==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 28-MAY-04 1TG9 . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Z.FISHER,J.A.HERNANDEZ PRADA,C.K.TU,D.DUDA,C.YOSHIOKA,H.AN, . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12105.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 164 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 21.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 25 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 6.2 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 1 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 RESIDUES PER ALPHA HELIX . 1 2 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 PARALLEL BRIDGES PER LADDER . 2 3 1 1 1 1 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 1 0 0 0 0 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 3 A H 0 0 186 0, 0.0 2,-0.3 0, 0.0 8,-0.0 0.000 360.0 360.0 360.0 136.3 13.1 -0.7 6.7 2 4 A H - 0 0 135 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.972 360.0 -57.4-166.9 170.9 10.2 -0.0 9.0 3 5 A W + 0 0 75 -2,-0.3 2,-0.2 11,-0.1 7,-0.2 -0.163 62.1 131.6 -60.6 150.8 7.8 -1.6 11.5 4 6 A G - 0 0 13 5,-2.8 10,-0.1 2,-0.1 58,-0.1 -0.806 64.8 -84.7-167.5-153.2 5.6 -4.5 10.5 5 7 A Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.183 82.3 110.4-122.9 16.7 4.5 -8.0 11.6 6 8 A G S > S- 0 0 27 4,-0.1 4,-1.1 1,-0.1 -2,-0.1 -0.191 85.3 -94.0 -83.7-179.9 7.4 -10.1 10.3 7 9 A K T 4 S+ 0 0 177 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.753 124.0 36.9 -67.0 -24.2 10.2 -11.9 12.2 8 10 A H T 4 S+ 0 0 143 1,-0.1 -1,-0.2 4,-0.0 -5,-0.0 0.609 130.3 26.6-105.1 -14.1 12.6 -8.9 11.8 9 11 A N T 4 S+ 0 0 48 -3,-0.1 -5,-2.8 -6,-0.1 -2,-0.2 0.154 93.7 127.5-132.4 16.8 10.2 -5.9 12.1 10 12 A G S >X S- 0 0 0 -4,-1.1 3,-2.9 -5,-0.2 4,-0.9 0.024 79.7 -77.8 -71.1 178.3 7.5 -7.4 14.2 11 13 A P T 34 S+ 0 0 23 0, 0.0 4,-0.5 0, 0.0 3,-0.4 0.775 127.0 63.1 -45.4 -36.6 5.9 -6.3 17.6 12 14 A E T 34 S+ 0 0 107 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.669 107.3 44.3 -66.7 -15.8 8.9 -7.6 19.5 13 15 A H T X4 S+ 0 0 54 -3,-2.9 3,-1.9 1,-0.1 4,-0.5 0.633 87.1 89.4-101.4 -20.2 11.1 -5.0 17.6 14 16 A W G >X S+ 0 0 4 -4,-0.9 4,-2.5 -3,-0.4 3,-1.1 0.782 72.4 71.2 -50.2 -36.1 8.8 -1.9 17.8 15 17 A H G 34 S+ 0 0 67 -4,-0.5 -1,-0.3 1,-0.3 7,-0.1 0.754 88.5 65.0 -56.7 -25.1 10.2 -0.7 21.2 16 18 A K G <4 S+ 0 0 131 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.875 116.3 25.8 -67.5 -37.1 13.5 0.3 19.4 17 19 A D T <4 S+ 0 0 102 -3,-1.1 -2,-0.2 -4,-0.5 -1,-0.2 0.682 134.8 36.5 -97.0 -21.2 11.7 3.0 17.3 18 20 A F >< - 0 0 55 -4,-2.5 3,-2.5 1,-0.1 -1,-0.2 -0.751 64.5-175.4-135.1 84.9 8.9 3.6 19.7 19 21 A P G > S+ 0 0 101 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 0.744 78.9 74.5 -50.3 -29.6 10.0 3.4 23.4 20 22 A I G > S+ 0 0 57 1,-0.3 3,-2.7 2,-0.2 -5,-0.1 0.643 71.1 88.7 -63.6 -10.1 6.5 3.8 24.6 21 23 A A G < S+ 0 0 7 -3,-2.5 -1,-0.3 1,-0.3 -6,-0.1 0.771 89.8 47.5 -57.8 -25.2 5.9 0.2 23.5 22 24 A K G < S+ 0 0 143 -3,-2.0 -1,-0.3 -4,-0.1 -2,-0.2 0.027 95.3 135.4-103.4 25.3 7.1 -0.7 27.0 23 25 A G < - 0 0 19 -3,-2.7 3,-0.4 1,-0.1 -3,-0.0 0.129 68.6-105.8 -67.6-177.6 4.8 1.9 28.5 24 26 A E S S+ 0 0 110 1,-0.2 226,-0.2 225,-0.1 -1,-0.1 0.635 112.4 35.3 -85.9 -19.4 2.4 1.8 31.5 25 27 A R S S+ 0 0 47 168,-0.1 -1,-0.2 224,-0.1 2,-0.2 -0.339 80.7 154.5-133.9 57.1 -0.9 1.6 29.6 26 28 A Q - 0 0 5 -3,-0.4 220,-0.2 221,-0.3 170,-0.1 -0.513 32.6-101.2 -86.0 151.8 -0.2 -0.4 26.5 27 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.891 76.2 40.2-128.0 158.7 -2.7 -2.5 24.5 28 30 A P + 0 0 0 0, 0.0 218,-3.1 0, 0.0 2,-0.3 0.566 64.3 174.8 -80.8-177.1 -4.0 -5.0 23.9 29 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.5 -0.924 36.7 -98.9-143.1 165.2 -4.4 -7.0 27.1 30 32 A D E -a 106 0A 39 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.775 34.5-137.2 -89.4 131.4 -6.0 -10.2 28.2 31 33 A I E -a 107 0A 0 75,-3.6 77,-2.6 -2,-0.5 2,-1.1 -0.804 10.6-157.9 -93.4 108.5 -9.4 -9.7 29.8 32 34 A D >> - 0 0 65 -2,-0.8 3,-1.8 75,-0.2 4,-1.5 -0.761 4.0-160.2 -86.2 101.5 -9.7 -11.9 32.9 33 35 A T T 34 S+ 0 0 47 -2,-1.1 -1,-0.2 1,-0.3 222,-0.0 0.695 87.8 52.1 -56.2 -23.6 -13.5 -12.1 33.2 34 36 A H T 34 S+ 0 0 167 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.0 0.585 112.5 44.0 -91.5 -10.4 -13.3 -13.1 36.9 35 37 A T T <4 S+ 0 0 101 -3,-1.8 2,-0.2 2,-0.1 -2,-0.2 0.578 87.7 101.7-106.2 -15.8 -11.1 -10.2 37.8 36 38 A A S < S- 0 0 21 -4,-1.5 2,-0.5 216,-0.1 218,-0.2 -0.507 72.4-129.2 -70.0 135.4 -12.9 -7.5 35.9 37 39 A K E -c 254 0B 133 216,-2.1 218,-2.4 -2,-0.2 2,-0.4 -0.759 8.1-126.2 -97.0 131.8 -15.1 -5.4 38.3 38 40 A Y E -c 255 0B 91 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.560 24.6-161.2 -69.6 124.5 -18.7 -4.7 37.7 39 41 A D > - 0 0 36 216,-2.3 3,-2.3 -2,-0.4 -1,-0.1 -0.878 11.7-167.9-115.2 100.4 -19.2 -1.0 37.9 40 42 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.720 86.1 65.8 -55.9 -23.1 -22.8 0.0 38.5 41 43 A S T 3 S+ 0 0 98 -3,-0.1 2,-0.3 2,-0.1 215,-0.1 0.567 74.1 111.6 -79.1 -8.1 -21.9 3.6 37.7 42 44 A L < - 0 0 29 -3,-2.3 3,-0.1 213,-0.2 38,-0.0 -0.530 63.7-139.6 -71.0 127.1 -21.1 2.8 34.0 43 45 A K - 0 0 140 37,-0.9 39,-0.1 -2,-0.3 3,-0.1 -0.417 27.1 -92.5 -82.7 157.2 -23.7 4.3 31.7 44 46 A P - 0 0 103 0, 0.0 36,-1.7 0, 0.0 2,-0.2 -0.372 47.0-102.3 -68.3 154.0 -25.0 2.5 28.7 45 47 A L E -D 79 0B 17 34,-0.2 2,-0.5 141,-0.2 34,-0.2 -0.492 29.1-151.5 -74.5 146.6 -23.2 3.0 25.4 46 48 A S E -D 78 0B 55 32,-2.7 32,-2.4 -2,-0.2 2,-0.6 -0.937 13.7-176.3-124.0 106.8 -24.8 5.4 22.9 47 49 A V E -D 77 0B 37 -2,-0.5 2,-0.6 30,-0.2 30,-0.2 -0.912 5.3-178.7-107.4 116.1 -24.0 4.6 19.3 48 50 A S E +D 76 0B 41 28,-2.9 28,-1.9 -2,-0.6 3,-0.2 -0.802 24.8 142.6-115.5 88.4 -25.4 7.1 16.7 49 51 A Y > + 0 0 3 -2,-0.6 3,-1.3 26,-0.2 130,-0.2 0.200 35.5 107.7-109.7 14.6 -24.4 5.8 13.3 50 52 A D T 3 S+ 0 0 96 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.750 86.5 40.0 -64.8 -23.7 -27.6 6.7 11.4 51 53 A Q T 3 S+ 0 0 129 23,-0.9 -1,-0.3 -3,-0.2 24,-0.2 0.169 83.0 146.5-110.7 17.4 -25.9 9.6 9.5 52 54 A A < - 0 0 26 -3,-1.3 2,-0.5 22,-0.2 18,-0.1 -0.223 31.9-160.3 -57.7 139.1 -22.6 7.9 8.9 53 55 A T - 0 0 49 16,-0.3 16,-2.6 122,-0.1 2,-0.1 -0.869 3.6-162.2-125.8 97.2 -20.9 8.9 5.6 54 56 A S E +E 68 0B 1 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.492 11.8 175.9 -75.4 150.2 -18.2 6.4 4.5 55 57 A L E - 0 0 79 12,-3.1 118,-2.2 1,-0.4 2,-0.3 0.720 50.1 -11.8-121.0 -49.8 -15.8 7.8 1.9 56 58 A R E -EF 67 172B 86 11,-0.9 11,-3.4 116,-0.3 2,-0.4 -0.979 43.3-139.1-155.9 163.4 -13.0 5.4 1.0 57 59 A I E +EF 66 171B 0 114,-2.2 114,-2.3 -2,-0.3 2,-0.4 -0.988 27.7 178.5-127.4 136.2 -11.2 2.2 1.7 58 60 A L E -EF 65 170B 30 7,-2.1 7,-2.3 -2,-0.4 2,-0.8 -0.998 31.1-134.3-144.6 148.1 -7.5 1.9 1.5 59 61 A N E +E 64 0B 0 110,-2.8 109,-3.0 -2,-0.4 5,-0.2 -0.880 24.5 176.3 -97.4 110.7 -4.8 -0.7 2.0 60 62 A H - 0 0 77 3,-1.8 4,-0.1 -2,-0.8 -1,-0.1 0.288 54.9 -98.9-100.6 10.8 -2.0 1.1 4.0 61 63 A G S S+ 0 0 13 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.090 116.1 57.0 100.9 -26.3 0.2 -1.9 4.4 62 64 A H S S- 0 0 10 1,-0.4 2,-0.3 -58,-0.1 166,-0.1 0.514 125.5 -39.0-111.6 -14.2 -0.7 -3.0 8.0 63 65 A A S S- 0 0 3 165,-0.1 -3,-1.8 31,-0.1 -2,-0.5 -0.935 70.7 -83.3 175.7-170.2 -4.4 -3.4 7.4 64 66 A F E -E 59 0B 0 -2,-0.3 29,-0.5 -5,-0.2 2,-0.4 -0.980 34.9-151.5-124.4 136.5 -7.2 -1.7 5.4 65 67 A N E -E 58 0B 22 -7,-2.3 -7,-2.1 -2,-0.4 2,-0.7 -0.887 9.0-151.1-109.5 140.1 -9.1 1.3 6.7 66 68 A V E -EG 57 91B 0 25,-2.3 25,-1.2 -2,-0.4 2,-0.3 -0.938 28.5-151.9-103.0 111.7 -12.7 2.3 5.9 67 69 A E E -EG 56 90B 50 -11,-3.4 -12,-3.1 -2,-0.7 -11,-0.9 -0.660 10.3-161.7 -94.6 144.9 -12.6 6.1 6.2 68 70 A F E -E 54 0B 7 21,-2.7 2,-0.6 -2,-0.3 -14,-0.2 -0.857 31.0-101.1-120.6 157.4 -15.6 8.3 7.2 69 71 A D + 0 0 38 -16,-2.6 -16,-0.3 -2,-0.3 5,-0.3 -0.660 39.7 175.0 -75.9 116.2 -16.3 12.0 6.8 70 72 A D + 0 0 43 -2,-0.6 -1,-0.1 1,-0.1 17,-0.1 -0.001 44.8 108.9-114.8 29.7 -15.6 13.4 10.3 71 73 A S S S+ 0 0 76 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.578 89.1 20.1 -79.5 -10.4 -16.1 17.1 9.6 72 74 A Q S S- 0 0 117 -3,-0.2 2,-2.1 3,-0.0 3,-0.4 -0.912 98.8 -83.6-147.3 172.7 -19.4 17.0 11.6 73 75 A D S S+ 0 0 88 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.447 76.0 129.5 -81.4 67.4 -21.1 14.9 14.2 74 76 A K S S+ 0 0 54 -2,-2.1 -23,-0.9 1,-0.3 2,-0.5 0.893 76.3 21.4 -86.0 -47.4 -22.6 12.5 11.7 75 77 A A S S+ 0 0 7 -3,-0.4 13,-2.7 -6,-0.2 2,-0.3 -0.950 85.3 165.9-125.6 108.8 -21.5 9.2 13.3 76 78 A V E -DH 48 87B 8 -28,-1.9 -28,-2.9 -2,-0.5 2,-0.4 -0.889 30.7-148.5-130.2 159.3 -20.8 9.5 17.0 77 79 A L E +DH 47 86B 0 9,-2.6 9,-2.0 -2,-0.3 2,-0.3 -0.973 29.0 158.8-121.9 133.8 -20.2 7.4 20.2 78 80 A K E +D 46 0B 87 -32,-2.4 -32,-2.7 -2,-0.4 7,-0.1 -0.869 35.3 34.2-144.0 176.1 -21.2 8.8 23.6 79 81 A G E > S+D 45 0B 14 5,-0.3 3,-2.2 -2,-0.3 -34,-0.2 -0.313 70.6 86.0 75.3-156.5 -22.1 7.5 27.0 80 82 A G T 3 S- 0 0 9 -36,-1.7 -37,-0.9 1,-0.3 -1,-0.1 -0.366 119.6 -25.6 58.5-136.0 -20.5 4.5 28.7 81 83 A P T 3 S+ 0 0 41 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.405 115.4 112.7 -87.6 2.6 -17.3 5.6 30.5 82 84 A L < - 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