==== 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 24-JUL-96 1UGF . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.R.SCOLNICK,D.W.CHRISTIANSON . 257 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11887.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 63.0 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 . 57 22.2 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 . 21 8.2 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 . 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 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 2 2 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 0 249 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -78.9 13.3 -0.6 7.0 2 4 A H - 0 0 106 1,-0.2 0, 0.0 15,-0.0 0, 0.0 -0.372 360.0 -54.7-106.4-175.3 10.2 0.3 9.1 3 5 A W + 0 0 59 -2,-0.1 2,-0.2 1,-0.1 -1,-0.2 -0.076 60.0 131.5 -60.5 152.4 7.7 -1.5 11.4 4 6 A G - 0 0 12 5,-2.6 10,-0.1 2,-0.2 -1,-0.1 -0.775 64.5 -84.1-166.0-149.8 5.6 -4.4 10.5 5 7 A Y S S+ 0 0 24 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.145 82.3 112.8-126.3 17.4 4.6 -7.8 11.8 6 8 A G S > S- 0 0 30 1,-0.1 4,-2.0 4,-0.1 3,-0.3 -0.333 83.2 -99.4 -87.4 173.9 7.5 -9.9 10.6 7 9 A K T 4 S+ 0 0 170 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.818 124.1 40.2 -61.0 -30.8 10.2 -11.6 12.5 8 10 A H T 4 S+ 0 0 172 1,-0.1 -1,-0.2 5,-0.0 -5,-0.0 0.696 131.6 21.8 -96.0 -14.1 12.6 -8.7 11.8 9 11 A N T 4 S+ 0 0 59 -3,-0.3 -5,-2.6 -6,-0.1 -2,-0.2 0.196 95.4 122.2-136.7 16.1 10.2 -5.8 12.2 10 12 A G S >X S- 0 0 4 -4,-2.0 3,-3.0 -5,-0.2 4,-0.8 -0.032 80.8 -69.9 -75.6-178.0 7.4 -7.2 14.4 11 13 A P T 34 S+ 0 0 29 0, 0.0 3,-0.5 0, 0.0 4,-0.4 0.718 126.2 61.3 -40.0 -40.1 5.9 -6.2 17.8 12 14 A E T 34 S+ 0 0 164 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.613 107.7 44.9 -69.1 -12.9 9.0 -7.3 19.8 13 15 A H T X4 S+ 0 0 59 -3,-3.0 3,-2.0 1,-0.1 4,-0.5 0.613 86.2 90.8-104.5 -16.5 11.2 -4.7 17.9 14 16 A W G >X S+ 0 0 6 -4,-0.8 4,-2.5 -3,-0.5 3,-0.9 0.775 71.9 71.4 -53.1 -31.4 8.8 -1.7 18.1 15 17 A H G 34 S+ 0 0 70 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.731 88.1 65.7 -59.0 -24.9 10.3 -0.4 21.3 16 18 A K G <4 S+ 0 0 128 -3,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.894 116.7 23.1 -66.8 -41.0 13.5 0.6 19.5 17 19 A D T <4 S+ 0 0 109 -3,-0.9 -2,-0.2 -4,-0.5 -1,-0.2 0.673 134.9 38.4 -97.6 -19.8 11.7 3.3 17.4 18 20 A F >< - 0 0 40 -4,-2.5 3,-2.3 1,-0.1 -1,-0.2 -0.740 64.3-175.7-134.0 85.5 8.8 3.8 19.8 19 21 A P G > S+ 0 0 101 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.736 77.9 74.8 -51.1 -28.3 10.0 3.7 23.5 20 22 A I G > + 0 0 57 1,-0.3 3,-2.9 2,-0.2 -5,-0.1 0.645 69.4 89.0 -65.4 -10.2 6.4 4.0 24.7 21 23 A A G < S+ 0 0 8 -3,-2.3 -1,-0.3 1,-0.3 -6,-0.1 0.740 91.9 46.3 -57.0 -23.4 5.9 0.4 23.6 22 24 A K G < S+ 0 0 144 -3,-1.8 -1,-0.3 -4,-0.1 -2,-0.2 0.108 94.0 127.5-106.2 21.2 7.0 -0.4 27.2 23 25 A G S < S- 0 0 17 -3,-2.9 3,-0.4 1,-0.1 -3,-0.0 0.137 72.1-100.8 -68.4-170.8 4.8 2.2 28.8 24 26 A E S S+ 0 0 123 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.567 111.4 37.1 -92.3 -15.2 2.3 2.0 31.6 25 27 A R S S+ 0 0 49 224,-0.1 -1,-0.2 168,-0.1 2,-0.2 -0.326 79.1 152.6-134.9 54.9 -1.0 1.9 29.7 26 28 A Q - 0 0 5 -3,-0.4 220,-0.2 221,-0.3 170,-0.1 -0.534 33.2 -99.4 -86.5 151.7 -0.3 -0.2 26.6 27 29 A S S S+ 0 0 0 168,-0.4 2,-0.1 -2,-0.2 -2,-0.0 -0.846 76.6 40.3-125.2 160.3 -2.9 -2.3 24.7 28 30 A P + 0 0 0 0, 0.0 218,-3.1 0, 0.0 2,-0.3 0.616 64.3 174.9 -82.4-179.2 -4.1 -4.8 24.0 29 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.1 2,-0.4 -0.893 36.4 -98.8-140.4 166.0 -4.5 -6.8 27.3 30 32 A D E -a 106 0A 35 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.755 33.9-136.8 -88.0 135.0 -6.1 -10.0 28.4 31 33 A I E -a 107 0A 0 75,-2.9 77,-2.8 -2,-0.4 2,-0.9 -0.856 12.4-159.9 -97.6 106.5 -9.5 -9.5 29.9 32 34 A D >> - 0 0 66 -2,-0.8 4,-1.1 75,-0.2 3,-1.0 -0.806 2.4-161.1 -85.6 109.8 -9.8 -11.7 33.1 33 35 A T T 34 S+ 0 0 46 -2,-0.9 -1,-0.1 1,-0.2 222,-0.0 0.682 85.8 54.6 -66.5 -20.3 -13.6 -11.9 33.6 34 36 A H T 34 S+ 0 0 168 1,-0.2 -1,-0.2 -3,-0.0 -2,-0.0 0.615 113.0 40.3 -90.0 -13.4 -13.3 -12.9 37.2 35 37 A T T <4 S+ 0 0 103 -3,-1.0 -2,-0.2 2,-0.1 2,-0.2 0.507 87.7 110.7-107.6 -11.9 -11.2 -10.0 38.2 36 38 A A S < S- 0 0 20 -4,-1.1 2,-0.6 216,-0.1 218,-0.2 -0.477 70.4-126.5 -65.7 133.2 -13.0 -7.4 36.1 37 39 A K E -c 254 0B 106 216,-2.4 218,-2.5 -2,-0.2 2,-0.4 -0.734 9.9-135.2 -89.9 117.0 -15.0 -5.0 38.4 38 40 A Y E -c 255 0B 122 -2,-0.6 218,-0.2 216,-0.2 216,-0.0 -0.560 22.6-162.4 -67.9 123.4 -18.7 -4.6 37.8 39 41 A D > - 0 0 29 216,-2.7 3,-1.5 -2,-0.4 -1,-0.1 -0.915 13.7-168.0-115.0 109.3 -19.3 -0.9 38.1 40 42 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.589 84.9 64.9 -68.3 -14.3 -23.0 0.1 38.6 41 43 A S T 3 S+ 0 0 81 2,-0.1 2,-0.2 40,-0.0 215,-0.1 0.492 74.3 111.0 -88.1 -4.7 -22.2 3.8 37.9 42 44 A L < - 0 0 33 -3,-1.5 3,-0.1 213,-0.2 38,-0.0 -0.538 65.0-136.2 -70.8 132.7 -21.3 3.1 34.3 43 45 A K - 0 0 128 37,-1.0 39,-0.1 -2,-0.2 -1,-0.1 -0.427 26.7 -89.9 -86.0 161.3 -23.9 4.5 31.8 44 46 A P - 0 0 107 0, 0.0 36,-2.0 0, 0.0 2,-0.2 -0.365 49.0-102.5 -67.4 154.0 -25.3 2.7 28.8 45 47 A L E -D 79 0B 18 141,-0.2 2,-0.5 34,-0.2 34,-0.2 -0.572 28.5-151.8 -77.2 144.1 -23.4 3.2 25.5 46 48 A S E -D 78 0B 48 32,-2.6 32,-2.0 -2,-0.2 2,-0.6 -0.944 14.9-179.7-121.9 107.5 -24.9 5.6 23.0 47 49 A V E -D 77 0B 35 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.935 3.8-179.3-109.1 110.8 -24.0 4.8 19.4 48 50 A S E +D 76 0B 36 28,-2.7 28,-1.9 -2,-0.6 3,-0.2 -0.801 23.8 143.3-113.6 88.6 -25.5 7.3 16.8 49 51 A Y > + 0 0 1 -2,-0.7 3,-1.8 26,-0.2 130,-0.2 0.328 36.0 105.9-106.6 5.7 -24.4 6.1 13.4 50 52 A D T 3 S+ 0 0 97 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.790 84.5 43.8 -58.1 -30.5 -27.5 6.9 11.4 51 53 A Q T 3 S+ 0 0 127 23,-1.0 -1,-0.3 -3,-0.2 24,-0.2 0.092 84.3 146.0-102.9 23.2 -26.0 9.9 9.7 52 54 A A < - 0 0 24 -3,-1.8 2,-0.4 22,-0.1 123,-0.1 -0.249 32.3-161.9 -62.6 145.4 -22.6 8.2 8.9 53 55 A T - 0 0 45 16,-0.2 16,-2.5 122,-0.1 2,-0.2 -0.847 3.2-163.4-132.8 94.1 -20.8 9.1 5.7 54 56 A S E +E 68 0B 1 -2,-0.4 121,-0.6 122,-0.3 14,-0.3 -0.508 11.2 175.5 -74.5 149.4 -18.2 6.7 4.5 55 57 A L E - 0 0 76 12,-3.1 118,-2.3 1,-0.4 2,-0.3 0.734 50.6 -7.1-120.3 -49.9 -15.7 8.0 1.9 56 58 A R E -EF 67 172B 83 11,-0.8 11,-3.1 116,-0.3 -1,-0.4 -0.968 44.2-142.6-153.1 161.8 -13.0 5.7 1.0 57 59 A I E +EF 66 171B 0 114,-2.3 114,-2.4 -2,-0.3 2,-0.3 -0.965 28.0 179.0-127.8 138.7 -11.3 2.3 1.8 58 60 A L E -EF 65 170B 27 7,-2.1 7,-2.2 -2,-0.4 2,-0.8 -1.000 32.9-131.6-145.9 151.7 -7.5 1.9 1.5 59 61 A N E -E 64 0B 0 110,-2.6 109,-3.0 -2,-0.3 5,-0.2 -0.893 23.8-178.4-100.4 108.8 -4.8 -0.6 2.0 60 62 A N - 0 0 47 3,-1.8 4,-0.1 -2,-0.8 -1,-0.1 0.306 52.5-100.7 -92.7 9.1 -2.1 1.2 4.2 61 63 A G S S+ 0 0 17 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.215 117.5 52.5 94.9 -19.4 0.3 -1.7 4.3 62 64 A H S S- 0 0 42 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.536 125.9 -30.1-122.4 -15.5 -0.6 -2.9 7.8 63 65 A T S S- 0 0 0 164,-0.1 -3,-1.8 165,-0.1 -2,-0.5 -0.899 70.8 -89.5-176.4-171.0 -4.4 -3.3 7.4 64 66 A F E -E 59 0B 0 -2,-0.3 29,-0.6 -5,-0.2 2,-0.4 -0.983 34.8-155.9-124.3 134.3 -7.2 -1.7 5.4 65 67 A N E -EG 58 92B 18 -7,-2.2 -7,-2.1 -2,-0.4 2,-0.6 -0.918 10.4-151.1-111.1 143.3 -9.1 1.4 6.7 66 68 A V E -EG 57 91B 0 25,-2.4 25,-1.6 -2,-0.4 2,-0.3 -0.965 27.8-149.6-109.2 118.7 -12.6 2.5 5.8 67 69 A E E -EG 56 90B 53 -11,-3.1 -12,-3.1 -2,-0.6 -11,-0.8 -0.712 10.0-158.9 -96.6 148.1 -12.7 6.3 6.3 68 70 A F E -E 54 0B 8 21,-2.5 2,-0.8 -2,-0.3 -14,-0.2 -0.847 29.8-103.9-123.5 155.1 -15.5 8.6 7.3 69 71 A D + 0 0 41 -16,-2.5 3,-0.3 -2,-0.3 5,-0.2 -0.708 38.7 175.3 -77.6 109.1 -16.3 12.3 6.9 70 72 A D + 0 0 43 -2,-0.8 -1,-0.1 1,-0.2 17,-0.1 -0.102 45.1 109.6-107.6 34.2 -15.7 13.6 10.5 71 73 A S S S+ 0 0 75 1,-0.0 2,-0.3 56,-0.0 -1,-0.2 0.523 87.7 17.9 -84.8 -6.7 -16.2 17.3 9.7 72 74 A Q S S- 0 0 118 -3,-0.3 2,-2.3 3,-0.1 3,-0.4 -0.954 99.7 -80.9-153.7 167.0 -19.5 17.3 11.7 73 75 A D S S+ 0 0 89 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.481 76.6 130.1 -75.3 74.4 -21.3 15.2 14.3 74 76 A K S S+ 0 0 50 -2,-2.3 -23,-1.0 1,-0.3 2,-0.4 0.810 75.9 19.4 -94.2 -45.3 -22.6 12.6 11.8 75 77 A A S S+ 0 0 7 -3,-0.4 13,-2.6 13,-0.2 -1,-0.3 -0.944 86.3 167.2-130.7 107.0 -21.5 9.3 13.5 76 78 A V E -DH 48 87B 11 -28,-1.9 -28,-2.7 -2,-0.4 2,-0.4 -0.877 28.2-150.3-128.2 161.1 -20.8 9.8 17.2 77 79 A L E +DH 47 86B 0 9,-2.5 9,-2.2 -2,-0.3 2,-0.3 -0.977 29.2 146.4-127.8 134.6 -20.2 7.8 20.4 78 80 A K E +D 46 0B 57 -32,-2.0 -32,-2.6 -2,-0.4 7,-0.1 -0.917 35.5 46.9-154.3 177.5 -21.1 9.0 23.9 79 81 A G E > S+D 45 0B 24 5,-0.3 3,-2.3 3,-0.3 -34,-0.2 -0.376 72.8 80.1 80.4-158.4 -22.2 7.7 27.2 80 82 A G T 3 S- 0 0 2 -36,-2.0 -37,-1.0 1,-0.3 -1,-0.1 -0.391 122.1 -23.2 58.2-132.1 -20.7 4.6 28.8 81 83 A P T 3 S+ 0 0 40 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.368 115.8 109.4 -90.2 4.1 -17.4 5.6 30.5 82 84 A L < - 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