==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE(OXO-ACID) 16-JUL-92 1HEC . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.K.NAIR,D.W.CHRISTIANSON . 256 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11703.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 62.5 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 21.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 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 . 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 . 36 14.1 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 4 A H 0 0 190 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-169.8 10.0 0.3 8.9 2 5 A W + 0 0 57 1,-0.1 2,-0.2 11,-0.1 7,-0.2 -0.170 360.0 137.6 -64.4 155.4 7.8 -1.6 11.4 3 6 A G - 0 0 11 5,-2.2 10,-0.1 2,-0.2 -1,-0.1 -0.716 63.4 -82.4-163.4-147.7 5.5 -4.5 10.4 4 7 A Y S S+ 0 0 33 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.097 83.7 111.5-128.0 18.8 4.5 -7.9 11.7 5 8 A G S > S- 0 0 23 4,-0.1 4,-1.6 1,-0.1 -2,-0.2 -0.211 84.2 -95.7 -85.0 174.2 7.5 -10.0 10.5 6 9 A K T 4 S+ 0 0 164 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.809 124.0 39.3 -58.3 -37.2 10.3 -11.7 12.3 7 10 A H T 4 S+ 0 0 164 1,-0.1 -1,-0.2 5,-0.0 -5,-0.0 0.616 130.8 24.1 -93.2 -19.0 12.6 -8.7 11.7 8 11 A N T 4 S+ 0 0 57 -3,-0.1 -5,-2.2 -6,-0.0 -2,-0.2 0.214 92.9 130.6-135.8 13.8 10.2 -5.8 12.2 9 12 A G S >X S- 0 0 0 -4,-1.6 3,-2.7 -5,-0.2 4,-0.6 0.132 77.5 -78.5 -62.5 174.9 7.5 -7.3 14.4 10 13 A P T 34 S+ 0 0 24 0, 0.0 3,-0.4 0, 0.0 4,-0.3 0.685 126.2 63.8 -50.9 -26.7 6.0 -6.1 17.6 11 14 A E T 34 S+ 0 0 105 1,-0.2 -2,-0.1 2,-0.1 3,-0.1 0.550 105.7 46.9 -75.8 -10.2 8.9 -7.3 19.6 12 15 A H T X4 S+ 0 0 52 -3,-2.7 3,-1.5 1,-0.1 4,-0.4 0.540 85.5 89.4-103.9 -17.3 11.1 -4.7 17.7 13 16 A W G >X S+ 0 0 4 -4,-0.6 4,-2.7 -3,-0.4 3,-0.9 0.722 72.2 71.1 -56.6 -35.6 8.8 -1.7 17.9 14 17 A H G 34 S+ 0 0 64 -4,-0.3 -1,-0.3 1,-0.3 6,-0.2 0.670 88.4 66.1 -55.0 -31.4 10.3 -0.4 21.3 15 18 A K G <4 S+ 0 0 131 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.903 116.3 24.4 -61.3 -44.9 13.4 0.6 19.4 16 19 A D T <4 S+ 0 0 112 -3,-0.9 -2,-0.2 -4,-0.4 -1,-0.2 0.700 134.9 35.7 -92.5 -26.5 11.6 3.3 17.4 17 20 A F >< - 0 0 51 -4,-2.7 3,-2.5 1,-0.1 -1,-0.2 -0.762 65.1-174.6-130.5 82.9 8.7 3.9 19.8 18 21 A P G > S+ 0 0 101 0, 0.0 3,-1.7 0, 0.0 -4,-0.1 0.666 79.3 75.8 -51.4 -21.5 10.1 3.6 23.3 19 22 A I G > + 0 0 54 1,-0.3 3,-2.1 179,-0.1 -5,-0.1 0.526 68.6 94.3 -67.2 -8.6 6.4 4.1 24.6 20 23 A A G < S+ 0 0 7 -3,-2.5 -1,-0.3 1,-0.3 -6,-0.1 0.787 90.6 39.7 -53.3 -31.7 6.1 0.5 23.5 21 24 A K G < S+ 0 0 138 -3,-1.7 -1,-0.3 -7,-0.1 -2,-0.1 -0.169 94.4 131.0-113.8 40.2 6.9 -0.5 27.1 22 25 A G S < S- 0 0 15 -3,-2.1 3,-0.4 1,-0.0 -3,-0.0 0.047 70.4 -97.3 -76.4-171.9 4.9 2.3 28.7 23 26 A E S S+ 0 0 121 1,-0.2 227,-0.3 169,-0.0 -1,-0.0 0.580 113.7 38.9 -88.8 -14.8 2.3 2.1 31.5 24 27 A R S S+ 0 0 48 168,-0.1 -1,-0.2 2,-0.0 2,-0.1 -0.310 80.0 155.7-134.1 47.8 -1.0 2.0 29.6 25 28 A Q - 0 0 5 -3,-0.4 220,-0.1 221,-0.3 170,-0.1 -0.461 31.5-103.3 -78.5 148.5 -0.2 -0.2 26.6 26 29 A S S S+ 0 0 0 168,-0.4 2,-0.2 -2,-0.1 -2,-0.0 -0.815 74.7 39.2-121.6 151.4 -2.7 -2.2 24.6 27 30 A P + 0 0 0 0, 0.0 218,-2.7 0, 0.0 2,-0.3 0.733 66.6 175.5 -86.4 173.5 -4.2 -4.8 23.8 28 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.4 -0.879 35.9 -96.9-139.2 169.5 -4.5 -6.7 27.1 29 32 A D E -a 105 0A 30 216,-0.5 2,-0.8 -2,-0.3 77,-0.2 -0.807 32.8-141.1 -90.4 129.2 -6.1 -9.9 28.3 30 33 A I E -a 106 0A 0 75,-2.9 77,-2.8 -2,-0.4 2,-0.9 -0.897 10.6-158.9 -97.3 104.7 -9.5 -9.4 29.9 31 34 A D >> - 0 0 66 -2,-0.8 4,-1.6 75,-0.2 3,-0.9 -0.824 3.1-158.0 -85.6 104.3 -9.8 -11.6 32.9 32 35 A T T 34 S+ 0 0 46 -2,-0.9 -1,-0.1 1,-0.3 222,-0.0 0.696 88.6 52.0 -57.4 -29.4 -13.6 -11.9 33.4 33 36 A H T 34 S+ 0 0 163 1,-0.2 -1,-0.3 3,-0.0 -2,-0.0 0.690 113.8 41.9 -84.7 -22.1 -13.2 -12.9 37.1 34 37 A T T <4 S+ 0 0 99 -3,-0.9 -2,-0.2 2,-0.1 -1,-0.2 0.593 88.3 105.6 -96.0 -21.5 -11.0 -9.9 38.0 35 38 A A S < S- 0 0 20 -4,-1.6 2,-0.5 1,-0.1 218,-0.2 -0.481 72.3-127.7 -64.5 135.2 -13.0 -7.3 36.0 36 39 A K E -c 253 0B 121 216,-2.1 218,-2.6 -2,-0.1 2,-0.4 -0.777 8.8-127.2 -94.4 122.8 -15.0 -5.1 38.4 37 40 A Y E -c 254 0B 124 -2,-0.5 218,-0.2 216,-0.2 216,-0.0 -0.570 26.6-166.2 -67.4 120.5 -18.7 -4.5 37.9 38 41 A D > - 0 0 25 216,-2.5 3,-1.0 -2,-0.4 -1,-0.0 -0.953 15.7-174.3-119.0 108.2 -19.3 -0.8 37.9 39 42 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.550 81.6 70.3 -75.5 -9.5 -22.9 0.3 38.4 40 43 A S T 3 S+ 0 0 82 2,-0.1 2,-0.5 40,-0.0 215,-0.1 0.415 76.1 109.5 -89.3 -0.1 -21.9 4.0 37.8 41 44 A L < - 0 0 30 -3,-1.0 -3,-0.0 213,-0.2 38,-0.0 -0.664 63.1-143.8 -84.9 121.1 -21.3 3.0 34.2 42 45 A K - 0 0 119 37,-0.7 39,-0.1 -2,-0.5 2,-0.1 -0.387 27.7 -92.0 -83.9 156.1 -23.8 4.5 31.7 43 46 A P - 0 0 110 0, 0.0 36,-1.4 0, 0.0 -1,-0.1 -0.395 46.8-103.3 -66.4 147.8 -25.1 2.6 28.6 44 47 A L E -D 78 0B 18 141,-0.3 2,-0.4 34,-0.2 34,-0.2 -0.390 28.0-149.1 -68.2 152.3 -23.2 3.3 25.4 45 48 A S E -D 77 0B 42 32,-2.2 32,-1.9 -2,-0.1 2,-0.6 -0.956 12.8-174.5-134.1 108.8 -24.8 5.5 22.8 46 49 A V E -D 76 0B 35 -2,-0.4 2,-0.7 30,-0.2 30,-0.2 -0.935 3.8-178.9-108.0 111.6 -24.0 4.8 19.2 47 50 A S E +D 75 0B 35 28,-3.2 28,-2.5 -2,-0.6 3,-0.1 -0.859 27.5 138.0-110.7 89.1 -25.5 7.4 16.7 48 51 A Y > + 0 0 2 -2,-0.7 3,-1.3 26,-0.2 130,-0.2 0.289 33.0 105.5-116.3 10.1 -24.5 6.1 13.3 49 52 A D T 3 S+ 0 0 101 1,-0.3 25,-0.1 -3,-0.1 -1,-0.1 0.752 88.5 41.4 -60.6 -29.7 -27.6 6.8 11.2 50 53 A Q T 3 S+ 0 0 123 23,-0.8 -1,-0.3 -3,-0.1 24,-0.2 0.222 83.0 141.4-106.0 17.9 -26.1 9.8 9.5 51 54 A A < - 0 0 27 -3,-1.3 2,-0.4 22,-0.1 18,-0.1 -0.228 36.5-156.5 -56.8 144.9 -22.6 8.3 8.9 52 55 A T - 0 0 49 16,-0.3 16,-2.4 122,-0.1 2,-0.2 -0.918 4.1-160.9-128.6 97.5 -21.0 9.1 5.6 53 56 A S E +E 67 0B 0 -2,-0.4 121,-0.6 122,-0.2 14,-0.3 -0.570 10.4 179.3 -76.7 150.5 -18.3 6.7 4.4 54 57 A L E - 0 0 80 12,-2.8 118,-3.1 1,-0.4 2,-0.3 0.705 51.5 -30.6-118.2 -46.8 -15.9 8.0 1.8 55 58 A R E -EF 66 171B 83 11,-1.1 11,-3.4 116,-0.3 2,-0.4 -0.995 42.7-120.3-169.1 173.4 -13.4 5.3 0.9 56 59 A I E -EF 65 170B 0 114,-2.3 114,-2.1 -2,-0.3 2,-0.4 -0.976 29.0-175.5-126.6 138.3 -11.3 2.3 1.8 57 60 A L E -EF 64 169B 30 7,-1.9 7,-2.7 -2,-0.4 2,-0.8 -0.997 28.1-134.4-143.2 144.5 -7.6 2.0 1.6 58 61 A N E +E 63 0B 0 110,-2.6 109,-3.5 -2,-0.4 5,-0.2 -0.851 22.2 178.2 -95.3 110.6 -4.7 -0.5 2.0 59 62 A N - 0 0 37 3,-1.8 -1,-0.1 -2,-0.8 4,-0.1 0.427 54.5-101.8 -95.1 1.7 -2.1 1.3 4.2 60 63 A G S S+ 0 0 11 2,-0.6 3,-0.1 166,-0.2 106,-0.1 0.369 116.0 52.7 92.6 2.0 0.3 -1.8 4.2 61 64 A H S S- 0 0 50 1,-0.6 2,-0.3 -58,-0.1 166,-0.1 0.417 123.9 -22.0-137.3 -18.2 -0.6 -3.0 7.8 62 65 A A S S- 0 0 1 165,-0.1 -3,-1.8 -5,-0.1 -2,-0.6 -0.902 70.3 -92.5-174.1-176.2 -4.4 -3.2 7.5 63 66 A F E -E 58 0B 0 29,-0.3 29,-0.5 -2,-0.3 2,-0.4 -0.986 35.9-153.1-120.4 134.5 -7.4 -1.8 5.4 64 67 A N E -E 57 0B 20 -7,-2.7 -7,-1.9 -2,-0.4 2,-0.6 -0.916 12.8-154.0-113.0 137.3 -9.2 1.3 6.6 65 68 A V E -EG 56 90B 0 25,-2.4 25,-1.6 -2,-0.4 2,-0.3 -0.964 27.5-153.8-101.1 112.0 -12.8 2.5 5.9 66 69 A E E -EG 55 89B 47 -11,-3.4 -12,-2.8 -2,-0.6 -11,-1.1 -0.718 9.5-163.8 -95.1 144.6 -12.7 6.3 6.2 67 70 A F E -E 53 0B 9 21,-2.4 2,-0.7 -2,-0.3 -14,-0.2 -0.838 31.2-100.0-127.8 153.2 -15.7 8.5 7.2 68 71 A D + 0 0 39 -16,-2.4 -16,-0.3 -2,-0.3 3,-0.3 -0.718 39.3 174.9 -73.0 107.9 -16.4 12.2 6.9 69 72 A D + 0 0 42 -2,-0.7 -1,-0.1 1,-0.2 17,-0.1 -0.143 46.4 107.4-111.1 35.8 -15.7 13.6 10.4 70 73 A S S S+ 0 0 80 1,-0.1 2,-0.3 56,-0.0 -1,-0.2 0.586 88.3 23.9 -88.6 -8.0 -16.2 17.3 9.6 71 74 A Q S S- 0 0 114 -3,-0.3 2,-3.1 3,-0.0 3,-0.5 -0.964 100.0 -85.9-147.6 161.7 -19.5 17.3 11.6 72 75 A D S S+ 0 0 84 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.372 77.7 131.4 -69.7 69.1 -21.2 15.3 14.3 73 76 A K S S+ 0 0 52 -2,-3.1 -23,-0.8 1,-0.3 2,-0.5 0.861 73.1 21.3 -88.6 -47.0 -22.5 12.7 11.8 74 77 A A S S+ 0 0 7 -3,-0.5 13,-2.4 -6,-0.2 2,-0.3 -0.959 87.0 171.6-127.4 107.8 -21.5 9.3 13.4 75 78 A V E -DH 47 86B 14 -28,-2.5 -28,-3.2 -2,-0.5 2,-0.4 -0.911 28.3-154.1-130.3 153.3 -20.9 9.8 17.1 76 79 A L E +DH 46 85B 0 9,-2.5 9,-2.3 -2,-0.3 2,-0.3 -0.951 29.0 149.4-121.6 135.4 -20.2 7.8 20.2 77 80 A K E +D 45 0B 81 -32,-1.9 -32,-2.2 -2,-0.4 7,-0.1 -0.870 34.7 44.0-152.9 178.7 -21.2 9.0 23.7 78 81 A G E > S+D 44 0B 24 -2,-0.3 3,-1.8 3,-0.3 -34,-0.2 -0.265 72.1 83.2 74.9-159.4 -22.2 7.8 27.1 79 82 A G T 3 S- 0 0 1 -36,-1.4 -37,-0.7 1,-0.3 -1,-0.2 -0.394 120.3 -26.5 64.7-137.1 -20.6 4.8 28.8 80 83 A P T 3 S+ 0 0 41 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.424 116.6 109.1 -86.8 -1.1 -17.3 5.8 30.5 81 84 A L < - 0 0 11 -3,-1.8 2,-0.5 -39,-0.1 -3,-0.3 -0.463 55.4-154.5 -85.6 152.4 -17.0 8.8 28.1 82 85 A D - 0 0 125 -2,-0.2 2,-0.1 53,-0.1 -3,-0.0 -0.990 67.1 -1.6-125.8 116.1 -17.4 12.5 28.8 83 86 A G S S- 0 0 48 -2,-0.5 2,-0.4 38,-0.1 -5,-0.2 -0.299 99.0 -48.4 94.3-179.0 -18.3 14.5 25.6 84 87 A T - 0 0 33 -2,-0.1 38,-2.3 -7,-0.1 2,-0.4 -0.752 42.9-160.7 -95.9 131.0 -18.9 13.5 22.0 85 88 A Y E -HI 76 121B 5 -9,-2.3 -9,-2.5 -2,-0.4 2,-0.5 -0.948 12.7-142.5-115.7 133.8 -16.4 11.3 20.0 86 89 A R E -HI 75 120B 45 34,-2.5 34,-1.9 -2,-0.4 -11,-0.2 -0.861 16.9-120.1-102.4 129.9 -16.6 11.3 16.2 87 90 A L E + I 0 119B 3 -13,-2.4 32,-0.2 -2,-0.5 -13,-0.2 -0.401 36.7 166.3 -64.1 129.3 -16.0 8.2 14.1 88 91 A I E - 0 0 31 30,-2.5 -21,-2.4 1,-0.5 2,-0.3 0.695 60.3 -22.3-113.6 -41.4 -13.0 8.7 11.7 89 92 A Q E -GI 66 118B 33 29,-1.2 29,-2.2 -23,-0.2 -1,-0.5 -0.976 48.5-144.1-162.7 171.1 -12.2 5.2 10.5 90 93 A F E +GI 65 117B 1 -25,-1.6 -25,-2.4 -2,-0.3 2,-0.3 -0.979 23.4 162.6-142.3 147.3 -12.6 1.5 11.2 91 94 A H E - I 0 116B 21 25,-1.7 25,-3.3 -2,-0.3 2,-0.3 -0.892 22.6-131.7-154.8 171.6 -10.2 -1.4 10.5 92 95 A F E - I 0 115B 2 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.3 -0.916 2.3-145.5-128.1 162.9 -9.6 -5.0 11.5 93 96 A H E + I 0 114B 2 21,-2.0 21,-2.2 -2,-0.3 2,-0.3 -0.959 31.7 170.2-124.0 137.3 -6.8 -7.3 12.7 94 97 A W E - I 0 113B 0 -2,-0.4 146,-1.3 19,-0.2 145,-0.4 -0.853 21.7-122.5-144.6 174.5 -6.9 -10.9 11.6 95 98 A G - 0 0 0 17,-1.0 6,-0.1 5,-0.5 3,-0.1 -0.622 24.5-116.3-116.7 179.7 -4.9 -14.1 11.5 96 99 A S S S+ 0 0 39 -2,-0.2 2,-0.3 142,-0.1 5,-0.1 0.632 106.1 30.0 -82.9 -21.7 -3.5 -16.7 9.1 97 100 A L S > S- 0 0 107 3,-0.3 3,-1.3 15,-0.1 -2,-0.1 -0.939 88.7-110.8-135.5 159.3 -5.7 -19.3 10.8 98 101 A D T 3 S+ 0 0 67 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.569 108.7 69.1 -68.0 -16.2 -9.1 -19.1 12.6 99 102 A G T 3 S+ 0 0 58 13,-0.1 2,-0.3 2,-0.1 11,-0.3 0.379 107.0 32.0 -83.6 1.5 -7.6 -19.8 16.0 100 103 A Q < + 0 0 57 -3,-1.3 -5,-0.5 12,-0.1 -3,-0.3 -0.968 64.9 97.9-153.8 157.4 -5.8 -16.4 16.2 101 104 A G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 -0.044 54.8 105.1 151.8 -37.1 -6.3 -12.8 15.0 102 105 A S - 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