==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE/LYASE INHIBITOR 01-AUG-11 3T83 . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.HOFMANN,C.K.WANG . 257 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11829.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 64.6 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 . 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 . 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 . 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 0 179 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-141.8 31.5 0.6 9.0 2 5 A W + 0 0 43 2,-0.0 2,-0.2 11,-0.0 7,-0.2 -0.508 360.0 129.3 -96.1 156.4 29.0 -1.2 11.2 3 6 A G - 0 0 6 5,-2.3 10,-0.1 -2,-0.2 58,-0.1 -0.788 62.6 -80.9-167.1-146.7 26.8 -4.2 10.5 4 7 A Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.331 83.0 105.0-124.9 2.9 25.7 -7.6 11.7 5 8 A G S > S- 0 0 37 4,-0.1 4,-1.3 1,-0.1 3,-0.3 -0.075 86.3 -91.8 -76.9-177.3 28.6 -9.8 10.4 6 9 A K T 4 S+ 0 0 158 1,-0.2 -1,-0.1 2,-0.2 5,-0.1 0.852 122.9 39.1 -65.7 -35.6 31.4 -11.4 12.3 7 10 A H T 4 S+ 0 0 165 1,-0.1 -1,-0.2 4,-0.0 -3,-0.0 0.534 130.2 24.8-100.3 -5.5 33.9 -8.6 11.7 8 11 A N T 4 S+ 0 0 60 -3,-0.3 -5,-2.3 -6,-0.1 -2,-0.2 0.261 95.4 116.6-136.6 10.7 31.5 -5.6 12.1 9 12 A G S >X S- 0 0 0 -4,-1.3 3,-3.0 -5,-0.2 4,-0.8 0.075 84.7 -67.6 -79.0-172.9 28.7 -6.9 14.3 10 13 A P T 34 S+ 0 0 21 0, 0.0 4,-0.4 0, 0.0 3,-0.3 0.733 127.2 62.7 -47.9 -33.9 27.4 -6.0 17.7 11 14 A E T 34 S+ 0 0 105 1,-0.2 3,-0.1 2,-0.1 -5,-0.1 0.667 109.6 42.7 -65.4 -16.7 30.5 -7.3 19.5 12 15 A H T X> S+ 0 0 59 -3,-3.0 3,-1.8 1,-0.1 4,-0.5 0.633 87.8 88.5-103.5 -20.0 32.5 -4.6 17.6 13 16 A W H >X S+ 0 0 7 -4,-0.8 4,-2.6 -3,-0.3 3,-0.7 0.783 74.0 70.3 -57.3 -32.1 30.2 -1.6 17.9 14 17 A H H 34 S+ 0 0 68 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.718 88.2 65.5 -62.5 -20.7 31.7 -0.4 21.3 15 18 A K H <4 S+ 0 0 135 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.924 117.0 24.2 -70.0 -43.2 34.9 0.7 19.6 16 19 A D H << S+ 0 0 110 -3,-0.7 -2,-0.2 -4,-0.5 -1,-0.2 0.744 136.1 38.2 -86.1 -26.1 33.4 3.4 17.5 17 20 A F >< + 0 0 44 -4,-2.6 3,-2.7 -5,-0.2 -1,-0.2 -0.703 63.5 179.6-130.1 80.3 30.4 3.8 19.9 18 21 A P G > S+ 0 0 99 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.707 76.4 75.6 -58.5 -21.2 31.5 3.5 23.5 19 22 A I G > S+ 0 0 54 1,-0.3 3,-2.5 2,-0.2 -5,-0.1 0.640 71.4 87.9 -65.5 -11.6 27.9 4.1 24.7 20 23 A A G < S+ 0 0 6 -3,-2.7 -1,-0.3 1,-0.3 -6,-0.1 0.720 92.4 43.6 -55.5 -23.5 27.3 0.5 23.6 21 24 A K G < S+ 0 0 141 -3,-1.9 -1,-0.3 -7,-0.1 -2,-0.2 0.017 99.4 131.6-108.4 26.2 28.5 -0.4 27.1 22 25 A G S X S- 0 0 17 -3,-2.5 3,-0.5 1,-0.1 -3,-0.1 0.179 72.1 -90.6 -80.8-170.5 26.4 2.4 28.7 23 26 A E T 3 S+ 0 0 104 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.691 115.1 24.2 -76.6 -22.6 23.9 2.8 31.5 24 27 A R T 3 S+ 0 0 32 224,-0.1 -1,-0.2 168,-0.1 2,-0.1 -0.319 79.1 163.3-145.4 58.8 20.7 2.1 29.6 25 28 A Q < - 0 0 5 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.430 27.9 -99.5 -85.3 155.1 21.3 -0.0 26.5 26 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.1 -2,-0.0 -0.887 77.6 37.6-128.1 157.3 18.7 -2.0 24.4 27 30 A P + 0 0 0 0, 0.0 218,-2.8 0, 0.0 2,-0.3 0.609 66.5 177.1 -77.6 178.8 17.4 -4.5 23.7 28 31 A V - 0 0 1 216,-0.3 77,-1.3 -2,-0.2 2,-0.4 -0.918 36.3 -99.2-135.3 164.0 17.0 -6.5 27.0 29 32 A D E -a 105 0A 28 216,-0.5 2,-0.9 -2,-0.3 77,-0.2 -0.752 34.4-139.1 -79.0 133.9 15.6 -9.8 28.1 30 33 A I E -a 106 0A 1 75,-2.8 77,-2.4 -2,-0.4 2,-0.9 -0.856 10.8-158.8 -97.0 103.7 12.1 -9.2 29.6 31 34 A D >> - 0 0 66 -2,-0.9 3,-2.1 75,-0.2 4,-1.5 -0.776 4.3-159.0 -83.1 106.2 11.9 -11.4 32.7 32 35 A T T 34 S+ 0 0 41 -2,-0.9 -1,-0.2 1,-0.3 222,-0.0 0.712 87.7 53.7 -65.1 -20.8 8.1 -11.6 33.1 33 36 A H T 34 S+ 0 0 165 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.351 110.1 47.1 -96.6 4.0 8.3 -12.6 36.8 34 37 A T T <4 S+ 0 0 94 -3,-2.1 -2,-0.2 2,-0.0 -1,-0.2 0.589 87.4 99.6-111.3 -22.9 10.5 -9.6 37.7 35 38 A A S < S- 0 0 21 -4,-1.5 2,-0.5 218,-0.1 218,-0.2 -0.352 70.2-131.4 -66.9 148.4 8.5 -6.9 35.9 36 39 A K E -c 253 0B 131 216,-2.0 218,-2.6 221,-0.0 2,-0.2 -0.887 10.2-125.6-110.0 123.6 6.2 -4.9 38.2 37 40 A Y E -c 254 0B 84 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.485 24.8-159.2 -62.1 132.4 2.6 -4.1 37.4 38 41 A D > - 0 0 32 216,-2.2 3,-1.3 -2,-0.2 -1,-0.1 -0.868 14.1-174.4-122.2 96.5 2.1 -0.4 37.6 39 42 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.546 81.2 67.7 -70.7 -4.8 -1.6 0.6 38.1 40 43 A S T 3 S+ 0 0 92 2,-0.1 215,-0.1 40,-0.0 39,-0.0 0.754 73.2 107.4 -84.1 -26.2 -0.7 4.3 37.8 41 44 A L S < S- 0 0 31 -3,-1.3 3,-0.1 213,-0.2 213,-0.0 -0.251 70.2-131.3 -48.9 132.3 0.2 3.9 34.1 42 45 A K - 0 0 136 37,-1.2 37,-0.4 1,-0.1 39,-0.1 -0.425 37.7 -75.8 -81.1 163.1 -2.5 5.5 31.9 43 46 A P - 0 0 107 0, 0.0 36,-0.7 0, 0.0 2,-0.3 -0.321 51.1-109.9 -58.6 142.1 -4.1 3.6 29.0 44 47 A L E -D 78 0B 22 34,-0.3 2,-0.6 141,-0.1 34,-0.2 -0.594 31.4-156.1 -71.8 133.6 -1.9 3.4 25.8 45 48 A S E -D 77 0B 49 32,-3.1 32,-2.4 -2,-0.3 2,-0.7 -0.920 12.8-176.9-119.4 106.0 -3.3 5.6 23.0 46 49 A V E -D 76 0B 32 -2,-0.6 2,-0.6 30,-0.2 30,-0.2 -0.896 5.1-179.2-100.0 111.3 -2.4 4.7 19.4 47 50 A S E +D 75 0B 52 28,-2.9 28,-2.1 -2,-0.7 3,-0.2 -0.790 23.1 143.1-117.1 89.6 -3.9 7.3 17.1 48 51 A Y > + 0 0 2 -2,-0.6 3,-1.9 26,-0.2 130,-0.2 0.223 30.8 113.6-111.3 11.0 -3.0 6.4 13.5 49 52 A D T 3 S+ 0 0 102 1,-0.3 -1,-0.1 127,-0.1 25,-0.1 0.843 85.9 37.2 -55.5 -38.4 -6.2 7.4 11.7 50 53 A Q T 3 S+ 0 0 123 23,-1.0 -1,-0.3 -3,-0.2 24,-0.2 0.193 84.9 146.9-100.9 19.0 -4.6 10.2 9.8 51 54 A A < - 0 0 24 -3,-1.9 2,-0.5 22,-0.1 23,-0.1 -0.256 32.0-160.1 -59.1 136.6 -1.3 8.4 9.2 52 55 A T - 0 0 50 16,-0.3 16,-2.5 122,-0.1 2,-0.1 -0.885 2.0-160.2-124.5 100.3 0.3 9.2 5.8 53 56 A S E +E 67 0B 1 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.475 13.1 174.8 -78.7 152.6 2.9 6.7 4.5 54 57 A L E - 0 0 72 12,-2.8 118,-2.3 1,-0.4 2,-0.3 0.745 49.4 -13.0-121.1 -52.5 5.3 8.0 1.9 55 58 A R E -EF 66 171B 86 11,-0.6 11,-3.1 116,-0.3 2,-0.4 -0.984 45.6-130.9-161.4 156.0 8.0 5.6 0.9 56 59 A I E -EF 65 170B 0 114,-2.4 114,-2.2 -2,-0.3 2,-0.4 -0.964 29.2-171.6-122.3 136.1 9.8 2.3 1.7 57 60 A L E -EF 64 169B 35 7,-2.2 7,-2.2 -2,-0.4 2,-0.6 -0.991 23.9-150.2-137.1 134.0 13.6 2.2 1.8 58 61 A N E +E 63 0B 0 110,-2.8 109,-3.0 -2,-0.4 5,-0.2 -0.933 18.1 178.0 -97.0 115.5 16.3 -0.4 2.0 59 62 A N - 0 0 82 3,-1.9 4,-0.1 -2,-0.6 107,-0.1 0.249 55.3 -99.2-103.9 11.9 19.3 1.3 3.8 60 63 A G S S+ 0 0 6 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.387 118.5 58.6 88.6 -6.0 21.6 -1.7 3.9 61 64 A H S S- 0 0 46 1,-0.6 2,-0.3 -58,-0.1 166,-0.1 0.569 122.9 -36.6-120.2 -30.4 20.7 -2.6 7.5 62 65 A A - 0 0 12 164,-0.1 -3,-1.9 165,-0.1 -1,-0.6 -0.897 65.4 -96.0-169.5-171.1 17.0 -3.0 7.3 63 66 A F E -E 58 0B 3 29,-0.3 29,-0.7 -2,-0.3 2,-0.4 -0.975 33.1-163.4-123.8 145.4 14.0 -1.5 5.4 64 67 A N E -EG 57 91B 31 -7,-2.2 -7,-2.2 -2,-0.4 2,-0.6 -0.976 18.7-141.4-127.9 148.1 11.7 1.2 6.7 65 68 A V E -EG 56 90B 0 25,-2.3 25,-1.9 -2,-0.4 -9,-0.2 -0.932 31.8-146.6 -98.6 122.0 8.3 2.6 5.8 66 69 A E E -EG 55 89B 42 -11,-3.1 -12,-2.8 -2,-0.6 -11,-0.6 -0.591 10.6-157.2 -94.2 151.8 8.4 6.4 6.2 67 70 A F E -E 53 0B 8 21,-2.4 2,-0.7 -14,-0.3 -14,-0.2 -0.921 29.1-103.8-127.6 150.8 5.6 8.7 7.3 68 71 A D + 0 0 39 -16,-2.5 -16,-0.3 -2,-0.3 5,-0.3 -0.636 40.6 173.0 -68.8 110.7 4.8 12.4 7.0 69 72 A D + 0 0 44 -2,-0.7 -1,-0.1 1,-0.2 17,-0.1 -0.021 44.9 107.2-113.5 29.3 5.6 13.7 10.5 70 73 A S S S+ 0 0 78 2,-0.0 2,-0.3 3,-0.0 -1,-0.2 0.506 89.4 21.0 -83.5 -6.0 5.2 17.4 9.8 71 74 A Q S S- 0 0 115 -3,-0.3 2,-2.3 3,-0.1 3,-0.5 -0.934 99.9 -84.6-148.2 171.0 1.9 17.4 11.8 72 75 A D S S+ 0 0 86 -2,-0.3 3,-0.2 1,-0.2 -22,-0.1 -0.311 76.3 131.9 -76.1 58.0 0.3 15.3 14.5 73 76 A K S S+ 0 0 53 -2,-2.3 -23,-1.0 1,-0.3 2,-0.4 0.788 76.2 18.5 -80.9 -30.7 -1.2 12.8 11.9 74 77 A A S S+ 0 0 7 -3,-0.5 13,-2.9 -24,-0.2 2,-0.3 -0.908 83.5 165.1-146.1 110.0 -0.1 9.6 13.6 75 78 A V E -DH 47 86B 12 -28,-2.1 -28,-2.9 -2,-0.4 2,-0.4 -0.919 31.2-144.6-134.7 156.4 0.8 9.7 17.3 76 79 A L E +DH 46 85B 0 9,-2.6 9,-1.9 -2,-0.3 2,-0.3 -0.968 31.6 159.0-116.8 131.0 1.4 7.6 20.4 77 80 A K E +D 45 0B 76 -32,-2.4 -32,-3.1 -2,-0.4 7,-0.1 -0.899 33.7 34.9-140.9 171.7 0.3 8.9 23.8 78 81 A G E > S+D 44 0B 11 3,-0.4 3,-2.2 5,-0.4 -34,-0.3 -0.274 71.9 79.7 81.2-164.2 -0.5 7.6 27.2 79 82 A G T 3 S- 0 0 7 -36,-0.7 -37,-1.2 -37,-0.4 -1,-0.1 -0.437 122.8 -20.6 58.6-130.3 1.1 4.6 29.0 80 83 A P T 3 S+ 0 0 47 0, 0.0 2,-0.3 0, 0.0 -1,-0.3 0.448 115.4 113.1 -84.2 0.8 4.4 5.8 30.5 81 84 A L < - 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