==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 13-SEP-10 3OTM . 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) . 9645.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 161 78.5 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 . 23 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 13.2 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 0 132 0, 0.0 30,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 147.6 20.7 8.8 14.2 2 10 A N + 0 0 44 1,-0.1 30,-2.5 29,-0.1 2,-0.6 0.516 360.0 67.6 -89.9 -5.8 18.7 7.4 11.3 3 11 A I E S+a 32 0A 60 28,-0.2 2,-0.3 30,-0.0 30,-0.2 -0.974 78.1 162.8-112.9 113.7 21.6 5.1 10.2 4 12 A R E -a 33 0A 132 28,-2.4 30,-2.6 -2,-0.6 2,-0.1 -0.888 39.7-107.5-137.1 157.5 21.9 2.5 13.0 5 13 A E - 0 0 117 -2,-0.3 12,-0.2 28,-0.2 48,-0.0 -0.432 39.3-111.2 -77.3 157.8 23.2 -0.9 14.0 6 14 A N - 0 0 7 10,-1.6 2,-0.1 46,-0.1 -1,-0.1 -0.468 40.2-102.4 -81.8 162.8 21.0 -3.8 14.5 7 15 A P - 0 0 71 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.452 31.3 -96.1 -88.1 163.6 20.5 -5.2 18.0 8 16 A V + 0 0 99 -2,-0.1 6,-0.0 5,-0.1 0, 0.0 -0.614 56.3 156.5 -74.1 128.1 22.0 -8.2 19.8 9 17 A T B > -M 12 0B 30 3,-1.5 3,-1.5 -2,-0.4 45,-0.0 -0.876 59.8 -88.6-141.8 176.4 19.5 -11.1 19.5 10 18 A P T 3 S+ 0 0 79 0, 0.0 72,-0.1 0, 0.0 -2,-0.0 0.747 130.2 40.7 -67.5 -15.6 19.8 -14.9 19.7 11 19 A W T 3 S+ 0 0 66 1,-0.2 66,-0.1 70,-0.1 -3,-0.0 0.310 115.8 53.7-106.5 5.5 20.4 -15.0 16.0 12 20 A N B < +M 9 0B 12 -3,-1.5 -3,-1.5 1,-0.1 -1,-0.2 -0.688 54.5 168.4-143.9 82.4 22.7 -12.0 15.9 13 21 A P S S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -5,-0.1 0.777 73.8 43.5 -64.9 -29.4 25.6 -12.2 18.3 14 22 A E S S- 0 0 143 -7,-0.1 -8,-0.1 -6,-0.0 2,-0.0 -0.975 84.6-127.6-126.4 118.2 27.4 -9.2 16.8 15 23 A P - 0 0 56 0, 0.0 2,-0.4 0, 0.0 -7,-0.1 -0.383 23.8-156.0 -64.3 145.1 25.8 -6.0 15.8 16 24 A S - 0 0 37 -9,-0.1 -10,-1.6 -12,-0.1 18,-0.3 -0.934 2.3-149.6-119.4 145.9 26.4 -4.7 12.2 17 25 A A - 0 0 48 -2,-0.4 -12,-0.2 -12,-0.2 16,-0.1 -0.818 35.1 -89.1-108.3 151.9 26.2 -1.2 10.9 18 26 A P - 0 0 21 0, 0.0 2,-0.6 0, 0.0 19,-0.2 -0.273 27.9-140.7 -60.0 145.2 25.3 -0.3 7.3 19 27 A V E -b 37 0A 94 17,-2.9 19,-2.8 2,-0.0 2,-0.5 -0.959 28.7-178.7-106.1 111.3 28.0 -0.0 4.6 20 28 A I E -b 38 0A 48 -2,-0.6 19,-0.2 17,-0.2 20,-0.1 -0.960 28.0-122.6-124.6 122.8 27.1 2.9 2.5 21 29 A D > - 0 0 56 17,-2.1 3,-2.0 -2,-0.5 21,-0.1 -0.328 26.0-122.5 -59.9 140.1 29.0 4.2 -0.6 22 30 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 17,-0.1 0.708 110.1 58.5 -61.3 -19.2 30.0 7.8 -0.2 23 31 A T T 3 S+ 0 0 59 2,-0.1 2,-0.2 179,-0.0 179,-0.1 0.486 86.2 99.0 -89.6 -2.3 28.2 8.7 -3.4 24 32 A A < - 0 0 3 -3,-2.0 2,-0.5 17,-0.2 19,-0.2 -0.512 65.7-141.5 -80.2 152.0 24.8 7.5 -2.1 25 33 A Y E -n 43 0C 15 17,-2.9 19,-2.6 -2,-0.2 2,-0.6 -0.975 13.8-171.6-115.4 120.5 22.3 9.9 -0.6 26 34 A I E -n 44 0C 25 -2,-0.5 19,-0.1 17,-0.2 17,-0.1 -0.954 25.2-129.1-109.3 114.4 20.2 8.7 2.4 27 35 A D > - 0 0 17 17,-2.1 3,-2.0 -2,-0.6 20,-0.1 -0.344 15.9-123.4 -60.5 144.4 17.4 11.2 3.3 28 36 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 17,-0.1 0.730 112.4 54.5 -61.9 -20.1 17.4 12.2 6.9 29 37 A Q T 3 S+ 0 0 131 2,-0.1 18,-1.9 -27,-0.0 2,-0.2 0.226 92.5 89.1-101.9 15.5 13.8 11.0 7.2 30 38 A A S < S- 0 0 3 -3,-2.0 2,-0.4 16,-0.2 19,-0.2 -0.623 70.2-138.3 -94.9 164.6 14.7 7.5 5.9 31 39 A S E + c 0 49A 32 17,-2.4 19,-2.8 -2,-0.2 2,-0.4 -0.997 19.4 179.3-126.1 129.8 15.7 4.7 8.3 32 40 A V E +ac 3 50A 0 -30,-2.5 -28,-2.4 -2,-0.4 2,-0.4 -0.974 12.6 177.4-132.6 115.7 18.5 2.3 7.5 33 41 A I E -ac 4 51A 15 17,-2.7 19,-2.9 -2,-0.4 -28,-0.2 -0.969 35.8 -25.5-126.1 130.0 19.3 -0.4 10.1 34 42 A G E S+ c 0 52A 0 -30,-2.6 2,-1.8 -2,-0.4 19,-0.2 -0.442 106.7 13.2 91.5-144.0 21.7 -3.2 10.4 35 43 A E S S+ 0 0 65 17,-1.5 23,-2.1 21,-0.2 2,-0.4 -0.549 82.8 137.9 -87.0 82.3 23.5 -5.5 7.9 36 44 A V E - d 0 58A 2 -2,-1.8 -17,-2.9 21,-0.2 2,-0.5 -0.986 38.3-159.5-129.7 136.9 22.8 -3.5 4.8 37 45 A T E -bd 19 59A 49 21,-2.3 23,-2.6 -2,-0.4 2,-0.5 -0.989 10.4-168.8-116.6 125.9 25.1 -2.6 1.8 38 46 A I E -bd 20 60A 3 -19,-2.8 -17,-2.1 -2,-0.5 23,-0.2 -0.972 13.2-143.4-118.0 128.4 24.2 0.3 -0.3 39 47 A G > - 0 0 8 21,-2.3 3,-1.0 -2,-0.5 -18,-0.2 0.078 34.7 -54.8 -82.7-173.2 26.0 0.9 -3.6 40 48 A A T 3 S+ 0 0 17 1,-0.2 23,-3.2 -16,-0.1 24,-0.3 -0.323 112.6 3.1 -67.7 142.2 27.1 3.9 -5.6 41 49 A N T 3 S+ 0 0 53 1,-0.2 2,-0.3 21,-0.2 -1,-0.2 0.721 86.0 156.3 61.6 24.0 24.8 6.8 -6.6 42 50 A V < - 0 0 0 -3,-1.0 -17,-2.9 21,-0.1 2,-0.5 -0.624 32.0-149.4 -83.1 139.0 21.8 5.3 -4.8 43 51 A M E -no 25 65C 5 21,-1.2 23,-2.9 -2,-0.3 2,-0.5 -0.950 9.4-170.2-109.0 122.1 19.0 7.6 -3.7 44 52 A V E -no 26 66C 0 -19,-2.6 -17,-2.1 -2,-0.5 23,-0.2 -0.972 18.9-151.0-113.2 117.4 17.0 6.6 -0.6 45 53 A S > - 0 0 9 21,-2.7 3,-1.6 -2,-0.5 24,-0.2 -0.262 29.5 -66.5 -88.1 169.0 14.0 8.9 -0.2 46 54 A P T 3 S+ 0 0 32 0, 0.0 23,-1.1 0, 0.0 -16,-0.2 -0.210 115.5 15.0 -53.8 140.7 11.9 10.1 2.8 47 55 A M T 3 S+ 0 0 115 -18,-1.9 -17,-0.2 1,-0.3 2,-0.2 0.428 86.3 138.6 74.4 4.2 10.0 7.5 4.8 48 56 A A < - 0 0 2 -3,-1.6 -17,-2.4 21,-0.2 2,-0.4 -0.520 37.9-156.7 -73.1 147.2 11.8 4.5 3.3 49 57 A S E +ce 31 71A 33 21,-2.7 23,-2.4 -19,-0.2 2,-0.6 -0.960 14.5 179.2-129.8 113.5 12.7 1.8 5.8 50 58 A I E +ce 32 72A 1 -19,-2.8 -17,-2.7 -2,-0.4 2,-0.5 -0.966 15.1 176.8-112.7 111.3 15.5 -0.6 5.1 51 59 A R E +c 33 0A 93 21,-2.5 2,-0.6 -2,-0.6 23,-0.3 -0.946 17.9 176.3-131.9 109.6 15.8 -2.9 8.1 52 60 A S E +c 34 0A 5 -19,-2.9 -17,-1.5 -2,-0.5 -46,-0.1 -0.768 36.1 124.5-114.4 83.8 18.2 -5.8 8.3 53 61 A D + 0 0 26 -2,-0.6 -1,-0.1 -19,-0.2 3,-0.1 0.306 56.8 68.4-129.8 13.3 17.7 -7.2 11.8 54 62 A E S S- 0 0 51 1,-0.3 23,-1.9 2,-0.2 24,-0.6 0.142 110.4 -78.9-121.0 24.4 16.9 -10.9 11.2 55 63 A G S S+ 0 0 6 1,-0.2 -1,-0.3 21,-0.2 -2,-0.1 0.174 89.7 50.9 95.4 145.4 20.3 -12.2 9.9 56 64 A M S S- 0 0 27 -3,-0.1 -2,-0.2 -4,-0.1 -1,-0.2 0.322 85.0 -69.5 74.5 154.8 22.0 -12.0 6.5 57 65 A P - 0 0 25 0, 0.0 41,-2.4 0, 0.0 42,-1.3 -0.475 24.5-147.0 -85.6 145.2 22.6 -8.9 4.3 58 66 A I E -df 36 99A 0 -23,-2.1 -21,-2.3 40,-0.2 2,-0.4 -0.962 26.8-163.2-100.0 124.2 20.2 -6.7 2.4 59 67 A F E -df 37 100A 44 40,-2.5 42,-2.5 -2,-0.5 2,-0.5 -0.945 14.6-170.4-116.2 132.2 22.1 -5.5 -0.6 60 68 A V E -df 38 101A 0 -23,-2.6 -21,-2.3 -2,-0.4 42,-0.2 -0.982 24.3-137.8-123.5 115.9 21.1 -2.6 -2.9 61 69 A G > - 0 0 0 40,-2.0 3,-1.3 41,-0.7 -22,-0.2 0.025 32.9 -64.5 -72.3 175.2 23.2 -2.3 -6.0 62 70 A D T 3 S+ 0 0 59 1,-0.2 42,-2.4 -24,-0.1 43,-0.2 -0.291 114.0 7.3 -62.8 139.5 24.7 0.6 -7.8 63 71 A R T 3 S+ 0 0 94 -23,-3.2 -1,-0.2 1,-0.2 2,-0.2 0.676 94.8 134.3 64.1 21.2 22.5 3.3 -9.3 64 72 A S < - 0 0 2 -3,-1.3 -21,-1.2 -24,-0.3 2,-0.4 -0.481 43.7-142.1 -89.7 166.0 19.4 1.9 -7.8 65 73 A N E -op 43 106C 1 40,-2.5 42,-2.2 -23,-0.2 2,-0.5 -0.992 11.7-160.6-136.8 144.0 16.8 3.9 -6.0 66 74 A V E -op 44 107C 0 -23,-2.9 -21,-2.7 -2,-0.4 -18,-0.2 -0.948 28.7-156.1-123.7 100.7 14.6 3.3 -3.0 67 75 A Q > - 0 0 12 40,-2.6 3,-1.9 -2,-0.5 43,-0.1 -0.010 33.5 -50.6 -85.9-176.5 11.7 5.7 -3.1 68 76 A D T 3 S+ 0 0 59 1,-0.3 42,-2.2 41,-0.1 -21,-0.2 -0.211 119.9 1.4 -62.8 132.2 9.3 7.2 -0.5 69 77 A G T 3 S+ 0 0 28 -23,-1.1 -1,-0.3 1,-0.2 -21,-0.2 0.573 88.1 149.6 74.0 8.4 7.7 4.8 1.9 70 78 A V < - 0 0 0 -3,-1.9 -21,-2.7 37,-0.1 2,-0.4 -0.504 31.7-153.0 -73.7 141.9 9.4 1.7 0.5 71 79 A V E -eg 49 112A 51 40,-1.5 42,-1.8 -23,-0.2 2,-0.4 -0.980 14.2-176.8-118.0 131.5 10.1 -1.1 2.9 72 80 A L E +eg 50 113A 1 -23,-2.4 -21,-2.5 -2,-0.4 2,-0.3 -0.999 25.8 137.0-120.3 125.8 12.9 -3.7 2.7 73 81 A H E - g 0 114A 18 40,-1.0 42,-2.9 -2,-0.4 2,-0.3 -0.930 31.4-145.3-156.1 170.8 12.9 -6.4 5.4 74 82 A A E - g 0 115A 7 -23,-0.3 -21,-0.2 -2,-0.3 3,-0.1 -0.993 19.2-106.3-148.7 152.0 13.5 -10.2 5.5 75 83 A L - 0 0 54 40,-1.0 -21,-0.1 -2,-0.3 40,-0.0 -0.352 63.8 -71.3 -67.4 159.9 12.4 -13.4 7.2 76 84 A E - 0 0 52 1,-0.1 -21,-0.2 -2,-0.1 -1,-0.2 -0.230 43.9-175.6 -59.8 134.4 14.9 -15.0 9.6 77 85 A T S S+ 0 0 0 -23,-1.9 8,-2.3 1,-0.3 2,-0.4 0.535 73.2 41.5-108.4 -14.0 17.9 -16.5 7.9 78 86 A I B S-T 84 0D 43 -24,-0.6 -1,-0.3 6,-0.3 5,-0.0 -0.991 78.0-143.9-135.3 123.8 19.6 -18.0 10.9 79 87 A N > - 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