==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 22-OCT-04 1XTM . COMPND 2 MOLECULE: HYPOTHETICAL SUPEROXIDE DISMUTASE-LIKE PROTEIN YO . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR V.CALDERONE,S.MANGANI,L.BANCI,M.BENVENUTI,I.BERTINI,A.FANTON . 305 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14869.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 58.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 93 30.5 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 . 6 2.0 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-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 . 1 0.3 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 . 26 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 . 3 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 4 0 3 1 2 4 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 . 2 0 0 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 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 39 B S 0 0 142 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -47.5 2.3 37.7 48.7 2 40 B A + 0 0 75 1,-0.6 22,-0.5 20,-0.0 2,-0.4 0.114 360.0 104.6 93.3 -18.8 1.7 40.1 45.8 3 41 B F + 0 0 52 20,-0.2 -1,-0.6 18,-0.0 20,-0.2 -0.802 50.0 135.9 -76.8 135.9 3.8 38.1 43.4 4 42 B G E +A 22 0A 27 18,-2.2 18,-3.3 -2,-0.4 3,-0.1 -0.719 20.9 90.5-153.2-154.4 1.4 36.2 41.2 5 43 B H E - 0 0 90 -2,-0.2 -1,-0.1 16,-0.2 15,-0.1 0.910 67.6-151.3 51.6 48.9 0.7 35.3 37.6 6 44 B H E - 0 0 108 15,-0.1 2,-0.4 -3,-0.1 15,-0.2 -0.231 14.1-168.0 -56.4 134.6 2.7 32.0 38.1 7 45 B V E -A 20 0A 4 13,-2.4 13,-2.4 -3,-0.1 2,-0.4 -0.998 14.7-137.5-129.4 114.3 4.3 30.7 34.9 8 46 B Q E -A 19 0A 96 -2,-0.4 142,-0.4 11,-0.2 2,-0.4 -0.660 17.4-140.4 -74.8 135.8 5.8 27.2 34.6 9 47 B L E - 0 0 0 9,-3.0 8,-2.4 -2,-0.4 9,-0.4 -0.748 20.6-176.3 -95.3 137.0 9.2 26.9 32.9 10 48 B V E -AB 16 148A 33 138,-2.1 138,-2.5 -2,-0.4 6,-0.2 -0.979 16.1-134.7-134.8 144.4 9.9 24.0 30.5 11 49 B N E > - B 0 147A 21 4,-2.2 3,-1.7 -2,-0.3 136,-0.2 -0.235 40.1 -90.4 -87.6-175.7 13.0 23.0 28.6 12 50 B R T 3 S+ 0 0 77 134,-0.8 135,-0.1 1,-0.3 48,-0.1 0.739 128.2 53.0 -70.3 -21.6 13.3 21.9 24.9 13 51 B E T 3 S- 0 0 146 2,-0.1 -1,-0.3 44,-0.1 44,-0.0 0.426 121.2-107.1 -89.6 -2.8 12.8 18.2 26.0 14 52 B G < + 0 0 35 -3,-1.7 2,-0.3 1,-0.3 -2,-0.1 0.535 68.6 148.0 82.5 9.8 9.6 19.1 27.9 15 53 B K - 0 0 108 1,-0.1 -4,-2.2 2,-0.0 2,-0.4 -0.608 53.8-117.4 -74.1 134.1 11.0 18.8 31.4 16 54 B A E +A 10 0A 57 -2,-0.3 -6,-0.2 -6,-0.2 3,-0.1 -0.594 38.1 173.9 -66.2 122.4 9.6 21.1 34.1 17 55 B V E - 0 0 1 -8,-2.4 20,-1.9 -2,-0.4 2,-0.3 0.042 48.7 -70.7-131.3 27.8 12.5 23.3 35.2 18 56 B G E - C 0 36A 17 -9,-0.4 -9,-3.0 18,-0.2 -1,-0.4 -0.774 52.6 -93.1 121.7-155.8 11.0 25.9 37.6 19 57 B F E -AC 8 35A 54 16,-1.9 16,-2.7 -11,-0.3 2,-0.3 -0.934 9.0-136.1-154.3 166.6 8.8 28.9 37.5 20 58 B I E -AC 7 34A 0 -13,-2.4 -13,-2.4 -2,-0.3 2,-0.3 -0.969 17.2-172.8-125.3 143.8 8.4 32.6 37.2 21 59 B E E - C 0 33A 46 12,-2.1 12,-2.8 -2,-0.3 2,-0.4 -0.952 13.8-143.0-131.5 160.6 6.0 34.9 39.3 22 60 B I E -AC 4 32A 3 -18,-3.3 -18,-2.2 -2,-0.3 2,-0.4 -0.958 10.3-165.2-132.5 139.0 5.4 38.6 38.7 23 61 B K E - C 0 31A 59 8,-2.6 8,-2.4 -2,-0.4 2,-0.8 -0.961 28.6-122.4-123.3 139.1 4.7 41.7 40.9 24 62 B E E - C 0 30A 95 -22,-0.5 6,-0.2 -2,-0.4 2,-0.1 -0.731 44.4-133.5 -76.7 108.0 3.4 45.1 40.0 25 63 B S - 0 0 14 4,-2.1 3,-0.4 -2,-0.8 4,-0.3 -0.373 3.8-135.2 -76.4 140.4 6.4 47.2 41.1 26 64 B D S S+ 0 0 140 1,-0.4 -1,-0.1 2,-0.2 4,-0.0 -0.575 101.7 34.7-125.4 70.7 5.9 50.3 43.3 27 65 B D S S- 0 0 132 -2,-0.2 -1,-0.4 2,-0.1 3,-0.1 0.622 122.6 -22.4-146.3 175.1 7.9 51.5 41.4 28 66 B E S S- 0 0 82 -3,-0.4 2,-0.2 77,-0.2 -2,-0.2 0.760 87.0 -30.8-132.6-175.9 8.2 50.9 38.5 29 67 B G S S- 0 0 13 -4,-0.3 -4,-2.1 74,-0.1 2,-0.3 -0.543 93.3 -43.6 69.6-143.9 7.4 48.3 35.8 30 68 B L E -CD 24 104A 1 74,-2.0 74,-3.3 -6,-0.2 2,-0.5 -0.886 40.7-137.0-121.6 146.4 7.3 44.7 37.1 31 69 B D E -CD 23 103A 30 -8,-2.4 -8,-2.6 -2,-0.3 2,-0.5 -0.917 21.3-153.7 -99.7 134.7 9.5 42.6 39.3 32 70 B I E -CD 22 102A 1 70,-3.2 70,-2.4 -2,-0.5 2,-0.7 -0.917 4.7-159.8-112.8 116.4 10.2 39.1 38.0 33 71 B H E -CD 21 101A 40 -12,-2.8 -12,-2.1 -2,-0.5 2,-0.5 -0.889 16.5-175.1 -93.2 115.8 10.9 36.3 40.5 34 72 B I E +CD 20 100A 0 66,-2.8 66,-2.2 -2,-0.7 2,-0.5 -0.959 13.1 173.7-117.5 123.5 12.7 33.5 38.5 35 73 B S E +CD 19 99A 29 -16,-2.7 -16,-1.9 -2,-0.5 2,-0.3 -0.877 21.0 157.0-130.1 101.3 13.5 30.2 40.2 36 74 B A E -CD 18 98A 3 62,-2.5 62,-2.0 -2,-0.5 2,-0.2 -0.755 19.1-169.8-125.1 167.5 14.9 27.7 37.6 37 75 B N + 0 0 55 -20,-1.9 60,-0.2 -2,-0.3 59,-0.1 -0.835 58.0 55.9-146.2 174.5 17.0 24.7 37.5 38 76 B S S S+ 0 0 58 57,-0.3 2,-0.2 -2,-0.2 59,-0.2 0.862 76.6 137.3 61.6 33.8 18.8 22.3 35.1 39 77 B L - 0 0 11 57,-2.6 -1,-0.2 -3,-0.1 3,-0.0 -0.697 67.8 -76.7-107.5 166.7 20.8 25.2 33.6 40 78 B R > - 0 0 173 -2,-0.2 3,-2.0 1,-0.1 52,-0.3 -0.460 56.1-116.1 -70.2 112.6 24.4 25.4 32.6 41 79 B P T 3 S+ 0 0 80 0, 0.0 53,-0.2 0, 0.0 52,-0.2 -0.192 91.2 1.1 -55.8 131.9 26.4 25.9 35.9 42 80 B G T 3 S+ 0 0 63 50,-0.7 2,-0.2 51,-0.6 51,-0.1 0.508 99.8 134.9 72.9 5.1 28.3 29.2 36.1 43 81 B A < - 0 0 17 -3,-2.0 49,-2.6 50,-0.2 2,-0.6 -0.525 55.8-132.9 -82.6 153.1 27.0 30.5 32.7 44 82 B S E -I 91 0B 46 47,-0.2 2,-0.4 -2,-0.2 47,-0.2 -0.958 34.0-163.6 -98.4 121.5 25.6 33.9 31.9 45 83 B L E -I 90 0B 1 45,-2.6 45,-2.5 -2,-0.6 86,-0.3 -0.919 20.2-113.2-119.8 132.5 22.4 33.3 29.9 46 84 B G - 0 0 0 84,-2.6 82,-2.5 -2,-0.4 2,-0.4 -0.230 34.4-172.2 -58.6 143.5 20.3 35.5 27.7 47 85 B F E +E 127 0A 1 40,-0.5 40,-1.4 80,-0.2 2,-0.3 -0.962 11.2 158.4-151.1 119.8 16.9 36.3 29.1 48 86 B H E -EF 126 86A 0 78,-1.9 78,-2.7 -2,-0.4 2,-0.6 -0.988 41.2-121.5-145.9 149.2 14.1 38.1 27.3 49 87 B I E -E 125 0A 0 36,-2.6 18,-2.9 -2,-0.3 76,-0.2 -0.832 37.5-153.6 -89.5 122.5 10.4 38.6 27.2 50 88 B H E -EG 124 66A 0 74,-3.4 74,-1.6 -2,-0.6 16,-0.3 -0.640 21.5-109.8 -98.9 165.0 9.1 37.6 23.8 51 89 B E S S+ 0 0 90 14,-2.7 2,-0.4 -2,-0.2 13,-0.2 0.566 92.0 48.4 -76.1 -14.2 6.0 38.9 22.1 52 90 B K S S- 0 0 89 11,-1.5 2,-2.1 13,-0.2 71,-0.3 -0.996 74.5-127.7-139.9 131.8 3.6 35.9 22.1 53 91 B G + 0 0 11 68,-2.3 2,-0.3 -2,-0.4 97,-0.1 -0.527 69.5 117.1 -76.1 72.1 2.6 33.5 24.9 54 92 B S - 0 0 28 -2,-2.1 2,-0.5 95,-0.1 -2,-0.1 -0.920 37.4-179.3-149.0 118.6 3.5 30.3 23.0 55 93 B a + 0 0 34 -2,-0.3 2,-0.6 7,-0.1 93,-0.1 -0.673 12.2 172.7-123.9 74.4 6.1 27.7 24.0 56 94 B V > - 0 0 85 -2,-0.5 4,-2.2 1,-0.0 6,-0.3 -0.746 36.6 -92.2 -89.4 116.7 6.1 25.0 21.3 57 95 B R T 4 S+ 0 0 138 -2,-0.6 -44,-0.1 1,-0.2 -45,-0.1 -0.289 87.7 12.0 -69.5 157.7 8.9 22.5 21.8 58 96 B P T 4 S+ 0 0 66 0, 0.0 -1,-0.2 0, 0.0 -44,-0.1 -0.983 131.8 22.3 -90.3 -7.1 11.6 21.9 21.0 59 97 B D T 4 S- 0 0 46 -3,-0.2 86,-0.4 -47,-0.0 -2,-0.2 0.651 74.2-147.6 -95.8 -20.8 12.6 25.2 19.3 60 98 B F >< + 0 0 0 -4,-2.2 3,-1.2 1,-0.1 4,-0.2 0.659 51.8 136.5 56.6 26.1 10.2 27.8 20.8 61 99 B E G > + 0 0 133 -5,-0.3 3,-2.3 1,-0.2 -1,-0.1 0.821 56.5 80.1 -72.5 -16.8 10.1 29.9 17.6 62 100 B S G 3 S+ 0 0 37 -6,-0.3 -1,-0.2 1,-0.3 -7,-0.1 0.725 76.4 72.3 -62.1 -25.8 6.4 30.1 18.2 63 101 B A G < S- 0 0 0 -3,-1.2 -11,-1.5 1,-0.2 -1,-0.3 0.670 92.5-153.8 -59.6 -17.4 7.1 32.9 20.7 64 102 B G < - 0 0 25 -3,-2.3 -1,-0.2 -4,-0.2 3,-0.1 -0.472 38.7 -21.9 80.8-155.8 8.0 35.3 17.9 65 103 B G S S- 0 0 29 1,-0.2 -14,-2.7 -2,-0.1 -13,-0.2 -0.200 83.0 -68.4-108.5 179.5 10.3 38.2 18.3 66 104 B H B -G 50 0A 16 -16,-0.3 -16,-0.3 72,-0.2 2,-0.3 -0.462 64.5 -94.3 -64.8 144.8 11.5 40.2 21.5 67 105 B F + 0 0 13 -18,-2.9 18,-2.5 16,-0.1 19,-0.2 -0.492 58.8 165.1 -67.1 121.7 8.6 42.2 23.0 68 106 B N > + 0 0 42 -2,-0.3 3,-1.6 16,-0.2 -1,-0.1 -0.422 14.3 155.7-145.4 58.4 9.2 45.6 21.3 69 107 B P T 3 S+ 0 0 50 0, 0.0 -1,-0.1 0, 0.0 46,-0.1 0.829 81.2 50.7 -61.5 -32.1 6.1 48.0 21.7 70 108 B L T 3 S- 0 0 92 12,-0.1 45,-0.0 45,-0.0 13,-0.0 0.386 108.4-123.2 -88.6 2.7 8.4 51.1 21.2 71 109 B N < + 0 0 140 -3,-1.6 2,-0.2 1,-0.1 12,-0.1 0.908 56.5 148.3 53.8 51.5 10.1 49.8 18.0 72 110 B K - 0 0 98 1,-0.1 9,-0.2 10,-0.1 -1,-0.1 -0.518 47.9-103.8 -99.5 172.8 13.8 50.0 19.2 73 111 B E B -j 81 0C 81 7,-2.2 9,-0.6 -2,-0.2 10,-0.3 -0.353 51.0 -79.9 -83.3 173.1 16.8 47.8 18.3 74 112 B H S S+ 0 0 0 8,-0.2 7,-0.2 7,-0.2 6,-0.1 -0.557 78.8 44.7 -77.4 141.0 18.2 45.2 20.6 75 113 B G > - 0 0 0 -2,-0.3 3,-1.5 63,-0.1 6,-0.3 0.503 62.7-117.7 112.7 129.9 20.5 45.8 23.6 76 114 B F T 3 S+ 0 0 72 1,-0.3 59,-0.1 11,-0.1 -1,-0.1 0.758 118.7 45.3 -57.3 -28.2 21.2 47.9 26.8 77 115 B N T 3 S+ 0 0 111 57,-2.5 -1,-0.3 56,-0.0 58,-0.2 0.338 89.5 96.7-101.1 3.3 24.5 49.0 25.2 78 116 B N X - 0 0 18 -3,-1.5 3,-2.5 56,-0.4 -5,-0.1 -0.839 68.2-147.6 -91.5 117.3 23.2 49.8 21.7 79 117 B P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.793 103.7 53.2 -61.2 -22.7 22.5 53.5 21.5 80 118 B M T 3 S+ 0 0 119 -6,-0.1 -7,-2.2 -8,-0.1 -5,-0.1 0.418 109.5 141.3 -85.0 -2.2 19.6 52.6 19.1 81 119 B G B < +j 73 0C 7 -3,-2.5 -7,-0.2 -6,-0.3 -5,-0.1 -0.139 11.7 53.5 -77.2 177.4 18.3 50.1 21.9 82 120 B H - 0 0 58 -9,-0.6 -8,-0.2 -10,-0.1 -12,-0.1 0.637 31.5-143.7-139.1 166.1 16.5 48.6 23.6 83 121 B H > - 0 0 13 -10,-0.3 3,-2.2 1,-0.1 -15,-0.2 -0.399 28.3-129.0 -64.7 142.5 13.6 46.3 23.5 84 122 B A T 3 S+ 0 0 9 1,-0.3 22,-0.4 -17,-0.1 -16,-0.2 0.836 112.1 55.5 -54.7 -32.7 11.0 46.6 26.3 85 123 B G T 3 S+ 0 0 0 -18,-2.5 -36,-2.6 -36,-0.1 2,-0.5 0.402 79.3 116.8 -83.9 1.5 11.5 42.8 26.6 86 124 B D B < +F 48 0A 8 -3,-2.2 20,-0.2 -19,-0.2 -38,-0.2 -0.623 41.1 176.7 -79.8 125.6 15.3 43.0 27.1 87 125 B L - 0 0 3 -40,-1.4 -40,-0.5 -2,-0.5 -11,-0.1 -0.815 34.9 -90.0-124.0 163.0 16.3 41.7 30.5 88 126 B P - 0 0 48 0, 0.0 -1,-0.1 0, 0.0 -43,-0.1 -0.385 55.0 -88.3 -70.5 154.8 19.7 41.2 32.2 89 127 B N - 0 0 20 43,-0.2 2,-0.4 -43,-0.1 -43,-0.2 -0.265 39.3-117.9 -52.7 142.9 21.5 37.9 31.7 90 128 B L E -I 45 0B 2 -45,-2.5 -45,-2.6 -3,-0.1 2,-0.7 -0.743 21.6-144.9 -80.7 132.4 20.7 35.1 34.3 91 129 B E E -I 44 0B 114 -2,-0.4 -47,-0.2 -47,-0.2 2,-0.2 -0.899 18.9-148.8-108.2 105.3 23.9 34.2 36.3 92 130 B V - 0 0 9 -49,-2.6 -50,-0.7 -2,-0.7 6,-0.2 -0.452 6.1-130.7 -80.1 138.1 23.7 30.4 37.0 93 131 B G > - 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