==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 24-OCT-06 2NNG . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.W.CHRISTIANSON,K.M.JUDE . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12002.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 63.2 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 . 33 12.8 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 3 A H 0 0 189 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -12.9 9.0 3.9 9.3 2 4 A H + 0 0 173 7,-0.1 2,-0.1 2,-0.0 0, 0.0 -0.017 360.0 134.5-140.6 33.9 9.7 0.2 8.5 3 5 A W + 0 0 44 1,-0.1 2,-0.2 2,-0.1 7,-0.2 -0.418 19.1 136.2 -78.8 158.1 7.6 -1.5 11.2 4 6 A G - 0 0 7 5,-2.7 10,-0.1 2,-0.2 58,-0.1 -0.747 62.5 -79.4-165.8-145.3 5.4 -4.5 10.5 5 7 A Y S S+ 0 0 36 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.210 83.2 109.7-125.0 11.2 4.4 -7.9 11.7 6 8 A G S > S- 0 0 41 1,-0.1 4,-1.8 4,-0.1 3,-0.4 -0.223 84.3 -97.9 -80.9 175.8 7.3 -10.0 10.5 7 9 A K T 4 S+ 0 0 171 1,-0.2 -1,-0.1 2,-0.2 5,-0.1 0.860 123.7 39.8 -62.1 -34.8 10.1 -11.7 12.5 8 10 A H T 4 S+ 0 0 140 1,-0.1 -1,-0.2 4,-0.0 -3,-0.0 0.597 131.2 22.8 -99.7 -6.4 12.5 -8.8 11.8 9 11 A N T 4 S+ 0 0 59 -3,-0.4 -5,-2.7 -6,-0.1 -2,-0.2 0.321 96.0 114.7-138.7 10.6 10.1 -5.8 12.1 10 12 A G S >X S- 0 0 2 -4,-1.8 3,-3.0 -7,-0.2 4,-0.8 0.139 84.9 -64.4 -81.5-172.2 7.2 -7.1 14.3 11 13 A P T 34 S+ 0 0 27 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.726 127.1 61.1 -48.6 -31.7 5.9 -6.2 17.7 12 14 A E T 34 S+ 0 0 145 1,-0.2 3,-0.1 2,-0.1 -5,-0.1 0.631 109.9 43.8 -73.5 -12.1 9.1 -7.3 19.5 13 15 A H T X> S+ 0 0 61 -3,-3.0 3,-1.7 1,-0.1 4,-0.5 0.592 87.6 88.8-100.4 -14.8 11.1 -4.7 17.6 14 16 A W H >X S+ 0 0 6 -4,-0.8 4,-2.4 -3,-0.4 3,-0.8 0.800 73.9 70.2 -60.5 -31.9 8.7 -1.8 17.8 15 17 A H H 34 S+ 0 0 66 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.747 87.1 66.3 -61.0 -23.1 10.2 -0.4 21.1 16 18 A K H <4 S+ 0 0 133 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.937 117.6 23.1 -69.3 -37.6 13.4 0.6 19.4 17 19 A D H << S+ 0 0 116 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.711 136.9 37.0 -92.6 -23.1 11.8 3.3 17.2 18 20 A F >< + 0 0 47 -4,-2.4 3,-2.7 1,-0.1 -1,-0.2 -0.750 65.7 179.5-130.4 77.4 8.7 3.7 19.6 19 21 A P G > S+ 0 0 99 0, 0.0 3,-1.9 0, 0.0 -4,-0.1 0.718 74.8 76.7 -59.8 -18.9 9.9 3.4 23.2 20 22 A I G > S+ 0 0 57 1,-0.3 3,-2.6 179,-0.2 -5,-0.1 0.635 70.7 88.1 -63.1 -13.0 6.4 4.0 24.4 21 23 A A G < S+ 0 0 7 -3,-2.7 -1,-0.3 1,-0.3 -6,-0.1 0.741 90.8 46.2 -51.0 -28.9 5.9 0.3 23.3 22 24 A K G < S+ 0 0 143 -3,-1.9 -1,-0.3 -4,-0.1 -2,-0.2 0.021 97.0 130.3 -99.2 21.3 7.1 -0.5 26.9 23 25 A G S < S- 0 0 15 -3,-2.6 3,-0.5 1,-0.1 -3,-0.1 0.102 71.9-101.2 -78.2-173.2 4.8 2.1 28.4 24 26 A E S S+ 0 0 123 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.550 112.2 33.2 -87.1 -12.1 2.4 2.1 31.3 25 27 A R S S+ 0 0 47 224,-0.1 -1,-0.2 2,-0.0 2,-0.2 -0.263 79.0 155.1-144.5 56.9 -0.9 1.9 29.3 26 28 A Q - 0 0 2 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.476 32.8 -99.7 -86.9 153.3 -0.2 -0.2 26.2 27 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.894 77.3 40.0-124.8 158.2 -2.8 -2.1 24.2 28 30 A P + 0 0 0 0, 0.0 218,-3.0 0, 0.0 2,-0.3 0.586 64.8 178.1 -79.9-179.1 -4.1 -4.7 23.6 29 31 A V - 0 0 1 216,-0.3 77,-1.3 -2,-0.2 2,-0.4 -0.922 35.3-100.9-137.1 161.3 -4.5 -6.6 26.8 30 32 A D E -a 106 0A 29 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.739 33.6-139.4 -78.8 134.2 -6.0 -9.9 28.0 31 33 A I E -a 107 0A 0 75,-3.0 77,-2.7 -2,-0.4 2,-0.9 -0.877 10.5-159.0 -98.0 104.1 -9.4 -9.3 29.5 32 34 A D >> - 0 0 66 -2,-0.8 4,-1.7 75,-0.2 3,-0.9 -0.800 5.0-160.3 -85.4 109.0 -9.6 -11.6 32.5 33 35 A T T 34 S+ 0 0 42 -2,-0.9 -1,-0.2 1,-0.3 222,-0.0 0.760 85.9 54.1 -67.2 -27.2 -13.4 -11.8 32.9 34 36 A H T 34 S+ 0 0 169 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.706 112.7 43.5 -82.6 -18.0 -13.3 -12.9 36.5 35 37 A T T <4 S+ 0 0 113 -3,-0.9 -2,-0.2 2,-0.1 -1,-0.2 0.612 89.5 98.9 -97.9 -21.2 -11.1 -9.9 37.6 36 38 A A S < S- 0 0 18 -4,-1.7 2,-0.5 218,-0.1 218,-0.2 -0.366 71.0-136.7 -61.9 140.3 -13.0 -7.2 35.6 37 39 A K E -c 254 0B 161 216,-2.1 218,-2.6 -2,-0.1 2,-0.2 -0.880 8.7-119.9-111.1 134.8 -15.3 -5.4 37.9 38 40 A Y E -c 255 0B 83 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.415 29.4-156.8 -61.3 132.6 -18.9 -4.4 37.1 39 41 A D > - 0 0 20 216,-2.4 3,-1.4 -2,-0.2 -1,-0.1 -0.901 17.9-171.8-119.6 104.9 -19.1 -0.6 37.4 40 42 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.618 83.2 74.1 -66.5 -10.8 -22.5 0.9 38.1 41 43 A S T 3 S+ 0 0 86 -3,-0.1 2,-0.2 2,-0.1 215,-0.1 0.795 73.0 100.6 -77.3 -15.9 -21.0 4.3 37.4 42 44 A L < - 0 0 30 -3,-1.4 3,-0.1 213,-0.2 38,-0.0 -0.449 65.9-147.5 -67.5 131.6 -20.9 3.6 33.7 43 45 A K - 0 0 125 37,-1.3 37,-0.3 -2,-0.2 39,-0.1 -0.528 40.5 -71.6 -88.6 167.9 -23.8 5.3 31.8 44 46 A P - 0 0 114 0, 0.0 36,-1.4 0, 0.0 2,-0.3 -0.252 50.6-113.2 -58.5 144.7 -25.3 3.5 28.7 45 47 A L E -D 79 0B 20 34,-0.3 2,-0.5 141,-0.1 34,-0.2 -0.600 26.6-155.6 -74.7 137.3 -23.2 3.5 25.6 46 48 A S E -D 78 0B 37 32,-2.8 32,-2.3 -2,-0.3 2,-0.6 -0.955 11.2-175.8-121.3 109.6 -24.6 5.5 22.7 47 49 A V E -D 77 0B 32 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.947 6.3-177.6-104.2 109.8 -23.6 4.5 19.2 48 50 A S E +D 76 0B 54 28,-3.1 28,-2.3 -2,-0.6 3,-0.2 -0.815 24.6 142.3-118.6 87.6 -25.1 7.0 16.8 49 51 A Y > + 0 0 4 -2,-0.7 3,-2.1 26,-0.2 130,-0.2 0.254 31.3 111.3-109.0 5.3 -24.2 6.0 13.3 50 52 A D T 3 S+ 0 0 101 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.788 87.6 37.5 -52.9 -35.3 -27.4 6.9 11.5 51 53 A Q T 3 S+ 0 0 105 23,-0.8 -1,-0.3 -3,-0.2 24,-0.2 0.178 83.5 145.9-104.2 21.7 -25.8 9.7 9.6 52 54 A A < - 0 0 24 -3,-2.1 2,-0.5 1,-0.1 23,-0.1 -0.267 33.0-159.0 -60.5 139.3 -22.4 8.1 9.0 53 55 A T - 0 0 53 16,-0.3 16,-2.8 122,-0.1 2,-0.1 -0.886 4.8-164.4-124.4 94.6 -20.8 9.0 5.7 54 56 A S E +E 68 0B 1 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.518 11.7 173.9 -75.3 152.2 -18.2 6.5 4.5 55 57 A L E - 0 0 76 12,-3.2 118,-2.1 1,-0.4 2,-0.3 0.684 49.3 -4.7-123.1 -45.1 -16.0 7.7 1.7 56 58 A R E -EF 67 172B 87 11,-1.0 11,-3.0 117,-0.3 -1,-0.4 -0.979 46.6-134.4-156.5 156.3 -13.1 5.4 0.8 57 59 A I E -EF 66 171B 0 114,-2.4 114,-2.3 -2,-0.3 2,-0.4 -0.988 27.0-170.9-122.8 135.7 -11.4 2.1 1.6 58 60 A L E -EF 65 170B 32 7,-2.2 7,-2.5 -2,-0.4 2,-0.7 -0.988 24.2-145.8-133.5 131.4 -7.6 2.1 1.7 59 61 A N E -E 64 0B 0 110,-2.9 109,-3.0 -2,-0.4 5,-0.2 -0.882 21.5-179.5 -88.6 111.0 -5.0 -0.7 2.0 60 62 A N - 0 0 45 3,-1.9 4,-0.1 -2,-0.7 -1,-0.1 0.271 51.8-101.7 -98.8 13.4 -2.2 1.0 4.0 61 63 A G S S+ 0 0 6 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.362 117.7 56.1 87.4 -7.6 0.2 -1.9 4.1 62 64 A H S S- 0 0 39 1,-0.6 2,-0.3 -58,-0.1 166,-0.1 0.588 124.7 -34.7-123.8 -34.5 -0.8 -2.9 7.6 63 65 A A S S- 0 0 6 -5,-0.1 -3,-1.9 164,-0.1 -1,-0.6 -0.846 70.9 -88.3-162.5-166.8 -4.6 -3.4 7.4 64 66 A F E -E 59 0B 0 29,-0.3 2,-0.5 -2,-0.3 29,-0.5 -0.989 34.2-151.6-120.1 141.3 -7.4 -1.7 5.4 65 67 A N E -E 58 0B 21 -7,-2.5 -7,-2.2 -2,-0.4 2,-0.7 -0.928 9.5-152.0-112.9 133.0 -9.3 1.3 6.6 66 68 A V E -EG 57 91B 0 25,-2.8 25,-2.0 -2,-0.5 2,-0.3 -0.914 30.7-150.7 -94.5 117.0 -12.8 2.3 5.8 67 69 A E E -EG 56 90B 45 -11,-3.0 -12,-3.2 -2,-0.7 -11,-1.0 -0.688 10.6-158.5-100.7 144.0 -12.7 6.1 6.1 68 70 A F E -E 54 0B 9 21,-2.5 2,-0.8 -2,-0.3 -14,-0.2 -0.850 29.6-103.4-117.7 154.1 -15.5 8.4 7.1 69 71 A D + 0 0 49 -16,-2.8 -16,-0.3 -2,-0.3 5,-0.3 -0.665 40.7 171.3 -75.4 110.0 -16.3 12.1 6.7 70 72 A D + 0 0 42 -2,-0.8 -1,-0.1 1,-0.2 17,-0.1 0.022 43.5 110.1-110.9 26.3 -15.5 13.4 10.1 71 73 A S S S+ 0 0 80 2,-0.0 2,-0.3 3,-0.0 -1,-0.2 0.501 90.3 15.9 -77.4 -6.9 -15.9 17.1 9.2 72 74 A Q S S- 0 0 116 -3,-0.3 2,-2.6 3,-0.1 3,-0.3 -0.925 102.3 -79.9-153.4 167.7 -19.1 17.2 11.3 73 75 A D S S+ 0 0 87 -2,-0.3 3,-0.2 1,-0.2 -22,-0.1 -0.336 74.1 135.7 -73.2 68.5 -20.8 15.1 14.0 74 76 A K S S+ 0 0 61 -2,-2.6 -23,-0.8 1,-0.3 2,-0.3 0.737 74.8 16.6 -85.4 -24.1 -22.2 12.6 11.5 75 77 A A S S+ 0 0 4 -3,-0.3 13,-2.8 -24,-0.2 2,-0.3 -0.884 82.4 169.7-152.3 110.6 -21.4 9.4 13.4 76 78 A V E -DH 48 87B 15 -28,-2.3 -28,-3.1 -2,-0.3 2,-0.4 -0.930 29.5-145.3-136.0 158.5 -20.5 9.5 17.0 77 79 A L E +DH 47 86B 0 9,-2.6 9,-2.3 -2,-0.3 2,-0.3 -0.974 32.7 155.6-118.3 132.7 -19.9 7.5 20.1 78 80 A K E +D 46 0B 81 -32,-2.3 -32,-2.8 -2,-0.4 7,-0.1 -0.893 34.5 35.5-145.9 174.7 -20.9 8.8 23.4 79 81 A G E > S+D 45 0B 10 5,-0.5 3,-2.5 3,-0.3 -34,-0.3 -0.315 73.0 81.7 74.9-160.1 -21.9 7.6 26.9 80 82 A G T 3 S- 0 0 4 -36,-1.4 -37,-1.3 -37,-0.3 -1,-0.1 -0.389 121.8 -21.3 57.0-130.3 -20.4 4.6 28.6 81 83 A P T 3 S+ 0 0 46 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.477 115.3 111.8 -83.9 -0.7 -17.1 5.6 30.2 82 84 A L < - 0 0 6 -3,-2.5 2,-0.6 -39,-0.1 -3,-0.3 -0.515 55.4-152.7 -87.1 139.9 -16.8 8.6 27.8 83 85 A D - 0 0 104 -2,-0.2 2,-0.2 53,-0.1 -1,-0.0 -0.935 69.2 -14.9-100.3 120.7 -17.0 12.3 28.6 84 86 A G S S- 0 0 38 -2,-0.6 -5,-0.5 38,-0.1 2,-0.4 -0.481 100.8 -36.3 89.0-155.6 -18.3 14.2 25.6 85 87 A T - 0 0 35 -2,-0.2 38,-2.6 -7,-0.1 2,-0.5 -0.937 41.8-163.6-121.3 131.5 -18.6 13.3 22.0 86 88 A Y E -HI 77 122B 4 -9,-2.3 -9,-2.6 -2,-0.4 2,-0.4 -0.969 15.4-143.0-120.1 125.6 -16.2 11.1 19.9 87 89 A R E -HI 76 121B 37 34,-2.9 34,-2.1 -2,-0.5 2,-0.3 -0.727 17.4-118.8 -94.0 133.8 -16.4 11.3 16.1 88 90 A L E + I 0 120B 2 -13,-2.8 32,-0.3 -2,-0.4 -14,-0.1 -0.499 37.7 164.9 -66.9 127.2 -16.0 8.2 13.9 89 91 A I E - 0 0 37 30,-2.7 -21,-2.5 1,-0.4 2,-0.3 0.715 60.2 -25.0-111.3 -38.5 -13.0 8.6 11.6 90 92 A Q E -GI 67 119B 35 29,-1.1 29,-3.0 -23,-0.2 -1,-0.4 -0.982 47.7-142.5-163.0 161.9 -12.3 5.1 10.3 91 93 A F E +GI 66 118B 0 -25,-2.0 -25,-2.8 -2,-0.3 2,-0.3 -0.972 23.4 161.8-128.7 160.2 -12.7 1.4 11.0 92 94 A H E - I 0 117B 22 25,-1.9 25,-3.1 -2,-0.3 2,-0.3 -0.921 23.2-125.8-157.1 176.6 -10.3 -1.5 10.3 93 95 A F E - I 0 116B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.3 -0.867 0.8-150.4-127.6 161.4 -9.6 -5.0 11.3 94 96 A H E + I 0 115B 3 21,-2.0 21,-2.3 -2,-0.3 2,-0.3 -0.975 31.0 167.0-124.7 140.3 -6.9 -7.3 12.6 95 97 A W E - I 0 114B 0 -2,-0.4 146,-1.2 19,-0.2 145,-0.9 -0.941 24.3-115.3-152.7 171.2 -7.0 -10.9 11.7 96 98 A G - 0 0 0 17,-1.4 6,-0.1 5,-0.6 3,-0.1 -0.454 24.3-118.8-106.1 177.2 -5.0 -14.2 11.6 97 99 A S S S+ 0 0 43 -2,-0.2 2,-0.3 142,-0.1 5,-0.1 0.662 105.9 24.7 -84.1 -21.2 -3.6 -16.7 9.2 98 100 A L S > S- 0 0 120 3,-0.2 3,-1.5 15,-0.1 -2,-0.1 -0.912 91.9-104.7-140.4 162.3 -5.9 -19.3 10.8 99 101 A D T 3 S+ 0 0 71 -2,-0.3 48,-0.1 1,-0.3 15,-0.1 0.727 110.4 70.3 -70.6 -18.5 -9.2 -19.1 12.7 100 102 A G T 3 S+ 0 0 58 13,-0.1 2,-0.3 2,-0.1 11,-0.3 0.362 106.1 29.2 -80.1 6.2 -7.5 -19.7 16.0 101 103 A Q < + 0 0 64 -3,-1.5 -5,-0.6 12,-0.1 -3,-0.2 -0.971 66.0 97.4-155.9 162.4 -5.8 -16.4 16.1 102 104 A G + 0 0 0 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 -0.009 55.2 105.7 144.8 -32.8 -6.2 -12.8 14.9 103 105 A S - 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