==== 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 20-FEB-08 3CAJ . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.DI FIORE,G.DE SIMONE . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12073.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 62.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 7.0 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 . 24 9.3 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 . 15 5.8 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 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 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 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 0 200 0, 0.0 2,-0.2 0, 0.0 8,-0.1 0.000 360.0 360.0 360.0-166.8 13.2 -0.9 7.1 2 4 A H - 0 0 109 2,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.470 360.0 -87.3 153.7 137.7 9.7 -0.1 8.5 3 5 A W + 0 0 36 -2,-0.2 2,-0.2 1,-0.1 7,-0.2 -0.208 61.5 136.2 -60.3 153.0 7.7 -1.6 11.3 4 6 A G - 0 0 10 5,-2.7 10,-0.1 2,-0.2 -1,-0.1 -0.741 64.6 -81.7-164.9-147.3 5.5 -4.5 10.4 5 7 A Y S S+ 0 0 38 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.142 84.0 110.9-126.4 16.8 4.5 -8.0 11.6 6 8 A G S > S- 0 0 28 4,-0.1 4,-1.3 1,-0.1 3,-0.3 -0.193 83.9 -94.4 -85.1-179.6 7.4 -10.0 10.3 7 9 A K T 4 S+ 0 0 176 1,-0.2 -1,-0.1 2,-0.2 5,-0.1 0.859 123.3 34.5 -63.5 -38.1 10.2 -11.7 12.2 8 10 A H T 4 S+ 0 0 142 1,-0.1 -1,-0.2 5,-0.0 -5,-0.0 0.489 131.7 28.3 -99.5 -2.1 12.6 -8.8 11.8 9 11 A N T 4 S+ 0 0 43 -3,-0.3 -5,-2.7 -8,-0.1 -2,-0.2 0.222 93.6 120.9-139.1 13.2 10.2 -5.9 12.1 10 12 A G S >X S- 0 0 3 -4,-1.3 3,-2.7 -5,-0.2 4,-0.9 0.086 81.9 -70.3 -73.3-175.5 7.4 -7.3 14.2 11 13 A P T 34 S+ 0 0 27 0, 0.0 4,-0.5 0, 0.0 3,-0.3 0.764 128.1 59.5 -45.3 -37.7 5.8 -6.3 17.6 12 14 A E T 34 S+ 0 0 144 1,-0.2 -2,-0.1 2,-0.1 -5,-0.0 0.600 108.5 47.0 -72.5 -8.7 8.9 -7.3 19.6 13 15 A H T X4 S+ 0 0 60 -3,-2.7 3,-1.7 1,-0.1 4,-0.5 0.637 87.0 86.7-103.1 -21.7 11.0 -4.8 17.6 14 16 A W G >X S+ 0 0 5 -4,-0.9 4,-2.8 -3,-0.3 3,-0.8 0.788 73.4 71.6 -52.0 -36.1 8.7 -1.8 17.7 15 17 A H G 34 S+ 0 0 68 -4,-0.5 -1,-0.3 1,-0.2 6,-0.1 0.776 87.7 65.7 -55.9 -27.5 10.1 -0.5 21.0 16 18 A K G <4 S+ 0 0 126 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.919 117.1 23.4 -62.4 -45.5 13.3 0.6 19.3 17 19 A D T <4 S+ 0 0 127 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.729 136.4 38.1 -90.2 -24.5 11.7 3.2 17.1 18 20 A F >< - 0 0 55 -4,-2.8 3,-2.6 -5,-0.2 -1,-0.2 -0.673 65.0-179.1-129.6 78.3 8.7 3.6 19.5 19 21 A P G > S+ 0 0 100 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.701 76.5 75.1 -48.0 -27.5 9.9 3.4 23.2 20 22 A I G > S+ 0 0 60 1,-0.3 3,-2.6 179,-0.2 -5,-0.1 0.615 71.3 89.2 -64.0 -10.2 6.3 3.9 24.4 21 23 A A G < S+ 0 0 6 -3,-2.6 -1,-0.3 1,-0.3 -6,-0.1 0.746 90.8 44.3 -59.1 -23.3 5.8 0.3 23.3 22 24 A K G < S+ 0 0 139 -3,-1.9 -1,-0.3 -4,-0.1 -2,-0.2 -0.017 96.7 134.5-108.3 26.3 7.0 -0.7 26.8 23 25 A G < - 0 0 13 -3,-2.6 3,-0.4 1,-0.1 -3,-0.1 0.126 69.9-101.8 -68.2-175.8 4.8 2.0 28.4 24 26 A E S S+ 0 0 121 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.566 112.7 32.3 -87.4 -12.7 2.4 2.0 31.3 25 27 A R S S+ 0 0 47 224,-0.1 -1,-0.2 168,-0.0 2,-0.2 -0.325 80.3 156.6-142.8 58.9 -0.9 1.7 29.4 26 28 A Q - 0 0 2 -3,-0.4 220,-0.2 221,-0.4 170,-0.1 -0.512 31.7 -98.2 -87.5 153.9 -0.3 -0.3 26.3 27 29 A S S S+ 0 0 0 168,-0.4 2,-0.2 -2,-0.2 -2,-0.0 -0.894 78.9 38.5-126.9 156.9 -2.8 -2.2 24.2 28 30 A P + 0 0 0 0, 0.0 218,-3.0 0, 0.0 2,-0.3 0.569 66.1 176.4 -81.6-178.5 -4.1 -4.7 23.6 29 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.4 -0.937 36.2 -98.5-141.7 162.1 -4.4 -6.7 26.8 30 32 A D E -a 106 0A 24 216,-0.4 2,-0.9 -2,-0.3 77,-0.2 -0.684 34.6-137.4 -82.5 136.8 -5.9 -10.0 28.0 31 33 A I E -a 107 0A 0 75,-3.6 77,-2.3 -2,-0.4 2,-1.2 -0.842 11.3-159.9-100.0 104.1 -9.4 -9.5 29.5 32 34 A D >> - 0 0 65 -2,-0.9 4,-1.7 75,-0.2 3,-1.3 -0.726 3.9-161.5 -84.7 98.9 -9.7 -11.6 32.6 33 35 A T T 34 S+ 0 0 42 -2,-1.2 -1,-0.2 1,-0.3 222,-0.0 0.747 86.3 53.7 -52.4 -30.3 -13.4 -11.8 32.9 34 36 A H T 34 S+ 0 0 163 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.749 111.7 43.1 -80.8 -22.7 -13.2 -12.9 36.6 35 37 A T T <4 S+ 0 0 107 -3,-1.3 -2,-0.2 2,-0.1 -1,-0.2 0.675 91.2 98.9 -93.9 -20.8 -11.1 -10.0 37.6 36 38 A A < - 0 0 18 -4,-1.7 2,-0.4 218,-0.1 218,-0.2 -0.445 68.3-143.7 -66.0 139.2 -13.0 -7.4 35.6 37 39 A K E -c 254 0B 138 216,-1.7 218,-2.8 -2,-0.1 2,-0.1 -0.898 13.3-113.7-114.3 138.5 -15.4 -5.5 37.9 38 40 A Y E -c 255 0B 102 -2,-0.4 218,-0.2 216,-0.2 220,-0.1 -0.445 31.1-152.5 -63.8 133.4 -19.0 -4.3 37.2 39 41 A D > - 0 0 30 216,-2.6 3,-1.6 -2,-0.1 -1,-0.1 -0.895 17.0-172.8-117.0 105.0 -18.9 -0.5 37.3 40 42 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.682 82.8 71.3 -67.3 -16.1 -22.2 1.2 38.2 41 43 A S T 3 S+ 0 0 88 2,-0.1 2,-0.3 40,-0.0 -2,-0.0 0.617 75.6 104.6 -75.4 -11.2 -20.7 4.6 37.5 42 44 A L < - 0 0 27 -3,-1.6 3,-0.1 213,-0.2 38,-0.0 -0.541 65.2-143.9 -73.7 132.3 -20.8 3.7 33.8 43 45 A K - 0 0 150 37,-1.7 37,-0.4 -2,-0.3 39,-0.1 -0.475 39.1 -71.3 -90.2 164.4 -23.6 5.4 31.8 44 46 A P - 0 0 116 0, 0.0 36,-1.0 0, 0.0 2,-0.3 -0.281 53.5-118.6 -55.8 138.7 -25.5 3.8 29.0 45 47 A L E -D 79 0B 25 34,-0.3 2,-0.5 -3,-0.1 34,-0.2 -0.639 27.2-158.6 -80.6 137.4 -23.3 3.4 25.9 46 48 A S E -D 78 0B 44 32,-3.3 32,-2.4 -2,-0.3 2,-0.6 -0.954 13.4-179.1-124.6 115.2 -24.6 5.3 22.8 47 49 A V E -D 77 0B 33 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.931 5.5-179.8-112.7 106.0 -23.6 4.3 19.3 48 50 A S E +D 76 0B 42 28,-2.8 28,-2.2 -2,-0.6 3,-0.2 -0.820 21.5 145.8-111.6 93.4 -25.2 6.7 16.8 49 51 A Y > + 0 0 3 -2,-0.7 3,-1.7 26,-0.2 130,-0.2 0.257 35.7 109.2-109.0 10.0 -24.2 5.7 13.3 50 52 A D T 3 S+ 0 0 92 1,-0.3 -1,-0.1 24,-0.2 25,-0.1 0.811 86.3 39.6 -58.0 -32.5 -27.4 6.5 11.4 51 53 A Q T 3 S+ 0 0 118 -3,-0.2 24,-0.3 23,-0.2 -1,-0.3 0.229 85.0 144.8-102.0 14.3 -25.8 9.5 9.6 52 54 A A < - 0 0 22 -3,-1.7 2,-0.5 22,-0.2 18,-0.1 -0.211 33.0-160.6 -55.3 138.5 -22.5 7.8 9.0 53 55 A T - 0 0 40 16,-0.3 16,-2.7 122,-0.1 2,-0.1 -0.840 3.0-165.2-128.1 95.9 -20.8 8.8 5.7 54 56 A S E +E 68 0B 0 -2,-0.5 121,-0.6 122,-0.4 14,-0.3 -0.427 11.8 172.8 -74.9 153.9 -18.1 6.4 4.4 55 57 A L E - 0 0 77 12,-2.9 118,-2.2 1,-0.4 2,-0.3 0.656 52.6 -0.4-129.5 -41.9 -15.9 7.8 1.7 56 58 A R E -EF 67 172B 85 11,-1.0 11,-3.0 116,-0.3 2,-0.4 -0.978 47.7-138.0-153.6 160.8 -13.1 5.4 0.8 57 59 A I E -EF 66 171B 0 114,-2.4 114,-2.0 -2,-0.3 2,-0.4 -0.987 27.4-169.9-124.4 134.4 -11.4 2.1 1.6 58 60 A L E -EF 65 170B 30 7,-2.4 7,-2.6 -2,-0.4 2,-0.8 -0.983 26.3-146.8-134.7 137.5 -7.6 1.9 1.8 59 61 A N E +E 64 0B 0 110,-2.7 109,-2.7 -2,-0.4 5,-0.2 -0.878 21.6 178.3 -95.4 107.9 -4.9 -0.7 2.0 60 62 A N - 0 0 46 3,-2.0 4,-0.1 -2,-0.8 -1,-0.1 0.261 54.0-101.2 -96.6 12.7 -2.2 1.0 4.1 61 63 A G S S+ 0 0 9 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.416 117.6 56.2 86.2 -2.6 0.1 -2.0 4.1 62 64 A H S S- 0 0 46 1,-0.7 2,-0.3 -58,-0.1 166,-0.1 0.506 124.9 -34.2-128.5 -27.8 -0.9 -3.1 7.7 63 65 A A S S- 0 0 5 164,-0.1 -3,-2.0 -5,-0.1 -1,-0.7 -0.902 71.0 -86.4-173.3-170.1 -4.6 -3.5 7.3 64 66 A F E -E 59 0B 0 -2,-0.3 2,-0.5 29,-0.2 29,-0.4 -0.985 33.8-151.6-124.0 133.7 -7.4 -1.8 5.3 65 67 A N E -E 58 0B 21 -7,-2.6 -7,-2.4 -2,-0.4 2,-0.8 -0.898 9.2-153.8-108.3 130.4 -9.2 1.3 6.5 66 68 A V E -EG 57 91B 0 25,-2.5 25,-1.6 -2,-0.5 2,-0.3 -0.913 30.4-154.6 -97.2 111.0 -12.8 2.2 5.7 67 69 A E E -EG 56 90B 48 -11,-3.0 -12,-2.9 -2,-0.8 -11,-1.0 -0.643 9.0-158.5 -93.0 149.0 -12.6 6.0 6.1 68 70 A F E -E 54 0B 9 21,-2.5 2,-0.8 -14,-0.3 -14,-0.2 -0.827 28.3-103.5-123.4 160.5 -15.5 8.3 6.9 69 71 A D + 0 0 43 -16,-2.7 -16,-0.3 -2,-0.3 3,-0.3 -0.762 39.2 172.3 -83.8 112.9 -16.2 12.0 6.5 70 72 A D + 0 0 39 -2,-0.8 -1,-0.1 1,-0.2 17,-0.1 -0.006 44.9 108.2-111.9 27.7 -15.7 13.4 10.0 71 73 A S S S+ 0 0 84 2,-0.0 2,-0.3 56,-0.0 -1,-0.2 0.528 86.0 33.3 -80.0 -7.0 -16.0 17.1 9.1 72 74 A Q S S- 0 0 118 -3,-0.3 2,-1.3 3,-0.0 3,-0.2 -0.949 99.8 -90.7-142.6 160.3 -19.4 17.2 10.9 73 75 A D S S+ 0 0 94 -2,-0.3 3,-0.1 1,-0.1 -3,-0.1 -0.619 77.1 117.9 -78.7 96.8 -21.0 15.4 13.8 74 76 A K + 0 0 59 -2,-1.3 2,-0.9 1,-0.3 -22,-0.2 0.502 64.4 36.6-119.9 -91.6 -22.6 12.3 12.3 75 77 A A S S+ 0 0 5 -24,-0.3 13,-2.8 -3,-0.2 2,-0.3 -0.578 82.2 169.8 -71.3 106.4 -21.4 8.9 13.4 76 78 A V E -DH 48 87B 18 -28,-2.2 -28,-2.8 -2,-0.9 2,-0.4 -0.923 30.5-155.1-127.8 151.6 -20.7 9.4 17.1 77 79 A L E +DH 47 86B 0 9,-2.9 9,-2.1 -2,-0.3 2,-0.3 -0.970 30.9 145.7-120.0 132.6 -19.9 7.3 20.1 78 80 A K E +D 46 0B 91 -32,-2.4 -32,-3.3 -2,-0.4 7,-0.1 -0.937 31.1 45.6-155.1 175.9 -20.8 8.6 23.6 79 81 A G E > S+D 45 0B 17 5,-0.5 3,-2.1 3,-0.3 -34,-0.3 -0.352 73.4 77.7 80.1-164.3 -21.9 7.5 27.0 80 82 A G T 3 S- 0 0 5 -36,-1.0 -37,-1.7 -37,-0.4 -1,-0.1 -0.417 123.3 -20.6 61.3-131.6 -20.4 4.5 28.8 81 83 A P T 3 S+ 0 0 48 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.521 116.0 109.4 -85.8 -5.1 -17.1 5.5 30.3 82 84 A L < - 0 0 16 -3,-2.1 2,-0.6 -39,-0.1 -3,-0.3 -0.469 55.7-154.6 -81.1 142.6 -16.8 8.5 27.9 83 85 A D - 0 0 129 -2,-0.2 2,-0.2 53,-0.1 -1,-0.0 -0.965 67.1 -13.0-111.9 119.3 -17.2 12.1 28.7 84 86 A G S S- 0 0 38 -2,-0.6 -5,-0.5 39,-0.1 2,-0.4 -0.503 101.9 -34.7 92.4-159.8 -18.3 14.2 25.8 85 87 A T - 0 0 32 -2,-0.2 38,-3.0 -7,-0.1 2,-0.5 -0.899 41.6-165.9-115.1 132.7 -18.5 13.2 22.1 86 88 A Y E -HI 77 122B 4 -9,-2.1 -9,-2.9 -2,-0.4 2,-0.4 -0.953 14.9-146.1-115.5 130.5 -16.3 11.0 20.0 87 89 A R E -HI 76 121B 29 34,-2.8 34,-2.1 -2,-0.5 -11,-0.2 -0.831 17.0-118.8-103.6 130.7 -16.5 11.1 16.2 88 90 A L E + I 0 120B 2 -13,-2.8 32,-0.3 -2,-0.4 -13,-0.2 -0.426 37.2 164.4 -65.1 128.3 -16.0 8.1 14.0 89 91 A I E - 0 0 37 30,-2.8 -21,-2.5 1,-0.4 2,-0.3 0.689 60.9 -25.2-115.0 -32.9 -13.1 8.5 11.6 90 92 A Q E -GI 67 119B 34 29,-1.1 29,-2.8 -23,-0.2 -1,-0.4 -0.982 47.9-145.3-170.9 164.6 -12.4 5.0 10.3 91 93 A F E +GI 66 118B 0 -25,-1.6 -25,-2.5 -2,-0.3 2,-0.3 -0.970 21.4 162.4-139.6 154.7 -12.6 1.3 11.1 92 94 A H E - I 0 117B 24 25,-1.7 25,-3.3 -2,-0.3 2,-0.3 -0.910 24.2-122.8-156.2 179.7 -10.3 -1.6 10.2 93 95 A F E - I 0 116B 0 -29,-0.4 2,-0.4 -2,-0.3 -29,-0.2 -0.873 1.2-149.5-132.6 165.3 -9.7 -5.2 11.3 94 96 A H E + I 0 115B 2 21,-1.6 21,-2.2 -2,-0.3 2,-0.3 -0.993 31.5 167.4-131.4 132.0 -6.8 -7.4 12.6 95 97 A W E - I 0 114B 0 -2,-0.4 146,-1.2 19,-0.2 145,-0.8 -0.927 24.1-119.8-144.9 170.2 -6.9 -11.0 11.6 96 98 A G - 0 0 0 17,-1.4 6,-0.1 5,-0.7 3,-0.1 -0.417 25.4-116.0-107.1-178.1 -4.9 -14.2 11.5 97 99 A S S S+ 0 0 42 142,-0.2 2,-0.3 -2,-0.1 5,-0.1 0.608 105.9 31.8 -86.8 -16.2 -3.6 -16.8 9.1 98 100 A L S > S- 0 0 109 3,-0.3 3,-1.6 15,-0.1 -2,-0.2 -0.947 88.4-111.6-138.5 157.0 -5.8 -19.3 10.8 99 101 A D T 3 S+ 0 0 70 -2,-0.3 48,-0.1 1,-0.3 -3,-0.1 0.791 109.6 70.1 -60.2 -28.6 -9.2 -19.2 12.5 100 102 A G T 3 S+ 0 0 59 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.439 107.9 24.3 -72.2 1.5 -7.5 -19.9 15.9 101 103 A Q < + 0 0 56 -3,-1.6 -5,-0.7 12,-0.1 -3,-0.3 -0.983 65.7 100.6-157.8 163.3 -5.8 -16.5 16.1 102 104 A G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 0.060 53.9 105.0 146.7 -33.1 -6.2 -13.0 14.8 103 105 A S - 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