==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 03-MAR-10 2X7U . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.E.COZIER,M.P.LEESE,M.D.LLOYD,M.D.BAKER,N.THIYAGARAJAN, . 257 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11889.0 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 . 18 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 21.8 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 . 27 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 13.2 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 . 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 4 A H 0 0 177 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 141.4 15.8 2.5 -11.6 2 5 A W + 0 0 34 1,-0.1 2,-0.2 2,-0.1 7,-0.2 -0.217 360.0 143.9 -67.6 156.6 14.1 5.8 -12.5 3 6 A G - 0 0 8 5,-2.7 10,-0.1 2,-0.2 -1,-0.1 -0.679 59.2 -80.7-159.0-146.9 11.9 7.8 -10.2 4 7 A Y S S+ 0 0 36 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.252 83.3 111.1-122.3 9.2 11.0 11.4 -9.2 5 8 A G S > S- 0 0 37 1,-0.1 4,-1.3 4,-0.1 -2,-0.2 -0.240 84.0 -97.3 -79.7 172.7 14.0 12.2 -7.0 6 9 A K T 4 S+ 0 0 157 1,-0.2 -1,-0.1 2,-0.2 5,-0.1 0.821 122.3 38.0 -59.4 -33.2 16.8 14.7 -7.8 7 10 A H T 4 S+ 0 0 155 1,-0.1 -1,-0.2 4,-0.0 -5,-0.0 0.703 129.9 26.8 -96.5 -16.3 19.1 12.0 -9.0 8 11 A N T 4 S+ 0 0 60 -3,-0.2 -5,-2.7 -6,-0.1 -2,-0.2 0.155 98.4 117.5-127.7 16.5 16.7 9.7 -10.9 9 12 A G S >X S- 0 0 3 -4,-1.3 3,-2.7 -5,-0.2 4,-1.2 -0.021 84.5 -73.0 -78.7-176.5 14.1 12.2 -11.8 10 13 A P H 3> S+ 0 0 28 0, 0.0 4,-0.6 0, 0.0 -6,-0.1 0.736 127.0 61.4 -46.2 -36.7 12.7 13.6 -15.1 11 14 A E H 34 S+ 0 0 152 1,-0.2 4,-0.1 2,-0.1 -5,-0.1 0.671 111.5 41.4 -69.2 -15.6 15.8 15.6 -15.8 12 15 A H H X4 S+ 0 0 52 -3,-2.7 3,-2.0 2,-0.1 4,-0.5 0.694 90.0 86.2-101.9 -26.5 17.7 12.3 -15.9 13 16 A W H >X S+ 0 0 7 -4,-1.2 4,-2.4 1,-0.3 3,-1.0 0.809 75.3 71.0 -46.6 -39.8 15.3 10.1 -17.8 14 17 A H T 3< S+ 0 0 68 -4,-0.6 -1,-0.3 1,-0.2 6,-0.2 0.794 88.8 64.8 -52.2 -29.1 16.7 11.1 -21.2 15 18 A K T <4 S+ 0 0 131 -3,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.900 114.1 28.0 -63.2 -44.4 19.9 9.1 -20.5 16 19 A D T <4 S+ 0 0 126 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.716 135.7 33.6 -87.4 -23.7 18.2 5.7 -20.4 17 20 A F >< - 0 0 55 -4,-2.4 3,-2.5 1,-0.1 -1,-0.2 -0.713 65.5-174.5-135.8 84.9 15.4 6.7 -22.7 18 21 A P G > S+ 0 0 100 0, 0.0 3,-2.4 0, 0.0 -1,-0.1 0.744 77.5 78.4 -49.2 -30.6 16.6 9.3 -25.4 19 22 A I G > + 0 0 51 1,-0.3 3,-2.5 179,-0.2 -5,-0.1 0.653 67.8 89.6 -57.8 -12.0 13.0 9.6 -26.6 20 23 A A G < S+ 0 0 6 -3,-2.5 -1,-0.3 1,-0.3 -6,-0.1 0.781 89.0 49.1 -54.7 -25.6 12.5 11.9 -23.6 21 24 A K G < S+ 0 0 146 -3,-2.4 -1,-0.3 -7,-0.1 -2,-0.2 -0.045 92.0 129.8-104.1 29.8 13.6 14.6 -26.0 22 25 A G S < S- 0 0 14 -3,-2.5 3,-0.5 1,-0.1 -3,-0.0 -0.024 71.3-107.5 -76.7-176.6 11.2 13.6 -28.7 23 26 A E S S+ 0 0 107 1,-0.2 227,-0.2 169,-0.1 -1,-0.1 0.606 112.5 41.8 -87.8 -14.0 8.7 15.6 -30.8 24 27 A R S S+ 0 0 71 168,-0.1 -1,-0.2 2,-0.0 2,-0.2 -0.253 76.8 149.6-130.8 48.6 5.6 14.3 -29.1 25 28 A Q - 0 0 2 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.508 36.8-102.5 -83.1 150.2 6.4 14.1 -25.4 26 29 A S S S+ 0 0 0 168,-0.5 2,-0.1 -2,-0.2 -2,-0.0 -0.850 76.7 42.7-121.7 158.8 3.7 14.5 -22.7 27 30 A P + 0 0 0 0, 0.0 218,-3.6 0, 0.0 2,-0.3 0.596 65.2 170.4 -83.3-178.6 2.4 16.2 -20.6 28 31 A V - 0 0 0 216,-0.3 77,-1.2 -2,-0.1 2,-0.4 -0.926 38.0 -93.8-145.8 168.4 1.9 19.6 -22.0 29 32 A D E -a 105 0A 16 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.732 32.7-142.2 -87.1 135.8 0.2 22.9 -21.2 30 33 A I E -a 106 0A 1 75,-3.8 77,-2.4 -2,-0.4 2,-0.8 -0.854 12.0-162.3-102.1 103.5 -3.2 23.3 -22.8 31 34 A D >> - 0 0 50 -2,-0.8 4,-1.3 75,-0.2 3,-1.0 -0.781 9.1-152.2 -87.8 112.7 -3.8 26.9 -23.9 32 35 A T T 34 S+ 0 0 54 -2,-0.8 -1,-0.1 1,-0.2 222,-0.0 0.673 92.3 55.3 -58.3 -20.1 -7.5 27.4 -24.4 33 36 A H T 34 S+ 0 0 165 1,-0.1 -1,-0.2 3,-0.0 -2,-0.0 0.770 112.9 38.2 -85.9 -26.6 -6.9 30.1 -27.0 34 37 A T T <4 S+ 0 0 101 -3,-1.0 2,-1.1 1,-0.1 218,-0.3 0.512 94.7 88.7-101.0 -8.2 -4.7 28.0 -29.3 35 38 A A S < S- 0 0 9 -4,-1.3 218,-0.2 216,-0.1 2,-0.1 -0.788 70.2-164.0 -92.9 98.1 -6.6 24.7 -29.0 36 39 A K E -c 253 0B 124 -2,-1.1 218,-3.1 216,-0.7 2,-0.2 -0.351 22.2 -94.8 -84.7 162.6 -9.2 25.0 -31.7 37 40 A Y E -c 254 0B 119 216,-0.2 218,-0.2 -2,-0.1 -1,-0.1 -0.532 32.7-161.0 -76.3 136.0 -12.5 23.1 -32.4 38 41 A D > - 0 0 27 216,-2.0 3,-1.4 -2,-0.2 215,-0.0 -0.939 10.2-167.9-124.5 109.3 -12.3 20.2 -34.8 39 42 A P T 3 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.787 84.3 71.6 -63.5 -31.5 -15.6 18.9 -36.3 40 43 A S T 3 S+ 0 0 84 2,-0.0 2,-0.4 40,-0.0 -2,-0.0 0.620 79.0 100.9 -61.7 -11.0 -14.0 15.7 -37.7 41 44 A L < - 0 0 23 -3,-1.4 38,-0.1 213,-0.1 3,-0.1 -0.635 69.2-145.4 -77.0 128.1 -14.0 14.8 -34.0 42 45 A K - 0 0 99 37,-2.3 39,-0.1 -2,-0.4 -2,-0.0 -0.403 33.1 -73.5 -90.9 169.0 -16.8 12.4 -33.2 43 46 A P - 0 0 115 0, 0.0 36,-1.5 0, 0.0 2,-0.5 -0.357 55.1-112.7 -59.3 140.3 -18.9 12.2 -30.0 44 47 A L E -D 78 0B 20 34,-0.3 2,-0.6 141,-0.1 34,-0.2 -0.661 30.7-158.8 -80.4 126.0 -16.8 10.6 -27.2 45 48 A S E -D 77 0B 38 32,-2.6 32,-2.3 -2,-0.5 2,-0.6 -0.897 10.9-177.5-112.2 108.9 -18.2 7.2 -26.2 46 49 A V E -D 76 0B 35 -2,-0.6 2,-0.6 30,-0.2 30,-0.2 -0.910 0.1-177.9-105.7 113.8 -17.3 5.8 -22.8 47 50 A S E +D 75 0B 36 28,-2.7 28,-2.4 -2,-0.6 3,-0.2 -0.813 24.6 141.3-115.4 91.9 -18.7 2.3 -22.1 48 51 A Y > + 0 0 2 -2,-0.6 3,-1.9 26,-0.2 130,-0.2 0.341 39.5 99.9-110.6 3.9 -17.8 1.2 -18.6 49 52 A D T 3 S+ 0 0 101 1,-0.3 -1,-0.1 127,-0.1 25,-0.1 0.730 86.6 50.3 -64.6 -19.2 -20.9 -0.6 -17.4 50 53 A Q T 3 S+ 0 0 112 23,-0.8 -1,-0.3 -3,-0.2 24,-0.2 0.265 82.6 139.0 -99.8 9.3 -19.3 -4.0 -18.2 51 54 A A < - 0 0 21 -3,-1.9 2,-0.6 22,-0.2 18,-0.1 -0.335 35.3-165.0 -63.3 130.0 -16.1 -3.1 -16.3 52 55 A T - 0 0 51 16,-0.4 16,-2.5 -2,-0.1 2,-0.2 -0.912 8.3-155.8-117.4 101.6 -14.5 -5.9 -14.2 53 56 A S E +E 67 0B 2 -2,-0.6 121,-0.5 122,-0.3 14,-0.3 -0.515 14.2 178.1 -75.8 144.0 -12.0 -4.6 -11.7 54 57 A L E - 0 0 82 12,-2.7 118,-3.1 1,-0.4 2,-0.3 0.789 50.6 -24.9-110.9 -61.2 -9.3 -7.1 -10.6 55 58 A R E -EF 66 171B 103 11,-0.8 11,-2.2 116,-0.3 -1,-0.4 -0.939 42.3-132.1-151.8 174.4 -6.8 -5.6 -8.2 56 59 A I E +EF 65 170B 0 114,-2.3 114,-1.6 -2,-0.3 2,-0.3 -0.988 31.4 170.3-132.2 138.9 -5.0 -2.5 -6.9 57 60 A L E -EF 64 169B 19 7,-2.3 7,-2.3 -2,-0.4 2,-0.6 -0.970 35.0-124.8-150.8 163.8 -1.3 -2.2 -6.3 58 61 A N E +E 63 0B 2 110,-2.1 109,-3.3 -2,-0.3 5,-0.2 -0.942 21.4 176.9-111.3 111.5 1.7 0.0 -5.6 59 62 A N - 0 0 60 3,-1.7 4,-0.1 -2,-0.6 107,-0.1 0.278 57.7-101.3 -99.2 11.9 4.5 -0.2 -8.2 60 63 A G S S+ 0 0 9 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.291 117.5 65.7 89.0 -10.3 6.7 2.4 -6.6 61 64 A H S S- 0 0 36 1,-0.6 2,-0.3 -58,-0.1 166,-0.1 0.601 121.4 -48.1-113.2 -22.6 5.7 5.1 -9.1 62 65 A A - 0 0 4 164,-0.1 -3,-1.7 165,-0.1 -1,-0.6 -0.930 69.5 -74.8 174.7-169.1 2.0 5.4 -8.0 63 66 A F E -E 58 0B 0 -2,-0.3 29,-0.5 29,-0.2 2,-0.3 -0.969 41.9-158.9-118.1 132.6 -0.9 3.0 -7.4 64 67 A N E -E 57 0B 18 -7,-2.3 -7,-2.3 -2,-0.4 2,-0.6 -0.830 12.8-152.1-111.0 148.9 -2.7 1.3 -10.2 65 68 A V E -EG 56 90B 0 25,-2.2 25,-1.3 -2,-0.3 -9,-0.2 -0.961 24.9-156.9-116.9 109.6 -6.2 -0.3 -10.4 66 69 A E E -EG 55 89B 62 -11,-2.2 -12,-2.7 -2,-0.6 -11,-0.8 -0.583 5.5-158.3 -91.3 153.8 -6.2 -3.1 -13.1 67 70 A F E -E 53 0B 6 21,-2.6 2,-0.6 -14,-0.3 -14,-0.2 -0.894 31.0 -98.5-127.2 155.8 -9.1 -4.5 -15.0 68 71 A D + 0 0 40 -16,-2.5 -16,-0.4 -2,-0.3 3,-0.3 -0.634 39.5 178.1 -73.9 115.9 -9.8 -7.7 -16.8 69 72 A D + 0 0 46 -2,-0.6 -1,-0.1 1,-0.2 17,-0.1 -0.246 45.4 109.6-115.1 43.8 -9.2 -6.8 -20.5 70 73 A S S S+ 0 0 69 1,-0.0 2,-0.3 2,-0.0 -1,-0.2 0.625 84.4 28.8 -90.1 -16.7 -9.8 -10.2 -22.1 71 74 A Q S S- 0 0 115 -3,-0.3 2,-2.0 3,-0.0 3,-0.4 -0.884 96.2 -93.3-137.3 167.8 -13.1 -8.9 -23.7 72 75 A D S S+ 0 0 92 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.268 78.6 128.5 -80.2 53.0 -14.5 -5.7 -25.0 73 76 A K S S+ 0 0 40 -2,-2.0 -23,-0.8 1,-0.3 2,-0.5 0.884 71.6 23.1 -74.5 -46.3 -16.1 -5.0 -21.6 74 77 A A S S+ 0 0 7 -3,-0.4 13,-2.4 -24,-0.2 2,-0.3 -0.982 89.5 166.4-124.4 109.3 -15.1 -1.5 -20.5 75 78 A V E -DH 47 86B 9 -28,-2.4 -28,-2.7 -2,-0.5 2,-0.4 -0.875 32.7-147.1-131.0 163.8 -14.2 0.3 -23.7 76 79 A L E +DH 46 85B 0 9,-2.7 9,-1.6 -2,-0.3 2,-0.3 -0.992 32.5 145.1-127.7 132.3 -13.5 3.7 -25.1 77 80 A K E +D 45 0B 79 -32,-2.3 -32,-2.6 -2,-0.4 7,-0.1 -0.890 32.1 48.6-152.8-177.6 -14.4 4.8 -28.6 78 81 A G E > S+D 44 0B 17 5,-0.4 3,-2.2 -2,-0.3 -34,-0.3 -0.392 72.1 80.8 77.8-156.6 -15.5 7.7 -30.7 79 82 A G T 3 S- 0 0 0 -36,-1.5 -37,-2.3 1,-0.3 -1,-0.1 -0.341 121.4 -27.1 57.3-131.9 -13.9 11.1 -30.4 80 83 A P T 3 S+ 0 0 44 0, 0.0 -1,-0.3 0, 0.0 2,-0.1 0.287 114.3 114.1 -96.2 7.9 -10.7 11.2 -32.5 81 84 A L < - 0 0 3 -3,-2.2 2,-0.5 -39,-0.1 -3,-0.2 -0.423 61.0-137.6 -84.6 154.2 -10.2 7.4 -32.1 82 85 A D - 0 0 109 53,-0.1 -1,-0.0 -2,-0.1 -3,-0.0 -0.919 66.3 -35.6-107.2 132.4 -10.4 4.6 -34.6 83 86 A G S S- 0 0 59 -2,-0.5 -5,-0.4 38,-0.1 2,-0.3 -0.109 103.7 -22.5 56.4-150.7 -12.2 1.5 -33.6 84 87 A T - 0 0 33 -7,-0.1 38,-1.9 -9,-0.0 2,-0.4 -0.674 43.7-165.1-102.1 150.1 -12.2 0.3 -30.0 85 88 A Y E -HI 76 121B 3 -9,-1.6 -9,-2.7 -2,-0.3 2,-0.4 -0.989 18.6-141.5-132.0 121.0 -9.8 0.8 -27.1 86 89 A R E -HI 75 120B 45 34,-2.1 34,-1.8 -2,-0.4 -11,-0.2 -0.682 16.6-122.1 -88.4 132.3 -10.0 -1.5 -24.0 87 90 A L E + I 0 119B 3 -13,-2.4 32,-0.3 -2,-0.4 -13,-0.2 -0.464 36.6 165.7 -68.6 134.8 -9.6 -0.1 -20.5 88 91 A I E - 0 0 27 30,-2.7 -21,-2.6 1,-0.5 2,-0.3 0.636 58.8 -27.8-121.9 -28.7 -6.7 -2.0 -18.7 89 92 A Q E -GI 66 118B 28 29,-1.3 29,-3.0 -23,-0.3 -1,-0.5 -0.976 46.3-144.4-176.6 165.2 -6.0 0.2 -15.7 90 93 A F E +GI 65 117B 0 -25,-1.3 -25,-2.2 -2,-0.3 2,-0.3 -0.966 19.1 167.2-140.6 156.8 -6.0 3.7 -14.2 91 94 A H E - I 0 116B 28 25,-1.7 25,-2.7 -2,-0.3 2,-0.3 -0.886 22.0-121.0-153.4-176.8 -3.8 5.6 -11.8 92 95 A F E - I 0 115B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.2 -0.900 2.9-150.7-136.4 164.3 -3.1 9.1 -10.4 93 96 A H E + I 0 114B 3 21,-1.8 21,-2.2 -2,-0.3 2,-0.3 -0.980 28.3 166.3-131.6 139.7 -0.4 11.7 -10.2 94 97 A W E - I 0 113B 0 -2,-0.4 146,-1.1 19,-0.2 145,-0.6 -0.949 23.3-119.1-151.6 169.6 -0.3 14.2 -7.2 95 98 A G - 0 0 0 17,-1.0 6,-0.1 5,-0.8 3,-0.1 -0.526 28.6-109.2-112.3 178.1 1.8 16.8 -5.4 96 99 A S S S+ 0 0 54 -2,-0.2 2,-0.3 142,-0.1 5,-0.1 0.561 106.9 26.4 -79.9 -10.4 3.3 17.5 -2.0 97 100 A L S > S- 0 0 97 3,-0.2 3,-1.9 15,-0.1 -2,-0.1 -0.985 89.7-105.4-150.9 150.6 0.7 20.3 -1.6 98 101 A D T 3 S+ 0 0 63 -2,-0.3 48,-0.2 1,-0.3 15,-0.0 0.664 111.4 68.2 -48.1 -24.9 -2.8 21.1 -2.9 99 102 A G T 3 S+ 0 0 57 2,-0.1 -1,-0.3 13,-0.1 2,-0.2 0.823 107.1 30.5 -69.5 -31.1 -1.5 23.7 -5.2 100 103 A Q < + 0 0 43 -3,-1.9 -5,-0.8 12,-0.1 -3,-0.2 -0.758 64.9 104.8-123.3 170.1 0.4 21.3 -7.5 101 104 A G + 0 0 0 1,-0.5 13,-0.4 -7,-0.3 11,-0.2 0.016 52.4 97.6 152.1 -40.2 -0.1 17.7 -8.6 102 105 A S - 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