==== 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) 09-DEC-94 1CCS . 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) . 11517.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 169 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 22.4 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 . 3 1.2 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 . 27 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 14.1 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 . 1 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 5 A W 0 0 114 0, 0.0 2,-0.2 0, 0.0 7,-0.2 0.000 360.0 360.0 360.0 144.0 7.8 -1.5 11.4 2 6 A G - 0 0 12 5,-2.6 10,-0.1 2,-0.2 58,-0.1 -0.741 360.0 -83.3-166.4-149.4 5.5 -4.4 10.5 3 7 A Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.098 83.5 112.1-128.5 19.3 4.5 -7.8 11.8 4 8 A G S > S- 0 0 25 1,-0.1 4,-1.4 4,-0.1 -2,-0.2 -0.266 84.8 -96.2 -88.4 175.5 7.4 -9.9 10.5 5 9 A K T 4 S+ 0 0 168 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.722 123.6 39.3 -61.3 -27.7 10.2 -11.7 12.4 6 10 A H T 4 S+ 0 0 161 1,-0.1 -1,-0.2 5,-0.0 0, 0.0 0.665 130.5 23.2-100.9 -19.7 12.5 -8.7 11.8 7 11 A N T 4 S+ 0 0 66 -3,-0.1 -5,-2.6 -6,-0.0 -2,-0.2 0.133 94.4 130.6-131.4 15.2 10.2 -5.7 12.2 8 12 A G S >X S- 0 0 0 -4,-1.4 3,-2.6 -5,-0.2 4,-0.6 0.078 77.1 -78.9 -67.5 174.7 7.5 -7.3 14.3 9 13 A P T 34 S+ 0 0 24 0, 0.0 3,-0.4 0, 0.0 4,-0.3 0.684 125.6 62.7 -52.9 -25.4 5.9 -6.1 17.5 10 14 A E T 34 S+ 0 0 113 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.527 106.9 48.3 -76.1 -10.0 8.8 -7.3 19.7 11 15 A H T X4 S+ 0 0 52 -3,-2.6 3,-1.6 1,-0.1 4,-0.3 0.551 83.8 89.3-103.8 -21.7 10.9 -4.8 17.8 12 16 A W G >X S+ 0 0 6 -4,-0.6 4,-2.7 -3,-0.4 3,-1.5 0.729 70.8 73.7 -54.6 -31.1 8.8 -1.6 17.9 13 17 A H G 34 S+ 0 0 68 -4,-0.3 -1,-0.3 1,-0.3 7,-0.1 0.686 86.0 67.7 -56.8 -27.4 10.2 -0.3 21.3 14 18 A K G <4 S+ 0 0 126 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.818 117.5 19.9 -66.0 -38.8 13.4 0.7 19.4 15 19 A D T <4 S+ 0 0 130 -3,-1.5 -2,-0.2 -4,-0.3 -1,-0.2 0.655 135.5 39.7-101.5 -22.0 11.7 3.5 17.4 16 20 A F >< - 0 0 61 -4,-2.7 3,-2.0 1,-0.1 -1,-0.2 -0.771 66.8-176.8-130.6 85.3 8.7 3.9 19.6 17 21 A P G > S+ 0 0 98 0, 0.0 3,-1.5 0, 0.0 -4,-0.1 0.637 75.0 75.4 -56.9 -20.4 9.8 3.7 23.2 18 22 A I G > + 0 0 49 1,-0.3 3,-2.8 179,-0.2 5,-0.2 0.597 69.0 95.1 -71.2 -5.9 6.3 4.0 24.6 19 23 A A G < S+ 0 0 8 -3,-2.0 -1,-0.3 1,-0.3 -6,-0.1 0.767 90.3 40.2 -53.2 -32.4 5.9 0.4 23.5 20 24 A K G < S+ 0 0 142 -3,-1.5 -1,-0.3 -7,-0.1 -2,-0.1 -0.028 94.7 127.3-108.8 29.8 6.9 -0.5 27.1 21 25 A G S < S- 0 0 17 -3,-2.8 3,-0.4 1,-0.0 -3,-0.0 0.057 73.3 -97.2 -77.6-173.9 4.9 2.2 28.8 22 26 A E S S+ 0 0 118 1,-0.2 227,-0.3 169,-0.0 -3,-0.1 0.567 113.2 39.3 -84.0 -12.7 2.3 2.0 31.5 23 27 A R S S+ 0 0 45 -5,-0.2 -1,-0.2 168,-0.1 2,-0.1 -0.243 77.7 150.2-136.9 53.4 -0.9 2.0 29.5 24 28 A Q - 0 0 3 -3,-0.4 220,-0.1 221,-0.3 170,-0.1 -0.435 35.0 -97.6 -83.2 153.4 -0.2 -0.2 26.4 25 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.1 -2,-0.0 -0.867 75.4 37.0-128.7 161.5 -2.8 -2.2 24.4 26 30 A P + 0 0 0 0, 0.0 218,-2.8 0, 0.0 2,-0.3 0.627 64.2 177.3 -82.6-174.7 -4.2 -4.7 23.8 27 31 A V - 0 0 1 216,-0.3 77,-1.3 -2,-0.2 2,-0.5 -0.849 34.8 -98.6-143.0 168.5 -4.6 -6.7 27.0 28 32 A D E -a 104 0A 35 216,-0.5 2,-0.8 -2,-0.3 77,-0.2 -0.838 33.8-136.7 -91.9 126.8 -6.1 -9.9 28.2 29 33 A I E -a 105 0A 0 75,-3.3 77,-2.3 -2,-0.5 2,-1.0 -0.825 11.6-160.5 -92.2 104.4 -9.5 -9.5 29.8 30 34 A D >> - 0 0 65 -2,-0.8 4,-1.5 75,-0.2 3,-1.0 -0.767 4.3-165.0 -84.7 104.8 -9.7 -11.6 33.0 31 35 A T T 34 S+ 0 0 48 -2,-1.0 -1,-0.2 1,-0.3 222,-0.0 0.646 85.3 56.3 -68.9 -17.3 -13.5 -11.8 33.4 32 36 A H T 34 S+ 0 0 168 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.701 114.1 38.6 -86.4 -20.9 -13.2 -13.0 36.9 33 37 A T T <4 S+ 0 0 99 -3,-1.0 -2,-0.2 2,-0.1 -1,-0.2 0.503 89.1 106.5 -97.2 -23.3 -11.1 -10.0 37.9 34 38 A A S < S- 0 0 18 -4,-1.5 2,-0.6 216,-0.1 218,-0.3 -0.412 72.0-125.2 -61.2 137.9 -12.9 -7.3 35.9 35 39 A K E -c 252 0B 124 216,-2.9 218,-2.5 -2,-0.1 2,-0.4 -0.841 7.3-130.7-100.3 124.6 -15.0 -5.1 38.2 36 40 A Y E -c 253 0B 124 -2,-0.6 218,-0.2 216,-0.2 216,-0.0 -0.602 26.1-163.5 -66.2 116.5 -18.7 -4.6 37.7 37 41 A D > - 0 0 26 216,-2.6 3,-1.3 -2,-0.4 -1,-0.0 -0.951 12.8-168.0-113.4 106.9 -19.1 -0.8 37.9 38 42 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.626 83.3 69.0 -68.3 -14.3 -22.8 0.2 38.5 39 43 A S T 3 S+ 0 0 84 2,-0.1 2,-0.5 40,-0.0 215,-0.1 0.219 73.8 113.1 -87.7 10.3 -22.0 3.8 37.7 40 44 A L < - 0 0 29 -3,-1.3 3,-0.1 213,-0.2 213,-0.0 -0.748 60.1-144.1 -84.9 125.4 -21.3 2.9 34.0 41 45 A K - 0 0 115 37,-0.8 39,-0.1 -2,-0.5 -2,-0.1 -0.507 28.3 -91.8 -85.8 159.5 -23.9 4.4 31.7 42 46 A P - 0 0 111 0, 0.0 36,-1.9 0, 0.0 2,-0.2 -0.275 48.1 -99.6 -66.4 155.8 -25.1 2.6 28.6 43 47 A L E -D 77 0B 18 141,-0.2 2,-0.5 34,-0.2 34,-0.2 -0.493 28.0-148.8 -75.4 152.1 -23.3 3.2 25.4 44 48 A S E -D 76 0B 41 32,-2.5 32,-1.8 -2,-0.2 2,-0.7 -0.929 15.6-179.4-130.8 104.7 -24.8 5.7 22.8 45 49 A V E +D 75 0B 35 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.917 3.0 178.7-105.9 107.4 -24.0 4.8 19.2 46 50 A S E +D 74 0B 32 28,-3.4 28,-2.8 -2,-0.7 3,-0.1 -0.899 26.5 137.2-109.5 94.7 -25.5 7.4 16.7 47 51 A Y > + 0 0 2 -2,-0.7 3,-1.9 26,-0.2 130,-0.2 0.315 32.6 106.1-121.7 5.6 -24.4 6.2 13.3 48 52 A D T 3 S+ 0 0 99 1,-0.3 25,-0.1 -3,-0.1 -1,-0.1 0.730 87.1 45.2 -57.7 -24.8 -27.6 6.7 11.2 49 53 A Q T 3 S+ 0 0 123 23,-0.8 -1,-0.3 -3,-0.1 24,-0.2 0.088 84.1 142.7-104.9 19.9 -26.1 9.7 9.5 50 54 A A < - 0 0 23 -3,-1.9 2,-0.5 22,-0.1 123,-0.1 -0.275 34.4-158.5 -67.5 146.8 -22.7 8.2 8.8 51 55 A T - 0 0 50 16,-0.3 16,-2.2 122,-0.1 2,-0.2 -0.935 3.4-163.0-128.9 102.0 -20.8 9.0 5.6 52 56 A S E +E 66 0B 0 -2,-0.5 121,-0.6 14,-0.2 14,-0.3 -0.610 9.6 178.7 -81.8 152.3 -18.1 6.7 4.3 53 57 A L E - 0 0 71 12,-2.3 118,-3.6 1,-0.4 2,-0.3 0.655 53.2 -23.6-117.0 -53.7 -15.7 8.0 1.7 54 58 A R E -EF 65 170B 83 11,-0.9 11,-3.0 116,-0.3 -1,-0.4 -0.979 43.3-127.3-161.1 171.1 -13.2 5.3 0.8 55 59 A I E -EF 64 169B 0 114,-2.4 114,-2.6 -2,-0.3 2,-0.3 -0.962 29.8-176.8-125.6 142.7 -11.3 2.2 1.8 56 60 A L E -EF 63 168B 31 7,-1.9 7,-2.8 -2,-0.4 2,-0.7 -0.999 29.6-134.5-151.0 150.8 -7.5 1.9 1.6 57 61 A N E -E 62 0B 2 110,-2.2 109,-2.9 -2,-0.3 5,-0.2 -0.915 21.6-180.0-100.6 104.1 -4.7 -0.6 2.1 58 62 A N - 0 0 34 3,-2.0 4,-0.1 -2,-0.7 -1,-0.1 0.243 56.5 -97.0 -95.5 8.5 -2.0 1.2 4.2 59 63 A G S S+ 0 0 13 2,-0.4 3,-0.1 166,-0.2 106,-0.1 0.212 119.9 50.4 93.8 -8.0 0.4 -1.8 4.2 60 64 A H S S- 0 0 50 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.448 124.2 -26.0-131.7 -10.7 -0.6 -3.0 7.7 61 65 A A - 0 0 3 164,-0.1 -3,-2.0 165,-0.1 -1,-0.5 -0.935 67.9 -89.6 179.1-176.1 -4.4 -3.2 7.3 62 66 A F E -E 57 0B 0 -2,-0.3 29,-0.5 29,-0.2 2,-0.4 -0.954 34.7-155.9-121.0 140.6 -7.3 -1.7 5.4 63 67 A N E -EG 56 90B 22 -7,-2.8 -7,-1.9 -2,-0.4 2,-0.7 -0.946 12.9-151.7-120.5 140.3 -9.2 1.4 6.6 64 68 A V E -EG 55 89B 0 25,-2.3 25,-1.4 -2,-0.4 2,-0.3 -0.963 28.4-151.2-107.2 107.0 -12.8 2.6 5.9 65 69 A E E -EG 54 88B 44 -11,-3.0 -12,-2.3 -2,-0.7 -11,-0.9 -0.661 9.4-160.3 -88.9 144.5 -12.6 6.4 6.2 66 70 A F E -E 52 0B 7 21,-2.7 2,-0.7 -2,-0.3 -14,-0.2 -0.873 28.5-105.8-121.8 152.9 -15.5 8.6 7.3 67 71 A D + 0 0 43 -16,-2.2 -16,-0.3 -2,-0.3 5,-0.2 -0.754 37.9 175.1 -76.9 112.9 -16.2 12.3 6.9 68 72 A D + 0 0 39 -2,-0.7 -1,-0.1 1,-0.1 17,-0.1 -0.316 46.4 107.6-115.7 41.3 -15.7 13.7 10.5 69 73 A S S S+ 0 0 80 1,-0.1 2,-0.3 56,-0.0 -1,-0.1 0.537 88.7 25.0 -91.4 -11.4 -16.2 17.4 9.7 70 74 A Q S S- 0 0 116 -3,-0.2 2,-2.5 3,-0.0 3,-0.4 -0.967 98.3 -89.0-146.6 161.1 -19.5 17.2 11.5 71 75 A D S S+ 0 0 84 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.443 76.6 128.6 -73.2 69.6 -21.2 15.1 14.3 72 76 A K S S+ 0 0 44 -2,-2.5 -23,-0.8 1,-0.3 2,-0.5 0.853 73.4 25.5 -91.6 -47.5 -22.6 12.6 11.8 73 77 A A S S+ 0 0 7 -3,-0.4 13,-2.5 13,-0.2 2,-0.3 -0.967 85.7 170.8-124.8 108.7 -21.4 9.3 13.4 74 78 A V E -DH 46 85B 13 -28,-2.8 -28,-3.4 -2,-0.5 2,-0.4 -0.916 29.1-158.2-131.8 157.5 -20.9 9.6 17.1 75 79 A L E +DH 45 84B 0 9,-2.6 9,-2.3 -2,-0.3 2,-0.3 -0.977 29.7 145.9-123.5 133.4 -20.2 7.7 20.2 76 80 A K E +D 44 0B 82 -32,-1.8 -32,-2.5 -2,-0.4 7,-0.1 -0.840 35.1 47.3-156.7 176.4 -21.1 9.0 23.7 77 81 A G E > S+D 43 0B 24 3,-0.3 3,-1.7 -2,-0.3 -34,-0.2 -0.206 71.8 81.1 77.5-165.4 -22.2 7.7 27.1 78 82 A G T 3 S- 0 0 1 -36,-1.9 -37,-0.8 1,-0.2 -1,-0.2 -0.508 120.9 -26.9 66.9-138.1 -20.7 4.7 28.8 79 83 A P T 3 S+ 0 0 41 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.385 114.4 110.7 -87.2 -2.6 -17.5 5.8 30.5 80 84 A L < - 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