==== 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) 18-DEC-92 1DCA . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.A.IPPOLITO,D.W.CHRISTIANSON . 255 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11514.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 65.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 22.0 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 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 6.3 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 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 . 2 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 5 A W 0 0 107 0, 0.0 2,-0.2 0, 0.0 7,-0.2 0.000 360.0 360.0 360.0 147.5 7.7 -1.5 11.6 2 6 A G - 0 0 12 5,-2.4 10,-0.1 2,-0.2 58,-0.1 -0.700 360.0 -87.7-161.6-151.2 5.4 -4.3 10.5 3 7 A Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.113 84.0 114.6-126.4 11.3 4.4 -7.7 11.8 4 8 A G S > S- 0 0 22 4,-0.1 4,-1.6 1,-0.1 -2,-0.2 -0.150 82.9 -95.7 -77.1 177.1 7.2 -9.7 10.4 5 9 A K T 4 S+ 0 0 164 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.738 123.9 33.1 -64.9 -28.6 10.1 -11.6 12.1 6 10 A H T 4 S+ 0 0 164 1,-0.1 -1,-0.2 4,-0.0 -3,-0.0 0.543 131.8 30.3-106.4 -18.8 12.5 -8.6 11.8 7 11 A N T 4 S+ 0 0 69 -3,-0.1 -5,-2.4 -6,-0.0 -2,-0.2 0.213 92.5 128.2-124.4 11.1 10.1 -5.7 12.2 8 12 A G S >X S- 0 0 0 -4,-1.6 3,-2.3 -5,-0.2 4,-0.5 0.180 78.9 -81.4 -66.5 177.4 7.5 -7.2 14.3 9 13 A P G >4 S+ 0 0 24 0, 0.0 3,-0.6 0, 0.0 4,-0.4 0.742 125.1 65.1 -52.0 -33.3 5.8 -6.1 17.6 10 14 A E G 34 S+ 0 0 105 1,-0.2 3,-0.1 2,-0.1 -5,-0.1 0.684 107.2 44.2 -64.7 -15.5 8.8 -7.4 19.6 11 15 A H G X4 S+ 0 0 48 -3,-2.3 3,-1.7 1,-0.1 4,-0.4 0.554 84.1 92.3-103.4 -20.8 10.9 -4.8 17.8 12 16 A W G XX S+ 0 0 5 -3,-0.6 4,-3.1 -4,-0.5 3,-1.1 0.792 71.7 72.3 -53.2 -33.4 8.7 -1.7 18.0 13 17 A H G 34 S+ 0 0 68 -4,-0.4 -1,-0.3 1,-0.3 7,-0.1 0.682 86.8 67.0 -54.9 -25.7 10.2 -0.4 21.3 14 18 A K G <4 S+ 0 0 132 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.906 117.8 20.4 -65.0 -41.3 13.3 0.5 19.4 15 19 A D T <4 S+ 0 0 128 -3,-1.1 -2,-0.2 -4,-0.4 -1,-0.2 0.695 135.6 40.7 -96.6 -22.1 11.6 3.3 17.4 16 20 A F >< - 0 0 57 -4,-3.1 3,-2.0 -5,-0.2 -1,-0.2 -0.814 62.8-180.0-132.7 86.6 8.7 3.7 19.8 17 21 A P G > S+ 0 0 101 0, 0.0 3,-1.6 0, 0.0 -4,-0.1 0.666 77.2 73.8 -56.7 -21.7 9.8 3.5 23.4 18 22 A I G > S+ 0 0 57 1,-0.3 3,-3.6 179,-0.2 -5,-0.1 0.751 71.9 91.0 -69.0 -17.3 6.3 4.0 24.7 19 23 A A G < S+ 0 0 8 -3,-2.0 -1,-0.3 1,-0.3 -6,-0.1 0.645 90.8 42.3 -47.9 -27.5 5.9 0.5 23.5 20 24 A K G < S+ 0 0 139 -3,-1.6 -1,-0.3 -7,-0.1 -2,-0.2 0.036 94.7 125.3-114.8 27.6 6.9 -0.6 27.1 21 25 A G S < S- 0 0 14 -3,-3.6 3,-0.4 1,-0.0 -3,-0.1 0.159 73.7 -94.2 -75.2-170.9 4.9 2.1 28.9 22 26 A E S S+ 0 0 122 1,-0.2 227,-0.3 169,-0.0 -3,-0.1 0.672 113.0 37.6 -80.3 -25.3 2.3 1.9 31.6 23 27 A R S S+ 0 0 50 168,-0.1 2,-0.2 2,-0.0 -1,-0.2 -0.415 79.0 155.3-133.7 63.4 -1.0 1.8 29.7 24 28 A Q - 0 0 0 -3,-0.4 220,-0.2 221,-0.4 170,-0.1 -0.579 32.4 -98.9 -88.7 151.3 -0.3 -0.2 26.6 25 29 A S S S+ 0 0 0 168,-0.4 2,-0.1 -2,-0.2 -2,-0.0 -0.843 78.0 37.1-123.8 146.9 -2.8 -2.2 24.4 26 30 A P + 0 0 0 0, 0.0 218,-2.9 0, 0.0 2,-0.3 0.689 67.7 176.7 -88.1 173.5 -4.2 -4.9 23.7 27 31 A V B -a 244 0A 1 216,-0.3 77,-1.1 -2,-0.1 2,-0.4 -0.922 35.9 -98.2-142.6 164.9 -4.6 -6.8 27.1 28 32 A D E -b 104 0B 29 216,-0.5 2,-0.8 -2,-0.3 77,-0.2 -0.782 33.8-138.8 -91.4 129.3 -6.1 -10.0 28.3 29 33 A I E -b 105 0B 0 75,-3.2 77,-2.6 -2,-0.4 2,-0.9 -0.867 11.8-159.9 -92.0 106.4 -9.5 -9.5 29.8 30 34 A D >> - 0 0 66 -2,-0.8 4,-1.4 75,-0.2 3,-1.1 -0.826 3.0-162.6 -89.1 108.2 -9.7 -11.6 33.0 31 35 A T T 34 S+ 0 0 46 -2,-0.9 -1,-0.2 1,-0.2 222,-0.0 0.710 86.5 52.0 -64.6 -25.2 -13.5 -11.8 33.4 32 36 A H T 34 S+ 0 0 165 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.607 114.3 43.6 -86.5 -15.8 -13.3 -12.9 37.1 33 37 A T T <4 S+ 0 0 98 -3,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.568 88.8 105.8-103.9 -16.8 -11.1 -10.0 37.9 34 38 A A S < S- 0 0 19 -4,-1.4 2,-0.6 1,-0.1 218,-0.2 -0.414 71.8-126.6 -65.4 141.8 -13.0 -7.4 36.0 35 39 A K E -d 252 0C 118 216,-2.7 218,-2.5 -2,-0.1 2,-0.3 -0.837 8.1-134.9-100.2 118.7 -15.0 -5.1 38.2 36 40 A Y E -d 253 0C 127 -2,-0.6 218,-0.2 216,-0.2 3,-0.1 -0.531 23.9-162.7 -66.4 124.0 -18.8 -4.6 37.7 37 41 A D > - 0 0 30 216,-2.6 3,-1.6 -2,-0.3 -1,-0.1 -0.949 15.0-168.4-119.7 106.5 -19.3 -0.9 37.9 38 42 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.638 85.8 68.0 -62.4 -22.1 -22.9 0.1 38.5 39 43 A S T 3 S+ 0 0 83 -3,-0.1 2,-0.5 2,-0.1 215,-0.1 0.462 74.7 109.6 -83.3 -0.7 -22.0 3.8 37.8 40 44 A L < - 0 0 29 -3,-1.6 3,-0.1 213,-0.2 -3,-0.0 -0.680 62.3-144.8 -80.8 123.4 -21.3 2.9 34.1 41 45 A K - 0 0 115 37,-0.8 39,-0.1 -2,-0.5 2,-0.1 -0.450 28.5 -89.3 -82.3 159.0 -23.9 4.4 31.8 42 46 A P - 0 0 111 0, 0.0 36,-1.4 0, 0.0 -1,-0.1 -0.361 47.0-103.0 -65.3 151.6 -25.1 2.6 28.7 43 47 A L E -E 77 0C 16 141,-0.3 2,-0.4 34,-0.3 34,-0.2 -0.456 26.4-147.5 -76.6 152.0 -23.2 3.3 25.4 44 48 A S E -E 76 0C 43 32,-2.8 32,-1.3 -2,-0.1 2,-0.8 -0.886 15.0-176.6-129.1 96.5 -24.8 5.6 22.9 45 49 A V E +E 75 0C 34 -2,-0.4 2,-0.7 30,-0.2 30,-0.2 -0.827 3.7 177.2 -98.5 104.2 -24.0 4.7 19.3 46 50 A S E +E 74 0C 34 28,-2.8 28,-2.2 -2,-0.8 3,-0.2 -0.822 24.3 139.4-109.7 88.7 -25.5 7.2 16.8 47 51 A Y > + 0 0 3 -2,-0.7 3,-1.6 26,-0.2 130,-0.2 0.185 33.3 109.3-115.5 15.3 -24.4 6.1 13.4 48 52 A D T 3 S+ 0 0 100 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.778 85.7 44.1 -60.3 -35.0 -27.7 6.8 11.4 49 53 A Q T 3 S+ 0 0 109 23,-1.0 -1,-0.3 -3,-0.2 24,-0.2 0.152 82.2 148.4 -97.8 14.4 -26.0 9.8 9.7 50 54 A A < - 0 0 23 -3,-1.6 2,-0.5 22,-0.1 123,-0.1 -0.193 31.0-160.5 -55.5 135.2 -22.6 8.1 8.8 51 55 A T - 0 0 52 16,-0.3 16,-2.3 122,-0.1 2,-0.1 -0.897 6.5-164.1-120.8 102.8 -20.9 9.3 5.7 52 56 A S E +F 66 0C 1 -2,-0.5 121,-0.5 122,-0.3 14,-0.2 -0.477 10.2 178.1 -85.0 151.9 -18.3 6.8 4.4 53 57 A L E - 0 0 72 12,-2.5 118,-2.3 1,-0.4 2,-0.3 0.699 49.9 -27.6-120.8 -49.2 -15.8 8.0 1.8 54 58 A R E -FG 65 170C 81 11,-0.9 11,-2.6 116,-0.3 2,-0.4 -0.984 42.6-124.1-168.0 167.8 -13.2 5.3 0.8 55 59 A I E -FG 64 169C 0 114,-2.6 114,-2.7 -2,-0.3 2,-0.3 -0.938 30.3-176.4-125.1 140.0 -11.3 2.2 1.7 56 60 A L E -FG 63 168C 28 7,-1.9 7,-2.3 -2,-0.4 2,-0.7 -0.993 29.6-132.9-144.8 147.2 -7.5 1.9 1.6 57 61 A N E +F 62 0C 2 110,-3.3 109,-3.5 -2,-0.3 5,-0.2 -0.895 21.2 179.2 -98.1 112.7 -4.7 -0.5 2.0 58 62 A N - 0 0 33 3,-2.2 4,-0.1 -2,-0.7 -1,-0.1 0.234 55.0-102.2 -95.9 4.8 -2.0 1.2 4.2 59 63 A G S S+ 0 0 11 2,-0.4 3,-0.1 166,-0.2 106,-0.1 0.262 117.5 53.5 89.7 -9.9 0.3 -1.8 4.1 60 64 A H S S- 0 0 51 1,-0.6 2,-0.3 -58,-0.1 -1,-0.1 0.566 123.2 -23.7-122.5 -25.8 -0.6 -3.0 7.6 61 65 A A - 0 0 4 165,-0.1 -3,-2.2 164,-0.1 -1,-0.6 -0.923 69.1 -89.8-165.7-176.2 -4.4 -3.2 7.3 62 66 A F E -F 57 0C 0 -2,-0.3 29,-0.5 29,-0.3 2,-0.4 -0.935 37.6-157.7-114.9 135.1 -7.4 -1.8 5.3 63 67 A N E -F 56 0C 21 -7,-2.3 -7,-1.9 -2,-0.4 2,-0.6 -0.953 11.7-155.7-117.9 133.5 -9.1 1.3 6.6 64 68 A V E -FH 55 89C 0 25,-2.5 25,-1.7 -2,-0.4 2,-0.3 -0.949 25.3-154.6-106.3 112.5 -12.6 2.5 5.9 65 69 A E E -FH 54 88C 49 -11,-2.6 -12,-2.5 -2,-0.6 -11,-0.9 -0.678 8.0-160.6 -96.2 146.4 -12.6 6.3 6.4 66 70 A F E -F 52 0C 7 21,-2.8 2,-0.6 -2,-0.3 -14,-0.2 -0.917 30.4-101.8-126.7 153.0 -15.5 8.6 7.3 67 71 A D + 0 0 42 -16,-2.3 -16,-0.3 -2,-0.3 5,-0.3 -0.675 39.1 175.1 -72.8 116.0 -16.2 12.3 7.0 68 72 A D + 0 0 41 -2,-0.6 -1,-0.1 1,-0.1 17,-0.1 -0.240 46.9 106.1-118.9 36.0 -15.6 13.6 10.5 69 73 A S S S+ 0 0 80 1,-0.1 2,-0.3 56,-0.0 -1,-0.1 0.525 88.5 26.7 -93.1 -6.4 -16.1 17.3 9.8 70 74 A Q S S- 0 0 120 -3,-0.2 2,-2.1 3,-0.1 3,-0.4 -0.941 98.6 -91.7-148.0 159.0 -19.5 17.3 11.5 71 75 A D S S+ 0 0 83 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.531 75.3 129.5 -75.2 79.8 -21.1 15.2 14.3 72 76 A K S S+ 0 0 43 -2,-2.1 -23,-1.0 1,-0.3 2,-0.5 0.778 74.6 26.1-104.2 -40.0 -22.7 12.6 11.8 73 77 A A S S+ 0 0 8 -3,-0.4 13,-2.5 13,-0.2 -1,-0.3 -0.958 85.5 166.9-130.1 108.4 -21.5 9.3 13.4 74 78 A V E -EI 46 85C 13 -28,-2.2 -28,-2.8 -2,-0.5 2,-0.4 -0.875 28.6-153.6-129.2 162.1 -20.9 9.7 17.1 75 79 A L E +EI 45 84C 0 9,-2.4 9,-1.9 -2,-0.3 2,-0.3 -0.976 27.3 150.6-130.5 137.2 -20.3 7.7 20.3 76 80 A K E +E 44 0C 74 -32,-1.3 -32,-2.8 -2,-0.4 7,-0.1 -0.909 34.6 45.9-157.0 174.3 -21.2 8.9 23.8 77 81 A G E > S+E 43 0C 22 5,-0.3 3,-2.0 -2,-0.3 -34,-0.3 -0.345 70.9 83.4 80.9-159.9 -22.2 7.5 27.2 78 82 A G T 3 S- 0 0 1 -36,-1.4 -37,-0.8 1,-0.3 -1,-0.1 -0.433 121.2 -28.4 63.9-139.7 -20.4 4.6 28.8 79 83 A P T 3 S+ 0 0 45 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.321 116.6 109.8 -86.5 -0.8 -17.3 5.8 30.6 80 84 A L < - 0 0 10 -3,-2.0 2,-0.4 -39,-0.1 -3,-0.2 -0.497 52.9-158.6 -81.5 150.5 -17.0 8.7 28.1 81 85 A D + 0 0 121 -2,-0.2 2,-0.1 53,-0.1 -5,-0.0 -0.995 65.8 5.1-123.2 126.9 -17.6 12.3 28.8 82 86 A G S S- 0 0 49 -2,-0.4 2,-0.3 38,-0.1 -5,-0.3 -0.206 99.1 -56.2 87.1 173.1 -18.3 14.5 25.6 83 87 A T - 0 0 33 -7,-0.1 38,-2.4 -2,-0.1 2,-0.4 -0.742 41.5-159.9 -96.5 139.3 -18.9 13.3 22.1 84 88 A Y E -IJ 75 120C 5 -9,-1.9 -9,-2.4 -2,-0.3 2,-0.3 -0.995 13.0-140.4-123.8 125.9 -16.5 11.3 20.0 85 89 A R E -IJ 74 119C 46 34,-2.0 34,-1.8 -2,-0.4 2,-0.3 -0.750 17.8-117.6 -92.5 137.9 -16.6 11.2 16.2 86 90 A L E + J 0 118C 2 -13,-2.5 32,-0.2 -2,-0.3 -13,-0.2 -0.597 39.9 162.8 -70.7 124.6 -16.1 8.1 14.0 87 91 A I E - 0 0 30 30,-2.9 -21,-2.8 1,-0.4 2,-0.3 0.661 61.2 -24.6-113.6 -42.1 -13.1 8.8 11.8 88 92 A Q E -HJ 65 117C 35 29,-1.3 29,-3.2 -23,-0.2 -1,-0.4 -0.979 46.2-147.3-163.4 168.8 -12.3 5.3 10.7 89 93 A F E +HJ 64 116C 0 -25,-1.7 -25,-2.5 -2,-0.3 2,-0.3 -0.972 20.2 165.2-143.6 152.4 -12.5 1.5 11.3 90 94 A H E - J 0 115C 16 25,-1.6 25,-2.6 -2,-0.3 2,-0.3 -0.874 22.5-128.0-154.1 172.5 -10.1 -1.3 10.5 91 95 A F E - J 0 114C 1 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.3 -0.868 1.1-148.3-129.8 164.2 -9.6 -5.0 11.4 92 96 A H E + J 0 113C 3 21,-1.8 21,-1.9 -2,-0.3 2,-0.3 -0.981 29.3 169.8-129.1 130.2 -6.8 -7.3 12.7 93 97 A W E - J 0 112C 0 -2,-0.4 146,-1.2 19,-0.2 145,-0.4 -0.902 22.9-124.0-141.1 170.9 -7.0 -11.0 11.7 94 98 A G - 0 0 0 17,-1.2 6,-0.1 5,-0.7 3,-0.1 -0.385 25.6-116.4-107.1-177.6 -4.9 -14.1 11.7 95 99 A S S S+ 0 0 41 142,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.703 106.0 36.7 -88.7 -23.1 -3.6 -16.7 9.3 96 100 A L S > S- 0 0 107 3,-0.1 3,-1.3 1,-0.0 -2,-0.3 -0.822 88.4-113.9-126.1 166.7 -5.8 -19.2 11.1 97 101 A D T 3 S+ 0 0 74 -2,-0.3 48,-0.1 1,-0.3 15,-0.1 0.735 110.8 65.9 -70.4 -29.4 -9.2 -19.1 12.7 98 102 A G T 3 S+ 0 0 56 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.371 108.3 33.4 -73.3 -2.8 -7.7 -19.7 16.2 99 103 A Q < + 0 0 54 -3,-1.3 -5,-0.7 12,-0.2 139,-0.1 -0.964 65.8 94.0-150.1 162.6 -5.8 -16.3 16.2 100 104 A G + 0 0 1 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 -0.061 57.7 104.1 143.6 -30.4 -6.3 -12.8 14.9 101 105 A S - 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