==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 18-JUL-08 3DVB . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.S.AVVARU . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11989.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 64.3 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 . 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 . 27 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 13.6 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 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 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 0 217 0, 0.0 3,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-132.2 13.6 -1.0 8.8 2 4 A H - 0 0 119 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.398 360.0 -99.2 -69.2 146.3 10.0 0.2 8.8 3 5 A W + 0 0 38 -2,-0.1 2,-0.2 1,-0.1 7,-0.2 -0.260 60.7 130.2 -66.9 154.2 7.8 -1.4 11.5 4 6 A G - 0 0 11 5,-2.5 10,-0.1 2,-0.1 -1,-0.1 -0.795 66.1 -80.1-168.6-148.3 5.5 -4.3 10.6 5 7 A Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.088 82.9 112.9-127.4 20.1 4.4 -7.8 11.6 6 8 A G S > S- 0 0 40 1,-0.1 4,-0.8 4,-0.1 -2,-0.1 -0.123 83.2 -96.6 -83.3-174.9 7.3 -9.8 10.1 7 9 A K T 4 S+ 0 0 175 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.804 123.0 37.0 -74.5 -29.7 10.0 -11.7 11.9 8 10 A H T 4 S+ 0 0 161 1,-0.1 -1,-0.2 5,-0.0 -3,-0.0 0.501 130.3 28.0-101.9 -4.6 12.5 -8.8 11.7 9 11 A N T 4 S+ 0 0 49 -6,-0.1 -5,-2.5 -3,-0.0 -2,-0.2 0.184 91.1 127.3-139.9 17.1 10.2 -5.9 12.2 10 12 A G S >X S- 0 0 4 -4,-0.8 3,-2.9 -5,-0.2 4,-0.8 0.030 79.0 -73.8 -71.7-179.8 7.4 -7.3 14.3 11 13 A P T 34 S+ 0 0 28 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.746 126.8 62.8 -44.2 -35.7 5.8 -6.2 17.7 12 14 A E T 34 S+ 0 0 146 1,-0.2 3,-0.1 2,-0.1 -2,-0.1 0.637 107.0 45.7 -70.2 -11.8 8.9 -7.3 19.7 13 15 A H T X4 S+ 0 0 62 -3,-2.9 3,-1.9 1,-0.1 4,-0.4 0.599 86.1 90.2-102.9 -18.2 11.0 -4.8 17.8 14 16 A W G >X S+ 0 0 4 -4,-0.8 4,-2.7 -3,-0.4 3,-1.3 0.790 72.5 70.2 -51.7 -36.0 8.7 -1.8 18.0 15 17 A H G 34 S+ 0 0 69 -4,-0.4 -1,-0.3 1,-0.3 7,-0.1 0.725 87.6 67.0 -57.8 -23.0 10.2 -0.4 21.2 16 18 A K G <4 S+ 0 0 131 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.851 116.7 23.5 -68.2 -34.4 13.4 0.5 19.4 17 19 A D T <4 S+ 0 0 108 -3,-1.3 -2,-0.2 -4,-0.4 -1,-0.2 0.700 135.0 37.6-100.4 -26.3 11.7 3.2 17.4 18 20 A F >< - 0 0 58 -4,-2.7 3,-2.4 1,-0.1 -1,-0.2 -0.774 64.1-176.1-129.8 85.3 8.8 3.8 19.8 19 21 A P G > S+ 0 0 101 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 0.757 78.1 74.8 -51.6 -29.7 9.9 3.6 23.4 20 22 A I G > S+ 0 0 54 1,-0.3 3,-2.7 2,-0.2 -5,-0.1 0.630 70.8 89.2 -62.2 -10.5 6.3 4.0 24.6 21 23 A A G < S+ 0 0 6 -3,-2.4 -1,-0.3 1,-0.3 -6,-0.1 0.760 89.9 46.7 -58.0 -23.3 5.8 0.4 23.5 22 24 A K G < S+ 0 0 137 -3,-2.0 -1,-0.3 -4,-0.1 -2,-0.2 0.029 95.2 133.5-106.0 25.4 6.9 -0.5 27.1 23 25 A G < - 0 0 15 -3,-2.7 3,-0.4 1,-0.1 -3,-0.0 0.120 69.3-104.1 -68.2-176.3 4.6 2.1 28.6 24 26 A E S S+ 0 0 123 1,-0.2 226,-0.2 225,-0.1 -1,-0.1 0.628 112.0 35.2 -86.3 -19.7 2.2 2.0 31.5 25 27 A R S S+ 0 0 48 224,-0.1 -1,-0.2 168,-0.1 2,-0.2 -0.335 80.0 153.2-134.2 56.8 -1.1 1.8 29.6 26 28 A Q - 0 0 4 -3,-0.4 220,-0.2 221,-0.3 170,-0.1 -0.525 33.2-101.5 -86.6 152.5 -0.4 -0.2 26.5 27 29 A S S S+ 0 0 0 168,-0.4 2,-0.2 -2,-0.2 -2,-0.0 -0.863 76.2 42.4-126.2 160.1 -2.9 -2.2 24.5 28 30 A P + 0 0 0 0, 0.0 218,-3.1 0, 0.0 2,-0.3 0.590 64.6 175.1 -81.0-179.9 -4.2 -4.8 23.8 29 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.5 -0.925 36.5-100.0-141.6 165.4 -4.6 -6.8 27.1 30 32 A D E -a 106 0A 29 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.776 33.4-139.1 -88.2 132.0 -6.2 -10.0 28.2 31 33 A I E -a 107 0A 0 75,-3.0 77,-2.4 -2,-0.5 2,-0.9 -0.839 10.6-158.0 -95.0 109.1 -9.5 -9.5 29.8 32 34 A D >> - 0 0 66 -2,-0.8 4,-1.2 75,-0.2 3,-1.2 -0.804 3.6-158.9 -87.6 107.2 -9.8 -11.7 32.8 33 35 A T T 34 S+ 0 0 46 -2,-0.9 -1,-0.2 1,-0.3 222,-0.0 0.717 87.8 52.6 -61.2 -23.5 -13.6 -12.0 33.3 34 36 A H T 34 S+ 0 0 166 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.653 112.6 42.9 -88.3 -15.5 -13.3 -13.0 36.9 35 37 A T T <4 S+ 0 0 95 -3,-1.2 -2,-0.2 2,-0.1 218,-0.2 0.525 88.7 108.6-103.8 -11.7 -11.1 -10.1 37.9 36 38 A A < - 0 0 21 -4,-1.2 2,-0.6 216,-0.1 218,-0.2 -0.390 69.6-127.9 -65.3 144.5 -13.1 -7.5 35.9 37 39 A K E -c 254 0B 118 216,-2.6 218,-2.6 -2,-0.1 2,-0.4 -0.864 8.5-134.3-104.0 120.8 -15.1 -5.1 38.2 38 40 A Y E -c 255 0B 83 -2,-0.6 218,-0.2 216,-0.2 220,-0.1 -0.567 22.4-163.6 -70.0 125.1 -18.8 -4.6 37.6 39 41 A D > - 0 0 38 216,-2.5 3,-1.6 -2,-0.4 -1,-0.1 -0.908 15.4-169.7-117.2 104.9 -19.4 -0.8 37.8 40 42 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.616 85.2 69.8 -66.3 -10.7 -23.0 0.2 38.3 41 43 A S T 3 S+ 0 0 99 2,-0.1 2,-0.1 -3,-0.0 215,-0.1 0.704 75.3 103.1 -79.3 -21.4 -22.0 3.8 37.6 42 44 A L < - 0 0 30 -3,-1.6 3,-0.1 213,-0.2 38,-0.0 -0.417 66.3-140.1 -66.6 134.2 -21.3 3.0 34.0 43 45 A K - 0 0 135 37,-0.9 39,-0.1 -2,-0.1 3,-0.1 -0.517 27.1 -91.2 -92.1 160.4 -23.9 4.2 31.6 44 46 A P - 0 0 109 0, 0.0 36,-1.7 0, 0.0 2,-0.2 -0.334 50.6-100.3 -66.3 154.7 -25.2 2.4 28.5 45 47 A L E -D 79 0B 17 141,-0.3 2,-0.6 34,-0.2 34,-0.2 -0.495 28.0-148.6 -75.7 148.2 -23.3 3.2 25.3 46 48 A S E -D 78 0B 46 32,-2.7 32,-2.2 -2,-0.2 2,-0.7 -0.916 17.0-178.6-121.3 101.6 -25.0 5.6 22.9 47 49 A V E -D 77 0B 35 -2,-0.6 2,-0.7 30,-0.2 30,-0.2 -0.898 4.8-179.3-105.3 113.8 -24.1 4.8 19.3 48 50 A S E +D 76 0B 40 28,-2.6 28,-1.8 -2,-0.7 3,-0.2 -0.824 24.3 142.5-114.6 90.7 -25.6 7.2 16.7 49 51 A Y > + 0 0 4 -2,-0.7 3,-1.6 26,-0.2 130,-0.2 0.239 35.9 107.4-110.6 10.2 -24.6 6.1 13.3 50 52 A D T 3 S+ 0 0 91 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.782 87.1 40.0 -60.7 -27.8 -27.8 6.9 11.4 51 53 A Q T 3 S+ 0 0 128 23,-0.9 -1,-0.3 -3,-0.2 24,-0.2 0.158 84.1 144.3-107.6 18.2 -26.2 9.8 9.6 52 54 A A < - 0 0 23 -3,-1.6 2,-0.5 22,-0.2 18,-0.1 -0.273 34.1-158.9 -60.2 139.1 -22.8 8.2 9.0 53 55 A T - 0 0 50 16,-0.3 16,-2.7 122,-0.1 2,-0.2 -0.891 4.5-163.0-124.4 99.5 -21.1 9.1 5.7 54 56 A S E +E 68 0B 1 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.521 11.7 175.3 -78.3 149.9 -18.5 6.7 4.5 55 57 A L E - 0 0 82 12,-3.1 118,-1.8 1,-0.4 2,-0.3 0.712 49.6 -8.2-123.9 -41.6 -16.1 8.0 1.9 56 58 A R E -EF 67 172B 84 11,-1.1 11,-3.0 116,-0.3 2,-0.4 -0.991 44.0-135.0-160.1 160.7 -13.4 5.6 0.9 57 59 A I E -EF 66 171B 0 114,-2.3 114,-2.2 -2,-0.3 2,-0.4 -0.986 30.1-175.6-122.4 133.1 -11.6 2.3 1.7 58 60 A L E -EF 65 170B 29 7,-2.4 7,-2.6 -2,-0.4 2,-0.9 -0.991 29.5-133.7-136.4 138.4 -7.8 2.3 1.7 59 61 A N E -E 64 0B 1 110,-2.6 109,-2.9 -2,-0.4 5,-0.2 -0.809 24.4-177.6 -88.0 109.1 -5.0 -0.3 2.0 60 62 A V - 0 0 40 3,-2.0 2,-0.4 -2,-0.9 4,-0.2 0.318 47.6-106.4 -91.7 8.4 -2.7 1.4 4.5 61 63 A G S S+ 0 0 10 2,-0.6 106,-0.1 166,-0.2 3,-0.1 -0.297 114.3 49.7 100.6 -50.2 -0.1 -1.3 4.4 62 64 A H S S- 0 0 51 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.428 130.4 -25.5-101.4 -2.6 -0.8 -2.9 7.8 63 65 A A S S- 0 0 1 164,-0.1 -3,-2.0 165,-0.1 -2,-0.6 -0.944 73.2 -89.9 178.1-173.9 -4.5 -3.1 7.3 64 66 A F E -E 59 0B 0 -2,-0.3 29,-0.5 -5,-0.2 2,-0.4 -0.980 33.5-151.9-123.3 139.7 -7.3 -1.5 5.4 65 67 A N E -E 58 0B 23 -7,-2.6 -7,-2.4 -2,-0.4 2,-0.7 -0.909 9.1-151.2-113.3 138.0 -9.3 1.5 6.7 66 68 A V E -EG 57 91B 0 25,-2.6 25,-1.6 -2,-0.4 2,-0.3 -0.947 28.9-151.6-103.5 116.0 -12.8 2.5 5.8 67 69 A E E -EG 56 90B 55 -11,-3.0 -12,-3.1 -2,-0.7 -11,-1.1 -0.676 10.7-161.9 -95.7 146.1 -12.9 6.3 6.2 68 70 A F E -E 54 0B 8 21,-2.5 2,-0.6 -2,-0.3 -14,-0.2 -0.844 32.1 -98.2-122.9 157.4 -15.8 8.5 7.2 69 71 A D + 0 0 35 -16,-2.7 -16,-0.3 -2,-0.3 5,-0.3 -0.655 40.8 173.8 -74.7 115.8 -16.6 12.2 6.9 70 72 A D + 0 0 44 -2,-0.6 -1,-0.1 1,-0.1 17,-0.1 -0.061 47.2 104.7-115.8 32.2 -15.7 13.6 10.4 71 73 A S S S+ 0 0 77 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.494 90.2 22.9 -88.1 -5.6 -16.2 17.3 9.6 72 74 A Q S S- 0 0 116 -3,-0.2 2,-2.1 3,-0.0 3,-0.4 -0.935 98.7 -86.8-150.0 168.1 -19.5 17.3 11.5 73 75 A D S S+ 0 0 92 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.423 76.0 129.5 -80.9 66.3 -21.3 15.2 14.2 74 76 A K S S+ 0 0 54 -2,-2.1 -23,-0.9 1,-0.3 2,-0.5 0.899 75.5 22.4 -85.3 -47.8 -22.7 12.7 11.7 75 77 A A S S+ 0 0 6 -3,-0.4 13,-2.9 -6,-0.3 2,-0.3 -0.945 85.0 166.7-124.6 106.7 -21.6 9.4 13.4 76 78 A V E -DH 48 87B 12 -28,-1.8 -28,-2.6 -2,-0.5 2,-0.4 -0.883 29.7-149.2-128.1 157.4 -20.9 9.8 17.1 77 79 A L E +DH 47 86B 0 9,-2.8 9,-2.1 -2,-0.3 2,-0.3 -0.978 29.5 155.0-121.3 130.9 -20.3 7.7 20.2 78 80 A K E +D 46 0B 68 -32,-2.2 -32,-2.7 -2,-0.4 7,-0.1 -0.856 35.6 38.7-143.3 178.1 -21.4 9.0 23.6 79 81 A G E > S+D 45 0B 15 5,-0.4 3,-2.1 -2,-0.3 -34,-0.2 -0.307 71.8 83.3 75.6-159.5 -22.3 7.6 27.0 80 82 A G T 3 S- 0 0 8 -36,-1.7 -37,-0.9 1,-0.3 -1,-0.1 -0.393 119.9 -25.2 60.8-134.5 -20.7 4.6 28.6 81 83 A P T 3 S+ 0 0 40 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.381 114.8 112.1 -90.6 4.5 -17.5 5.7 30.4 82 84 A L < - 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I 0 117B 21 25,-1.8 25,-3.0 -2,-0.3 2,-0.3 -0.930 23.4-123.2-155.7 174.7 -10.4 -1.4 10.4 93 95 A F E - I 0 116B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.2 -0.806 1.5-150.5-127.3 167.8 -9.7 -5.0 11.3 94 96 A H E + I 0 115B 1 21,-1.5 21,-2.2 -2,-0.3 2,-0.3 -0.983 30.9 166.2-132.9 135.8 -6.9 -7.2 12.7 95 97 A W E - I 0 114B 0 -2,-0.4 146,-1.2 19,-0.2 145,-0.8 -0.954 24.2-122.1-150.2 169.3 -7.0 -10.9 11.7 96 98 A G - 0 0 0 17,-1.3 6,-0.1 5,-0.7 3,-0.1 -0.456 25.3-116.6-110.0-178.2 -4.9 -14.1 11.6 97 99 A S S S+ 0 0 46 -2,-0.1 2,-0.3 142,-0.1 5,-0.1 0.599 105.5 36.4 -88.7 -14.8 -3.6 -16.6 9.2 98 100 A L S > S- 0 0 108 3,-0.2 3,-1.6 15,-0.1 -2,-0.2 -0.943 88.5-114.5-134.8 154.6 -5.7 -19.3 10.9 99 101 A D T 3 S+ 0 0 70 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.725 109.5 68.7 -63.2 -20.6 -9.2 -19.1 12.5 100 102 A G T 3 S+ 0 0 58 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.445 107.1 29.5 -80.2 0.7 -7.7 -19.7 15.9 101 103 A Q < + 0 0 53 -3,-1.6 -5,-0.7 12,-0.1 -3,-0.2 -0.962 64.9 99.1-151.4 164.6 -5.9 -16.4 16.1 102 104 A G + 0 0 0 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 0.028 55.3 104.3 144.5 -32.5 -6.3 -12.8 14.9 103 105 A S - 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