==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 04-JUN-08 3DCS . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.GENIS,K.H.SIPPEL,N.CASE,L.GOVINDASAMY,M.AGBANDJE-MCKENNA, . 257 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11979.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 65.4 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 . 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 . 26 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 14.0 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 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 4 A H 0 0 202 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 151.2 10.0 -0.1 8.8 2 5 A W + 0 0 39 1,-0.1 2,-0.2 2,-0.1 7,-0.2 -0.358 360.0 132.0 -74.8 157.1 7.7 -1.8 11.4 3 6 A G - 0 0 6 5,-2.7 10,-0.1 2,-0.1 -1,-0.1 -0.808 63.6 -84.6-168.1-149.3 5.5 -4.7 10.6 4 7 A Y S S+ 0 0 32 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.353 82.2 108.4-124.3 6.9 4.4 -8.1 11.7 5 8 A G S >> S- 0 0 38 3,-0.1 4,-0.9 4,-0.1 3,-0.5 -0.065 86.0 -92.0 -76.2 178.6 7.1 -10.3 10.1 6 9 A K T 34 S+ 0 0 171 1,-0.2 3,-0.2 2,-0.2 -1,-0.1 0.884 122.9 40.3 -63.6 -34.1 9.9 -12.1 11.9 7 10 A H T 34 S+ 0 0 153 1,-0.2 -1,-0.2 -5,-0.0 -3,-0.0 0.629 128.9 24.9 -96.4 -3.6 12.4 -9.2 11.6 8 11 A N T <4 S+ 0 0 58 -3,-0.5 -5,-2.7 -6,-0.0 -1,-0.2 0.152 91.6 126.4-141.8 22.2 10.2 -6.2 12.3 9 12 A G S >X S- 0 0 0 -4,-0.9 3,-3.3 -5,-0.2 4,-0.7 -0.046 78.6 -69.3 -82.0 179.2 7.3 -7.5 14.3 10 13 A P T 34 S+ 0 0 23 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.712 127.3 59.6 -47.1 -31.0 5.9 -6.5 17.7 11 14 A E T 34 S+ 0 0 130 1,-0.2 3,-0.1 2,-0.1 4,-0.0 0.668 108.0 47.3 -78.9 -9.1 8.9 -7.6 19.7 12 15 A H T X> S+ 0 0 59 -3,-3.3 3,-2.0 1,-0.1 4,-0.5 0.624 87.7 88.7 -95.7 -17.2 11.1 -5.2 17.7 13 16 A W H >X S+ 0 0 4 -4,-0.7 4,-2.2 -3,-0.4 3,-1.4 0.815 73.5 68.3 -57.2 -33.1 8.8 -2.2 18.0 14 17 A H H 34 S+ 0 0 64 -4,-0.4 -1,-0.3 1,-0.3 7,-0.1 0.745 87.1 68.3 -66.2 -16.9 10.2 -0.9 21.2 15 18 A K H <4 S+ 0 0 134 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.885 117.0 23.2 -70.0 -32.3 13.5 0.0 19.5 16 19 A D H << S+ 0 0 129 -3,-1.4 -2,-0.2 -4,-0.5 -1,-0.2 0.701 136.0 35.8-100.8 -18.3 11.8 2.8 17.5 17 20 A F >< - 0 0 59 -4,-2.2 3,-2.7 1,-0.1 -1,-0.2 -0.746 64.2-178.2-135.9 77.9 8.8 3.4 19.9 18 21 A P G > S+ 0 0 99 0, 0.0 3,-2.2 0, 0.0 -4,-0.1 0.771 75.4 77.4 -58.3 -20.6 9.9 2.9 23.5 19 22 A I G > S+ 0 0 54 1,-0.3 3,-3.1 2,-0.2 -5,-0.1 0.712 71.0 88.1 -64.7 -9.7 6.4 3.6 24.7 20 23 A A G < S+ 0 0 7 -3,-2.7 -1,-0.3 1,-0.3 -6,-0.1 0.753 90.2 46.7 -50.8 -27.9 5.8 -0.1 23.6 21 24 A K G < S+ 0 0 147 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.021 95.2 134.7-102.7 23.6 7.0 -0.9 27.1 22 25 A G < - 0 0 15 -3,-3.1 3,-0.5 1,-0.1 -3,-0.0 0.094 68.8-105.7 -68.2 179.0 4.7 1.7 28.6 23 26 A E S S+ 0 0 123 1,-0.2 226,-0.2 225,-0.1 -1,-0.1 0.495 111.9 35.0 -85.1 -13.0 2.3 1.5 31.6 24 27 A R S S+ 0 0 47 224,-0.1 -1,-0.2 168,-0.1 2,-0.1 -0.173 80.2 155.8-142.6 56.1 -0.9 1.3 29.7 25 28 A Q - 0 0 5 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.452 32.3-100.3 -83.9 154.3 -0.3 -0.7 26.6 26 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.1 -2,-0.1 -0.887 76.8 41.6-123.5 160.3 -2.9 -2.6 24.6 27 30 A P + 0 0 0 0, 0.0 218,-2.5 0, 0.0 2,-0.3 0.630 64.8 178.2 -82.2-178.2 -4.2 -5.2 23.9 28 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.4 -0.905 35.4-101.8-136.1 164.2 -4.6 -7.2 27.1 29 32 A D E -a 105 0A 31 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.745 34.5-138.4 -81.1 132.4 -6.1 -10.5 28.2 30 33 A I E -a 106 0A 0 75,-3.1 77,-2.3 -2,-0.4 2,-0.8 -0.851 11.2-157.4 -96.1 107.0 -9.5 -9.9 29.8 31 34 A D >> - 0 0 61 -2,-0.8 3,-1.5 75,-0.2 4,-1.3 -0.767 2.8-160.3 -80.9 107.2 -9.8 -12.2 32.8 32 35 A T T 34 S+ 0 0 48 -2,-0.8 -1,-0.2 1,-0.3 222,-0.0 0.684 85.5 55.5 -67.0 -19.0 -13.6 -12.5 33.3 33 36 A H T 34 S+ 0 0 170 1,-0.2 -1,-0.3 3,-0.0 -2,-0.0 0.620 114.4 38.3 -89.9 -12.1 -13.4 -13.6 36.9 34 37 A T T <4 S+ 0 0 77 -3,-1.5 -2,-0.2 2,-0.1 218,-0.2 0.493 86.4 109.6-114.3 -5.1 -11.3 -10.5 38.0 35 38 A A S < S- 0 0 21 -4,-1.3 2,-0.6 216,-0.1 218,-0.2 -0.421 70.7-125.2 -61.3 151.5 -13.0 -7.9 35.9 36 39 A K E -c 253 0B 135 216,-2.6 218,-2.9 2,-0.0 2,-0.2 -0.892 9.3-131.2-108.2 120.4 -15.1 -5.6 38.2 37 40 A Y E -c 254 0B 92 -2,-0.6 218,-0.2 216,-0.2 220,-0.1 -0.531 23.5-169.9 -63.0 132.8 -18.7 -5.0 37.6 38 41 A D > - 0 0 28 216,-2.7 3,-2.5 -2,-0.2 -1,-0.1 -0.859 11.6-174.0-129.3 92.7 -19.4 -1.2 37.8 39 42 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.553 82.1 70.8 -70.3 -1.7 -23.1 -0.4 37.8 40 43 A S T 3 S+ 0 0 79 2,-0.1 2,-0.3 40,-0.0 215,-0.1 0.569 75.6 107.2 -83.5 -8.4 -22.3 3.2 37.6 41 44 A L < - 0 0 21 -3,-2.5 3,-0.1 213,-0.2 38,-0.0 -0.550 68.9-136.7 -72.4 130.8 -21.2 2.5 34.0 42 45 A K - 0 0 127 37,-1.0 39,-0.1 -2,-0.3 -1,-0.1 -0.450 24.3 -92.5 -86.3 161.2 -23.8 3.9 31.6 43 46 A P - 0 0 107 0, 0.0 36,-1.7 0, 0.0 2,-0.1 -0.351 48.6-101.7 -62.8 149.2 -25.2 2.1 28.5 44 47 A L E -D 78 0B 18 141,-0.3 2,-0.6 34,-0.3 34,-0.2 -0.484 28.3-149.6 -69.3 146.0 -23.3 2.8 25.3 45 48 A S E -D 77 0B 44 32,-3.1 32,-2.4 -2,-0.1 2,-0.6 -0.945 15.8-178.4-117.7 108.0 -24.9 5.2 22.9 46 49 A V E +D 76 0B 33 -2,-0.6 2,-0.5 30,-0.2 30,-0.2 -0.916 4.7 179.0-104.4 118.1 -24.2 4.5 19.3 47 50 A S E +D 75 0B 48 28,-2.8 28,-1.3 -2,-0.6 3,-0.3 -0.655 23.6 142.4-121.1 79.2 -25.7 7.0 16.8 48 51 A Y > + 0 0 4 -2,-0.5 3,-1.5 26,-0.2 130,-0.2 0.190 33.6 108.6-102.2 12.1 -24.6 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 0.838 86.0 40.7 -69.5 -23.3 -27.7 6.6 11.4 50 53 A Q T 3 S+ 0 0 117 23,-0.9 -1,-0.3 -3,-0.3 24,-0.2 0.196 83.4 143.4-104.4 15.6 -26.1 9.6 9.6 51 54 A A < - 0 0 23 -3,-1.5 2,-0.5 22,-0.2 123,-0.1 -0.167 35.2-157.2 -56.3 141.1 -22.7 7.9 9.0 52 55 A T - 0 0 51 16,-0.3 16,-2.5 122,-0.1 2,-0.1 -0.822 3.8-160.8-124.0 102.8 -21.1 8.8 5.7 53 56 A S E +E 67 0B 1 -2,-0.5 121,-0.5 122,-0.3 14,-0.3 -0.489 13.0 174.4 -77.9 150.5 -18.5 6.3 4.5 54 57 A L E - 0 0 83 12,-3.2 118,-2.5 1,-0.4 2,-0.3 0.722 50.5 -8.6-116.5 -47.4 -16.0 7.6 1.9 55 58 A R E -EF 66 171B 89 11,-0.9 11,-2.9 116,-0.3 2,-0.4 -0.984 45.2-135.2-158.4 153.1 -13.3 5.2 0.9 56 59 A I E -EF 65 170B 0 114,-2.5 114,-2.1 -2,-0.3 2,-0.4 -0.987 29.1-172.3-121.5 138.5 -11.6 1.9 1.6 57 60 A L E -EF 64 169B 26 7,-2.6 7,-2.7 -2,-0.4 2,-0.8 -0.987 29.2-139.7-135.1 138.0 -7.8 1.7 1.7 58 61 A N E -E 63 0B 0 110,-2.9 109,-2.8 -2,-0.4 5,-0.2 -0.859 23.5-175.9 -85.9 109.8 -5.2 -1.0 2.0 59 62 A N - 0 0 51 3,-1.9 4,-0.1 -2,-0.8 -1,-0.1 0.340 46.9-107.5 -95.4 9.3 -2.7 0.8 4.3 60 63 A G S S+ 0 0 8 2,-0.6 3,-0.1 166,-0.2 106,-0.1 0.251 115.1 53.6 87.8 -9.7 -0.1 -2.0 4.1 61 64 A H S S- 0 0 46 1,-0.6 2,-0.3 -58,-0.1 166,-0.1 0.442 127.3 -26.9-128.8 -14.6 -0.8 -3.1 7.6 62 65 A S S S- 0 0 6 164,-0.1 -3,-1.9 165,-0.1 -1,-0.6 -0.888 71.0 -94.8-173.8-171.7 -4.6 -3.7 7.4 63 66 A F E -E 58 0B 0 -2,-0.3 29,-0.7 29,-0.3 2,-0.4 -0.960 38.0-164.9-121.7 147.3 -7.5 -2.3 5.4 64 67 A Q E -EG 57 91B 28 -7,-2.7 -7,-2.6 -2,-0.4 2,-0.5 -0.977 17.3-144.7-134.4 145.1 -9.6 0.6 6.7 65 68 A V E -EG 56 90B 0 25,-2.7 25,-1.9 -2,-0.4 2,-0.3 -0.950 26.7-147.5-104.8 127.1 -12.9 2.1 5.8 66 69 A E E -EG 55 89B 38 -11,-2.9 -12,-3.2 -2,-0.5 -11,-0.9 -0.716 10.3-161.3-101.7 146.7 -12.9 5.9 6.2 67 70 A F E -E 53 0B 7 21,-2.5 2,-0.6 -2,-0.3 -14,-0.2 -0.840 31.8-100.8-120.2 155.6 -15.8 8.1 7.3 68 71 A D + 0 0 41 -16,-2.5 -16,-0.3 -2,-0.3 5,-0.2 -0.697 40.2 172.6 -73.5 116.5 -16.5 11.9 7.0 69 72 A D + 0 0 44 -2,-0.6 -1,-0.1 1,-0.1 17,-0.1 -0.085 44.4 109.7-116.1 29.0 -15.7 13.2 10.5 70 73 A S S S+ 0 0 77 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.602 88.7 14.6 -82.3 -15.0 -16.1 16.9 9.6 71 74 A Q S S- 0 0 119 -3,-0.2 2,-1.7 3,-0.0 3,-0.4 -0.937 101.0 -77.5-146.2 172.3 -19.3 17.1 11.6 72 75 A D S S+ 0 0 92 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.563 76.9 128.8 -70.8 78.7 -21.2 15.0 14.3 73 76 A K S S+ 0 0 51 -2,-1.7 -23,-0.9 1,-0.3 2,-0.4 0.824 75.0 20.0 -99.6 -50.3 -22.6 12.4 11.9 74 77 A A S S+ 0 0 7 -3,-0.4 13,-2.5 -6,-0.2 2,-0.3 -0.960 84.0 168.6-126.9 105.3 -21.7 9.1 13.4 75 78 A V E -DH 47 86B 16 -28,-1.3 -28,-2.8 -2,-0.4 2,-0.4 -0.891 30.0-146.2-130.2 156.9 -20.9 9.4 17.2 76 79 A L E +DH 46 85B 0 9,-2.4 9,-2.5 -2,-0.3 2,-0.3 -0.952 30.4 155.4-115.2 132.1 -20.3 7.3 20.2 77 80 A K E +D 45 0B 88 -32,-2.4 -32,-3.1 -2,-0.4 2,-0.1 -0.864 37.4 40.4-145.5 174.9 -21.4 8.6 23.6 78 81 A G E > S+D 44 0B 22 3,-0.3 3,-2.1 5,-0.3 -34,-0.3 -0.407 71.0 85.8 79.9-155.4 -22.3 7.0 27.0 79 82 A G T 3 S- 0 0 6 -36,-1.7 -37,-1.0 1,-0.2 -1,-0.1 -0.352 118.8 -29.3 56.5-138.5 -20.5 4.1 28.5 80 83 A P T 3 S+ 0 0 41 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 0.264 115.0 111.8 -89.7 8.4 -17.4 5.3 30.4 81 84 A L < - 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