==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL-BINDING PROTEIN 22-FEB-08 2VOW . COMPND 2 MOLECULE: SURFACE-ASSOCIATED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: METHYLOCOCCUS CAPSULATUS; . AUTHOR R.HELLAND,A.FJELLBIRKELAND,O.A.KARLSEN,T.VE,J.R.LILLEHAUG, . 290 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12502.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 59.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 25.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 29 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 0 0 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 PARALLEL BRIDGES PER LADDER . 1 3 1 2 0 2 2 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 . 5 1 1 0 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 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 47 A G 0 0 102 0, 0.0 2,-0.1 0, 0.0 162,-0.1 0.000 360.0 360.0 360.0 -80.2 0.3 0.5 12.7 2 48 A V - 0 0 41 160,-0.2 161,-0.1 1,-0.1 66,-0.0 0.680 360.0-133.7-103.5 171.8 2.7 -0.4 11.4 3 49 A A E -a 163 0A 4 159,-0.7 161,-2.8 -2,-0.1 2,-0.4 -0.232 16.3-141.8 -59.6 156.2 3.0 0.0 7.6 4 50 A E E -a 164 0A 113 159,-0.2 2,-0.5 193,-0.0 161,-0.2 -0.999 8.3-158.9-121.2 129.5 4.2 -2.9 5.5 5 51 A V E -a 165 0A 18 159,-2.9 161,-3.0 -2,-0.4 2,-0.5 -0.942 9.1-159.0-108.4 123.8 6.5 -2.1 2.6 6 52 A V E -a 166 0A 63 -2,-0.5 2,-0.3 159,-0.2 161,-0.2 -0.923 7.2-166.0-111.1 120.9 6.6 -4.9 -0.0 7 53 A E E -a 167 0A 17 159,-3.1 161,-2.6 -2,-0.5 2,-0.6 -0.758 17.5-130.3-104.5 153.2 9.6 -5.1 -2.4 8 54 A T E -a 168 0A 81 -2,-0.3 7,-0.2 159,-0.2 161,-0.2 -0.915 30.4-119.1-104.2 123.4 9.9 -7.1 -5.6 9 55 A F + 0 0 30 159,-3.0 2,-0.3 -2,-0.6 7,-0.2 -0.381 39.3 166.7 -61.8 129.0 13.1 -9.2 -5.8 10 56 A K - 0 0 138 5,-1.4 128,-0.1 -2,-0.1 160,-0.0 -0.975 25.3-137.6-142.9 131.4 15.4 -8.4 -8.7 11 57 A N S S+ 0 0 56 -2,-0.3 2,-0.1 1,-0.2 3,-0.0 -0.956 97.9 32.5-133.6 117.7 19.1 -9.6 -9.1 12 58 A P S S+ 0 0 119 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.487 112.7 89.6 -70.0 154.5 20.9 -7.6 -10.0 13 59 A G S > S- 0 0 31 -2,-0.1 3,-0.6 1,-0.1 125,-0.1 -0.938 87.2 -85.1 167.8 171.4 19.1 -4.9 -8.3 14 60 A T T 3 S+ 0 0 66 -2,-0.3 143,-2.1 1,-0.3 2,-0.8 0.888 123.7 46.5 -65.2 -37.9 18.4 -2.7 -5.2 15 61 A Y T 3 S+ 0 0 35 -7,-0.2 -5,-1.4 141,-0.2 -1,-0.3 -0.508 73.7 124.1-106.0 61.4 16.1 -5.4 -3.7 16 62 A S S < S- 0 0 0 -2,-0.8 122,-2.8 -3,-0.6 123,-0.2 0.138 80.4-111.6-108.4 14.7 18.3 -8.3 -4.3 17 63 A S - 0 0 0 138,-2.2 122,-0.4 120,-0.2 138,-0.2 0.925 47.4-163.7 53.3 54.5 18.5 -9.5 -0.7 18 64 A P - 0 0 0 0, 0.0 136,-2.5 0, 0.0 2,-0.3 -0.190 17.3-106.0 -69.3 163.8 22.1 -8.7 -0.2 19 65 A V E -C 153 0B 22 134,-0.2 2,-0.3 136,-0.1 134,-0.2 -0.668 28.9-159.4 -89.3 135.8 24.3 -10.0 2.7 20 66 A I E -C 152 0B 4 132,-3.3 132,-1.8 -2,-0.3 2,-0.4 -0.760 13.3-129.2-110.8 165.6 25.4 -7.7 5.6 21 67 A N E -C 151 0B 43 -2,-0.3 69,-0.5 130,-0.2 130,-0.2 -0.946 6.3-156.8-123.6 132.1 28.3 -8.3 8.0 22 68 A F S S+ 0 0 2 128,-3.0 17,-2.0 -2,-0.4 129,-0.1 0.462 92.0 46.4 -87.2 -3.1 28.2 -8.3 11.8 23 69 A K S S+ 0 0 55 127,-0.4 13,-2.4 15,-0.2 -1,-0.2 0.740 75.9 108.6-106.9 -35.5 31.9 -7.5 12.3 24 70 A I B +D 35 0C 41 11,-0.2 11,-0.2 1,-0.1 66,-0.1 -0.205 33.8 162.8 -54.3 131.5 32.7 -4.6 9.9 25 71 A A + 0 0 5 9,-3.2 26,-2.7 25,-0.1 10,-0.2 0.575 31.9 104.4-128.5 -22.4 33.2 -1.5 12.0 26 72 A S S S- 0 0 14 8,-1.3 3,-0.1 24,-0.2 24,-0.0 -0.247 70.3-108.6 -66.5 155.1 35.0 1.2 9.9 27 73 A P - 0 0 29 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 -0.212 46.3 -80.4 -70.3 171.9 33.3 4.2 8.4 28 74 A P S S+ 0 0 41 0, 0.0 251,-0.7 0, 0.0 252,-0.2 -0.394 85.1 79.8 -65.6 152.8 32.6 4.6 4.7 29 75 A G S S- 0 0 46 250,-0.1 2,-0.1 249,-0.1 249,-0.0 -0.663 83.2 -53.2 136.9 173.8 35.5 5.8 2.6 30 76 A P S S+ 0 0 126 0, 0.0 2,-0.2 0, 0.0 0, 0.0 -0.361 84.9 62.4 -75.2 160.8 38.6 4.4 1.0 31 77 A G S S- 0 0 69 -2,-0.1 -2,-0.1 2,-0.0 0, 0.0 -0.566 88.6 -23.7 121.0 178.6 41.1 2.5 3.0 32 78 A T - 0 0 131 -2,-0.2 2,-0.1 1,-0.1 0, 0.0 -0.458 64.1-128.4 -68.9 123.5 41.8 -0.5 5.1 33 79 A P - 0 0 66 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.404 15.7-137.2 -70.2 154.0 38.5 -1.9 6.5 34 80 A I - 0 0 86 -7,-0.1 -9,-3.2 -2,-0.1 -8,-1.3 -0.966 17.2-169.1-114.9 123.5 38.3 -2.5 10.3 35 81 A Y B -D 24 0C 134 -2,-0.5 -11,-0.2 -11,-0.2 -12,-0.0 -0.958 7.1-179.7-111.0 130.5 36.7 -5.7 11.5 36 82 A G - 0 0 23 -13,-2.4 3,-0.1 -2,-0.5 14,-0.0 -0.328 45.3 -55.8-106.0-164.2 35.9 -6.1 15.2 37 83 A P S S- 0 0 82 0, 0.0 -1,-0.3 0, 0.0 2,-0.1 -0.377 73.6 -82.6 -70.3 155.5 34.3 -9.0 17.0 38 84 A P - 0 0 43 0, 0.0 2,-2.0 0, 0.0 -15,-0.2 -0.403 43.2-118.6 -62.1 138.8 30.8 -10.0 15.8 39 85 A R + 0 0 5 -17,-2.0 53,-2.7 51,-0.3 2,-0.6 -0.529 52.5 156.3 -85.4 77.0 28.2 -7.8 17.3 40 86 A D B -e 92 0D 46 -2,-2.0 53,-0.2 51,-0.2 51,-0.0 -0.921 21.2-177.8-105.5 112.3 26.2 -10.4 19.2 41 87 A F > + 0 0 0 51,-2.8 3,-2.6 -2,-0.6 52,-0.2 0.283 33.2 140.2 -92.9 6.3 24.3 -8.9 22.1 42 88 A S T 3 S+ 0 0 23 50,-0.3 53,-0.1 1,-0.3 -2,-0.1 -0.242 72.0 22.2 -52.2 132.9 22.9 -12.3 23.3 43 89 A G T 3 S- 0 0 60 51,-0.6 -1,-0.3 245,-0.0 246,-0.1 0.125 109.9-129.6 93.8 -21.7 23.0 -12.4 27.1 44 90 A Y S < S+ 0 0 17 -3,-2.6 244,-0.2 244,-0.1 3,-0.1 0.096 81.1 92.7 61.8-176.6 22.9 -8.6 27.2 45 91 A N + 0 0 106 242,-2.1 2,-0.3 1,-0.3 243,-0.2 0.915 69.4 130.4 54.4 44.6 25.2 -6.2 29.1 46 92 A K E -J 287 0E 76 241,-1.4 241,-2.1 -5,-0.1 2,-0.3 -0.902 38.2-169.2-125.2 154.9 27.3 -6.1 26.0 47 93 A S E -J 286 0E 56 -2,-0.3 2,-0.3 239,-0.2 239,-0.2 -0.995 5.0-177.5-150.7 137.1 28.7 -3.1 24.1 48 94 A Y E -J 285 0E 40 237,-2.2 237,-3.0 -2,-0.3 2,-0.3 -0.994 16.8-139.3-137.8 147.9 30.5 -2.6 20.8 49 95 A S E +J 284 0E 45 -2,-0.3 2,-0.3 235,-0.2 235,-0.2 -0.808 33.7 144.9-108.1 143.1 32.0 0.4 19.0 50 96 A L E -J 283 0E 0 233,-2.3 233,-3.1 -2,-0.3 2,-0.4 -0.970 42.6-103.9-166.4 164.7 31.6 1.1 15.3 51 97 A A E -J 282 0E 0 -26,-2.7 2,-0.4 -2,-0.3 231,-0.2 -0.851 24.8-159.0-107.0 145.2 31.2 4.0 12.8 52 98 A I E -J 281 0E 0 229,-2.4 229,-2.1 -2,-0.4 36,-0.2 -0.950 29.3-100.2-123.7 136.4 28.0 5.0 11.0 53 99 A G E > -J 280 0E 3 34,-2.8 3,-1.8 -2,-0.4 199,-0.7 -0.181 35.9-108.9 -57.4 146.3 27.7 7.1 7.8 54 100 A K T 3 S+ 0 0 57 225,-2.3 3,-0.1 1,-0.3 -1,-0.1 0.792 113.5 12.4 -42.7 -49.7 26.9 10.8 8.1 55 101 A T T > S+ 0 0 18 198,-0.1 3,-1.0 1,-0.1 -1,-0.3 0.006 87.9 130.7-121.4 28.1 23.3 10.6 6.7 56 102 A S T < + 0 0 0 -3,-1.8 28,-2.8 1,-0.2 32,-0.2 0.759 69.1 50.9 -60.6 -31.4 22.9 6.8 6.9 57 103 A Y T 3 S+ 0 0 0 195,-2.6 2,-0.3 -4,-0.3 -1,-0.2 0.792 127.1 9.1 -76.4 -29.7 19.5 6.8 8.7 58 104 A Y S < S+ 0 0 3 -3,-1.0 196,-0.3 194,-0.7 -1,-0.3 -0.871 73.6 154.7-159.0 110.1 17.6 9.2 6.4 59 105 A D > - 0 0 8 23,-2.5 3,-2.1 -2,-0.3 23,-0.3 -0.917 36.7-153.6-152.4 113.4 19.0 10.4 3.1 60 106 A P G > S+ 0 0 0 0, 0.0 3,-2.3 0, 0.0 -1,-0.1 0.738 92.8 79.0 -58.6 -21.4 17.2 11.7 -0.0 61 107 A T G 3 S+ 0 0 46 1,-0.3 205,-0.0 2,-0.1 200,-0.0 0.693 73.1 77.8 -58.7 -19.4 20.3 10.5 -2.0 62 108 A T G < S- 0 0 15 -3,-2.1 -1,-0.3 20,-0.3 3,-0.1 0.762 95.7-143.1 -60.8 -24.7 18.8 7.0 -1.7 63 109 A G < + 0 0 58 -3,-2.3 2,-0.4 202,-0.3 -2,-0.1 0.560 65.1 97.8 73.0 8.2 16.5 8.2 -4.5 64 110 A T - 0 0 49 18,-0.1 18,-1.5 -4,-0.1 2,-0.3 -0.997 50.0-170.1-132.9 137.6 13.6 6.3 -3.1 65 111 A K E -M 81 0F 84 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.898 4.8-164.2-117.1 145.7 10.7 7.4 -0.9 66 112 A W E -M 80 0F 8 14,-2.6 14,-3.4 -2,-0.3 2,-0.4 -0.785 13.2-132.3-119.9 170.3 8.1 5.3 0.8 67 113 A N - 0 0 93 -2,-0.3 2,-0.7 12,-0.2 11,-0.2 -0.972 0.3-148.2-127.3 140.3 4.8 6.2 2.3 68 114 A D > - 0 0 1 9,-3.5 3,-0.9 -2,-0.4 9,-0.1 -0.909 14.3-179.4-107.3 102.9 3.2 5.3 5.7 69 115 A D T 3 S+ 0 0 121 -2,-0.7 -1,-0.1 1,-0.2 5,-0.1 0.408 71.8 77.7 -85.8 3.6 -0.5 5.1 5.2 70 116 A T T 3 S+ 0 0 59 7,-0.1 2,-0.4 4,-0.1 -1,-0.2 0.379 78.2 96.3 -86.7 3.2 -1.1 4.2 8.9 71 117 A I S < S- 0 0 32 -3,-0.9 6,-0.3 3,-0.1 5,-0.1 -0.805 76.3-121.6-100.5 134.2 -0.6 7.9 9.7 72 118 A T S S+ 0 0 129 -2,-0.4 2,-0.1 1,-0.2 -2,-0.0 -0.981 102.3 37.0-118.5 122.1 -3.5 10.4 10.0 73 119 A P S > S- 0 0 75 0, 0.0 3,-1.7 0, 0.0 4,-0.3 0.527 87.9-148.2 -71.1 150.6 -3.6 12.7 8.2 74 120 A V G > S+ 0 0 91 1,-0.3 3,-1.6 2,-0.2 -6,-0.2 0.776 93.4 65.4 -63.6 -31.4 -2.2 10.6 5.3 75 121 A S G > S+ 0 0 68 1,-0.3 3,-0.9 2,-0.2 -1,-0.3 0.754 95.9 61.4 -59.5 -25.1 -0.3 13.6 3.7 76 122 A D G < S+ 0 0 57 -3,-1.7 -1,-0.3 1,-0.2 143,-0.2 0.572 102.9 48.3 -80.2 -13.6 1.9 13.5 6.9 77 123 A G G < S+ 0 0 1 -3,-1.6 -9,-3.5 -4,-0.3 3,-0.3 0.116 93.3 111.0-107.9 19.9 3.1 10.0 6.2 78 124 A Q < + 0 0 94 -3,-0.9 -11,-0.2 -11,-0.2 142,-0.2 -0.680 68.7 13.3-100.5 149.4 4.0 10.7 2.6 79 125 A D + 0 0 73 -2,-0.3 2,-0.6 1,-0.2 -1,-0.2 0.926 69.5 177.9 60.6 53.9 7.4 10.9 0.8 80 126 A I E -M 66 0F 0 -14,-3.4 -14,-2.6 -3,-0.3 -1,-0.2 -0.792 24.0-134.9 -89.1 116.5 9.6 9.3 3.5 81 127 A W E -M 65 0F 46 -2,-0.6 -16,-0.2 -16,-0.2 136,-0.1 -0.407 22.2-125.3 -68.5 146.9 13.3 9.1 2.3 82 128 A R - 0 0 9 -18,-1.5 -23,-2.5 -23,-0.3 -20,-0.3 -0.349 14.9-121.4 -83.8 171.9 15.0 5.8 3.0 83 129 A G E -N 159 0G 0 76,-2.3 76,-2.3 -25,-0.2 2,-0.6 -0.570 31.3 -97.7-100.2 172.1 18.2 5.1 4.9 84 130 A W E > -N 158 0G 72 -28,-2.8 4,-1.1 74,-0.2 3,-0.3 -0.827 23.6-154.8 -93.4 122.6 21.3 3.3 3.6 85 131 A T T 4 S+ 0 0 0 72,-2.0 -1,-0.1 -2,-0.6 73,-0.1 0.899 90.5 38.9 -60.1 -40.8 21.5 -0.4 4.5 86 132 A H T 4 S+ 0 0 82 71,-0.5 -1,-0.2 1,-0.2 4,-0.1 0.514 109.9 55.0-100.7 -7.6 25.3 -0.7 4.3 87 133 A T T 4 S+ 0 0 40 -3,-0.3 -34,-2.8 -31,-0.2 -1,-0.2 0.580 101.7 67.0-100.4 -12.9 26.5 2.6 5.8 88 134 A G S < S- 0 0 2 -4,-1.1 2,-0.4 -32,-0.2 163,-0.2 -0.305 94.5-115.6 -76.1-178.1 24.5 2.0 8.9 89 135 A K E - F 0 250D 8 161,-2.9 161,-2.2 -2,-0.1 2,-0.3 -0.986 20.6-142.1-130.2 141.9 25.8 -1.0 11.0 90 136 A W E + F 0 249D 5 -69,-0.5 -51,-0.3 -2,-0.4 2,-0.3 -0.773 23.0 161.4-106.0 146.7 24.2 -4.3 11.8 91 137 A S E - F 0 248D 0 157,-2.2 157,-2.7 -2,-0.3 2,-0.3 -0.869 15.0-157.5-145.7 174.6 24.2 -6.4 14.9 92 138 A F E -eF 40 247D 30 -53,-2.7 -51,-2.8 -2,-0.3 -50,-0.3 -0.958 7.7-173.1-148.7 169.9 22.0 -9.2 16.3 93 139 A F E - 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