==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 13-NOV-09 3KOK . 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) . 11878.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 62.0 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 . 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 . 22 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 12.8 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 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 0 203 0, 0.0 16,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 178.4 13.8 0.2 10.2 2 4 A H - 0 0 111 1,-0.1 2,-0.1 15,-0.0 15,-0.0 -0.110 360.0-115.9 -48.4 135.9 10.2 0.7 9.2 3 5 A W + 0 0 34 11,-0.1 2,-0.2 1,-0.1 7,-0.2 -0.399 49.5 132.7 -82.6 156.0 7.7 -1.3 11.4 4 6 A G - 0 0 8 5,-2.5 10,-0.1 2,-0.1 58,-0.1 -0.774 62.9 -82.6-165.7-145.9 5.4 -4.1 10.3 5 7 A Y S S+ 0 0 33 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.241 81.7 109.4-128.4 14.7 4.4 -7.6 11.5 6 8 A G S > S- 0 0 39 4,-0.1 4,-1.1 1,-0.1 3,-0.3 -0.147 84.8 -91.8 -82.7-175.5 7.2 -9.8 10.1 7 9 A K T 4 S+ 0 0 185 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.774 123.3 39.0 -69.7 -22.2 10.0 -11.6 12.0 8 10 A H T 4 S+ 0 0 165 1,-0.1 -1,-0.2 5,-0.0 -3,-0.0 0.604 129.5 25.0-107.9 -7.9 12.4 -8.7 11.7 9 11 A N T 4 S+ 0 0 53 -3,-0.3 -5,-2.5 -6,-0.1 -2,-0.2 0.217 92.8 123.2-139.0 22.1 10.2 -5.7 12.1 10 12 A G S >X S- 0 0 4 -4,-1.1 3,-2.8 -5,-0.2 4,-0.7 0.042 81.9 -68.1 -79.4-174.9 7.3 -7.0 14.2 11 13 A P G >4 S+ 0 0 30 0, 0.0 3,-0.7 0, 0.0 4,-0.4 0.753 127.2 62.3 -46.1 -35.4 5.8 -5.9 17.5 12 14 A E G 34 S+ 0 0 155 1,-0.2 4,-0.1 2,-0.1 -2,-0.0 0.600 107.4 45.7 -72.0 -6.2 8.9 -7.1 19.5 13 15 A H G X> S+ 0 0 60 -3,-2.8 3,-1.7 1,-0.1 4,-0.6 0.585 86.6 88.1-106.3 -15.0 11.0 -4.6 17.6 14 16 A W H XX S+ 0 0 5 -3,-0.7 4,-2.4 -4,-0.7 3,-0.8 0.807 73.9 70.1 -61.7 -29.6 8.8 -1.5 17.8 15 17 A H H 34 S+ 0 0 62 -4,-0.4 -1,-0.3 1,-0.3 7,-0.1 0.766 87.8 67.1 -63.1 -22.5 10.2 -0.3 21.1 16 18 A K H <4 S+ 0 0 133 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.918 117.4 22.6 -69.6 -37.0 13.5 0.6 19.5 17 19 A D H << S+ 0 0 96 -3,-0.8 -2,-0.2 -4,-0.6 -1,-0.2 0.709 135.8 38.5 -91.7 -21.3 11.8 3.4 17.4 18 20 A F >< - 0 0 54 -4,-2.4 3,-2.8 1,-0.1 -1,-0.2 -0.753 64.3-178.3-132.1 77.8 8.8 3.9 19.7 19 21 A P G > S+ 0 0 101 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 0.745 75.8 76.2 -57.8 -22.1 10.0 3.6 23.3 20 22 A I G > S+ 0 0 54 1,-0.3 3,-2.6 179,-0.2 -5,-0.1 0.645 71.4 88.8 -61.9 -10.8 6.4 4.1 24.6 21 23 A A G < S+ 0 0 6 -3,-2.8 -1,-0.3 1,-0.3 -6,-0.1 0.799 89.4 45.7 -57.3 -25.4 5.9 0.5 23.5 22 24 A K G < S+ 0 0 135 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.1 -0.007 96.6 134.4-104.5 30.9 7.0 -0.5 26.9 23 25 A G < - 0 0 15 -3,-2.6 3,-0.5 1,-0.1 -3,-0.1 0.132 70.0-103.0 -71.2-178.5 4.8 2.2 28.5 24 26 A E S S+ 0 0 115 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.577 113.0 33.5 -88.2 -10.3 2.4 2.1 31.4 25 27 A R S S+ 0 0 47 224,-0.1 -1,-0.2 168,-0.1 2,-0.2 -0.319 79.6 155.6-143.3 54.8 -0.9 2.0 29.4 26 28 A Q - 0 0 4 -3,-0.5 220,-0.2 221,-0.4 170,-0.1 -0.535 33.1-102.2 -86.3 149.6 -0.2 -0.1 26.3 27 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.864 77.2 42.5-121.5 156.4 -2.8 -2.0 24.3 28 30 A P + 0 0 0 0, 0.0 218,-2.8 0, 0.0 2,-0.3 0.594 65.1 176.4 -80.9-175.9 -4.0 -4.6 23.6 29 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.4 -0.939 35.9 -99.4-142.2 159.6 -4.5 -6.5 26.8 30 32 A D E -a 106 0A 27 216,-0.4 2,-0.9 -2,-0.3 77,-0.2 -0.739 33.9-137.8 -77.9 134.4 -5.9 -9.8 28.0 31 33 A I E -a 107 0A 0 75,-3.3 77,-2.7 -2,-0.4 2,-0.9 -0.874 11.3-159.7 -96.6 104.0 -9.4 -9.3 29.5 32 34 A D >> - 0 0 66 -2,-0.9 4,-1.7 75,-0.2 3,-0.7 -0.787 6.0-162.0 -83.1 104.9 -9.5 -11.5 32.6 33 35 A T T 34 S+ 0 0 41 -2,-0.9 -1,-0.2 1,-0.3 222,-0.0 0.678 83.9 53.4 -68.5 -22.4 -13.3 -11.7 32.9 34 36 A H T 34 S+ 0 0 170 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.798 113.4 43.3 -82.3 -28.6 -13.3 -12.8 36.5 35 37 A T T <4 S+ 0 0 87 -3,-0.7 -2,-0.2 2,-0.1 -1,-0.2 0.647 86.1 103.1 -88.6 -26.3 -11.1 -9.9 37.6 36 38 A A S < S- 0 0 17 -4,-1.7 2,-0.5 218,-0.1 218,-0.2 -0.414 73.2-129.2 -56.3 137.1 -12.9 -7.1 35.6 37 39 A K E -c 254 0B 141 216,-2.0 218,-2.4 -2,-0.0 2,-0.2 -0.809 10.0-123.4 -96.1 125.0 -15.1 -5.2 38.1 38 40 A Y E -c 255 0B 92 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.455 24.8-161.8 -58.1 129.6 -18.7 -4.5 37.3 39 41 A D > - 0 0 32 216,-2.7 3,-2.7 -2,-0.2 -1,-0.1 -0.849 13.4-175.7-118.5 91.2 -19.1 -0.7 37.4 40 42 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.688 82.5 71.2 -65.5 -12.6 -22.9 0.1 37.9 41 43 A S T 3 S+ 0 0 87 -3,-0.1 2,-0.4 2,-0.1 215,-0.1 0.488 78.2 102.0 -74.2 -5.2 -21.8 3.8 37.5 42 44 A L < - 0 0 24 -3,-2.7 3,-0.1 213,-0.2 -3,-0.0 -0.732 67.0-140.9 -87.3 131.8 -21.1 3.1 33.9 43 45 A K - 0 0 123 37,-0.9 2,-0.1 -2,-0.4 39,-0.1 -0.276 28.3 -87.8 -78.6 165.0 -23.8 4.3 31.4 44 46 A P - 0 0 112 0, 0.0 36,-1.6 0, 0.0 -1,-0.1 -0.514 50.3-104.8 -64.8 146.6 -25.0 2.6 28.3 45 47 A L E -D 79 0B 15 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.415 26.6-145.8 -64.7 147.9 -23.0 3.3 25.3 46 48 A S E -D 78 0B 38 32,-2.6 32,-2.0 -2,-0.1 2,-0.6 -0.964 17.9-179.5-119.8 106.2 -24.6 5.7 22.7 47 49 A V E -D 77 0B 33 -2,-0.5 2,-0.6 30,-0.2 30,-0.2 -0.933 0.3-179.7-100.6 116.4 -23.7 4.8 19.2 48 50 A S E +D 76 0B 44 28,-3.0 28,-2.0 -2,-0.6 3,-0.2 -0.813 22.3 144.5-122.1 93.4 -25.3 7.2 16.8 49 51 A Y > + 0 0 3 -2,-0.6 3,-1.9 26,-0.2 130,-0.2 0.216 32.3 111.9-112.2 9.6 -24.3 6.2 13.2 50 52 A D T 3 S+ 0 0 93 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.894 85.8 37.7 -55.8 -41.1 -27.6 7.1 11.4 51 53 A Q T 3 S+ 0 0 125 23,-0.7 -1,-0.3 -3,-0.2 24,-0.1 0.217 84.4 149.1 -98.0 20.6 -26.0 9.9 9.5 52 54 A A < - 0 0 23 -3,-1.9 2,-0.5 1,-0.1 123,-0.1 -0.202 32.0-158.1 -57.9 140.0 -22.6 8.3 8.9 53 55 A T - 0 0 44 16,-0.3 16,-2.5 122,-0.1 2,-0.1 -0.822 5.5-166.4-120.2 91.8 -20.9 9.2 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 11.6 172.4 -72.4 152.1 -18.3 6.7 4.5 55 57 A L E - 0 0 80 12,-3.2 118,-2.5 1,-0.4 2,-0.3 0.701 49.2 -2.3-121.7 -44.1 -16.0 8.0 1.8 56 58 A R E -EF 67 172B 83 11,-1.1 11,-3.1 116,-0.3 -1,-0.4 -0.974 46.2-137.1-154.9 156.6 -13.2 5.7 0.9 57 59 A I E -EF 66 171B 0 114,-2.4 114,-2.0 -2,-0.3 2,-0.4 -0.994 27.6-170.5-125.6 133.1 -11.4 2.4 1.6 58 60 A L E -EF 65 170B 32 7,-2.5 7,-2.6 -2,-0.4 2,-0.8 -0.982 25.2-145.1-129.0 133.3 -7.6 2.4 1.8 59 61 A N E +E 64 0B 0 110,-3.1 109,-3.2 -2,-0.4 110,-0.2 -0.870 23.0 179.9 -87.0 111.0 -5.0 -0.3 2.0 60 62 A N - 0 0 52 3,-1.9 4,-0.1 -2,-0.8 -1,-0.1 0.321 52.7 -98.4 -98.5 11.7 -2.3 1.4 4.1 61 63 A G S S+ 0 0 6 2,-0.5 106,-0.1 166,-0.2 3,-0.1 0.275 118.1 49.9 94.5 -12.2 0.2 -1.4 4.2 62 64 A H S S- 0 0 34 1,-0.5 2,-0.2 -58,-0.1 166,-0.1 0.588 124.7 -23.8-121.8 -39.2 -0.9 -2.7 7.6 63 65 A A S S- 0 0 6 -5,-0.1 -3,-1.9 165,-0.1 -1,-0.5 -0.798 70.4 -93.3-154.1-174.1 -4.6 -3.0 7.4 64 66 A F E -E 59 0B 0 -2,-0.2 2,-0.5 29,-0.2 29,-0.4 -0.983 35.0-154.1-116.9 138.7 -7.5 -1.5 5.3 65 67 A N E -E 58 0B 22 -7,-2.6 -7,-2.5 -2,-0.4 2,-0.7 -0.937 9.6-150.9-109.7 130.8 -9.3 1.5 6.7 66 68 A V E -EG 57 91B 0 25,-2.7 25,-1.8 -2,-0.5 2,-0.3 -0.907 29.6-151.4 -92.4 116.2 -12.9 2.5 5.8 67 69 A E E -EG 56 90B 44 -11,-3.1 -12,-3.2 -2,-0.7 -11,-1.1 -0.709 11.3-161.0 -99.7 147.6 -12.8 6.2 6.2 68 70 A F E -E 54 0B 8 21,-2.4 2,-0.7 -2,-0.3 -14,-0.2 -0.801 31.9 -98.2-121.0 156.9 -15.6 8.5 7.1 69 71 A D + 0 0 34 -16,-2.5 -16,-0.3 -2,-0.3 5,-0.3 -0.718 42.6 170.7 -71.7 111.9 -16.5 12.2 6.9 70 72 A D + 0 0 41 -2,-0.7 -1,-0.1 1,-0.1 17,-0.1 -0.059 47.8 102.2-112.7 28.1 -15.5 13.5 10.3 71 73 A S S S+ 0 0 81 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.433 90.9 27.7 -92.0 0.8 -15.9 17.2 9.5 72 74 A Q S S- 0 0 119 -3,-0.2 2,-2.6 3,-0.1 3,-0.4 -0.961 99.8 -89.8-149.8 163.7 -19.2 17.2 11.3 73 75 A D S S+ 0 0 85 -2,-0.3 3,-0.2 1,-0.2 -22,-0.1 -0.334 76.7 129.4 -75.8 62.9 -20.9 15.2 14.1 74 76 A K S S+ 0 0 43 -2,-2.6 -23,-0.7 1,-0.3 2,-0.4 0.790 72.8 23.6 -86.8 -32.0 -22.4 12.6 11.7 75 77 A A S S+ 0 0 4 -3,-0.4 13,-3.2 -24,-0.1 2,-0.3 -0.866 85.0 169.9-137.0 100.7 -21.3 9.4 13.3 76 78 A V E -DH 48 87B 16 -28,-2.0 -28,-3.0 -2,-0.4 2,-0.4 -0.900 29.7-152.0-130.7 154.1 -20.6 9.7 17.0 77 79 A L E +DH 47 86B 0 9,-2.9 9,-2.4 -2,-0.3 2,-0.3 -0.945 29.7 151.0-113.9 136.0 -19.9 7.7 20.1 78 80 A K E +D 46 0B 58 -32,-2.0 -32,-2.6 -2,-0.4 7,-0.1 -0.903 37.2 39.2-149.8 172.3 -20.9 9.1 23.6 79 81 A G E > S+D 45 0B 17 5,-0.4 3,-2.5 3,-0.3 -34,-0.3 -0.371 72.5 81.9 81.5-161.6 -21.9 7.6 26.9 80 82 A G T 3 S- 0 0 4 -36,-1.6 -37,-0.9 1,-0.3 -1,-0.2 -0.334 121.9 -22.9 53.9-132.2 -20.4 4.6 28.5 81 83 A P T 3 S+ 0 0 47 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.479 114.7 112.9 -85.4 -0.8 -17.2 5.7 30.2 82 84 A L < - 0 0 15 -3,-2.5 2,-0.5 -39,-0.1 -3,-0.3 -0.487 54.1-153.8 -85.5 144.8 -16.8 8.7 27.9 83 85 A D - 0 0 130 -2,-0.2 2,-0.0 53,-0.1 -1,-0.0 -0.921 69.6 -9.8 -97.5 125.6 -17.1 12.4 28.7 84 86 A G S S- 0 0 45 -2,-0.5 -5,-0.4 38,-0.1 2,-0.4 -0.394 98.9 -44.2 85.4-167.4 -18.2 14.4 25.6 85 87 A T - 0 0 34 -7,-0.1 38,-2.8 -2,-0.0 2,-0.5 -0.891 41.1-162.1-119.5 135.8 -18.6 13.4 22.0 86 88 A Y E -HI 77 122B 4 -9,-2.4 -9,-2.9 -2,-0.4 2,-0.4 -0.980 13.3-142.5-123.6 128.3 -16.3 11.4 19.8 87 89 A R E -HI 76 121B 48 34,-2.7 34,-2.1 -2,-0.5 2,-0.3 -0.733 19.2-117.7 -94.1 133.4 -16.5 11.4 16.0 88 90 A L E + I 0 120B 2 -13,-3.2 32,-0.3 -2,-0.4 -13,-0.1 -0.496 37.1 166.5 -66.8 128.9 -16.0 8.3 13.9 89 91 A I E - 0 0 32 30,-2.9 -21,-2.4 1,-0.4 2,-0.3 0.749 60.0 -25.1-110.5 -39.5 -13.0 8.7 11.6 90 92 A Q E -GI 67 119B 29 29,-1.2 29,-2.8 -23,-0.2 -1,-0.4 -0.978 47.7-143.6-163.7 159.5 -12.3 5.2 10.3 91 93 A F E +GI 66 118B 0 -25,-1.8 -25,-2.7 -2,-0.3 2,-0.3 -0.952 23.9 163.3-128.1 155.9 -12.7 1.5 11.1 92 94 A H E - I 0 117B 21 25,-1.9 25,-3.2 -2,-0.3 2,-0.3 -0.915 23.6-124.4-153.7 176.0 -10.3 -1.3 10.3 93 95 A F E - I 0 116B 0 -29,-0.4 2,-0.4 -2,-0.3 -29,-0.2 -0.882 0.6-149.3-128.4 161.6 -9.6 -4.9 11.3 94 96 A H E + I 0 115B 5 21,-2.0 21,-2.3 -2,-0.3 2,-0.3 -0.983 31.7 168.7-121.9 136.5 -6.9 -7.1 12.6 95 97 A W E - I 0 114B 0 -2,-0.4 146,-1.2 19,-0.2 145,-0.8 -0.926 23.8-119.7-150.8 170.0 -6.8 -10.8 11.6 96 98 A G - 0 0 0 17,-1.4 6,-0.1 5,-0.6 3,-0.1 -0.482 24.8-119.5-106.6 172.7 -4.9 -13.9 11.5 97 99 A S S S+ 0 0 44 -2,-0.2 2,-0.3 142,-0.1 5,-0.1 0.649 106.4 30.4 -77.9 -18.0 -3.4 -16.4 9.1 98 100 A L S > S- 0 0 113 3,-0.2 3,-1.8 15,-0.1 -2,-0.2 -0.931 89.6-110.4-139.5 156.7 -5.7 -19.0 10.8 99 101 A D T 3 S+ 0 0 75 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.751 110.5 69.0 -67.4 -20.6 -9.0 -18.9 12.5 100 102 A G T 3 S+ 0 0 56 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.431 107.4 28.2 -76.0 1.1 -7.4 -19.6 15.8 101 103 A Q < + 0 0 54 -3,-1.8 -5,-0.6 12,-0.1 -3,-0.2 -0.963 66.5 98.0-153.3 165.1 -5.6 -16.2 16.0 102 104 A G + 0 0 0 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 -0.049 55.7 104.5 142.8 -34.9 -6.1 -12.7 14.7 103 105 A S - 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