 33 33 A N H >>>S+ 0 0 70 9,-0.3 5,-2.4 1,-0.2 4,-0.5 0.977 113.3 39.2 -57.1 -55.1 19.7 13.3 29.5 34 34 A E H 345S+ 0 0 177 1,-0.2 3,-0.4 3,-0.2 -1,-0.2 0.831 115.3 54.7 -67.0 -28.8 16.9 10.8 30.1 35 35 A A H 3<5S+ 0 0 16 -4,-2.1 94,-0.3 1,-0.2 -1,-0.2 0.809 117.6 34.4 -69.4 -30.8 18.1 10.4 33.8 36 36 A T H X<5S- 0 0 10 -4,-1.9 3,-1.5 -3,-0.5 -1,-0.2 0.231 108.9-113.2-111.9 11.4 17.9 14.1 34.5 37 37 A G T 3<5S- 0 0 76 -4,-0.5 -3,-0.2 -3,-0.4 -4,-0.1 0.822 80.4 -51.9 61.5 29.5 14.9 15.1 32.3 38 38 A G T 3 -OP 78 96C 2 4,-1.9 4,-1.7 -2,-0.4 22,-0.2 -0.895 28.3-132.0-121.6 147.5 38.5 30.1 21.0 75 79 A E T 4 S+ 0 0 120 20,-2.3 -1,-0.1 -2,-0.3 21,-0.1 0.967 108.8 38.4 -59.0 -47.4 37.8 33.8 20.9 76 80 A D T 4 S+ 0 0 76 19,-0.3 -1,-0.2 1,-0.2 20,-0.1 0.903 131.6 18.6 -74.8 -44.3 39.5 34.3 24.3 77 81 A I T 4 S- 0 0 77 1,-0.3 -1,-0.2 3,-0.0 -2,-0.2 0.428 93.9-135.8-113.5 -2.4 42.5 31.9 24.2 78 82 A G E < -O 74 0C 24 -4,-1.7 -4,-1.9 2,-0.1 -1,-0.3 -0.442 58.5 -1.8 87.9-157.0 43.1 31.1 20.4 79 83 A A E -O 73 0C 59 -6,-0.3 2,-0.4 -2,-0.1 -6,-0.3 -0.486 61.7-171.9 -77.4 142.3 43.9 27.7 18.9 80 84 A V E -O 72 0C 12 -8,-2.8 -8,-2.4 -2,-0.2 2,-0.5 -0.989 12.0-154.4-138.2 124.7 44.2 24.7 21.3 81 85 A X E -O 71 0C 81 -2,-0.4 2,-0.4 -10,-0.2 -10,-0.2 -0.881 16.1-168.3-101.9 121.4 45.4 21.2 20.4 82 86 A L E -O 70 0C 0 -12,-3.1 -12,-2.2 -2,-0.5 2,-0.2 -0.933 7.3-179.1-113.7 136.0 44.1 18.5 22.6 83 87 A E E > -O 69 0C 100 -2,-0.4 3,-2.6 -14,-0.2 -18,-0.3 -0.572 54.1 -45.8-114.2-176.6 45.3 14.8 22.8 84 88 A A T 3 S+ 0 0 50 -16,-0.7 -73,-0.3 1,-0.3 -18,-0.2 -0.225 132.1 25.1 -52.5 135.3 44.0 12.0 25.0 85 89 A G T 3 S+ 0 0 3 -20,-3.0 -1,-0.3 1,-0.4 2,-0.2 0.257 95.4 124.9 92.7 -12.5 43.7 13.2 28.6 86 90 A G < - 0 0 1 -3,-2.6 -21,-3.0 -76,-0.2 -1,-0.4 -0.551 41.5-164.3 -79.7 149.7 43.2 16.8 27.5 87 91 A S E -AF 9 64A 1 -78,-2.4 -78,-2.0 -23,-0.2 2,-0.4 -0.962 11.9-162.9-136.8 148.9 40.2 18.7 28.6 88 92 A A E -AF 8 63A 0 -25,-2.3 -25,-2.3 -2,-0.3 2,-0.6 -0.957 5.6-159.5-134.9 117.4 38.5 21.9 27.5 89 93 A F E -AF 7 62A 4 -82,-2.7 -82,-1.8 -2,-0.4 -27,-0.2 -0.858 14.8-158.2 -91.8 123.0 36.0 23.8 29.7 90 94 A Q - 0 0 1 -29,-2.4 -29,-0.2 -2,-0.6 3,-0.2 -0.907 13.9-131.2-109.0 112.4 33.9 26.1 27.4 91 95 A P > - 0 0 6 0, 0.0 3,-2.4 0, 0.0 -33,-0.1 -0.127 46.8 -68.5 -57.4 156.1 32.3 29.0 29.1 92 96 A P T 3 S- 0 0 71 0, 0.0 -33,-0.1 0, 0.0 -35,-0.1 -0.169 117.2 -9.1 -49.3 119.0 28.6 29.6 28.5 93 97 A G T 3 S+ 0 0 34 -37,-0.8 -36,-0.1 -35,-0.2 -34,-0.1 0.626 86.7 171.6 69.2 14.9 28.1 30.8 24.9 94 98 A V < - 0 0 19 -3,-2.4 2,-0.4 1,-0.1 -38,-0.3 -0.314 38.3-116.1 -58.9 137.4 31.9 31.2 24.2 95 99 A R + 0 0 116 -40,-0.1 -20,-2.3 -42,-0.1 2,-0.3 -0.655 58.1 140.1 -76.2 126.0 32.6 31.9 20.5 96 100 A H E -MP 54 74C 7 -42,-2.4 -42,-2.4 -2,-0.4 2,-0.3 -0.960 32.6-161.0-156.8 170.7 34.6 28.9 19.2 97 101 A R E - P 0 73C 61 -24,-2.1 -24,-2.5 -2,-0.3 2,-0.5 -0.975 25.4-116.2-155.4 162.3 35.1 26.6 16.3 98 102 A E E - P 0 72C 47 -2,-0.3 -26,-0.3 -26,-0.2 -46,-0.1 -0.938 23.6-173.5-104.2 123.5 36.7 23.2 15.6 99 103 A L E - 0 0 36 -28,-2.8 2,-0.3 -2,-0.5 -27,-0.2 0.849 58.6 -35.7 -85.6 -39.0 39.7 23.4 13.2 100 104 A R E - P 0 71C 135 -29,-1.2 -29,-2.8 2,-0.0 -1,-0.3 -0.952 53.2-161.2-175.7 161.9 40.5 19.7 12.6 101 105 A H E - P 0 70C 49 -2,-0.3 -31,-0.2 -31,-0.2 2,-0.1 -0.984 27.5 -94.3-153.8 164.1 40.7 16.3 14.3 102 106 A S > - 0 0 10 -33,-2.5 3,-1.5 -2,-0.3 -55,-0.2 -0.373 33.9-117.3 -76.6 156.9 42.1 12.9 14.0 103 107 A D T 3 S+ 0 0 117 1,-0.3 -1,-0.1 -2,-0.1 -35,-0.0 0.730 116.6 47.8 -64.2 -25.6 40.3 10.0 12.3 104 108 A D T 3 S+ 0 0 67 -56,-0.1 -1,-0.3 -58,-0.1 -2,-0.0 0.163 80.1 146.7-100.3 13.3 40.3 8.2 15.6 105 109 A L < + 0 0 5 -3,-1.5 -58,-2.0 -36,-0.2 2,-0.3 -0.278 18.3 174.3 -53.9 132.4 39.0 11.1 17.8 106 110 A E E +DE 46 67A 22 -39,-2.3 -40,-2.8 -60,-0.2 -39,-1.8 -0.973 6.9 172.7-136.5 126.6 36.8 10.0 20.7 107 111 A V E -DE 45 65A 6 -62,-2.4 -62,-3.2 -2,-0.3 2,-0.5 -0.998 27.1-136.6-139.7 136.1 35.7 12.7 23.2 108 112 A L E -DE 44 64A 0 -44,-2.7 -44,-2.4 -2,-0.4 2,-0.4 -0.776 20.4-163.5 -91.2 132.0 33.3 12.8 26.1 109 113 A E E -DE 43 63A 11 -66,-2.7 -66,-2.2 -2,-0.5 2,-0.4 -0.974 7.3-172.3-116.6 131.5 31.1 15.9 26.2 110 114 A I E +DE 42 62A 0 -48,-2.5 -48,-2.6 -2,-0.4 2,-0.3 -0.995 21.1 164.3-121.3 128.4 29.2 16.9 29.4 111 115 A V E -DE 41 61A 0 -70,-2.5 -70,-2.8 -2,-0.4 -50,-0.2 -0.992 31.5-118.2-150.4 146.4 26.8 19.7 29.0 112 116 A S S S+ 0 0 29 -52,-2.4 -53,-3.1 -2,-0.3 -72,-0.2 -0.999 94.9 27.1-129.4 131.0 23.8 21.5 30.6 113 117 A P S > S- 0 0 50 0, 0.0 3,-0.6 0, 0.0 -74,-0.2 0.719 75.2-146.2 -78.9 173.9 21.1 21.6 29.3 114 118 A A T 3 S+ 0 0 20 -76,-2.1 2,-0.9 1,-0.3 -75,-0.1 0.893 95.9 55.0 -63.1 -41.6 21.1 18.5 27.1 115 119 A G T 3 S+ 0 0 73 -77,-0.5 -1,-0.3 -82,-0.1 2,-0.1 -0.402 77.0 159.5 -97.5 57.3 19.0 20.3 24.5 116 120 A F < - 0 0 49 -2,-0.9 2,-0.2 -3,-0.6 -58,-0.1 -0.378 35.0-127.4 -73.9 152.5 21.1 23.4 23.8 117 121 A A - 0 0 54 -60,-0.2 -60,-2.3 -2,-0.1 2,-0.4 -0.603 15.8-144.0 -92.2 160.0 20.8 25.5 20.6 118 122 A T E -N 56 0C 81 -62,-0.2 2,-0.4 -2,-0.2 -62,-0.2 -0.997 13.5-168.8-127.5 131.4 23.8 26.3 18.3 119 123 A S E -N 55 0C 61 -64,-2.4 -64,-2.0 -2,-0.4 2,-0.3 -0.978 21.7-127.4-122.4 137.5 24.2 29.6 16.5 120 124 A V E -N 54 0C 108 -2,-0.4 2,-0.3 -66,-0.2 -66,-0.3 -0.615 38.1-109.6 -77.0 139.1 26.6 30.5 13.8 121 125 A V - 0 0 37 -68,-2.5 2,-1.0 -2,-0.3 -68,-0.1 -0.582 21.3-126.7 -75.6 129.8 28.5 33.8 14.7 122 126 A D - 0 0 94 -2,-0.3 -1,-0.1 1,-0.2 -68,-0.0 -0.695 29.8-175.7 -72.7 99.9 27.6 36.8 12.6 123 127 A L 0 0 92 -2,-1.0 -1,-0.2 -70,-0.1 -2,-0.0 0.861 360.0 360.0 -74.6 -36.7 31.1 37.7 11.5 124 128 A E 0 0 227 -3,-0.1 -2,-0.0 0, 0.0 0, 0.0 0.057 360.0 360.0 -71.1 360.0 30.2 40.9 9.6 125 !* 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 0.0 126 1 B X 0 0 213 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-172.0 11.3 12.0 44.1 127 2 B K - 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