==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 02-SEP-05 2AX2 . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.BUDAYOVA-SPANO,S.Z.FISHER,M.T.DAUVERGNE,D.N.SILVERMAN, . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12006.0 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 . 16 6.2 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 . 22 8.5 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 . 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 2 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 3 A H 0 0 195 0, 0.0 2,-0.3 0, 0.0 8,-0.0 0.000 360.0 360.0 360.0 147.3 12.5 -0.1 6.0 2 4 A H - 0 0 126 1,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.951 360.0 -41.6-175.3-179.9 10.0 -0.2 8.9 3 5 A W + 0 0 55 -2,-0.3 2,-0.2 1,-0.1 7,-0.2 -0.245 58.2 130.8 -66.6 154.5 7.7 -1.9 11.3 4 6 A G - 0 0 11 5,-2.3 10,-0.1 2,-0.1 -1,-0.1 -0.793 65.9 -77.3-169.6-148.7 5.4 -4.7 10.4 5 7 A Y S S+ 0 0 35 -2,-0.2 5,-0.2 5,-0.2 2,-0.1 -0.047 84.3 109.4-127.1 31.5 4.4 -8.2 11.5 6 8 A G S > S- 0 0 38 1,-0.0 4,-1.4 4,-0.0 3,-0.2 -0.403 83.6 -94.6 -98.5-178.0 7.4 -10.2 10.3 7 9 A K T 4 S+ 0 0 161 1,-0.2 -1,-0.0 2,-0.2 5,-0.0 0.793 123.6 36.9 -65.9 -27.7 10.2 -12.0 12.1 8 10 A H T 4 S+ 0 0 134 1,-0.1 -1,-0.2 5,-0.0 -5,-0.0 0.606 130.6 25.4-105.3 -11.4 12.5 -9.1 11.8 9 11 A N T 4 S+ 0 0 47 -3,-0.2 -5,-2.3 -6,-0.0 -2,-0.2 0.236 92.5 119.3-134.5 13.9 10.2 -6.2 12.2 10 12 A G S >X S- 0 0 3 -4,-1.4 3,-2.8 -7,-0.2 4,-0.8 0.097 81.7 -66.8 -82.5-169.2 7.3 -7.5 14.2 11 13 A P T 34 S+ 0 0 27 0, 0.0 4,-0.4 0, 0.0 3,-0.3 0.749 127.6 59.3 -55.1 -32.3 5.8 -6.6 17.6 12 14 A E T 34 S+ 0 0 139 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.650 109.0 46.9 -74.7 -7.9 8.8 -7.7 19.6 13 15 A H T X> S+ 0 0 60 -3,-2.8 3,-1.7 1,-0.1 4,-0.5 0.627 86.5 88.6-102.7 -19.4 10.9 -5.2 17.6 14 16 A W H >X S+ 0 0 5 -4,-0.8 4,-2.6 -3,-0.3 3,-0.7 0.776 73.1 69.8 -52.9 -34.1 8.7 -2.1 17.8 15 17 A H H 34 S+ 0 0 66 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.769 87.9 66.5 -59.1 -26.6 10.1 -0.8 21.1 16 18 A K H <4 S+ 0 0 130 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.912 117.7 23.1 -62.3 -48.3 13.3 0.1 19.4 17 19 A D H << S+ 0 0 105 -3,-0.7 -2,-0.2 -4,-0.5 -1,-0.2 0.701 136.4 37.0 -81.7 -27.1 11.6 2.8 17.3 18 20 A F >< - 0 0 49 -4,-2.6 3,-2.5 -5,-0.2 -1,-0.2 -0.744 64.9-178.7-131.0 80.9 8.7 3.3 19.7 19 21 A P G > S+ 0 0 98 0, 0.0 3,-1.9 0, 0.0 -4,-0.1 0.717 76.2 74.8 -59.6 -24.7 9.9 3.0 23.2 20 22 A I G > S+ 0 0 66 1,-0.3 3,-2.3 179,-0.2 -5,-0.1 0.628 71.6 90.0 -62.2 -8.9 6.3 3.5 24.6 21 23 A A G < S+ 0 0 5 -3,-2.5 -1,-0.3 1,-0.3 -6,-0.1 0.760 90.0 45.6 -57.7 -23.8 5.8 -0.0 23.4 22 24 A K G < S+ 0 0 137 -3,-1.9 -1,-0.3 -4,-0.1 -2,-0.1 -0.005 96.5 128.3-107.1 29.0 7.0 -1.0 26.9 23 25 A G S < S- 0 0 12 -3,-2.3 3,-0.4 1,-0.1 -3,-0.0 0.105 72.1 -98.6 -82.6-169.1 4.8 1.6 28.6 24 26 A E S S+ 0 0 123 1,-0.2 226,-0.2 225,-0.1 -1,-0.1 0.578 112.5 33.2 -93.1 -9.8 2.3 1.6 31.4 25 27 A R S S+ 0 0 44 224,-0.1 -1,-0.2 168,-0.1 2,-0.2 -0.329 79.5 154.8-141.4 58.0 -1.0 1.4 29.4 26 28 A Q - 0 0 3 -3,-0.4 220,-0.2 221,-0.4 170,-0.1 -0.531 32.9 -99.0 -87.4 152.0 -0.3 -0.6 26.3 27 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.890 77.9 38.0-126.0 159.3 -2.9 -2.5 24.3 28 30 A P + 0 0 0 0, 0.0 218,-2.7 0, 0.0 2,-0.3 0.607 65.6 176.1 -81.5-176.6 -4.1 -5.0 23.6 29 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.4 -0.904 37.0 -97.9-139.9 167.1 -4.5 -7.1 26.8 30 32 A D E -a 106 0A 28 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.743 34.8-139.4 -88.7 131.6 -6.0 -10.3 28.0 31 33 A I E -a 107 0A 0 75,-3.2 77,-2.3 -2,-0.4 2,-1.0 -0.856 10.0-157.7 -94.2 107.4 -9.4 -9.7 29.5 32 34 A D >> - 0 0 67 -2,-0.8 4,-1.5 75,-0.2 3,-1.0 -0.802 4.0-160.7 -84.3 100.1 -9.7 -12.0 32.5 33 35 A T T 34 S+ 0 0 42 -2,-1.0 -1,-0.2 1,-0.2 222,-0.0 0.738 86.8 52.6 -55.4 -29.2 -13.5 -12.2 32.8 34 36 A H T 34 S+ 0 0 168 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.776 112.6 43.4 -79.5 -24.7 -13.3 -13.3 36.4 35 37 A T T <4 S+ 0 0 109 -3,-1.0 -2,-0.2 2,-0.1 2,-0.2 0.609 88.4 101.2 -95.8 -19.6 -11.1 -10.4 37.5 36 38 A A S < S- 0 0 17 -4,-1.5 2,-0.5 216,-0.1 218,-0.2 -0.510 71.0-136.4 -65.8 133.2 -13.0 -7.7 35.6 37 39 A K E -c 254 0B 154 216,-1.8 218,-2.2 -2,-0.2 2,-0.2 -0.820 9.6-121.1-101.6 129.4 -15.2 -5.9 38.0 38 40 A Y E -c 255 0B 93 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.489 23.8-159.3 -61.2 132.1 -18.8 -5.0 37.3 39 41 A D > - 0 0 37 216,-2.6 3,-1.9 -2,-0.2 -1,-0.1 -0.898 10.1-169.7-119.4 98.3 -19.2 -1.2 37.5 40 42 A P T 3 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.693 84.8 67.5 -69.0 -13.0 -22.9 -0.4 38.0 41 43 A S T 3 S+ 0 0 74 -3,-0.1 2,-0.2 2,-0.1 215,-0.1 0.708 76.0 105.1 -75.1 -18.8 -22.0 3.3 37.4 42 44 A L < - 0 0 22 -3,-1.9 3,-0.1 213,-0.2 -3,-0.0 -0.437 67.0-138.1 -62.8 130.3 -21.1 2.6 33.8 43 45 A K - 0 0 100 37,-1.1 39,-0.1 -2,-0.2 -1,-0.1 -0.359 28.9 -85.0 -83.4 160.2 -23.8 3.9 31.4 44 46 A P - 0 0 110 0, 0.0 36,-1.4 0, 0.0 -1,-0.1 -0.409 52.3-106.6 -57.7 140.8 -25.2 2.1 28.4 45 47 A L E -D 79 0B 14 141,-0.3 2,-0.5 34,-0.2 34,-0.2 -0.464 27.0-145.3 -64.8 150.5 -23.0 2.7 25.4 46 48 A S E +D 78 0B 48 32,-2.5 32,-2.4 -2,-0.1 2,-0.7 -0.955 18.5 179.1-123.1 107.0 -24.5 5.0 22.8 47 49 A V E -D 77 0B 33 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.926 0.5-179.9-111.3 106.5 -23.6 4.1 19.2 48 50 A S E +D 76 0B 43 28,-2.8 28,-1.9 -2,-0.7 3,-0.2 -0.814 21.6 145.3-114.0 91.6 -25.2 6.5 16.7 49 51 A Y > + 0 0 3 -2,-0.7 3,-1.6 26,-0.2 130,-0.2 0.248 33.7 110.2-107.2 9.2 -24.3 5.5 13.2 50 52 A D T 3 S+ 0 0 90 1,-0.3 -1,-0.1 127,-0.1 25,-0.1 0.816 87.7 37.3 -58.6 -34.8 -27.5 6.4 11.3 51 53 A Q T 3 S+ 0 0 126 23,-1.0 -1,-0.3 -3,-0.2 24,-0.2 0.250 83.8 147.2-103.5 17.6 -25.8 9.3 9.5 52 54 A A < - 0 0 22 -3,-1.6 2,-0.5 22,-0.1 23,-0.1 -0.201 32.5-158.0 -54.1 138.6 -22.5 7.6 8.9 53 55 A T - 0 0 48 16,-0.3 16,-2.9 122,-0.1 2,-0.1 -0.851 5.3-166.7-125.5 93.1 -20.7 8.6 5.7 54 56 A S E +E 68 0B 0 -2,-0.5 121,-0.7 122,-0.3 14,-0.3 -0.477 10.6 173.6 -77.3 152.2 -18.1 6.2 4.5 55 57 A L E - 0 0 80 12,-3.4 118,-2.0 1,-0.4 2,-0.3 0.682 50.6 -4.4-121.8 -45.0 -15.9 7.4 1.8 56 58 A R E -EF 67 172B 86 11,-1.1 11,-3.0 116,-0.3 -1,-0.4 -0.985 46.9-135.2-155.2 159.2 -13.1 5.1 0.9 57 59 A I E -EF 66 171B 0 114,-2.4 114,-2.1 -2,-0.3 2,-0.4 -0.988 28.1-171.6-127.3 133.2 -11.4 1.9 1.6 58 60 A L E -EF 65 170B 33 7,-2.3 7,-2.4 -2,-0.4 2,-0.7 -0.978 25.2-145.4-131.1 132.1 -7.5 1.8 1.7 59 61 A N E +E 64 0B 0 110,-2.7 109,-2.6 -2,-0.4 5,-0.2 -0.902 22.3 179.9 -88.6 111.9 -4.9 -0.9 2.0 60 62 A N - 0 0 35 3,-2.0 4,-0.1 -2,-0.7 -1,-0.1 0.251 53.5 -97.5 -97.5 10.5 -2.2 0.8 4.1 61 63 A G S S+ 0 0 13 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.260 118.5 52.3 96.1 -17.4 0.3 -2.0 4.2 62 64 A H S S- 0 0 54 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.469 124.7 -30.1-124.7 -12.3 -0.8 -3.3 7.7 63 65 A A S S- 0 0 0 164,-0.1 -3,-2.0 165,-0.1 -1,-0.5 -0.927 71.3 -88.0 178.0-174.8 -4.6 -3.7 7.3 64 66 A F E -E 59 0B 0 -2,-0.3 2,-0.5 29,-0.2 29,-0.5 -0.984 34.5-151.5-121.9 135.9 -7.3 -2.0 5.3 65 67 A N E -E 58 0B 23 -7,-2.4 -7,-2.3 -2,-0.4 2,-0.7 -0.914 8.4-152.2-109.6 125.6 -9.2 1.0 6.6 66 68 A V E -EG 57 91B 0 25,-2.8 25,-1.7 -2,-0.5 2,-0.3 -0.930 29.5-152.1 -89.7 107.1 -12.8 1.9 5.8 67 69 A E E -EG 56 90B 43 -11,-3.0 -12,-3.4 -2,-0.7 -11,-1.1 -0.715 11.0-161.3 -90.7 145.3 -12.7 5.7 6.1 68 70 A F E -E 54 0B 9 21,-2.5 2,-0.8 -2,-0.3 -14,-0.2 -0.794 31.0-101.8-120.6 154.8 -15.5 8.0 7.0 69 71 A D + 0 0 35 -16,-2.9 -16,-0.3 -2,-0.3 3,-0.2 -0.745 40.6 172.5 -71.0 111.2 -16.3 11.7 6.7 70 72 A D + 0 0 44 -2,-0.8 -1,-0.1 1,-0.1 17,-0.1 -0.031 46.2 105.3-112.9 29.3 -15.6 13.0 10.2 71 73 A S S S+ 0 0 85 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.422 88.0 29.8 -88.5 -1.4 -15.9 16.8 9.4 72 74 A Q S S- 0 0 106 -3,-0.2 2,-1.2 3,-0.1 3,-0.3 -0.966 98.1 -87.9-146.9 167.3 -19.3 16.8 11.1 73 75 A D S S+ 0 0 80 -2,-0.3 3,-0.1 1,-0.2 -3,-0.1 -0.609 77.4 120.7 -78.6 92.6 -21.1 15.0 13.9 74 76 A K S S+ 0 0 54 -2,-1.2 -23,-1.0 1,-0.3 2,-0.4 0.660 71.4 28.0-129.3 -50.7 -22.6 12.1 11.9 75 77 A A S S+ 0 0 7 -3,-0.3 13,-2.9 -24,-0.2 2,-0.3 -0.905 82.2 170.3-113.4 108.4 -21.4 8.7 13.4 76 78 A V E -DH 48 87B 9 -28,-1.9 -28,-2.8 -2,-0.4 2,-0.5 -0.922 31.3-150.4-128.4 149.8 -20.7 9.1 17.1 77 79 A L E +DH 47 86B 0 9,-2.9 9,-2.2 -2,-0.3 2,-0.3 -0.955 32.3 154.5-115.7 129.9 -19.9 7.1 20.1 78 80 A K E +D 46 0B 85 -32,-2.4 -32,-2.5 -2,-0.5 7,-0.1 -0.882 35.2 30.4-144.3 171.3 -21.0 8.4 23.5 79 81 A G E > S+D 45 0B 24 5,-0.5 3,-2.3 3,-0.3 -34,-0.2 -0.292 73.0 86.2 73.5-157.4 -21.9 7.2 27.0 80 82 A G T 3 S- 0 0 0 -36,-1.4 -37,-1.1 1,-0.3 -1,-0.1 -0.416 120.7 -23.0 61.3-132.8 -20.5 4.1 28.6 81 83 A P T 3 S+ 0 0 36 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.513 117.4 110.5 -87.3 2.2 -17.2 5.1 30.3 82 84 A L < - 0 0 11 -3,-2.3 2,-0.5 -39,-0.1 -3,-0.3 -0.450 54.1-157.1 -88.6 143.9 -16.9 8.1 28.0 83 85 A D - 0 0 130 -2,-0.2 2,-0.1 -5,-0.1 -1,-0.0 -0.960 68.6 -3.3-109.7 127.4 -17.3 11.8 28.8 84 86 A G S S- 0 0 50 -2,-0.5 -5,-0.5 38,-0.1 2,-0.4 -0.422 98.7 -48.1 93.7-159.6 -18.2 13.8 25.7 85 87 A T - 0 0 27 -7,-0.1 38,-2.6 -2,-0.1 2,-0.4 -0.929 40.1-161.5-127.8 132.0 -18.6 12.8 22.1 86 88 A Y E -HI 77 122B 4 -9,-2.2 -9,-2.9 -2,-0.4 2,-0.4 -0.956 12.9-142.8-118.3 131.4 -16.3 10.7 19.9 87 89 A R E -HI 76 121B 47 34,-2.8 34,-1.9 -2,-0.4 -11,-0.2 -0.757 18.4-119.4 -98.2 134.8 -16.5 10.8 16.1 88 90 A L E + I 0 120B 3 -13,-2.9 32,-0.3 -2,-0.4 -13,-0.1 -0.432 37.1 165.8 -70.3 127.1 -16.0 7.7 13.9 89 91 A I E - 0 0 33 30,-2.9 -21,-2.5 1,-0.4 2,-0.3 0.715 60.4 -26.9-111.6 -34.5 -13.0 8.2 11.6 90 92 A Q E -GI 67 119B 30 29,-1.2 29,-2.8 -23,-0.2 -1,-0.4 -0.982 47.3-143.3-171.1 162.8 -12.3 4.7 10.3 91 93 A F E +GI 66 118B 0 -25,-1.7 -25,-2.8 -2,-0.3 2,-0.3 -0.970 22.4 163.7-135.8 153.1 -12.6 1.0 11.1 92 94 A H E - I 0 117B 20 25,-1.7 25,-3.0 -2,-0.3 2,-0.3 -0.927 22.9-124.8-154.7 174.8 -10.2 -1.9 10.3 93 95 A F E - I 0 116B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.2 -0.842 0.8-148.6-128.7 162.6 -9.6 -5.4 11.3 94 96 A H E + I 0 115B 1 21,-1.8 21,-2.3 -2,-0.3 2,-0.3 -0.980 30.8 167.2-124.1 130.0 -6.9 -7.7 12.6 95 97 A W E - I 0 114B 0 -2,-0.4 146,-1.2 19,-0.2 145,-1.0 -0.950 23.9-120.9-144.7 168.5 -6.9 -11.3 11.5 96 98 A G - 0 0 0 17,-1.4 6,-0.1 5,-0.7 3,-0.1 -0.405 25.3-117.6-106.9-179.0 -4.9 -14.5 11.5 97 99 A S S S+ 0 0 44 142,-0.2 2,-0.3 -2,-0.1 5,-0.1 0.593 106.6 32.2 -88.2 -10.3 -3.5 -17.0 9.0 98 100 A L S > S- 0 0 106 3,-0.2 3,-1.5 15,-0.1 -2,-0.2 -0.947 89.5-112.3-144.0 152.3 -5.7 -19.6 10.8 99 101 A D T 3 S+ 0 0 74 -2,-0.3 48,-0.1 1,-0.3 15,-0.1 0.747 109.7 70.4 -62.4 -23.0 -9.1 -19.4 12.5 100 102 A G T 3 S+ 0 0 59 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.448 106.6 28.4 -75.8 -1.0 -7.5 -20.1 15.9 101 103 A Q < + 0 0 49 -3,-1.5 -5,-0.7 12,-0.1 -3,-0.2 -0.956 66.0 97.1-151.2 166.9 -5.7 -16.8 16.0 102 104 A G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 -0.040 55.2 105.9 142.6 -33.7 -6.1 -13.2 14.8 103 105 A S - 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