==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 25-JUL-11 2LGE . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PARABACTEROIDES DISTASONIS; . AUTHOR P.SERRANO,M.GERALT,B.MOHANTY,K.WUTHRICH,JOINT CENTER FOR STR . 129 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8172.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 72 55.8 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 . 50 38.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 9 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 1.6 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+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 2 2 0 2 0 0 1 1 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 1 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 1 A G 0 0 104 0, 0.0 2,-1.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 115.5 27.0 -11.6 3.5 2 2 A D - 0 0 176 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.691 360.0 -36.4 73.3 -80.8 28.0 -13.5 0.3 3 3 A D - 0 0 119 -2,-1.6 2,-0.2 2,-0.0 0, 0.0 -0.949 57.7-145.1-164.5 155.2 29.3 -10.3 -1.3 4 4 A D - 0 0 130 -2,-0.3 -2,-0.0 2,-0.0 0, 0.0 -0.761 4.2-149.5-125.4 171.1 28.5 -6.6 -1.4 5 5 A E - 0 0 169 -2,-0.2 2,-0.1 2,-0.0 -2,-0.0 -0.854 14.2-162.9-154.8 85.6 28.7 -4.0 -4.1 6 6 A P + 0 0 118 0, 0.0 2,-0.0 0, 0.0 -2,-0.0 -0.442 39.5 101.6 -78.0 165.1 29.4 -0.4 -3.1 7 7 A G + 0 0 79 1,-0.3 2,-0.1 -2,-0.1 -2,-0.0 0.231 62.8 17.9 121.2 110.9 28.8 2.6 -5.4 8 8 A G - 0 0 65 -2,-0.0 -1,-0.3 2,-0.0 2,-0.2 -0.318 65.6 -88.6 106.2-176.9 25.9 5.1 -5.5 9 9 A K + 0 0 190 -2,-0.1 2,-0.3 62,-0.0 62,-0.0 -0.750 45.3 115.5-134.5 166.0 22.9 6.4 -3.4 10 10 A G - 0 0 40 -2,-0.2 63,-0.2 119,-0.0 2,-0.1 -0.929 42.1-113.4 158.7-154.2 19.3 5.9 -2.5 11 11 A A B -A 72 0A 14 61,-2.9 61,-1.6 -2,-0.3 2,-0.3 -0.372 19.9-103.0-138.5-162.5 17.3 5.0 0.6 12 12 A M - 0 0 74 59,-0.2 90,-0.7 -2,-0.1 2,-0.3 -0.880 34.4-161.5-128.6 165.1 15.0 2.4 2.2 13 13 A Y E -B 101 0B 10 -2,-0.3 55,-0.8 88,-0.2 2,-0.3 -0.981 14.7-171.7-146.8 154.9 11.2 2.7 2.4 14 14 A E E -BC 100 67B 74 86,-2.2 86,-3.0 -2,-0.3 2,-0.3 -0.944 9.7-165.3-146.6 121.0 8.2 1.2 4.4 15 15 A V E -BC 99 66B 14 51,-2.6 51,-2.2 -2,-0.3 2,-0.3 -0.826 5.8-158.9 -99.7 151.9 4.5 1.9 3.6 16 16 A T E -BC 98 65B 13 82,-2.2 82,-1.3 -2,-0.3 2,-0.3 -0.939 8.3-169.2-125.9 154.2 1.5 1.1 5.9 17 17 A I E -BC 97 64B 19 47,-2.7 47,-2.3 -2,-0.3 2,-0.3 -0.940 1.4-174.5-139.4 111.8 -2.1 0.6 5.3 18 18 A E E -BC 96 63B 83 78,-2.8 78,-2.1 -2,-0.3 2,-0.5 -0.832 18.5-146.2 -95.6 150.8 -4.7 0.4 8.1 19 19 A Q E -B 95 0B 11 43,-1.8 2,-0.2 -2,-0.3 76,-0.2 -0.967 20.5-177.8-128.9 106.9 -8.2 -0.5 6.8 20 20 A S E +B 94 0B 35 74,-2.0 74,-2.3 -2,-0.5 3,-0.2 -0.655 42.5 14.3-113.1 167.8 -11.1 1.1 8.7 21 21 A G E S-B 93 0B 56 72,-0.3 2,-1.1 -2,-0.2 72,-0.3 -0.332 121.1 -18.8 60.6-150.6 -14.9 0.9 8.4 22 22 A D S > S+ 0 0 52 70,-2.6 3,-1.1 1,-0.2 -1,-0.2 -0.061 79.6 143.2 -87.2 34.4 -16.6 -1.9 6.4 23 23 A F G > + 0 0 12 -2,-1.1 3,-0.7 1,-0.3 -1,-0.2 0.450 51.0 82.3 -58.6 -6.1 -13.5 -2.9 4.3 24 24 A R G 3 S+ 0 0 159 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.383 93.6 43.1 -86.3 0.8 -14.3 -6.7 4.4 25 25 A S G < S+ 0 0 46 -3,-1.1 2,-0.4 1,-0.0 -1,-0.2 -0.221 92.7 95.5-135.9 32.4 -16.9 -6.5 1.5 26 26 A F S < S- 0 0 1 -3,-0.7 2,-0.8 57,-0.1 57,-0.1 -0.892 71.3-133.8-143.3 102.3 -15.0 -4.2 -1.0 27 27 A I - 0 0 75 -2,-0.4 55,-0.2 54,-0.1 2,-0.2 -0.415 39.4-173.3 -69.2 96.9 -12.8 -5.7 -3.8 28 28 A K - 0 0 2 -2,-0.8 2,-0.4 53,-0.2 53,-0.2 -0.576 14.7-154.2-110.4 160.8 -9.7 -3.5 -3.4 29 29 A S E +G 80 0C 67 51,-2.2 51,-1.3 -2,-0.2 2,-0.3 -0.995 12.3 173.5-145.5 126.3 -6.5 -3.2 -5.4 30 30 A V E -GH 79 54C 30 24,-1.9 24,-1.9 -2,-0.4 2,-0.3 -0.944 12.8-156.1-135.6 155.7 -2.8 -2.1 -4.7 31 31 A V E - H 0 53C 40 47,-1.4 47,-0.3 -2,-0.3 2,-0.3 -0.893 4.7-168.7-119.4 154.6 0.5 -1.9 -6.6 32 32 A V E - H 0 52C 4 20,-2.4 20,-2.2 -2,-0.3 2,-0.4 -0.938 4.7-177.6-145.6 127.3 4.1 -1.9 -5.1 33 33 A V B -I 76 0C 57 43,-0.8 43,-0.6 -2,-0.3 2,-0.5 -0.995 4.4-168.9-127.8 125.5 7.2 -1.1 -7.3 34 34 A A - 0 0 15 -2,-0.4 2,-0.4 3,-0.1 3,-0.3 -0.960 8.3-154.1-123.2 112.2 10.8 -1.3 -5.8 35 35 A N S S- 0 0 65 -2,-0.5 38,-1.7 39,-0.3 39,-0.5 -0.699 78.7 -3.2 -74.5 128.1 13.8 0.1 -7.7 36 36 A G S S+ 0 0 60 -2,-0.4 2,-0.3 36,-0.2 35,-0.2 0.403 123.9 51.6 77.4 1.1 17.1 -1.5 -6.7 37 37 A T S S- 0 0 26 -3,-0.3 2,-0.2 33,-0.1 -3,-0.1 -0.936 78.8-102.4-153.4 175.9 15.9 -3.9 -3.9 38 38 A Q - 0 0 108 -2,-0.3 31,-2.8 11,-0.1 32,-0.4 -0.622 36.1-116.3-100.0 161.0 13.3 -6.6 -3.1 39 39 A L E -DE 48 68B 0 9,-2.2 9,-2.5 29,-0.2 2,-0.3 -0.426 17.1-140.9 -89.9 171.6 10.2 -6.1 -1.0 40 40 A K E -DE 47 67B 91 27,-1.8 27,-1.6 7,-0.3 2,-0.4 -0.996 13.8-129.8-137.7 139.5 9.2 -7.6 2.4 41 41 A D E >> - E 0 66B 33 5,-2.8 4,-2.3 -2,-0.3 3,-0.9 -0.746 6.2-147.0 -93.8 128.6 5.8 -8.8 3.5 42 42 A G T 34 S+ 0 0 46 23,-1.0 -1,-0.1 -2,-0.4 24,-0.1 0.723 90.1 69.7 -70.0 -21.6 4.4 -7.6 6.8 43 43 A A T 34 S- 0 0 80 1,-0.1 -1,-0.2 22,-0.1 23,-0.0 0.798 129.7 -10.5 -60.0 -37.1 2.5 -10.8 7.5 44 44 A T T <4 S- 0 0 100 -3,-0.9 -2,-0.2 2,-0.1 -1,-0.1 0.490 91.2-107.1-145.6 -28.6 5.6 -12.9 8.1 45 45 A G < + 0 0 30 -4,-2.3 -3,-0.1 1,-0.3 2,-0.1 0.546 62.7 156.2 88.3 13.9 8.7 -10.9 7.1 46 46 A E - 0 0 127 -5,-0.2 -5,-2.8 1,-0.1 -1,-0.3 -0.455 45.0-117.9 -62.7 138.0 9.2 -13.0 3.9 47 47 A S E -D 40 0B 81 -7,-0.2 2,-0.4 -2,-0.1 -7,-0.3 -0.487 31.5-153.3 -68.7 150.8 11.2 -11.3 1.2 48 48 A L E -D 39 0B 43 -9,-2.5 -9,-2.2 -2,-0.2 2,-1.8 -0.996 21.6-119.0-136.3 142.1 9.3 -10.8 -2.1 49 49 A A - 0 0 79 -2,-0.4 -11,-0.1 -11,-0.2 -9,-0.0 -0.522 55.4-132.7 -77.8 78.0 10.3 -10.4 -5.8 50 50 A S S S+ 0 0 24 -2,-1.8 -17,-0.1 2,-0.1 2,-0.1 -0.241 80.7 77.9 -54.7 156.3 8.9 -6.9 -6.5 51 51 A P S S+ 0 0 97 0, 0.0 2,-0.3 0, 0.0 -18,-0.2 0.430 74.9 158.5 -79.6 146.7 7.3 -5.4 -8.5 52 52 A V E -H 32 0C 43 -20,-2.2 -20,-2.4 -2,-0.1 2,-0.3 -0.889 35.7-142.3-140.3 159.1 4.0 -6.9 -7.1 53 53 A I E -H 31 0C 102 -2,-0.3 2,-0.5 -22,-0.2 -22,-0.2 -0.921 15.5-141.5-119.9 142.3 0.3 -6.3 -7.0 54 54 A L E -H 30 0C 8 -24,-1.9 -24,-1.9 -2,-0.3 2,-0.2 -0.961 17.2-157.2-108.4 128.1 -1.9 -7.1 -3.9 55 55 A S >> - 0 0 67 -2,-0.5 4,-1.7 -26,-0.2 3,-0.9 -0.443 37.0 -90.1 -94.3 173.6 -5.4 -8.5 -4.7 56 56 A D T 34 S+ 0 0 34 1,-0.3 -30,-0.1 2,-0.2 -27,-0.1 0.821 121.8 58.1 -60.2 -36.1 -8.4 -8.4 -2.4 57 57 A E T >4 S+ 0 0 175 1,-0.2 3,-0.8 2,-0.2 -1,-0.3 0.839 109.0 44.9 -63.4 -36.9 -7.7 -11.7 -0.6 58 58 A E G X4 S+ 0 0 94 -3,-0.9 3,-0.7 1,-0.2 -1,-0.2 0.861 111.4 53.9 -75.7 -36.8 -4.2 -10.4 0.6 59 59 A L G 3< S+ 0 0 2 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 -0.009 79.8 99.8 -86.5 24.5 -5.8 -7.0 1.6 60 60 A A G < + 0 0 42 -3,-0.8 -1,-0.2 -5,-0.1 2,-0.1 0.439 63.0 93.3 -88.2 -4.9 -8.4 -8.9 3.7 61 61 A V S < S- 0 0 69 -3,-0.7 3,-0.1 1,-0.1 -3,-0.0 -0.470 87.2-115.5 -82.8 163.2 -6.3 -8.1 6.9 62 62 A E S S+ 0 0 137 1,-0.2 -43,-1.8 -2,-0.1 2,-0.3 0.801 95.8 7.7 -62.1 -34.9 -6.8 -5.1 9.3 63 63 A K E -C 18 0B 87 -45,-0.2 2,-0.4 2,-0.0 -45,-0.2 -0.986 58.9-165.0-152.2 139.2 -3.4 -3.7 8.4 64 64 A V E -C 17 0B 15 -47,-2.3 -47,-2.7 -2,-0.3 2,-0.4 -0.936 2.6-174.0-118.7 152.4 -0.5 -4.3 6.0 65 65 A T E -C 16 0B 33 -2,-0.4 -23,-1.0 -49,-0.2 2,-0.4 -0.973 9.0-175.4-129.8 131.3 3.0 -2.9 6.3 66 66 A L E +CE 15 41B 11 -51,-2.2 -51,-2.6 -2,-0.4 -25,-0.2 -0.999 9.6 169.2-132.3 144.7 5.4 -3.6 3.4 67 67 A S E -CE 14 40B 23 -27,-1.6 -27,-1.8 -2,-0.4 2,-0.4 -0.506 31.2 -90.1-141.6-173.0 9.0 -2.6 3.3 68 68 A T E - E 0 39B 10 -55,-0.8 -29,-0.2 -29,-0.3 4,-0.1 -0.939 11.7-150.1-120.6 138.1 12.4 -3.0 1.5 69 69 A T S S- 0 0 66 -31,-2.8 2,-0.2 -2,-0.4 -30,-0.1 0.636 77.4 -19.1 -78.9 -12.0 15.1 -5.6 2.1 70 70 A G S S- 0 0 21 -32,-0.4 2,-1.3 -59,-0.0 -33,-0.1 -0.695 109.3 -6.3-168.3-157.2 17.9 -3.2 1.0 71 71 A K - 0 0 88 -35,-0.2 -59,-0.2 -2,-0.2 2,-0.2 -0.522 63.7-174.9 -73.4 91.7 19.0 -0.1 -0.8 72 72 A A B -A 11 0A 0 -61,-1.6 -61,-2.9 -2,-1.3 -36,-0.2 -0.527 20.6-169.8 -84.9 155.5 15.7 1.1 -2.5 73 73 A I + 0 0 52 -38,-1.7 2,-0.3 -63,-0.2 -37,-0.1 0.395 66.8 25.7-124.0 -5.9 15.6 4.0 -5.0 74 74 A E - 0 0 73 -39,-0.5 2,-0.3 55,-0.2 55,-0.3 -0.988 48.2-161.2-148.9 159.2 11.8 4.5 -5.3 75 75 A F E + J 0 128C 2 53,-2.5 53,-2.7 -2,-0.3 2,-0.3 -0.971 11.7 178.8-132.2 143.1 8.4 4.0 -3.9 76 76 A A E +IJ 33 127C 26 -43,-0.6 -43,-0.8 -2,-0.3 2,-0.4 -0.979 4.4 178.0-138.3 129.3 5.2 4.0 -5.9 77 77 A V E + J 0 126C 8 49,-2.4 49,-2.3 -2,-0.3 2,-0.3 -0.918 10.1 156.1-139.9 100.6 1.9 3.4 -4.1 78 78 A S E + J 0 125C 37 -2,-0.4 -47,-1.4 -47,-0.3 2,-0.3 -0.869 10.4 140.1-120.1 158.8 -1.4 3.5 -6.0 79 79 A G E +GJ 30 124C 8 45,-1.7 45,-2.1 -2,-0.3 44,-0.6 -0.933 13.0 164.8 178.1 171.5 -4.8 1.9 -5.2 80 80 A G E -G 29 0C 9 -51,-1.3 -51,-2.2 -2,-0.3 2,-0.2 -0.917 20.1-133.3-175.3-172.7 -8.6 2.1 -5.1 81 81 A V - 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