==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 07-NOV-08 3F7B . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.E.GREASLEY,R.A.A.FERRE,T.A.PAULY,R.PAZ . 504 5 4 1 3 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22553.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 325 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 113 22.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 4 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 . 0 0.0 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 . 48 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 6.5 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 0 2 1 1 0 0 2 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 5 0 2 2 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 . 6 4 5 3 0 2 0 2 2 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 . 1 2 0 0 0 0 0 0 0 0 0 2 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 2 A E 0 0 225 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 126.1 -63.4 -75.4 -6.6 2 3 A S - 0 0 46 15,-0.1 2,-0.2 13,-0.0 15,-0.2 -0.705 360.0-139.1-100.5 157.6 -60.7 -76.1 -4.0 3 4 A H E -a 17 0A 135 13,-0.5 15,-1.9 -2,-0.3 20,-0.0 -0.701 29.6 -84.7-111.8 163.6 -59.0 -73.7 -1.7 4 5 A W E +a 18 0A 53 -2,-0.2 2,-0.3 13,-0.2 15,-0.2 -0.226 50.5 163.8 -66.7 150.5 -55.4 -73.2 -0.6 5 6 A a - 0 0 1 13,-2.4 2,-0.2 12,-0.0 18,-0.1 -0.959 37.9-103.0-151.0 165.9 -54.1 -75.2 2.3 6 7 A Y >> - 0 0 2 -2,-0.3 3,-1.2 13,-0.2 4,-1.2 -0.588 43.5-104.0 -87.3 161.3 -50.7 -76.2 3.9 7 8 A E H 3> S+ 0 0 84 237,-0.3 4,-2.2 1,-0.3 3,-0.5 0.895 117.2 61.0 -55.2 -41.9 -49.4 -79.7 3.3 8 9 A V H 3> S+ 0 0 18 234,-0.5 4,-1.1 1,-0.3 -1,-0.3 0.833 102.2 53.5 -64.2 -27.4 -50.3 -81.0 6.7 9 10 A Q H <4 S+ 0 0 31 -3,-1.2 4,-0.3 2,-0.2 -1,-0.3 0.915 107.1 47.1 -80.0 -32.1 -53.9 -80.3 6.0 10 11 A A H >< S+ 0 0 32 -4,-1.2 3,-0.7 -3,-0.5 -2,-0.2 0.852 114.6 51.0 -63.6 -35.9 -54.2 -82.2 2.7 11 11AA E H 3< S+ 0 0 134 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.755 110.1 48.7 -73.9 -20.7 -52.3 -85.1 4.5 12 11BA S T 3< S+ 0 0 61 -4,-1.1 2,-0.3 -5,-0.2 -1,-0.2 0.285 113.7 22.3-108.9 5.7 -54.6 -85.2 7.5 13 11CA S S < S- 0 0 59 -3,-0.7 225,-0.0 -4,-0.3 0, 0.0 -0.962 74.1-102.4-160.8 176.7 -58.1 -85.2 6.0 14 11DA N S S+ 0 0 101 -2,-0.3 -1,-0.1 2,-0.1 -4,-0.1 0.738 77.4 115.9 -85.8 -17.0 -60.5 -85.8 3.1 15 11EA Y - 0 0 59 -6,-0.1 2,-0.4 1,-0.1 -2,-0.2 -0.236 64.0-138.3 -52.6 115.4 -60.7 -82.2 2.1 16 11FA P + 0 0 108 0, 0.0 -13,-0.5 0, 0.0 2,-0.3 -0.729 40.3 159.3 -68.9 130.4 -59.3 -81.6 -1.5 17 11GA a E -a 3 0A 29 -2,-0.4 2,-0.9 -15,-0.2 -13,-0.2 -0.947 48.4 -95.5-150.4 156.9 -57.3 -78.4 -1.1 18 11HA L E -a 4 0A 61 -15,-1.9 -13,-2.4 -2,-0.3 6,-0.1 -0.740 39.8-148.4 -82.5 102.5 -54.4 -76.7 -3.1 19 12 A V > - 0 0 13 -2,-0.9 3,-2.3 -15,-0.2 4,-0.4 -0.235 35.9 -90.2 -61.2 163.7 -51.1 -77.6 -1.4 20 13 A P G > S+ 0 0 12 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.826 125.1 59.2 -54.9 -35.0 -48.4 -75.1 -1.6 21 14 A V G 3 S+ 0 0 102 1,-0.3 -3,-0.0 7,-0.0 -2,-0.0 0.768 113.7 40.4 -62.1 -18.7 -46.9 -76.4 -4.9 22 15 A K G < S+ 0 0 142 -3,-2.3 -1,-0.3 6,-0.0 6,-0.1 0.238 79.5 135.0-115.8 8.9 -50.2 -75.8 -6.5 23 16 A W < - 0 0 2 -3,-1.5 -4,-0.1 -4,-0.4 -20,-0.0 -0.281 42.6-149.0 -53.6 138.9 -51.1 -72.5 -4.9 24 20 A G > + 0 0 46 3,-0.1 3,-1.6 2,-0.1 4,-0.2 0.259 62.8 62.8 -80.2-145.6 -52.6 -69.7 -7.8 25 21 A G T 3 S- 0 0 58 1,-0.2 3,-0.4 2,-0.1 178,-0.1 -0.279 126.2 -37.2 54.1-141.8 -52.2 -65.9 -7.6 26 22 A N T > S+ 0 0 45 176,-2.6 3,-2.3 1,-0.2 -1,-0.2 0.302 107.1 111.5 -92.4 8.1 -48.5 -64.9 -7.8 27 23 A b T < S+ 0 0 1 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.649 74.4 53.2 -65.6 -17.6 -47.4 -67.9 -5.7 28 24 A Q T 3 S+ 0 0 115 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.391 90.5 100.5 -98.5 6.5 -45.6 -69.5 -8.7 29 25 A K S < S- 0 0 116 -3,-2.3 3,-0.2 174,-0.1 -3,-0.0 0.107 79.7-103.9 -83.3-162.2 -43.4 -66.4 -9.6 30 26 A D S S+ 0 0 125 1,-0.2 222,-0.2 218,-0.1 -3,-0.1 0.314 102.2 61.8-121.9 6.9 -39.8 -65.8 -8.8 31 27 A R S S+ 0 0 88 220,-0.1 -1,-0.2 221,-0.1 2,-0.2 -0.483 79.0 148.3-121.2 54.6 -39.4 -63.2 -6.0 32 28 A Q - 0 0 2 217,-0.4 216,-0.1 -3,-0.2 167,-0.1 -0.482 34.2-100.6 -91.7 161.0 -41.2 -65.5 -3.5 33 29 A S S S+ 0 0 0 165,-0.4 2,-0.2 -2,-0.2 216,-0.1 -0.949 76.1 45.5-130.9 160.3 -40.8 -66.0 0.3 34 30 A P + 0 0 0 0, 0.0 214,-3.2 0, 0.0 2,-0.3 0.532 67.6 171.9 -83.8 177.3 -39.8 -67.4 2.7 35 31 A I - 0 0 0 212,-0.2 75,-1.6 -2,-0.2 2,-0.5 -0.873 38.2 -99.3-138.4 165.2 -36.1 -68.2 1.8 36 32 A N E -b 110 0B 52 212,-0.5 2,-0.7 -2,-0.3 75,-0.2 -0.803 34.5-148.8 -84.5 133.3 -33.0 -69.6 3.3 37 33 A I E -b 111 0B 0 73,-2.4 75,-2.6 -2,-0.5 2,-0.9 -0.910 3.3-154.7-109.6 107.7 -30.6 -66.9 4.4 38 34 A V > - 0 0 51 -2,-0.7 3,-1.5 73,-0.2 4,-0.5 -0.738 14.0-155.3 -79.6 103.3 -27.0 -67.8 4.2 39 35 A T G > S+ 0 0 27 -2,-0.9 3,-1.5 1,-0.3 -1,-0.2 0.884 86.4 53.9 -61.3 -33.6 -25.8 -65.4 6.8 40 36 A T G 3 S+ 0 0 121 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.680 105.4 54.4 -72.8 -17.5 -22.2 -65.1 5.5 41 37 A K G < S+ 0 0 169 -3,-1.5 2,-0.7 2,-0.1 -1,-0.3 0.510 86.6 94.6 -93.9 0.9 -23.4 -64.2 2.0 42 38 A A S < S- 0 0 2 -3,-1.5 214,-0.2 -4,-0.5 2,-0.2 -0.804 71.7-146.0 -92.3 116.0 -25.5 -61.3 3.4 43 39 A K E -d 256 0C 170 212,-0.8 214,-2.0 -2,-0.7 2,-0.1 -0.524 17.6-108.4 -84.7 147.2 -23.4 -58.2 3.1 44 40 A V E -d 257 0C 87 212,-0.2 2,-0.4 -2,-0.2 214,-0.2 -0.447 32.3-168.3 -69.0 137.2 -23.6 -55.3 5.7 45 41 A D > - 0 0 57 212,-2.0 3,-1.6 3,-0.1 211,-0.0 -0.972 15.8-154.6-127.9 124.0 -25.2 -52.3 4.3 46 42 A K T 3 S+ 0 0 142 -2,-0.4 39,-0.1 1,-0.3 -1,-0.1 0.622 88.2 76.5 -77.9 -9.8 -25.0 -49.1 6.4 47 43 A K T 3 S+ 0 0 101 1,-0.1 2,-1.4 2,-0.1 -1,-0.3 0.609 76.3 90.4 -62.1 -16.6 -28.2 -47.7 5.0 48 44 A L < + 0 0 13 -3,-1.6 -1,-0.1 209,-0.2 143,-0.1 -0.633 64.3 171.5 -88.6 87.2 -29.9 -50.2 7.3 49 45 A G - 0 0 35 -2,-1.4 35,-0.1 1,-0.2 37,-0.1 -0.144 39.9 -63.7 -90.1-178.7 -30.4 -48.1 10.5 50 46 A R - 0 0 115 33,-0.1 34,-1.6 34,-0.1 35,-0.3 -0.295 52.2-117.8 -61.3 149.6 -32.2 -48.8 13.7 51 47 A F E -E 83 0C 5 32,-0.3 2,-0.4 137,-0.2 32,-0.3 -0.640 21.3-148.9 -75.9 147.4 -36.0 -49.2 13.6 52 48 A F E -E 82 0C 24 30,-2.8 30,-1.9 -2,-0.3 2,-0.4 -0.953 12.8-157.4-116.6 143.7 -38.1 -46.7 15.5 53 49 A F E -E 81 0C 44 -2,-0.4 2,-0.3 28,-0.2 28,-0.2 -0.872 9.1-172.2-118.4 149.9 -41.4 -47.9 16.9 54 50 A S E S+E 80 0C 31 26,-2.7 26,-2.4 -2,-0.4 367,-0.0 -0.969 71.6 11.2-150.3 140.7 -44.4 -46.0 17.8 55 50AA G S S+ 0 0 22 -2,-0.3 123,-0.4 24,-0.2 3,-0.3 0.354 95.5 108.5 72.9 0.5 -47.7 -47.1 19.6 56 51 A Y S S+ 0 0 3 24,-0.2 123,-2.6 1,-0.2 122,-0.8 0.858 74.0 52.4 -72.9 -29.5 -45.7 -50.2 20.4 57 52 A D S S+ 0 0 112 121,-0.2 2,-0.3 120,-0.2 -1,-0.2 0.671 85.1 105.7 -77.9 -19.8 -45.5 -49.2 24.0 58 53 A K - 0 0 123 -3,-0.3 120,-0.4 20,-0.1 2,-0.4 -0.480 69.3-132.2 -77.4 125.8 -49.2 -48.6 24.5 59 54 A K + 0 0 111 -2,-0.3 118,-0.3 118,-0.2 2,-0.3 -0.610 41.4 161.8 -73.6 126.4 -51.2 -51.2 26.5 60 55 A Q B -P 176 0D 19 116,-3.3 116,-2.4 -2,-0.4 2,-0.5 -0.851 45.7-117.1-138.2 167.5 -54.3 -52.2 24.6 61 56 A T - 0 0 74 -2,-0.3 2,-0.3 114,-0.2 113,-0.1 -0.969 43.0-163.1-107.3 115.7 -57.0 -55.0 24.4 62 57 A W - 0 0 4 -2,-0.5 111,-2.7 112,-0.3 2,-0.4 -0.724 20.7-120.3-104.2 147.6 -56.6 -56.4 20.9 63 58 A T E -F 172 0C 46 11,-0.4 11,-2.6 -2,-0.3 2,-0.4 -0.740 34.0-174.5 -72.2 134.7 -59.0 -58.6 18.9 64 59 A V E -FG 171 73C 0 107,-2.3 107,-2.4 -2,-0.4 2,-0.3 -0.962 5.8-178.6-132.3 140.6 -57.3 -62.0 18.1 65 60 A Q E -FG 170 72C 52 7,-1.9 7,-3.0 -2,-0.4 2,-0.6 -0.986 33.5-126.0-141.1 159.6 -58.8 -64.6 15.8 66 61 A N E + G 0 71C 1 103,-2.5 102,-3.2 100,-0.3 103,-0.4 -0.907 24.9 177.7-102.2 112.3 -58.5 -68.0 14.3 67 62 A N - 0 0 37 3,-1.4 4,-0.1 -2,-0.6 -1,-0.1 0.073 58.5 -98.5-100.6 17.9 -58.9 -67.6 10.5 68 63 A G S S+ 0 0 9 2,-0.3 3,-0.1 163,-0.2 -2,-0.1 0.326 117.8 56.7 82.4 -11.6 -58.3 -71.2 9.8 69 64 A H S S- 0 0 52 1,-0.4 2,-0.3 -64,-0.1 -1,-0.1 0.557 118.0 -22.4-121.7 -21.5 -54.6 -70.7 8.9 70 65 A S S S- 0 0 5 28,-0.1 -3,-1.4 -5,-0.1 2,-0.5 -0.946 71.4 -84.4-167.8 179.1 -53.1 -69.0 11.9 71 66 A V E -G 66 0C 2 26,-0.4 26,-0.8 -2,-0.3 2,-0.5 -0.950 49.4-168.0-103.4 132.2 -53.9 -66.9 14.9 72 67 A M E -GH 65 96C 31 -7,-3.0 -7,-1.9 -2,-0.5 2,-0.4 -0.961 16.7-155.6-127.8 128.1 -54.1 -63.3 14.0 73 68 A M E -GH 64 95C 2 22,-2.9 22,-2.1 -2,-0.5 2,-0.6 -0.802 21.6-132.9 -99.9 135.6 -54.2 -60.2 16.1 74 69 A L E - H 0 94C 47 -11,-2.6 -11,-0.4 -2,-0.4 20,-0.3 -0.760 20.6-175.5 -95.2 121.3 -55.8 -57.2 14.4 75 70 A L > - 0 0 0 18,-2.0 3,-3.2 -2,-0.6 19,-0.2 0.621 15.2-156.2 -98.3 -17.1 -53.6 -54.1 14.9 76 71 A E T 3 - 0 0 108 17,-1.0 17,-0.2 1,-0.3 18,-0.1 0.735 63.0 -65.8 55.2 34.4 -55.9 -51.5 13.3 77 72 A N T 3 S+ 0 0 75 15,-1.8 -1,-0.3 1,-0.1 16,-0.1 0.622 99.5 132.8 62.6 22.0 -53.2 -48.9 12.4 78 76 A K < + 0 0 95 -3,-3.2 2,-0.3 14,-0.2 -1,-0.1 0.542 69.2 30.8 -85.2 0.3 -52.7 -48.4 16.2 79 77 A A - 0 0 3 13,-0.4 13,-3.1 -4,-0.2 2,-0.3 -0.956 64.5-174.9-147.2 170.7 -49.0 -48.7 15.8 80 78 A S E -EI 54 91C 10 -26,-2.4 -26,-2.7 -2,-0.3 2,-0.3 -0.950 9.4-150.8-158.1 160.0 -46.3 -47.9 13.2 81 79 A I E +EI 53 90C 0 9,-2.1 9,-2.7 -2,-0.3 2,-0.3 -0.933 13.5 172.9-134.4 160.7 -42.5 -48.2 12.5 82 80 A S E +E 52 0C 2 -30,-1.9 -30,-2.8 -2,-0.3 2,-0.1 -0.867 49.0 46.7-153.9-174.8 -39.9 -46.2 10.5 83 81 A G E > +E 51 0C 2 3,-0.4 3,-2.2 -2,-0.3 -32,-0.3 -0.474 56.1 114.2 67.3-153.9 -36.2 -46.3 10.1 84 82 A G T 3 S- 0 0 0 -34,-1.6 -33,-0.2 1,-0.3 -1,-0.1 0.793 116.7 -65.2 61.3 29.4 -34.8 -49.8 9.4 85 83 A G T 3 S+ 0 0 42 -35,-0.3 -1,-0.3 1,-0.2 -37,-0.1 0.523 99.8 145.7 71.4 3.4 -33.8 -48.6 5.9 86 84 A L < - 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