==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE(OXO-ACID) 20-OCT-93 1CIM . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.M.SMITH,R.S.ALEXANDER,D.W.CHRISTIANSON,B.M.MCKEEVER, . 256 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11876.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 169 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 21.9 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 14.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 6.6 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 2 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 . 0 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 4 A H 0 0 206 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 164.6 9.9 0.3 9.0 2 5 A W + 0 0 60 1,-0.1 2,-0.2 11,-0.1 7,-0.2 -0.167 360.0 137.9 -60.9 151.6 7.6 -1.6 11.3 3 6 A G - 0 0 10 5,-2.5 10,-0.1 2,-0.2 -1,-0.1 -0.740 61.1 -89.4-159.8-145.4 5.5 -4.5 10.3 4 7 A Y S S+ 0 0 32 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.182 81.9 106.2-132.0 14.0 4.5 -7.8 11.7 5 8 A G S > S- 0 0 33 4,-0.1 4,-1.4 1,-0.1 -2,-0.2 -0.279 87.1 -88.5 -85.8-175.7 7.3 -10.1 10.3 6 9 A K T 4 S+ 0 0 177 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.848 124.1 39.7 -60.2 -37.2 10.2 -11.7 12.2 7 10 A H T 4 S+ 0 0 165 1,-0.2 -1,-0.2 4,-0.0 -5,-0.0 0.747 130.3 21.8 -91.6 -20.6 12.5 -8.7 11.6 8 11 A N T 4 S+ 0 0 62 -3,-0.1 -5,-2.5 -6,-0.1 -2,-0.2 0.205 95.2 124.1-131.1 14.5 10.2 -5.7 12.0 9 12 A G S >X S- 0 0 0 -4,-1.4 3,-2.7 -7,-0.2 4,-0.6 0.040 78.7 -71.2 -77.5-174.0 7.4 -7.2 14.2 10 13 A P G >4 S+ 0 0 20 0, 0.0 3,-1.4 0, 0.0 4,-0.4 0.820 126.5 58.9 -52.2 -41.1 5.9 -6.2 17.6 11 14 A E G 34 S+ 0 0 115 1,-0.3 3,-0.1 2,-0.1 -5,-0.0 0.650 108.1 46.9 -65.8 -12.2 8.8 -7.3 19.6 12 15 A H G X> S+ 0 0 50 -3,-2.7 3,-1.3 1,-0.1 4,-0.5 0.557 85.9 90.6-102.0 -10.1 11.1 -4.9 17.7 13 16 A W H XX S+ 0 0 6 -3,-1.4 4,-2.7 -4,-0.6 3,-1.1 0.805 71.8 70.0 -67.0 -26.1 8.8 -1.8 17.9 14 17 A H H 34 S+ 0 0 66 -4,-0.4 -1,-0.3 1,-0.3 6,-0.1 0.827 87.5 66.3 -58.2 -33.5 10.3 -0.5 21.2 15 18 A K H <4 S+ 0 0 135 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.860 118.0 23.1 -60.8 -35.1 13.6 0.5 19.5 16 19 A D H << S+ 0 0 133 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.2 0.725 134.3 37.0-101.9 -24.8 11.8 3.1 17.4 17 20 A F >< - 0 0 59 -4,-2.7 3,-2.8 1,-0.1 -1,-0.2 -0.770 68.6-174.9-124.9 82.4 8.8 3.8 19.6 18 21 A P G > S+ 0 0 102 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.770 76.9 74.7 -56.3 -22.7 10.1 3.6 23.2 19 22 A I G > S+ 0 0 58 1,-0.3 3,-2.9 2,-0.2 -5,-0.1 0.695 70.2 88.9 -64.1 -12.2 6.6 4.0 24.5 20 23 A A G < S+ 0 0 7 -3,-2.8 -1,-0.3 1,-0.3 -6,-0.1 0.709 90.1 47.8 -54.3 -20.4 6.0 0.4 23.4 21 24 A K G < S+ 0 0 133 -3,-1.7 -1,-0.3 -4,-0.1 -2,-0.2 0.167 97.1 120.4-101.2 12.7 7.3 -0.6 26.9 22 25 A G S < S- 0 0 16 -3,-2.9 3,-0.4 2,-0.1 -3,-0.0 0.183 74.1 -93.8 -75.4-163.7 5.0 2.0 28.7 23 26 A E S S+ 0 0 127 1,-0.2 2,-0.1 169,-0.0 227,-0.1 0.783 109.5 33.5 -85.6 -38.9 2.3 2.0 31.3 24 27 A R S S+ 0 0 49 168,-0.1 -1,-0.2 2,-0.0 2,-0.2 -0.455 79.0 155.4-121.0 61.5 -1.0 1.9 29.5 25 28 A Q - 0 0 4 -3,-0.4 220,-0.1 221,-0.4 170,-0.1 -0.572 31.9-104.9 -88.0 153.2 -0.3 -0.2 26.4 26 29 A S S S+ 0 0 0 168,-0.4 2,-0.2 -2,-0.2 78,-0.0 -0.856 76.7 44.7-126.1 159.0 -2.9 -2.2 24.5 27 30 A P + 0 0 0 0, 0.0 218,-2.7 0, 0.0 2,-0.3 0.652 64.9 174.4 -73.8 179.3 -4.1 -4.9 23.7 28 31 A V - 0 0 1 216,-0.3 77,-1.1 -2,-0.2 2,-0.4 -0.923 37.3-101.4-142.1 161.5 -4.5 -6.8 27.1 29 32 A D E -a 105 0A 39 216,-0.5 2,-0.9 -2,-0.3 77,-0.2 -0.741 33.2-135.5 -81.6 134.5 -6.1 -10.0 28.1 30 33 A I E -a 106 0A 0 75,-2.9 77,-2.4 -2,-0.4 2,-1.0 -0.821 12.9-159.5 -94.8 106.6 -9.5 -9.5 29.7 31 34 A D >> - 0 0 68 -2,-0.9 3,-1.7 75,-0.2 4,-0.9 -0.785 3.6-161.4 -84.2 108.2 -9.7 -11.7 32.8 32 35 A T T 34 S+ 0 0 45 -2,-1.0 -1,-0.2 1,-0.3 222,-0.0 0.723 85.2 57.5 -66.6 -24.4 -13.5 -11.8 33.2 33 36 A H T 34 S+ 0 0 161 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.360 113.6 38.2 -86.1 1.5 -13.2 -13.0 36.9 34 37 A T T <4 S+ 0 0 96 -3,-1.7 2,-0.2 2,-0.0 218,-0.2 0.376 86.9 106.7-128.1 -3.3 -11.2 -9.9 37.9 35 38 A A S < S- 0 0 20 -4,-0.9 2,-0.6 216,-0.1 218,-0.2 -0.615 72.9-126.0 -74.6 138.9 -12.9 -7.3 35.8 36 39 A K E -c 253 0B 123 216,-2.4 218,-2.6 -2,-0.2 2,-0.3 -0.797 8.2-128.7 -98.2 126.6 -15.0 -5.2 38.2 37 40 A Y E -c 254 0B 120 -2,-0.6 218,-0.2 216,-0.2 151,-0.0 -0.519 25.9-164.6 -62.1 124.2 -18.7 -4.6 37.6 38 41 A D > - 0 0 29 216,-2.6 3,-2.1 -2,-0.3 -1,-0.1 -0.830 12.0-169.4-120.8 103.0 -19.2 -0.9 37.8 39 42 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.622 82.2 66.9 -66.3 -12.7 -22.8 0.1 38.2 40 43 A S T 3 S+ 0 0 90 2,-0.1 2,-0.5 0, 0.0 215,-0.1 0.514 73.6 109.5 -85.5 -2.0 -22.1 3.8 37.6 41 44 A L < - 0 0 27 -3,-2.1 3,-0.1 213,-0.2 38,-0.0 -0.648 66.7-136.7 -76.8 121.5 -21.1 3.1 33.9 42 45 A K - 0 0 146 37,-0.8 39,-0.1 -2,-0.5 3,-0.1 -0.309 28.4 -91.9 -67.8 154.9 -23.8 4.5 31.6 43 46 A P - 0 0 110 0, 0.0 36,-1.5 0, 0.0 2,-0.2 -0.362 49.2 -99.1 -64.8 150.8 -25.0 2.5 28.5 44 47 A L E -D 78 0B 14 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.519 29.3-153.4 -68.9 145.2 -23.2 3.2 25.2 45 48 A S E +D 77 0B 48 32,-2.7 32,-2.3 -2,-0.2 2,-0.6 -0.961 14.2 179.8-124.3 108.9 -24.8 5.5 22.8 46 49 A V E -D 76 0B 32 -2,-0.5 2,-0.8 30,-0.2 30,-0.2 -0.926 3.3-176.6-106.4 105.9 -23.8 4.8 19.2 47 50 A S E +D 75 0B 40 28,-2.6 28,-1.9 -2,-0.6 3,-0.2 -0.799 24.3 145.6-107.4 92.3 -25.5 7.3 16.8 48 51 A Y > + 0 0 2 -2,-0.8 3,-1.6 26,-0.2 130,-0.2 0.346 35.0 102.4-110.2 10.4 -24.4 6.0 13.4 49 52 A D T 3 S+ 0 0 89 1,-0.3 -1,-0.1 127,-0.1 25,-0.1 0.757 84.9 48.9 -66.4 -22.9 -27.5 6.7 11.2 50 53 A Q T 3 S+ 0 0 107 23,-0.8 -1,-0.3 -3,-0.2 24,-0.2 0.256 82.2 141.2 -95.4 6.8 -25.9 9.9 9.6 51 54 A A < - 0 0 20 -3,-1.6 2,-0.5 22,-0.2 123,-0.1 -0.196 35.2-162.0 -57.0 138.1 -22.6 8.2 8.8 52 55 A T - 0 0 45 16,-0.3 16,-2.3 122,-0.1 2,-0.3 -0.909 3.9-163.3-121.4 100.4 -20.9 9.1 5.5 53 56 A S E +E 67 0B 0 -2,-0.5 121,-0.6 122,-0.3 14,-0.2 -0.627 14.1 170.7 -81.1 147.1 -18.2 6.6 4.3 54 57 A L E + 0 0 71 12,-3.1 118,-2.4 1,-0.4 2,-0.3 0.749 50.8 5.5-120.3 -44.4 -15.9 7.9 1.7 55 58 A R E -EF 66 171B 94 11,-1.1 11,-2.5 116,-0.3 -1,-0.4 -0.933 43.1-150.0-145.4 155.8 -12.9 5.6 0.9 56 59 A I E +EF 65 170B 0 114,-1.8 114,-1.9 -2,-0.3 2,-0.3 -0.974 28.7 179.5-126.8 145.6 -11.4 2.3 1.6 57 60 A L E -EF 64 169B 28 7,-2.2 7,-2.2 -2,-0.4 2,-0.6 -1.000 30.4-135.0-147.9 142.1 -7.6 2.1 1.5 58 61 A N E -E 63 0B 0 110,-2.4 109,-2.4 -2,-0.3 5,-0.2 -0.909 23.6-178.3-100.4 125.2 -4.8 -0.5 1.9 59 62 A N - 0 0 40 3,-2.3 4,-0.1 -2,-0.6 -1,-0.1 0.195 52.8 -94.3-111.2 11.7 -2.2 1.2 4.1 60 63 A G S S+ 0 0 8 2,-0.4 3,-0.1 166,-0.3 106,-0.1 0.187 119.7 46.5 96.9 -20.6 0.4 -1.6 4.3 61 64 A H S S- 0 0 45 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.576 125.7 -24.4-125.2 -14.2 -0.7 -3.0 7.6 62 65 A A S S- 0 0 0 164,-0.1 -3,-2.3 165,-0.1 -1,-0.5 -0.910 70.7 -92.2-173.7-177.6 -4.5 -3.3 7.2 63 66 A F E -E 58 0B 0 -2,-0.3 29,-0.5 -5,-0.2 2,-0.4 -0.960 34.9-154.5-116.2 139.0 -7.3 -1.6 5.2 64 67 A N E -E 57 0B 21 -7,-2.2 -7,-2.2 -2,-0.4 2,-0.5 -0.926 10.0-150.2-110.9 144.5 -9.2 1.4 6.6 65 68 A V E -EG 56 90B 0 25,-2.3 25,-1.6 -2,-0.4 2,-0.3 -0.959 27.6-150.8-106.0 121.4 -12.7 2.6 5.7 66 69 A E E -EG 55 89B 46 -11,-2.5 -12,-3.1 -2,-0.5 -11,-1.1 -0.793 9.3-158.2-103.3 146.3 -12.6 6.4 6.2 67 70 A F E -E 53 0B 9 21,-3.0 2,-0.7 -2,-0.3 -14,-0.2 -0.799 28.8-103.0-122.8 153.5 -15.5 8.6 7.2 68 71 A D + 0 0 51 -16,-2.3 -16,-0.3 -2,-0.3 5,-0.2 -0.709 40.4 173.2 -74.2 116.9 -16.4 12.2 6.8 69 72 A D + 0 0 42 -2,-0.7 -1,-0.1 1,-0.1 3,-0.1 -0.171 43.3 108.2-118.7 36.4 -15.7 13.7 10.3 70 73 A S S S+ 0 0 78 1,-0.1 2,-0.3 56,-0.0 -1,-0.1 0.538 89.1 20.8 -88.1 -9.1 -16.2 17.4 9.6 71 74 A Q S S- 0 0 124 -3,-0.2 2,-2.2 3,-0.0 3,-0.4 -0.955 103.7 -81.3-152.4 158.9 -19.5 17.5 11.5 72 75 A D S S+ 0 0 85 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.415 74.2 135.8 -68.7 78.3 -21.1 15.2 14.1 73 76 A K S S+ 0 0 45 -2,-2.2 -23,-0.8 1,-0.3 2,-0.5 0.869 73.2 16.6 -96.7 -51.2 -22.4 12.6 11.7 74 77 A A S S+ 0 0 5 -3,-0.4 13,-2.8 13,-0.2 -1,-0.3 -0.979 85.9 168.3-122.6 112.0 -21.5 9.2 13.4 75 78 A V E -DH 47 86B 8 -28,-1.9 -28,-2.6 -2,-0.5 2,-0.4 -0.878 28.1-149.0-128.5 165.2 -20.7 9.7 17.0 76 79 A L E +DH 46 85B 0 9,-2.6 9,-2.6 -2,-0.3 2,-0.3 -0.990 29.3 147.4-131.4 131.6 -20.2 7.7 20.2 77 80 A K E +D 45 0B 74 -32,-2.3 -32,-2.7 -2,-0.4 2,-0.2 -0.921 36.1 51.4-151.7 178.2 -21.0 9.0 23.7 78 81 A G E > S+D 44 0B 21 3,-0.4 3,-2.5 -2,-0.3 -34,-0.3 -0.528 73.2 79.4 83.7-157.1 -22.2 7.5 27.0 79 82 A G T 3 S- 0 0 6 -36,-1.5 -37,-0.8 1,-0.3 -1,-0.1 -0.226 122.0 -26.4 52.5-138.5 -20.4 4.6 28.5 80 83 A P T 3 S+ 0 0 39 0, 0.0 2,-0.3 0, 0.0 -1,-0.3 0.290 114.1 112.1 -80.6 10.3 -17.2 5.7 30.3 81 84 A L < - 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