==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 30-JUL-98 1BNQ . COMPND 2 MOLECULE: CARBONIC ANHYDRASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.A.BORIACK-SJODIN,S.ZEITLIN,D.W.CHRISTIANSON . 255 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11649.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 167 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 6.3 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 . 24 9.4 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 . 17 6.7 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 4 A H 0 0 216 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 171.8 10.1 0.2 9.0 2 5 A W + 0 0 54 1,-0.1 2,-0.2 11,-0.1 7,-0.2 -0.063 360.0 131.6 -58.3 153.6 7.5 -1.4 11.4 3 6 A G - 0 0 8 5,-2.8 10,-0.1 2,-0.2 -1,-0.1 -0.764 63.9 -88.2-167.8-150.4 5.4 -4.3 10.5 4 7 A Y S S+ 0 0 32 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.205 83.2 105.9-127.8 9.4 4.3 -7.6 11.8 5 8 A G S >> S- 0 0 34 4,-0.1 4,-1.9 1,-0.1 3,-1.1 -0.377 86.8 -89.6 -93.1 175.6 7.1 -9.8 10.5 6 9 A K T 34 S+ 0 0 161 1,-0.3 3,-0.1 2,-0.2 -1,-0.1 0.829 123.8 39.6 -46.4 -40.6 10.1 -11.4 12.1 7 10 A H T 34 S+ 0 0 152 1,-0.2 -1,-0.3 -5,-0.0 -5,-0.0 0.685 132.3 18.9 -97.2 -5.9 12.3 -8.5 11.5 8 11 A N T <4 S+ 0 0 57 -3,-1.1 -5,-2.8 -6,-0.1 -2,-0.2 0.161 93.2 122.6-148.0 19.0 10.1 -5.6 12.2 9 12 A G S >X S- 0 0 0 -4,-1.9 3,-2.9 -5,-0.2 4,-0.6 -0.136 79.8 -66.6 -84.8-172.9 7.2 -7.0 14.2 10 13 A P G >4 S+ 0 0 22 0, 0.0 3,-0.5 0, 0.0 4,-0.5 0.700 125.5 60.7 -52.8 -27.9 5.8 -6.1 17.7 11 14 A E G 34 S+ 0 0 116 1,-0.2 4,-0.1 2,-0.1 -5,-0.0 0.607 108.2 45.7 -77.9 -9.7 8.9 -7.2 19.7 12 15 A H G X4 S+ 0 0 56 -3,-2.9 3,-1.9 2,-0.1 4,-0.4 0.572 86.8 91.1-106.1 -9.7 11.1 -4.7 17.9 13 16 A W G XX S+ 0 0 6 -4,-0.6 4,-2.4 -3,-0.5 3,-1.5 0.851 72.0 69.6 -62.6 -29.8 8.7 -1.8 18.2 14 17 A H G 34 S+ 0 0 67 -4,-0.5 -1,-0.3 1,-0.3 7,-0.1 0.795 86.9 69.6 -58.0 -25.1 10.1 -0.5 21.4 15 18 A K G <4 S+ 0 0 128 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.851 116.4 19.6 -69.4 -29.0 13.3 0.6 19.6 16 19 A D T <4 S+ 0 0 124 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.2 0.663 134.5 39.9-107.3 -18.3 11.6 3.4 17.7 17 20 A F >< - 0 0 59 -4,-2.4 3,-2.2 1,-0.1 -1,-0.3 -0.785 65.7-176.9-130.5 83.9 8.5 3.9 19.9 18 21 A P G > S+ 0 0 98 0, 0.0 3,-2.3 0, 0.0 -1,-0.1 0.782 75.1 78.8 -53.3 -31.2 9.8 3.5 23.5 19 22 A I G > + 0 0 61 1,-0.3 3,-2.0 179,-0.2 -5,-0.1 0.693 69.8 87.6 -54.8 -14.1 6.2 4.0 24.8 20 23 A A G < S+ 0 0 9 -3,-2.2 -1,-0.3 1,-0.3 -6,-0.1 0.777 88.9 48.4 -53.2 -28.9 5.8 0.2 23.8 21 24 A K G < S+ 0 0 139 -3,-2.3 -1,-0.3 -4,-0.1 -2,-0.1 -0.103 96.0 128.0-100.8 30.8 7.1 -0.6 27.3 22 25 A G S < S- 0 0 14 -3,-2.0 3,-0.4 1,-0.1 -3,-0.0 -0.048 71.5-101.2 -82.8-165.8 4.7 1.9 28.9 23 26 A E S S+ 0 0 124 1,-0.2 -1,-0.1 169,-0.0 -3,-0.1 0.519 110.7 31.0 -95.2 -13.9 2.1 1.8 31.7 24 27 A R S S+ 0 0 46 2,-0.1 -1,-0.2 168,-0.0 2,-0.2 -0.290 78.3 156.2-140.6 55.3 -1.2 1.5 29.8 25 28 A Q - 0 0 3 -3,-0.4 220,-0.1 221,-0.3 170,-0.1 -0.547 34.4-102.0 -81.0 149.4 -0.4 -0.3 26.5 26 29 A S S S+ 0 0 0 168,-0.6 2,-0.1 -2,-0.2 -2,-0.1 -0.825 80.8 45.6-118.8 159.3 -3.1 -2.2 24.6 27 30 A P + 0 0 0 0, 0.0 218,-3.1 0, 0.0 2,-0.3 0.623 65.5 173.6 -77.8 179.0 -4.3 -4.9 23.9 28 31 A V - 0 0 0 216,-0.3 77,-1.2 -2,-0.1 2,-0.5 -0.830 38.2 -96.0-135.9 178.1 -4.7 -6.7 27.4 29 32 A D E -a 105 0A 37 216,-0.4 2,-0.9 -2,-0.3 77,-0.2 -0.823 31.6-139.8 -94.4 130.8 -6.3 -10.0 28.4 30 33 A I E -a 106 0A 0 75,-2.5 77,-3.4 -2,-0.5 2,-1.0 -0.851 13.7-162.2 -92.5 108.4 -9.8 -9.5 29.8 31 34 A D >> - 0 0 59 -2,-0.9 3,-1.8 75,-0.2 4,-0.9 -0.800 4.6-158.4 -88.6 105.0 -10.0 -11.8 32.7 32 35 A T T 34 S+ 0 0 48 -2,-1.0 -1,-0.2 1,-0.3 3,-0.1 0.729 84.1 58.9 -59.4 -24.9 -13.7 -12.0 33.2 33 36 A H T 34 S+ 0 0 161 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.630 111.9 35.7 -85.9 -15.7 -13.5 -13.1 36.8 34 37 A T T <4 S+ 0 0 98 -3,-1.8 2,-0.4 2,-0.1 218,-0.2 0.320 83.6 115.2-118.2 14.3 -11.6 -10.1 38.1 35 38 A A S < S- 0 0 19 -4,-0.9 2,-0.6 216,-0.1 218,-0.2 -0.595 72.3-121.9 -74.8 131.7 -13.1 -7.4 36.0 36 39 A K E -c 253 0B 103 216,-2.4 218,-2.4 -2,-0.4 2,-0.4 -0.658 13.9-134.9 -83.8 116.5 -14.9 -5.2 38.5 37 40 A Y E -c 254 0B 137 -2,-0.6 218,-0.2 216,-0.2 151,-0.0 -0.602 24.6-165.0 -65.0 126.8 -18.6 -4.8 37.8 38 41 A D > - 0 0 34 216,-2.4 3,-0.9 -2,-0.4 215,-0.0 -0.958 14.0-163.9-121.8 120.0 -19.3 -1.1 38.1 39 42 A P T 3 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.349 82.7 66.5 -87.4 2.9 -22.9 0.1 38.5 40 43 A S T 3 S+ 0 0 79 2,-0.1 2,-0.5 40,-0.0 215,-0.1 0.294 71.1 112.9-103.1 7.5 -22.4 3.8 37.7 41 44 A L < - 0 0 29 -3,-0.9 38,-0.0 213,-0.2 213,-0.0 -0.700 63.3-143.0 -77.1 122.8 -21.4 3.0 34.1 42 45 A K - 0 0 132 37,-0.9 39,-0.1 -2,-0.5 -2,-0.1 -0.420 27.5 -91.4 -78.2 162.3 -24.1 4.5 31.9 43 46 A P - 0 0 109 0, 0.0 36,-2.0 0, 0.0 2,-0.2 -0.295 48.0 -95.1 -68.8 161.8 -25.2 2.6 28.7 44 47 A L E -D 78 0B 18 34,-0.3 2,-0.5 141,-0.2 34,-0.2 -0.589 25.1-151.0 -78.2 147.4 -23.5 3.3 25.4 45 48 A S E +D 77 0B 50 32,-2.8 32,-2.2 -2,-0.2 2,-0.6 -0.983 17.5 177.6-120.6 109.5 -25.0 5.8 22.9 46 49 A V E -D 76 0B 32 -2,-0.5 2,-0.6 30,-0.2 30,-0.2 -0.970 3.3-179.1-111.9 107.9 -24.0 4.8 19.4 47 50 A S E +D 75 0B 35 28,-2.9 28,-1.5 -2,-0.6 3,-0.3 -0.737 24.2 143.2-113.1 81.2 -25.5 7.2 16.8 48 51 A Y > + 0 0 2 -2,-0.6 3,-1.5 26,-0.2 130,-0.3 0.299 38.0 103.5 -99.7 7.9 -24.4 5.8 13.4 49 52 A D T 3 S+ 0 0 89 1,-0.3 -1,-0.2 -3,-0.1 25,-0.1 0.829 85.8 41.6 -63.3 -33.8 -27.6 6.6 11.5 50 53 A Q T 3 S+ 0 0 111 23,-0.9 -1,-0.3 -3,-0.3 2,-0.2 0.041 85.1 145.5 -97.8 29.4 -26.2 9.7 9.7 51 54 A A < - 0 0 18 -3,-1.5 2,-0.7 22,-0.2 123,-0.1 -0.415 35.5-155.7 -75.4 136.2 -22.7 8.2 8.9 52 55 A T - 0 0 50 16,-0.4 16,-2.7 -2,-0.2 2,-0.2 -0.851 6.6-167.2-107.5 98.8 -21.0 9.2 5.7 53 56 A S E +E 67 0B 1 -2,-0.7 121,-0.7 122,-0.3 14,-0.2 -0.611 12.0 170.7 -79.5 146.1 -18.4 6.6 4.5 54 57 A L E + 0 0 75 12,-2.5 118,-2.8 1,-0.4 2,-0.3 0.687 52.1 0.9-120.3 -41.3 -16.1 8.0 1.7 55 58 A R E -EF 66 171B 85 11,-1.2 11,-2.3 116,-0.3 -1,-0.4 -0.928 42.1-145.7-155.0 161.1 -13.3 5.5 1.0 56 59 A I E -EF 65 170B 0 114,-2.1 114,-2.1 -2,-0.3 2,-0.3 -0.956 28.2-178.6-131.4 147.3 -11.5 2.2 1.7 57 60 A L E -EF 64 169B 29 7,-1.9 7,-2.4 -2,-0.3 2,-0.8 -0.999 30.4-135.3-151.8 138.6 -7.7 2.0 1.5 58 61 A N E -E 63 0B 0 110,-2.7 109,-3.1 -2,-0.3 5,-0.2 -0.921 23.8-179.7 -99.4 115.8 -5.0 -0.6 1.9 59 62 A N - 0 0 52 3,-1.9 4,-0.1 -2,-0.8 -1,-0.1 0.157 53.0-100.6-100.2 11.3 -2.4 1.2 4.0 60 63 A G S S+ 0 0 8 2,-0.4 3,-0.1 166,-0.3 106,-0.1 0.512 117.9 55.3 85.6 1.0 0.1 -1.7 4.1 61 64 A H S S- 0 0 51 1,-0.7 2,-0.3 165,-0.1 -1,-0.1 0.517 124.8 -28.9-127.9 -41.2 -1.0 -2.7 7.7 62 65 A A - 0 0 5 -5,-0.1 -3,-1.9 31,-0.1 -1,-0.7 -0.832 69.9 -96.3-156.9-172.2 -4.7 -3.2 7.4 63 66 A F E -E 58 0B 0 -2,-0.3 29,-0.5 29,-0.2 2,-0.3 -0.961 38.9-155.6-116.4 143.4 -7.4 -1.8 5.2 64 67 A N E -E 57 0B 14 -7,-2.4 -7,-1.9 -2,-0.4 2,-0.6 -0.909 14.3-149.0-118.1 150.5 -9.4 1.2 6.5 65 68 A V E -EG 56 90B 0 25,-2.3 25,-1.3 -2,-0.3 2,-0.3 -0.978 27.4-153.7-111.7 115.9 -12.9 2.5 5.7 66 69 A E E -EG 55 89B 55 -11,-2.3 -12,-2.5 -2,-0.6 -11,-1.2 -0.699 6.7-157.3 -96.6 149.7 -12.7 6.3 6.3 67 70 A F E -E 53 0B 8 21,-2.5 2,-0.8 -2,-0.3 -14,-0.2 -0.858 29.3-102.0-123.2 153.4 -15.7 8.5 7.2 68 71 A D + 0 0 43 -16,-2.7 -16,-0.4 -2,-0.3 3,-0.3 -0.653 40.3 176.1 -72.4 110.7 -16.4 12.1 6.9 69 72 A D + 0 0 39 -2,-0.8 -1,-0.1 1,-0.2 17,-0.1 -0.202 44.2 106.8-111.3 42.3 -15.9 13.5 10.4 70 73 A S S S+ 0 0 78 1,-0.1 2,-0.3 56,-0.0 -1,-0.2 0.550 86.8 24.1 -95.4 -4.9 -16.4 17.2 9.9 71 74 A Q S S- 0 0 137 -3,-0.3 2,-2.0 3,-0.0 3,-0.4 -0.944 103.4 -82.2-148.0 162.5 -19.8 17.4 11.7 72 75 A D S S+ 0 0 83 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.438 75.3 131.7 -76.4 80.4 -21.4 15.1 14.3 73 76 A K S S+ 0 0 46 -2,-2.0 -23,-0.9 1,-0.3 2,-0.6 0.886 72.7 22.3 -95.0 -56.5 -22.7 12.4 12.1 74 77 A A S S+ 0 0 5 -3,-0.4 13,-2.5 -6,-0.2 -1,-0.3 -0.966 84.7 167.5-114.0 109.5 -21.6 9.1 13.6 75 78 A V E -DH 47 86B 12 -28,-1.5 -28,-2.9 -2,-0.6 2,-0.4 -0.882 30.2-150.7-125.3 161.2 -20.9 9.6 17.3 76 79 A L E +DH 46 85B 0 9,-2.5 9,-2.6 -2,-0.3 2,-0.3 -0.987 29.6 152.0-122.9 133.4 -20.3 7.6 20.5 77 80 A K E +D 45 0B 48 -32,-2.2 -32,-2.8 -2,-0.4 7,-0.1 -0.861 40.3 44.1-144.8-179.2 -21.3 9.0 23.9 78 81 A G E > S+D 44 0B 21 5,-0.3 3,-2.2 -2,-0.3 -34,-0.3 -0.405 73.9 81.4 77.1-156.2 -22.4 7.4 27.2 79 82 A G T 3 S- 0 0 3 -36,-2.0 -37,-0.9 1,-0.3 -1,-0.1 -0.280 119.6 -26.7 57.3-138.3 -20.6 4.4 28.6 80 83 A P T 3 S+ 0 0 29 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.220 115.1 108.1 -83.4 13.9 -17.4 5.5 30.5 81 84 A L < - 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