==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 04-JUN-08 3DD0 . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.GENIS,K.H.SIPPEL,N.CASE,L.GOVINDASAMY,M.AGBANDJE-MCKENNA, . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12014.0 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 . 16 6.2 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 . 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 . 25 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 13.6 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 . 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 3 A H 0 0 201 0, 0.0 2,-0.3 0, 0.0 8,-0.0 0.000 360.0 360.0 360.0 118.2 13.5 -0.8 7.3 2 4 A H - 0 0 130 1,-0.0 2,-0.0 0, 0.0 0, 0.0 -0.872 360.0 -80.2-142.2 163.2 10.1 0.0 8.8 3 5 A W + 0 0 38 -2,-0.3 2,-0.2 1,-0.1 7,-0.2 -0.332 59.9 130.4 -74.2 154.2 7.8 -1.6 11.4 4 6 A G - 0 0 11 5,-2.7 10,-0.1 2,-0.1 -1,-0.1 -0.794 65.9 -81.0-166.2-148.2 5.5 -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 0.211 83.1 113.1-122.0 13.9 4.4 -8.0 11.5 6 8 A G S > S- 0 0 37 1,-0.1 4,-1.3 4,-0.1 3,-0.2 -0.121 83.0 -98.4 -81.8 177.7 7.3 -9.9 10.0 7 9 A K T 4 S+ 0 0 159 1,-0.2 -1,-0.1 2,-0.2 3,-0.1 0.876 123.1 39.6 -65.1 -34.5 10.0 -11.9 11.8 8 10 A H T 4 S+ 0 0 136 1,-0.2 -1,-0.2 -5,-0.0 -3,-0.0 0.627 129.7 24.7 -97.2 -6.8 12.4 -9.1 11.5 9 11 A N T 4 S+ 0 0 45 -3,-0.2 -5,-2.7 -6,-0.1 -2,-0.2 0.292 90.3 123.6-138.9 18.2 10.2 -6.1 12.1 10 12 A G S >X S- 0 0 0 -4,-1.3 3,-2.7 -5,-0.2 4,-0.6 0.089 79.8 -67.3 -78.3-174.5 7.2 -7.3 14.2 11 13 A P G >4 S+ 0 0 24 0, 0.0 3,-0.8 0, 0.0 4,-0.4 0.726 125.8 61.6 -49.8 -33.9 5.9 -6.3 17.6 12 14 A E G 34 S+ 0 0 129 1,-0.2 3,-0.1 2,-0.1 -2,-0.0 0.675 108.5 46.1 -68.8 -13.0 8.9 -7.5 19.7 13 15 A H G X4 S+ 0 0 52 -3,-2.7 3,-1.8 1,-0.1 4,-0.5 0.586 86.3 90.0 -99.4 -14.0 11.1 -5.0 17.7 14 16 A W G XX S+ 0 0 4 -3,-0.8 4,-2.3 -4,-0.6 3,-1.2 0.805 73.5 69.7 -60.2 -33.0 8.7 -1.9 17.9 15 17 A H G 34 S+ 0 0 63 -4,-0.4 -1,-0.3 1,-0.3 7,-0.1 0.732 85.9 67.6 -60.7 -22.1 10.2 -0.6 21.1 16 18 A K G <4 S+ 0 0 132 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.849 117.7 22.6 -69.8 -30.8 13.5 0.3 19.4 17 19 A D T <4 S+ 0 0 122 -3,-1.2 -2,-0.2 -4,-0.5 -1,-0.2 0.717 135.7 37.5-101.0 -23.3 11.8 3.1 17.4 18 20 A F >< - 0 0 57 -4,-2.3 3,-2.4 1,-0.1 -1,-0.2 -0.775 64.5-179.3-129.8 79.0 8.8 3.6 19.7 19 21 A P G > S+ 0 0 101 0, 0.0 3,-1.9 0, 0.0 -4,-0.1 0.720 75.0 76.8 -61.1 -18.7 9.9 3.2 23.3 20 22 A I G > S+ 0 0 56 1,-0.3 3,-2.3 179,-0.2 -5,-0.1 0.628 71.9 88.2 -63.5 -10.1 6.4 3.8 24.6 21 23 A A G < S+ 0 0 7 -3,-2.4 -1,-0.3 1,-0.3 -6,-0.1 0.786 88.0 48.3 -55.0 -28.1 5.9 0.2 23.5 22 24 A K G < S+ 0 0 140 -3,-1.9 -1,-0.3 -4,-0.2 -2,-0.2 0.102 95.2 134.1-101.4 23.6 7.1 -0.7 27.0 23 25 A G < - 0 0 17 -3,-2.3 3,-0.5 1,-0.1 -3,-0.0 0.114 68.9-108.5 -65.7 175.1 4.7 1.8 28.6 24 26 A E S S+ 0 0 115 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.516 110.9 37.7 -86.7 -13.5 2.3 1.6 31.5 25 27 A R S S+ 0 0 48 224,-0.1 -1,-0.2 2,-0.1 2,-0.2 -0.207 79.8 150.4-136.3 53.3 -1.0 1.6 29.6 26 28 A Q - 0 0 3 -3,-0.5 220,-0.1 221,-0.3 170,-0.1 -0.503 34.4-101.0 -85.7 155.4 -0.3 -0.4 26.4 27 29 A S S S+ 0 0 0 168,-0.4 2,-0.2 -2,-0.2 -2,-0.1 -0.869 76.1 42.9-126.4 159.0 -2.9 -2.4 24.5 28 30 A P + 0 0 0 0, 0.0 218,-2.6 0, 0.0 2,-0.3 0.608 64.3 176.0 -79.7 179.0 -4.1 -5.0 23.8 29 31 A V - 0 0 1 216,-0.3 77,-1.3 -2,-0.2 2,-0.5 -0.925 35.7-100.8-136.5 163.5 -4.6 -7.0 27.0 30 32 A D E -a 106 0A 27 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.776 33.4-138.4 -81.5 130.1 -6.1 -10.2 28.2 31 33 A I E -a 107 0A 0 75,-3.1 77,-2.7 -2,-0.5 2,-0.8 -0.841 11.4-159.3 -91.9 109.0 -9.5 -9.7 29.7 32 34 A D >> - 0 0 62 -2,-0.8 4,-1.2 75,-0.2 3,-0.5 -0.830 3.8-160.8 -91.1 110.4 -9.7 -11.9 32.8 33 35 A T T 34 S+ 0 0 45 -2,-0.8 -1,-0.2 1,-0.2 222,-0.0 0.737 85.0 54.9 -68.6 -26.7 -13.5 -12.2 33.2 34 36 A H T 34 S+ 0 0 167 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.813 113.0 41.1 -79.4 -25.5 -13.3 -13.3 36.8 35 37 A T T <4 S+ 0 0 102 -3,-0.5 -2,-0.2 2,-0.1 -1,-0.2 0.494 87.0 108.7 -98.1 -11.0 -11.2 -10.3 38.0 36 38 A A S < S- 0 0 17 -4,-1.2 2,-0.6 216,-0.1 218,-0.2 -0.502 70.8-127.9 -58.9 135.1 -13.0 -7.6 35.9 37 39 A K E -c 254 0B 129 216,-2.3 218,-2.4 -2,-0.1 2,-0.3 -0.812 9.5-131.7 -94.4 119.3 -15.0 -5.4 38.3 38 40 A Y E -c 255 0B 89 -2,-0.6 218,-0.2 216,-0.2 220,-0.1 -0.568 24.0-163.1 -62.3 130.7 -18.7 -4.9 37.6 39 41 A D > - 0 0 27 216,-2.5 3,-1.7 -2,-0.3 -1,-0.1 -0.930 15.3-170.1-121.4 103.5 -19.3 -1.1 37.8 40 42 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.583 84.2 71.3 -72.8 -3.1 -23.0 -0.0 38.2 41 43 A S T 3 S+ 0 0 76 2,-0.1 2,-0.3 40,-0.0 215,-0.1 0.630 77.0 101.8 -77.5 -15.7 -21.9 3.6 37.6 42 44 A L < - 0 0 26 -3,-1.7 3,-0.1 213,-0.2 38,-0.0 -0.517 65.5-143.6 -77.1 136.2 -21.2 2.8 34.0 43 45 A K - 0 0 130 37,-0.9 39,-0.1 -2,-0.3 2,-0.1 -0.453 25.7 -88.9 -89.5 165.5 -23.9 3.9 31.5 44 46 A P - 0 0 109 0, 0.0 36,-2.0 0, 0.0 -1,-0.1 -0.411 49.1-103.1 -61.9 149.6 -25.1 2.2 28.4 45 47 A L E -D 79 0B 16 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.476 26.1-148.0 -64.5 147.1 -23.3 3.0 25.2 46 48 A S E -D 78 0B 51 32,-2.9 32,-2.3 -2,-0.1 2,-0.6 -0.959 16.7-177.1-122.0 109.5 -25.0 5.4 22.8 47 49 A V E -D 77 0B 33 -2,-0.5 2,-0.6 30,-0.2 30,-0.2 -0.920 3.9-179.2-107.1 114.0 -24.1 4.6 19.3 48 50 A S E +D 76 0B 40 28,-3.0 28,-2.3 -2,-0.6 3,-0.1 -0.839 23.6 142.5-119.0 95.3 -25.6 7.0 16.8 49 51 A Y > + 0 0 2 -2,-0.6 3,-1.6 26,-0.2 130,-0.2 0.214 33.7 108.5-115.8 10.6 -24.6 5.9 13.3 50 52 A D T 3 S+ 0 0 87 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.850 86.4 40.5 -61.5 -35.2 -27.7 6.7 11.3 51 53 A Q T 3 S+ 0 0 130 23,-0.7 -1,-0.3 -3,-0.1 24,-0.2 0.200 83.0 144.1 -98.1 15.5 -26.1 9.6 9.5 52 54 A A < - 0 0 22 -3,-1.6 2,-0.5 22,-0.2 18,-0.1 -0.228 34.3-157.9 -57.3 144.2 -22.7 8.1 8.9 53 55 A T - 0 0 45 16,-0.3 16,-2.5 122,-0.1 2,-0.2 -0.899 4.4-162.3-124.5 100.6 -21.0 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 -0.540 12.7 174.0 -77.8 150.8 -18.4 6.5 4.4 55 57 A L E - 0 0 83 12,-3.0 118,-2.0 1,-0.4 2,-0.3 0.696 49.6 -1.5-119.7 -46.3 -16.0 7.8 1.8 56 58 A R E -EF 67 172B 83 11,-1.0 11,-2.7 116,-0.3 2,-0.4 -0.969 44.0-138.0-154.0 156.7 -13.2 5.4 0.9 57 59 A I E -EF 66 171B 0 114,-2.2 114,-2.2 -2,-0.3 2,-0.4 -0.990 29.5-174.4-123.1 133.8 -11.5 2.1 1.6 58 60 A L E -EF 65 170B 30 7,-2.2 7,-2.5 -2,-0.4 2,-0.7 -0.995 26.8-144.8-133.5 134.0 -7.7 2.1 1.7 59 61 A N E -E 64 0B 0 110,-2.6 109,-2.9 -2,-0.4 5,-0.2 -0.881 21.7-179.7 -89.2 109.1 -5.0 -0.6 2.0 60 62 A N - 0 0 40 3,-1.6 4,-0.1 -2,-0.7 -1,-0.1 0.293 53.3 -97.1 -98.0 11.9 -2.3 1.2 4.1 61 63 A G S S+ 0 0 16 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.311 118.2 49.8 94.3 -12.8 0.2 -1.7 4.2 62 64 A H S S- 0 0 47 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.551 124.1 -23.3-129.7 -19.5 -0.9 -3.1 7.5 63 65 A A S S- 0 0 3 -5,-0.1 -3,-1.6 165,-0.1 -1,-0.5 -0.867 71.0 -92.3-164.4-172.3 -4.7 -3.4 7.3 64 66 A F E -E 59 0B 0 -2,-0.3 29,-0.5 29,-0.2 2,-0.4 -0.983 35.1-154.7-117.8 138.7 -7.5 -1.9 5.3 65 67 A N E -E 58 0B 19 -7,-2.5 -7,-2.2 -2,-0.4 2,-0.6 -0.942 10.2-151.5-110.2 132.5 -9.3 1.2 6.6 66 68 A V E -EG 57 91B 0 25,-2.6 25,-1.8 -2,-0.4 2,-0.3 -0.917 28.5-152.1 -94.2 120.7 -12.9 2.2 5.8 67 69 A E E -EG 56 90B 51 -11,-2.7 -12,-3.0 -2,-0.6 -11,-1.0 -0.751 10.5-161.9-103.5 144.6 -12.9 6.1 6.2 68 70 A F E -E 54 0B 9 21,-2.5 2,-0.7 -2,-0.3 -14,-0.2 -0.833 31.4-100.2-120.9 154.4 -15.7 8.4 7.2 69 71 A D + 0 0 40 -16,-2.5 -16,-0.3 -2,-0.3 6,-0.3 -0.692 40.1 173.1 -72.5 114.9 -16.4 12.0 6.9 70 72 A D + 0 0 43 -2,-0.7 -1,-0.1 1,-0.1 17,-0.1 -0.013 45.8 106.9-114.2 30.2 -15.7 13.4 10.4 71 73 A S S S+ 0 0 80 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.382 89.2 21.4 -86.1 0.1 -16.1 17.1 9.6 72 74 A Q S S- 0 0 123 -3,-0.2 2,-2.0 3,-0.1 3,-0.4 -0.970 99.0 -82.7-155.6 165.1 -19.4 17.1 11.5 73 75 A D S S+ 0 0 89 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.504 76.6 127.1 -74.5 75.7 -21.3 15.1 14.2 74 76 A K S S+ 0 0 55 -2,-2.0 -23,-0.7 1,-0.3 2,-0.5 0.908 74.8 20.9 -91.1 -58.8 -22.7 12.5 11.8 75 77 A A S S+ 0 0 6 -3,-0.4 13,-2.9 -6,-0.3 2,-0.3 -0.969 84.1 169.0-122.9 105.4 -21.7 9.2 13.4 76 78 A V E -DH 48 87B 11 -28,-2.3 -28,-3.0 -2,-0.5 2,-0.4 -0.913 30.5-147.8-134.7 153.9 -20.9 9.5 17.1 77 79 A L E +DH 47 86B 0 9,-2.7 9,-2.2 -2,-0.3 2,-0.3 -0.974 29.9 157.0-117.6 130.5 -20.3 7.5 20.2 78 80 A K E +D 46 0B 88 -32,-2.3 -32,-2.9 -2,-0.4 7,-0.1 -0.866 37.0 33.7-142.1 172.8 -21.4 8.8 23.6 79 81 A G E > S+D 45 0B 24 5,-0.4 3,-2.4 -2,-0.3 -34,-0.3 -0.400 70.8 87.0 80.1-154.2 -22.2 7.3 27.0 80 82 A G T 3 S- 0 0 6 -36,-2.0 -37,-0.9 1,-0.3 -1,-0.1 -0.303 118.9 -26.1 49.5-132.2 -20.6 4.3 28.5 81 83 A P T 3 S+ 0 0 41 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.362 115.2 111.3 -88.9 6.1 -17.5 5.5 30.4 82 84 A L < - 0 0 13 -3,-2.4 2,-0.5 -39,-0.1 -3,-0.3 -0.517 55.1-153.6 -88.8 149.1 -17.1 8.5 28.1 83 85 A D - 0 0 140 -2,-0.2 2,-0.1 53,-0.1 -3,-0.0 -0.983 67.6 -3.3-114.3 123.2 -17.4 12.1 28.8 84 86 A G S S- 0 0 47 -2,-0.5 2,-0.4 38,-0.1 -5,-0.4 -0.376 97.3 -44.7 93.4-174.0 -18.4 14.1 25.7 85 87 A T - 0 0 24 -7,-0.1 38,-2.5 -2,-0.1 2,-0.5 -0.826 43.0-164.4-104.5 125.5 -18.9 13.3 22.0 86 88 A Y E -HI 77 122B 5 -9,-2.2 -9,-2.7 -2,-0.4 2,-0.4 -0.952 12.5-144.4-117.9 127.0 -16.6 11.1 19.9 87 89 A R E -HI 76 121B 47 34,-2.8 34,-2.0 -2,-0.5 2,-0.4 -0.713 17.0-119.0 -92.1 133.8 -16.7 11.0 16.2 88 90 A L E + I 0 120B 2 -13,-2.9 32,-0.3 -2,-0.4 -13,-0.2 -0.557 37.1 165.0 -66.4 131.0 -16.2 8.0 14.1 89 91 A I E - 0 0 34 30,-2.7 -21,-2.5 1,-0.4 2,-0.3 0.739 59.3 -21.9-113.6 -39.1 -13.2 8.4 11.7 90 92 A Q E -GI 67 119B 34 29,-1.1 29,-2.7 -23,-0.2 -1,-0.4 -0.990 47.4-145.0-161.7 160.1 -12.4 4.9 10.4 91 93 A F E +GI 66 118B 0 -25,-1.8 -25,-2.6 -2,-0.3 2,-0.3 -0.966 22.1 163.9-128.3 160.6 -12.7 1.2 11.1 92 94 A H E - I 0 117B 22 25,-1.8 25,-3.0 -2,-0.3 2,-0.3 -0.931 23.2-126.8-157.1 170.8 -10.3 -1.6 10.4 93 95 A F E - I 0 116B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.2 -0.836 1.0-149.7-123.8 161.7 -9.7 -5.2 11.3 94 96 A H E + I 0 115B 4 21,-2.0 21,-2.3 -2,-0.3 2,-0.3 -0.977 31.1 169.5-122.9 138.3 -7.0 -7.4 12.6 95 97 A W E - I 0 114B 0 -2,-0.4 146,-1.2 19,-0.2 145,-1.0 -0.955 23.2-118.0-150.0 170.9 -6.9 -11.0 11.6 96 98 A G - 0 0 0 17,-1.4 6,-0.1 5,-0.6 3,-0.1 -0.488 23.3-122.3-106.0 169.5 -5.0 -14.3 11.6 97 99 A S S S+ 0 0 44 -2,-0.1 2,-0.3 142,-0.1 -1,-0.1 0.584 104.8 32.5 -81.0 -17.7 -3.6 -16.8 9.2 98 100 A L S > S- 0 0 108 3,-0.2 3,-1.5 15,-0.1 -2,-0.2 -0.920 90.2-110.7-139.8 155.3 -5.8 -19.5 10.9 99 101 A D T 3 S+ 0 0 71 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.684 110.4 64.8 -68.1 -18.7 -9.2 -19.3 12.5 100 102 A G T 3 S+ 0 0 56 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.333 107.7 35.7 -88.9 9.2 -7.8 -19.8 16.0 101 103 A Q < + 0 0 51 -3,-1.5 -5,-0.6 12,-0.1 -3,-0.2 -0.985 64.9 92.6-148.4 164.3 -5.9 -16.6 16.1 102 104 A G + 0 0 0 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 0.033 56.7 106.8 140.1 -27.0 -6.2 -13.0 14.8 103 105 A S - 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