==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 17-SEP-10 3OW5 . COMPND 2 MOLECULE: CARBONIC ANHYDRASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOSARCINA THERMOPHILA; . AUTHOR J.F.DOMSIC,A.H.ROBBINS,R.MCKENNA . 205 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9543.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 157 76.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 67 32.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 4.9 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 . 20 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 9.3 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 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 11 4 2 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 . 3 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 1 0 0 0 0 0 1 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 9 A S 0 0 130 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 144.9 35.1 71.4 42.1 2 10 A N + 0 0 46 1,-0.1 30,-2.6 29,-0.1 2,-0.6 0.593 360.0 63.5 -88.5 -11.8 32.0 70.1 43.9 3 11 A I E S+a 32 0A 63 28,-0.2 2,-0.3 30,-0.0 30,-0.2 -0.972 79.0 162.4-110.0 117.7 30.9 67.8 41.0 4 12 A R E -a 33 0A 132 28,-2.3 30,-2.4 -2,-0.6 2,-0.1 -0.883 40.1-108.3-140.2 157.7 33.7 65.3 40.7 5 13 A E - 0 0 120 -2,-0.3 12,-0.2 28,-0.2 48,-0.0 -0.476 40.3-110.7 -76.7 157.1 34.7 61.9 39.2 6 14 A N - 0 0 5 10,-1.7 2,-0.1 -2,-0.1 -1,-0.1 -0.427 41.3-100.7 -80.9 166.9 35.2 58.9 41.5 7 15 A P - 0 0 72 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.456 31.7 -96.3 -89.7 163.8 38.8 57.6 42.0 8 16 A V + 0 0 97 -2,-0.1 6,-0.0 5,-0.1 3,-0.0 -0.601 56.0 157.2 -70.3 129.5 40.5 54.6 40.4 9 17 A T B > -M 12 0B 32 3,-1.6 3,-1.3 -2,-0.4 45,-0.0 -0.878 59.2 -87.0-143.6 175.5 40.4 51.6 42.8 10 18 A P T 3 S+ 0 0 79 0, 0.0 72,-0.1 0, 0.0 69,-0.0 0.842 130.7 39.3 -60.1 -29.4 40.6 47.8 42.5 11 19 A W T 3 S+ 0 0 64 1,-0.2 -3,-0.0 67,-0.1 66,-0.0 0.413 117.1 53.4 -95.0 -0.3 36.8 47.6 41.7 12 20 A N B < +M 9 0B 16 -3,-1.3 -3,-1.6 1,-0.1 -1,-0.2 -0.685 54.6 168.1-140.0 81.7 36.8 50.8 39.6 13 21 A P S S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -5,-0.1 0.736 74.0 42.2 -65.6 -27.1 39.3 50.7 36.7 14 22 A E S S- 0 0 142 -7,-0.1 -8,-0.1 -6,-0.0 2,-0.0 -0.985 86.0-125.0-127.5 122.1 37.8 53.8 35.0 15 23 A P - 0 0 51 0, 0.0 2,-0.4 0, 0.0 -7,-0.1 -0.380 23.0-151.4 -65.7 149.2 36.5 56.9 36.7 16 24 A S - 0 0 37 -9,-0.1 -10,-1.7 -12,-0.1 18,-0.3 -0.911 2.1-148.9-115.7 145.9 32.9 57.9 36.1 17 25 A A - 0 0 53 -2,-0.4 -12,-0.2 -12,-0.2 19,-0.1 -0.839 32.7 -91.7-111.1 152.7 31.6 61.5 36.2 18 26 A P - 0 0 20 0, 0.0 2,-0.6 0, 0.0 19,-0.2 -0.293 27.8-141.3 -62.5 145.2 28.0 62.4 37.3 19 27 A V E -b 37 0A 94 17,-2.9 19,-2.7 2,-0.0 2,-0.5 -0.964 28.1-178.6-107.6 114.4 25.3 62.7 34.6 20 28 A I E -b 38 0A 47 -2,-0.6 19,-0.2 17,-0.2 20,-0.1 -0.963 28.0-122.0-125.0 123.6 23.2 65.7 35.5 21 29 A D > - 0 0 53 17,-2.2 3,-1.8 -2,-0.5 21,-0.1 -0.344 26.1-122.1 -58.8 141.1 20.2 66.9 33.6 22 30 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 17,-0.1 0.704 110.7 56.8 -60.8 -20.0 20.6 70.6 32.6 23 31 A T T 3 S+ 0 0 54 2,-0.1 2,-0.2 0, 0.0 179,-0.1 0.499 85.9 100.5 -90.0 -3.7 17.4 71.6 34.5 24 32 A A < - 0 0 2 -3,-1.8 2,-0.5 17,-0.2 19,-0.2 -0.501 66.1-142.0 -75.1 149.8 18.7 70.2 37.8 25 33 A Y E -n 43 0C 14 17,-2.9 19,-2.6 -2,-0.2 2,-0.6 -0.970 14.5-171.5-113.9 120.6 20.1 72.6 40.4 26 34 A I E -n 44 0C 25 -2,-0.5 19,-0.1 17,-0.2 17,-0.1 -0.945 25.2-128.2-110.1 115.2 23.2 71.5 42.3 27 35 A D > - 0 0 16 17,-2.3 3,-2.1 -2,-0.6 20,-0.1 -0.281 15.2-124.7 -62.2 143.3 24.1 73.9 45.2 28 36 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.2 0, 0.0 17,-0.1 0.751 112.2 54.9 -62.3 -21.0 27.7 74.9 45.1 29 37 A Q T 3 S+ 0 0 125 2,-0.1 18,-2.0 -27,-0.0 2,-0.2 0.234 92.4 88.1 -97.1 13.6 27.9 73.7 48.7 30 38 A A S < S- 0 0 4 -3,-2.1 2,-0.4 16,-0.2 19,-0.2 -0.634 70.9-138.4 -93.9 166.2 26.7 70.2 47.9 31 39 A S E - c 0 49A 28 17,-2.3 19,-2.7 -2,-0.2 2,-0.4 -0.998 19.1-179.9-125.5 131.1 29.0 67.4 46.8 32 40 A V E +ac 3 50A 0 -30,-2.6 -28,-2.3 -2,-0.4 2,-0.4 -0.968 12.8 177.2-131.3 118.0 28.2 65.0 44.0 33 41 A I E -ac 4 51A 14 17,-2.7 19,-2.8 -2,-0.4 -28,-0.2 -0.973 36.7 -22.3-128.3 129.8 30.9 62.4 43.3 34 42 A G E S+ c 0 52A 0 -30,-2.4 2,-1.7 -2,-0.4 19,-0.2 -0.420 107.3 9.8 92.1-149.4 31.1 59.4 40.8 35 43 A E S S+ 0 0 67 17,-1.4 23,-1.8 21,-0.2 2,-0.4 -0.573 82.4 139.0 -84.3 87.7 28.6 57.3 39.0 36 44 A V E - d 0 58A 2 -2,-1.7 -17,-2.9 21,-0.2 2,-0.5 -0.987 38.0-158.5-132.5 136.2 25.5 59.3 39.7 37 45 A T E -bd 19 59A 48 21,-2.5 23,-2.3 -2,-0.4 2,-0.5 -0.990 10.1-169.2-115.6 127.5 22.6 60.1 37.5 38 46 A I E -bd 20 60A 3 -19,-2.7 -17,-2.2 -2,-0.5 23,-0.2 -0.974 13.4-144.0-120.1 127.6 20.4 63.1 38.4 39 47 A G > - 0 0 8 21,-2.3 3,-1.0 -2,-0.5 -18,-0.1 0.009 35.2 -54.2 -84.0-174.6 17.1 63.7 36.6 40 48 A A T 3 S+ 0 0 17 1,-0.2 23,-3.3 -16,-0.1 24,-0.3 -0.283 113.2 2.2 -65.6 142.4 15.2 66.7 35.5 41 49 A N T 3 S+ 0 0 47 1,-0.2 2,-0.3 21,-0.2 -1,-0.2 0.749 85.7 156.7 59.5 24.8 14.2 69.6 37.9 42 50 A V < - 0 0 0 -3,-1.0 -17,-2.9 21,-0.1 2,-0.5 -0.655 32.5-148.0 -80.3 141.7 16.0 68.0 40.8 43 51 A M E -no 25 65C 9 21,-1.2 23,-3.0 -2,-0.3 2,-0.5 -0.957 11.0-171.0-109.1 123.0 17.0 70.3 43.7 44 52 A V E -no 26 66C 0 -19,-2.6 -17,-2.3 -2,-0.5 23,-0.2 -0.976 19.4-151.2-114.6 115.7 20.2 69.4 45.6 45 53 A S > - 0 0 5 21,-2.8 3,-1.6 -2,-0.5 24,-0.2 -0.275 28.9 -65.4 -87.4 169.1 20.6 71.6 48.6 46 54 A P T 3 S+ 0 0 33 0, 0.0 23,-1.0 0, 0.0 -16,-0.2 -0.217 115.8 12.2 -52.2 141.0 23.6 72.9 50.6 47 55 A M T 3 S+ 0 0 117 -18,-2.0 -17,-0.2 1,-0.3 2,-0.1 0.376 87.6 138.8 72.5 1.3 25.7 70.3 52.5 48 56 A A < - 0 0 2 -3,-1.6 -17,-2.3 21,-0.2 2,-0.5 -0.476 38.6-154.9 -69.2 147.7 24.1 67.2 50.8 49 57 A S E +ce 31 71A 33 21,-3.0 23,-2.5 -19,-0.2 2,-0.6 -0.960 16.2 179.0-129.9 116.9 26.6 64.5 49.9 50 58 A I E +ce 32 72A 0 -19,-2.7 -17,-2.7 -2,-0.5 2,-0.5 -0.968 14.5 175.5-114.7 114.7 25.9 62.1 47.0 51 59 A R E +c 33 0A 94 21,-2.6 2,-0.6 -2,-0.6 23,-0.3 -0.965 17.0 176.3-132.9 115.1 28.9 59.8 46.7 52 60 A S E +c 34 0A 4 -19,-2.8 -17,-1.4 -2,-0.5 -46,-0.1 -0.828 36.3 123.2-119.8 86.4 29.0 56.8 44.3 53 61 A D + 0 0 25 -2,-0.6 -1,-0.1 21,-0.2 3,-0.1 0.273 56.9 70.5-130.0 7.7 32.5 55.4 44.6 54 62 A E S S- 0 0 56 1,-0.3 23,-2.2 2,-0.2 24,-0.7 0.214 111.3 -73.9-113.8 20.0 31.9 51.7 45.6 55 63 A G S S+ 0 0 9 1,-0.2 -1,-0.3 21,-0.2 -2,-0.1 0.131 90.0 37.1 105.4 139.7 30.5 50.5 42.3 56 64 A M S S- 0 0 38 -4,-0.1 -1,-0.2 -3,-0.1 -2,-0.2 0.270 85.6 -58.2 69.3 161.6 27.3 50.8 40.3 57 65 A P - 0 0 23 0, 0.0 41,-2.8 0, 0.0 42,-1.5 -0.330 23.5-149.0 -87.9 155.5 25.1 53.8 40.0 58 66 A I E -df 36 99A 0 -23,-1.8 -21,-2.5 40,-0.2 2,-0.4 -0.991 27.3-163.5-109.8 124.8 23.1 56.0 42.3 59 67 A F E -df 37 100A 43 40,-2.5 42,-2.4 -2,-0.5 2,-0.5 -0.928 13.2-170.3-114.7 133.7 20.1 57.2 40.4 60 68 A V E -df 38 101A 0 -23,-2.3 -21,-2.3 -2,-0.4 42,-0.2 -0.986 24.2-138.7-126.3 114.2 17.8 60.2 41.5 61 69 A G > - 0 0 0 40,-1.9 3,-1.2 41,-0.8 -22,-0.3 -0.014 33.4 -63.6 -75.1 178.7 14.7 60.4 39.4 62 70 A D T 3 S+ 0 0 60 1,-0.2 42,-2.4 41,-0.1 43,-0.2 -0.289 114.0 7.8 -64.9 142.3 12.9 63.5 37.9 63 71 A R T 3 S+ 0 0 92 -23,-3.3 -1,-0.2 1,-0.2 2,-0.2 0.672 93.8 135.6 62.7 24.1 11.4 66.2 40.2 64 72 A S < - 0 0 2 -3,-1.2 -21,-1.2 -24,-0.3 2,-0.4 -0.505 43.2-144.1 -91.5 167.0 13.0 64.7 43.3 65 73 A N E -op 43 106C 1 40,-2.3 42,-2.3 -23,-0.2 2,-0.5 -0.991 10.6-161.3-137.3 144.8 14.7 66.8 45.9 66 74 A V E -op 44 107C 0 -23,-3.0 -21,-2.8 -2,-0.4 -18,-0.2 -0.956 28.6-153.2-126.4 103.5 17.8 66.0 48.1 67 75 A Q > - 0 0 12 40,-2.5 3,-2.0 -2,-0.5 43,-0.2 -0.018 32.6 -51.0 -89.4-175.9 17.7 68.4 51.0 68 76 A D T 3 S+ 0 0 61 1,-0.3 42,-2.1 41,-0.1 -21,-0.2 -0.209 120.7 1.1 -61.4 133.7 20.4 70.0 53.3 69 77 A G T 3 S+ 0 0 28 -23,-1.0 -1,-0.3 1,-0.2 -21,-0.2 0.569 88.4 150.0 76.6 4.4 22.8 67.5 54.9 70 78 A V < - 0 0 0 -3,-2.0 -21,-3.0 37,-0.1 2,-0.4 -0.506 32.1-152.0 -71.1 141.2 21.3 64.4 53.2 71 79 A V E -eg 49 112A 52 40,-1.5 42,-1.8 -23,-0.2 2,-0.4 -0.982 15.2-177.8-117.3 132.3 23.7 61.6 52.5 72 80 A L E +eg 50 113A 0 -23,-2.5 -21,-2.6 -2,-0.4 2,-0.3 -0.998 25.6 136.3-120.9 123.5 23.5 59.0 49.7 73 81 A H E - g 0 114A 16 40,-1.1 42,-2.8 -2,-0.4 2,-0.3 -0.923 32.3-143.9-151.0 175.8 26.2 56.4 49.6 74 82 A A E - g 0 115A 8 -23,-0.3 -21,-0.2 -2,-0.3 3,-0.1 -0.997 18.9-104.5-149.9 153.1 26.3 52.6 49.0 75 83 A L - 0 0 55 40,-1.1 -21,-0.1 -2,-0.3 40,-0.0 -0.312 62.7 -73.2 -65.0 159.2 28.0 49.3 50.1 76 84 A E - 0 0 50 1,-0.1 -21,-0.2 -23,-0.0 -1,-0.2 -0.260 45.3-177.5 -60.2 133.6 30.5 47.8 47.7 77 85 A T S S+ 0 0 0 -23,-2.2 8,-1.9 1,-0.3 2,-0.4 0.453 72.1 43.2-111.9 -7.6 28.7 46.2 44.7 78 86 A I B S-T 84 0D 31 -24,-0.7 -1,-0.3 6,-0.3 -67,-0.1 -0.970 78.8-144.2-138.7 118.0 31.8 44.8 42.9 79 87 A N > - 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