==== 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 02-JUN-08 3DBU . 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) . 11867.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 161 62.6 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 8.6 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 . 16 6.2 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 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 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 0 208 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.7 10.1 0.3 8.8 2 5 A W + 0 0 52 1,-0.1 2,-0.2 11,-0.1 7,-0.2 -0.326 360.0 130.9 -74.9 159.8 7.8 -1.4 11.3 3 6 A G - 0 0 11 5,-2.6 10,-0.1 2,-0.1 58,-0.1 -0.819 64.3 -77.4-171.1-145.7 5.5 -4.3 10.5 4 7 A Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.284 84.2 105.1-123.2 8.2 4.5 -7.8 11.6 5 8 A G S > S- 0 0 39 3,-0.1 4,-1.1 4,-0.1 3,-0.2 -0.043 85.3 -91.9 -80.9-173.4 7.3 -9.9 10.3 6 9 A K T 4 S+ 0 0 168 1,-0.2 3,-0.1 2,-0.2 -1,-0.1 0.874 122.3 39.1 -71.1 -31.5 10.2 -11.5 12.1 7 10 A H T 4 S+ 0 0 156 1,-0.2 -1,-0.2 4,-0.0 -3,-0.0 0.614 131.3 23.9 -99.0 -2.4 12.7 -8.7 11.7 8 11 A N T 4 S+ 0 0 61 -3,-0.2 -5,-2.6 -6,-0.1 -2,-0.2 0.206 92.9 121.6-140.7 18.8 10.3 -5.7 12.2 9 12 A G S >X S- 0 0 4 -4,-1.1 3,-2.9 -5,-0.2 4,-0.6 0.013 81.5 -68.3 -85.1-177.3 7.4 -7.1 14.3 10 13 A P G >4 S+ 0 0 29 0, 0.0 3,-0.7 0, 0.0 4,-0.4 0.736 127.0 61.2 -47.4 -32.8 6.0 -6.1 17.6 11 14 A E G 34 S+ 0 0 142 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.669 108.5 45.6 -73.4 -11.2 9.0 -7.3 19.6 12 15 A H G X> S+ 0 0 62 -3,-2.9 3,-1.7 1,-0.1 4,-0.5 0.567 86.7 89.4 -99.7 -11.6 11.1 -4.8 17.7 13 16 A W H XX S+ 0 0 5 -3,-0.7 4,-2.9 -4,-0.6 3,-1.0 0.819 73.1 69.8 -63.0 -30.2 8.9 -1.7 17.9 14 17 A H H 34 S+ 0 0 64 -4,-0.4 -1,-0.3 1,-0.3 7,-0.1 0.730 86.9 67.1 -64.4 -19.1 10.3 -0.4 21.1 15 18 A K H <4 S+ 0 0 136 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.895 117.7 23.6 -71.1 -35.8 13.6 0.6 19.5 16 19 A D H << S+ 0 0 127 -3,-1.0 -2,-0.2 -4,-0.5 -1,-0.2 0.772 136.7 35.8 -93.5 -26.5 11.9 3.2 17.4 17 20 A F >< - 0 0 55 -4,-2.9 3,-2.4 1,-0.1 -1,-0.2 -0.802 64.2-178.9-128.2 84.5 8.9 3.8 19.8 18 21 A P G > S+ 0 0 100 0, 0.0 3,-2.2 0, 0.0 -4,-0.1 0.778 75.6 76.0 -63.0 -21.4 10.0 3.4 23.4 19 22 A I G > S+ 0 0 54 1,-0.3 3,-3.3 2,-0.2 -5,-0.1 0.722 71.7 86.9 -62.9 -14.0 6.5 4.0 24.7 20 23 A A G < S+ 0 0 9 -3,-2.4 -1,-0.3 1,-0.3 -6,-0.1 0.794 89.7 48.9 -51.8 -27.1 5.9 0.4 23.5 21 24 A K G < S+ 0 0 138 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.078 95.6 134.0 -95.9 20.7 7.2 -0.4 27.0 22 25 A G < - 0 0 17 -3,-3.3 3,-0.4 1,-0.1 -3,-0.0 0.092 69.0-108.3 -66.4 177.2 4.8 2.1 28.5 23 26 A E S S+ 0 0 97 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.468 111.0 36.3 -83.7 -13.0 2.4 1.9 31.5 24 27 A R S S+ 0 0 47 224,-0.1 -1,-0.2 2,-0.1 2,-0.1 -0.224 80.1 154.2-142.6 53.5 -0.9 1.8 29.6 25 28 A Q - 0 0 4 -3,-0.4 220,-0.2 221,-0.3 170,-0.1 -0.466 32.5-101.6 -85.2 155.4 -0.2 -0.2 26.4 26 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.1 -2,-0.1 -0.896 76.8 42.9-123.6 158.8 -2.8 -2.2 24.5 27 30 A P + 0 0 0 0, 0.0 218,-2.7 0, 0.0 2,-0.3 0.593 65.0 175.9 -83.3-178.6 -4.0 -4.8 23.7 28 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.5 -0.932 35.5-101.2-139.5 161.9 -4.5 -6.7 27.0 29 32 A D E -a 105 0A 31 216,-0.4 2,-0.9 -2,-0.3 77,-0.2 -0.733 32.6-138.3 -81.3 132.3 -6.0 -10.0 28.1 30 33 A I E -a 106 0A 0 75,-3.5 77,-3.1 -2,-0.5 2,-0.9 -0.827 11.7-159.7 -95.2 111.4 -9.5 -9.5 29.6 31 34 A D >> - 0 0 61 -2,-0.9 3,-1.3 75,-0.2 4,-1.3 -0.818 3.6-159.1 -88.6 106.0 -9.7 -11.8 32.7 32 35 A T T 34 S+ 0 0 49 -2,-0.9 -1,-0.1 1,-0.3 222,-0.0 0.650 86.2 57.2 -65.5 -18.3 -13.4 -12.0 33.2 33 36 A H T 34 S+ 0 0 165 1,-0.2 -1,-0.3 3,-0.0 -2,-0.0 0.670 112.8 38.0 -89.2 -19.2 -13.1 -13.1 36.8 34 37 A T T <4 S+ 0 0 79 -3,-1.3 -2,-0.2 2,-0.1 218,-0.2 0.479 86.4 109.2-110.5 -3.0 -11.1 -10.0 37.9 35 38 A A S < S- 0 0 18 -4,-1.3 2,-0.6 216,-0.1 218,-0.2 -0.510 70.4-126.3 -64.4 140.5 -12.9 -7.4 35.8 36 39 A K E -c 253 0B 142 216,-2.5 218,-2.8 -2,-0.2 2,-0.3 -0.769 9.0-130.8 -96.4 122.7 -14.9 -5.2 38.1 37 40 A Y E -c 254 0B 94 -2,-0.6 218,-0.2 216,-0.2 220,-0.1 -0.513 23.3-165.2 -63.5 128.1 -18.6 -4.6 37.5 38 41 A D > - 0 0 28 216,-3.0 3,-2.5 -2,-0.3 -1,-0.1 -0.837 14.1-173.6-120.8 97.8 -19.1 -0.9 37.7 39 42 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.653 83.4 70.6 -67.1 -8.6 -22.9 0.0 38.0 40 43 A S T 3 S+ 0 0 80 -3,-0.1 2,-0.1 2,-0.1 215,-0.1 0.660 76.5 103.4 -75.3 -16.3 -21.8 3.7 37.6 41 44 A L < - 0 0 22 -3,-2.5 38,-0.1 213,-0.2 3,-0.1 -0.410 69.1-134.4 -72.2 141.1 -21.0 3.0 34.0 42 45 A K - 0 0 124 37,-1.0 39,-0.1 -2,-0.1 -1,-0.1 -0.525 25.1 -94.9 -88.6 161.0 -23.6 4.3 31.5 43 46 A P - 0 0 106 0, 0.0 36,-1.9 0, 0.0 2,-0.2 -0.418 49.2-102.0 -62.4 150.5 -25.0 2.4 28.5 44 47 A L E -D 78 0B 17 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.526 27.3-149.5 -70.7 145.8 -23.2 3.2 25.3 45 48 A S E -D 77 0B 55 32,-3.0 32,-2.2 -2,-0.2 2,-0.6 -0.938 15.4-177.1-117.7 105.8 -24.9 5.6 22.9 46 49 A V E +D 76 0B 35 -2,-0.5 2,-0.6 30,-0.2 30,-0.2 -0.876 3.6 180.0-100.4 113.1 -24.0 4.8 19.3 47 50 A S E +D 75 0B 38 28,-2.7 28,-2.0 -2,-0.6 3,-0.2 -0.750 24.1 142.1-119.3 90.4 -25.5 7.3 16.8 48 51 A Y > + 0 0 2 -2,-0.6 3,-1.6 26,-0.2 130,-0.2 0.158 33.9 110.5-110.4 11.4 -24.5 6.2 13.3 49 52 A D T 3 S+ 0 0 80 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.880 86.1 38.9 -56.4 -40.8 -27.7 7.0 11.5 50 53 A Q T 3 S+ 0 0 128 23,-0.8 -1,-0.3 -3,-0.2 24,-0.2 0.151 84.2 145.2-101.1 22.6 -26.1 9.9 9.6 51 54 A A < - 0 0 22 -3,-1.6 2,-0.5 22,-0.2 123,-0.1 -0.227 32.9-158.7 -59.6 142.6 -22.7 8.3 9.0 52 55 A T - 0 0 57 16,-0.3 16,-2.7 122,-0.1 2,-0.1 -0.844 3.1-161.5-126.5 102.2 -21.0 9.2 5.7 53 56 A S E +E 67 0B 1 -2,-0.5 121,-0.6 122,-0.4 14,-0.3 -0.484 10.3 178.7 -77.2 151.1 -18.4 6.8 4.4 54 57 A L E - 0 0 79 12,-3.2 118,-2.4 1,-0.4 2,-0.3 0.692 52.1 -19.0-117.2 -51.4 -16.0 8.1 1.8 55 58 A R E -EF 66 171B 91 11,-1.0 11,-2.8 116,-0.3 2,-0.4 -0.998 46.5-126.6-160.9 161.6 -13.4 5.6 0.8 56 59 A I E -EF 65 170B 0 114,-2.7 114,-2.4 -2,-0.3 2,-0.4 -0.943 30.0-171.3-118.7 141.0 -11.6 2.3 1.6 57 60 A L E -EF 64 169B 26 7,-2.7 7,-2.5 -2,-0.4 2,-0.7 -0.994 28.2-139.4-138.5 138.5 -7.8 2.1 1.7 58 61 A N E -E 63 0B 0 110,-2.6 109,-2.9 -2,-0.4 5,-0.2 -0.867 23.4-176.7 -87.5 112.5 -5.1 -0.5 2.0 59 62 A N - 0 0 36 3,-1.7 4,-0.1 -2,-0.7 -1,-0.1 0.358 49.8-102.3 -99.0 6.0 -2.6 1.3 4.2 60 63 A G S S+ 0 0 15 2,-0.6 106,-0.1 166,-0.2 3,-0.1 0.244 116.1 49.5 94.7 -9.7 0.0 -1.4 4.1 61 64 A H S S- 0 0 47 1,-0.5 2,-0.2 -58,-0.1 166,-0.1 0.484 126.7 -21.6-131.1 -15.7 -0.8 -2.9 7.6 62 65 A S S S- 0 0 0 164,-0.1 -3,-1.7 165,-0.1 -2,-0.6 -0.854 71.5 -97.1-163.3-168.3 -4.6 -3.3 7.4 63 66 A F E -E 58 0B 0 29,-0.3 29,-0.7 -2,-0.2 2,-0.4 -0.969 35.7-163.5-123.5 150.2 -7.4 -1.8 5.4 64 67 A Q E -EG 57 91B 28 -7,-2.5 -7,-2.7 -2,-0.4 2,-0.5 -0.985 16.3-144.9-134.5 144.2 -9.5 1.0 6.7 65 68 A V E -EG 56 90B 0 25,-2.5 25,-1.9 -2,-0.4 2,-0.3 -0.937 27.4-148.7-102.6 128.9 -12.9 2.5 5.7 66 69 A E E -EG 55 89B 40 -11,-2.8 -12,-3.2 -2,-0.5 -11,-1.0 -0.778 9.2-159.1-107.4 146.3 -12.9 6.3 6.2 67 70 A F E -E 53 0B 6 21,-2.6 2,-0.6 -2,-0.3 -14,-0.2 -0.833 30.1-102.1-119.3 155.9 -15.8 8.6 7.2 68 71 A D + 0 0 51 -16,-2.7 -16,-0.3 -2,-0.3 5,-0.2 -0.677 39.6 173.3 -72.9 118.8 -16.5 12.3 6.9 69 72 A D + 0 0 42 -2,-0.6 -1,-0.1 1,-0.1 17,-0.1 0.032 43.2 111.2-118.5 27.8 -15.8 13.7 10.3 70 73 A S S S+ 0 0 78 2,-0.0 2,-0.3 3,-0.0 -1,-0.1 0.554 87.9 17.8 -72.8 -12.5 -16.2 17.4 9.5 71 74 A Q S S- 0 0 130 -3,-0.2 2,-2.1 3,-0.0 3,-0.4 -0.947 100.9 -79.9-150.9 165.0 -19.4 17.5 11.6 72 75 A D S S+ 0 0 91 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.478 78.0 128.1 -69.8 72.5 -21.2 15.5 14.3 73 76 A K S S+ 0 0 25 -2,-2.1 -23,-0.8 1,-0.3 2,-0.5 0.874 74.3 20.5 -92.3 -50.7 -22.6 12.9 11.8 74 77 A A S S+ 0 0 5 -3,-0.4 13,-2.6 -6,-0.2 2,-0.3 -0.970 84.5 163.8-124.2 109.0 -21.6 9.6 13.4 75 78 A V E -DH 47 86B 13 -28,-2.0 -28,-2.7 -2,-0.5 2,-0.4 -0.899 30.8-146.0-136.9 161.4 -20.7 9.8 17.1 76 79 A L E +DH 46 85B 0 9,-2.7 9,-2.2 -2,-0.3 2,-0.3 -0.971 30.1 151.2-121.2 134.5 -20.2 7.8 20.2 77 80 A K E +D 45 0B 73 -32,-2.2 -32,-3.0 -2,-0.4 7,-0.1 -0.885 36.0 45.8-147.2-175.5 -21.1 8.9 23.6 78 81 A G E > S+D 44 0B 24 5,-0.3 3,-2.0 -2,-0.3 -34,-0.3 -0.404 72.1 83.7 76.1-156.6 -22.2 7.5 27.0 79 82 A G T 3 S- 0 0 6 -36,-1.9 -37,-1.0 1,-0.3 -1,-0.1 -0.383 119.9 -28.8 57.5-138.3 -20.4 4.5 28.5 80 83 A P T 3 S+ 0 0 47 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.325 114.1 111.4 -87.8 2.8 -17.3 5.7 30.3 81 84 A L < - 0 0 14 -3,-2.0 2,-0.6 -39,-0.1 -3,-0.3 -0.501 54.9-153.3 -86.9 147.1 -16.9 8.7 28.0 82 85 A D - 0 0 135 -2,-0.2 2,-0.2 53,-0.1 -1,-0.0 -0.962 67.7 -1.6-112.3 116.4 -17.3 12.4 28.7 83 86 A G S S- 0 0 33 -2,-0.6 2,-0.4 39,-0.1 -5,-0.3 -0.596 97.5 -45.8 106.8-174.2 -18.2 14.3 25.6 84 87 A T - 0 0 32 -2,-0.2 38,-2.4 -7,-0.1 2,-0.5 -0.882 42.4-163.1-110.2 127.6 -18.8 13.5 22.0 85 88 A Y E -HI 76 121B 4 -9,-2.2 -9,-2.7 -2,-0.4 2,-0.4 -0.956 12.2-143.8-114.1 127.6 -16.5 11.3 20.0 86 89 A R E -HI 75 120B 45 34,-2.8 34,-2.0 -2,-0.5 2,-0.3 -0.739 17.0-121.7 -94.3 133.6 -16.7 11.4 16.2 87 90 A L E + I 0 119B 2 -13,-2.6 32,-0.3 -2,-0.4 -13,-0.2 -0.542 37.2 164.8 -66.7 129.4 -16.1 8.2 14.0 88 91 A I E - 0 0 32 30,-2.5 -21,-2.6 1,-0.4 2,-0.3 0.664 59.4 -17.9-116.4 -35.2 -13.3 8.8 11.6 89 92 A Q E -GI 66 118B 32 29,-1.2 29,-2.8 -23,-0.2 -1,-0.4 -0.991 46.9-147.8-160.8 159.4 -12.4 5.2 10.4 90 93 A F E +GI 65 117B 0 -25,-1.9 -25,-2.5 -2,-0.3 2,-0.3 -0.977 22.6 165.6-128.2 157.8 -12.8 1.5 11.1 91 94 A H E -GI 64 116B 26 25,-2.0 25,-2.7 -2,-0.3 2,-0.3 -0.910 22.6-124.1-154.1 176.8 -10.3 -1.3 10.3 92 95 A F E - 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