==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 13-OCT-11 3U7C . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.M.WEST,C.U.KIM,A.H.ROBBINS,R.MCKENNA . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12138.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 62.8 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 . 3 1.2 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 . 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 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 0 165 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 147.1 9.8 3.6 9.7 2 4 A H + 0 0 172 2,-0.0 2,-0.1 7,-0.0 0, 0.0 -0.022 360.0 146.3-132.5 30.4 9.6 -0.0 8.6 3 5 A W + 0 0 53 1,-0.1 2,-0.2 2,-0.1 7,-0.2 -0.376 18.3 128.6 -66.3 153.7 7.5 -1.5 11.4 4 6 A G - 0 0 10 5,-2.6 10,-0.1 2,-0.1 58,-0.1 -0.770 66.6 -82.9-170.9-146.6 5.3 -4.4 10.5 5 7 A Y S S+ 0 0 29 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 -0.087 80.6 114.1-134.1 24.7 4.2 -7.9 11.4 6 8 A G S > S- 0 0 38 235,-0.0 4,-0.5 1,-0.0 -2,-0.1 -0.025 84.8 -79.5 -90.3-165.0 6.9 -9.9 9.5 7 9 A K T 4 S+ 0 0 193 1,-0.2 -1,-0.0 2,-0.1 0, 0.0 0.657 124.9 20.3 -73.3 -20.7 9.7 -12.1 10.6 8 10 A H T 4 S+ 0 0 160 5,-0.0 -1,-0.2 0, 0.0 -5,-0.0 0.348 126.1 44.0-130.9 -1.1 12.1 -9.2 11.5 9 11 A N T 4 S+ 0 0 56 -6,-0.1 -5,-2.6 5,-0.0 -2,-0.1 0.181 81.6 125.9-135.3 17.0 10.0 -6.1 12.1 10 12 A G S >X S- 0 0 1 -4,-0.5 3,-2.8 -7,-0.2 4,-0.6 0.096 78.5 -69.5 -76.5-176.2 7.1 -7.4 14.2 11 13 A P G >4 S+ 0 0 23 0, 0.0 3,-0.8 0, 0.0 4,-0.4 0.743 125.9 62.4 -48.8 -36.2 5.7 -6.2 17.5 12 14 A E G 34 S+ 0 0 123 1,-0.2 3,-0.1 2,-0.1 -2,-0.1 0.625 107.5 46.5 -69.5 -11.9 8.6 -7.4 19.6 13 15 A H G X> S+ 0 0 56 -3,-2.8 3,-1.7 1,-0.1 4,-0.5 0.551 85.4 90.1 -99.0 -14.9 10.8 -4.9 17.7 14 16 A W H XX S+ 0 0 5 -3,-0.8 4,-2.3 -4,-0.6 3,-0.8 0.796 72.4 71.2 -60.9 -30.7 8.6 -1.8 17.8 15 17 A H H 34 S+ 0 0 61 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.741 86.3 66.8 -58.2 -24.4 10.1 -0.6 21.1 16 18 A K H <4 S+ 0 0 136 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.919 117.5 23.1 -67.3 -42.6 13.4 0.4 19.4 17 19 A D H << S+ 0 0 97 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.713 135.9 37.0 -90.8 -21.3 11.7 3.1 17.3 18 20 A F >< - 0 0 31 -4,-2.3 3,-2.6 1,-0.1 -1,-0.2 -0.782 65.8-177.2-131.9 79.2 8.7 3.7 19.6 19 21 A P G > S+ 0 0 100 0, 0.0 3,-2.0 0, 0.0 -4,-0.1 0.751 76.1 75.1 -57.4 -23.1 9.9 3.3 23.2 20 22 A I G > S+ 0 0 55 1,-0.3 3,-2.9 179,-0.2 5,-0.2 0.665 71.1 89.0 -65.1 -10.2 6.4 3.8 24.6 21 23 A A G < S+ 0 0 6 -3,-2.6 -1,-0.3 1,-0.3 -6,-0.1 0.759 91.4 45.2 -52.5 -26.7 5.8 0.3 23.4 22 24 A K G < S+ 0 0 143 -3,-2.0 -1,-0.3 -4,-0.1 -2,-0.2 0.015 97.0 128.0-102.9 23.3 7.0 -0.7 26.9 23 25 A G S < S- 0 0 16 -3,-2.9 3,-0.5 1,-0.1 -3,-0.0 0.136 72.8-101.5 -74.6-174.1 4.8 2.0 28.6 24 26 A E S S+ 0 0 114 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.575 112.5 38.0 -85.1 -17.4 2.4 1.9 31.4 25 27 A R S S+ 0 0 86 -5,-0.2 -1,-0.2 224,-0.1 2,-0.2 -0.272 78.7 154.1-135.4 48.5 -0.9 1.9 29.4 26 28 A Q - 0 0 3 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.494 32.7-104.9 -86.5 152.2 -0.3 -0.3 26.3 27 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.899 76.9 41.9-126.6 156.9 -2.9 -2.1 24.3 28 30 A P + 0 0 0 0, 0.0 218,-2.8 0, 0.0 2,-0.3 0.564 66.1 177.4 -77.1-179.0 -4.2 -4.7 23.6 29 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.4 -0.921 35.6 -99.4-136.4 162.7 -4.6 -6.6 26.9 30 32 A D E -a 106 0A 35 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.734 33.0-140.4 -81.0 133.3 -6.0 -9.9 28.0 31 33 A I E -a 107 0A 0 75,-2.9 77,-2.6 -2,-0.4 2,-0.8 -0.881 11.5-158.6 -97.6 106.3 -9.5 -9.4 29.5 32 34 A D >> - 0 0 57 -2,-0.8 4,-2.0 75,-0.2 3,-1.6 -0.803 2.4-162.4 -88.8 107.9 -9.8 -11.7 32.5 33 35 A T T 34 S+ 0 0 57 -2,-0.8 -1,-0.2 1,-0.3 222,-0.0 0.586 87.3 61.2 -71.6 -5.6 -13.5 -12.1 33.0 34 36 A H T 34 S+ 0 0 146 1,-0.1 -1,-0.3 3,-0.0 -2,-0.0 0.511 114.5 30.6 -95.8 -8.2 -12.9 -13.4 36.5 35 37 A T T <4 S+ 0 0 106 -3,-1.6 2,-0.2 2,-0.0 -2,-0.2 0.515 90.5 101.8-123.3 -14.1 -11.2 -10.2 37.7 36 38 A A < - 0 0 20 -4,-2.0 2,-0.4 218,-0.1 218,-0.2 -0.520 67.0-143.1 -65.8 133.4 -13.0 -7.5 35.6 37 39 A K E -c 254 0B 145 216,-1.4 218,-2.4 -2,-0.2 2,-0.1 -0.853 11.8-111.5-109.0 137.6 -15.5 -5.9 38.0 38 40 A Y E -c 255 0B 85 -2,-0.4 218,-0.2 216,-0.2 220,-0.1 -0.417 29.0-156.0 -57.5 132.8 -19.0 -4.7 37.2 39 41 A D > - 0 0 37 216,-2.7 3,-1.8 -2,-0.1 -1,-0.1 -0.916 10.7-167.9-117.2 100.3 -19.0 -0.9 37.5 40 42 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.648 82.6 70.3 -67.7 -10.9 -22.6 0.4 38.2 41 43 A S T 3 + 0 0 83 2,-0.1 215,-0.1 -3,-0.0 -3,-0.0 0.644 67.2 111.5 -79.7 -13.8 -21.3 4.0 37.4 42 44 A L < - 0 0 29 -3,-1.8 3,-0.1 213,-0.2 38,-0.0 -0.469 66.2-137.6 -57.7 135.7 -20.9 3.4 33.7 43 45 A K - 0 0 138 37,-2.1 37,-0.4 1,-0.2 39,-0.1 -0.522 39.0 -73.0 -86.2 165.8 -23.6 5.5 32.0 44 46 A P - 0 0 118 0, 0.0 36,-1.5 0, 0.0 2,-0.3 -0.318 52.0-120.1 -56.0 137.0 -25.5 3.9 29.1 45 47 A L E -D 79 0B 27 34,-0.4 2,-0.4 141,-0.1 34,-0.3 -0.674 25.7-157.9 -77.8 147.6 -23.4 3.6 25.9 46 48 A S E -D 78 0B 48 32,-2.8 32,-2.3 -2,-0.3 2,-0.6 -0.968 12.3-175.5-137.5 110.7 -24.7 5.5 22.8 47 49 A V E -D 77 0B 32 -2,-0.4 2,-0.6 30,-0.2 30,-0.2 -0.955 7.0-177.4-107.7 113.9 -23.7 4.6 19.2 48 50 A S E +D 76 0B 41 28,-2.9 28,-2.0 -2,-0.6 3,-0.2 -0.844 25.1 141.7-117.2 87.4 -25.2 7.2 16.8 49 51 A Y > + 0 0 3 -2,-0.6 3,-1.8 26,-0.2 130,-0.2 0.261 32.6 109.3-112.4 8.1 -24.3 6.2 13.3 50 52 A D T 3 S+ 0 0 97 1,-0.3 -1,-0.1 127,-0.1 25,-0.1 0.817 88.4 39.1 -56.9 -32.7 -27.6 7.1 11.4 51 53 A Q T 3 S+ 0 0 130 23,-0.8 -1,-0.3 -3,-0.2 24,-0.2 0.242 83.9 144.0-104.2 15.3 -25.9 10.0 9.6 52 54 A A < - 0 0 22 -3,-1.8 2,-0.5 1,-0.1 23,-0.1 -0.261 34.2-158.7 -59.3 142.5 -22.5 8.4 9.0 53 55 A T - 0 0 44 16,-0.3 16,-2.6 122,-0.1 2,-0.2 -0.880 4.3-164.6-124.6 94.6 -20.8 9.3 5.7 54 56 A S E +E 68 0B 1 -2,-0.5 121,-0.7 122,-0.3 14,-0.3 -0.511 11.6 174.2 -72.2 150.1 -18.2 6.8 4.5 55 57 A L E - 0 0 83 12,-3.1 118,-2.3 1,-0.4 2,-0.3 0.690 49.6 -6.8-120.6 -44.1 -16.0 8.1 1.8 56 58 A R E -EF 67 172B 82 11,-1.1 11,-3.0 116,-0.3 -1,-0.4 -0.983 47.0-133.0-159.5 157.7 -13.1 5.8 0.9 57 59 A I E -EF 66 171B 0 114,-2.3 114,-2.2 -2,-0.3 2,-0.4 -0.990 26.7-169.7-126.0 134.0 -11.3 2.5 1.7 58 60 A L E -EF 65 170B 34 7,-2.2 7,-2.5 -2,-0.4 2,-0.8 -0.990 23.4-146.0-130.8 129.8 -7.5 2.5 1.8 59 61 A N E -E 64 0B 0 110,-2.8 109,-3.1 -2,-0.4 5,-0.2 -0.851 21.6-179.4 -86.4 109.3 -4.9 -0.3 2.0 60 62 A N - 0 0 38 3,-2.0 4,-0.1 -2,-0.8 -1,-0.1 0.278 51.6-101.2 -97.0 10.5 -2.2 1.4 4.2 61 63 A G S S+ 0 0 15 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.347 117.5 52.7 85.8 -7.5 0.2 -1.6 4.1 62 64 A H S S- 0 0 55 1,-0.6 2,-0.2 -58,-0.1 -1,-0.1 0.663 125.9 -28.3-119.1 -41.0 -0.8 -2.7 7.6 63 65 A A S S- 0 0 2 -5,-0.1 -3,-2.0 31,-0.1 -1,-0.6 -0.710 70.7 -93.4-148.8-168.0 -4.6 -3.0 7.4 64 66 A F E -E 59 0B 0 29,-0.3 2,-0.5 -5,-0.2 29,-0.5 -0.992 31.8-149.7-120.4 142.1 -7.3 -1.3 5.4 65 67 A N E -E 58 0B 27 -7,-2.5 -7,-2.2 -2,-0.4 2,-0.7 -0.925 7.3-151.8-109.9 129.2 -9.2 1.7 6.7 66 68 A V E -EG 57 91B 0 25,-2.8 25,-2.0 -2,-0.5 2,-0.3 -0.910 31.1-151.0 -91.2 114.5 -12.8 2.5 5.8 67 69 A E E -EG 56 90B 46 -11,-3.0 -12,-3.1 -2,-0.7 -11,-1.1 -0.699 12.3-161.4 -99.5 145.5 -12.7 6.3 6.2 68 70 A F E -E 54 0B 10 21,-2.5 2,-0.7 -2,-0.3 -14,-0.2 -0.830 32.1 -99.6-121.6 156.6 -15.6 8.7 7.2 69 71 A D + 0 0 35 -16,-2.6 -16,-0.3 -2,-0.3 3,-0.3 -0.704 41.5 173.5 -69.8 110.8 -16.4 12.4 6.9 70 72 A D + 0 0 43 -2,-0.7 -1,-0.1 1,-0.2 17,-0.1 -0.004 48.4 102.5-112.3 27.6 -15.5 13.6 10.5 71 73 A S S S+ 0 0 82 56,-0.0 2,-0.3 2,-0.0 -1,-0.2 0.354 90.0 25.2 -92.3 6.3 -15.9 17.4 9.8 72 74 A Q S S- 0 0 118 -3,-0.3 2,-1.8 3,-0.1 3,-0.3 -0.874 100.3 -87.0-152.5 164.8 -19.4 17.3 11.6 73 75 A D S S+ 0 0 87 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.548 76.1 132.0 -77.4 74.0 -21.1 15.2 14.3 74 76 A K S S+ 0 0 45 -2,-1.8 -23,-0.8 1,-0.3 2,-0.4 0.734 73.8 19.7 -93.1 -33.8 -22.4 12.7 11.8 75 77 A A S S+ 0 0 5 -3,-0.3 13,-2.9 -24,-0.2 2,-0.3 -0.870 84.5 170.5-142.7 104.1 -21.3 9.4 13.5 76 78 A V E -DH 48 87B 7 -28,-2.0 -28,-2.9 -2,-0.4 2,-0.4 -0.916 29.9-148.3-131.8 152.4 -20.6 9.7 17.1 77 79 A L E +DH 47 86B 0 9,-2.6 9,-2.2 -2,-0.3 2,-0.3 -0.961 31.2 157.2-114.8 129.9 -20.0 7.6 20.2 78 80 A K E +D 46 0B 82 -32,-2.3 -32,-2.8 -2,-0.4 7,-0.1 -0.882 37.3 28.9-142.0 171.5 -21.1 9.0 23.6 79 81 A G E > S+D 45 0B 20 5,-0.4 3,-2.6 3,-0.3 -34,-0.4 -0.326 73.0 88.3 70.7-156.0 -22.0 7.6 27.0 80 82 A G T 3 S- 0 0 2 -36,-1.5 -37,-2.1 -37,-0.4 -1,-0.1 -0.382 119.6 -24.2 64.1-130.3 -20.5 4.5 28.4 81 83 A P T 3 S+ 0 0 42 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.518 116.7 110.4 -84.3 -5.6 -17.3 5.5 30.2 82 84 A L < - 0 0 12 -3,-2.6 2,-0.4 -39,-0.1 -3,-0.3 -0.441 54.8-154.3 -86.9 149.4 -17.0 8.6 28.1 83 85 A D - 0 0 123 -2,-0.2 2,-0.1 -5,-0.1 -1,-0.0 -0.938 69.6 -6.7-105.7 131.7 -17.4 12.3 28.8 84 86 A G S S- 0 0 52 -2,-0.4 -5,-0.4 38,-0.1 2,-0.4 -0.406 98.8 -43.9 85.5-162.6 -18.3 14.3 25.8 85 87 A T - 0 0 24 -2,-0.1 38,-2.7 -7,-0.1 2,-0.5 -0.952 39.7-163.4-123.4 132.3 -18.6 13.4 22.1 86 88 A Y E -HI 77 122B 5 -9,-2.2 -9,-2.6 -2,-0.4 2,-0.4 -0.968 14.0-144.4-121.5 126.8 -16.3 11.3 20.0 87 89 A R E -HI 76 121B 46 34,-2.6 34,-2.1 -2,-0.5 2,-0.3 -0.715 19.0-116.6 -96.0 133.4 -16.6 11.3 16.2 88 90 A L E + I 0 120B 2 -13,-2.9 32,-0.3 -2,-0.4 -14,-0.1 -0.481 37.7 165.3 -66.1 125.3 -16.0 8.3 13.9 89 91 A I E - 0 0 34 30,-2.7 -21,-2.5 1,-0.4 2,-0.3 0.747 60.9 -24.7-108.0 -39.5 -13.0 8.8 11.7 90 92 A Q E -GI 67 119B 30 29,-1.2 29,-2.9 -23,-0.2 -1,-0.4 -0.985 47.2-143.3-163.1 159.6 -12.3 5.2 10.4 91 93 A F E +GI 66 118B 0 -25,-2.0 -25,-2.8 -2,-0.3 2,-0.3 -0.963 23.8 162.8-126.0 159.0 -12.7 1.6 11.1 92 94 A H E - I 0 117B 21 25,-1.8 25,-3.1 -2,-0.3 2,-0.3 -0.940 22.7-128.0-156.7 173.8 -10.3 -1.3 10.3 93 95 A F E - I 0 116B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.3 -0.862 0.8-149.7-126.6 162.5 -9.6 -4.9 11.3 94 96 A H E + I 0 115B 3 21,-2.0 21,-2.3 -2,-0.3 2,-0.3 -0.980 30.8 169.4-124.9 140.0 -6.9 -7.1 12.5 95 97 A W E - I 0 114B 1 -2,-0.4 146,-1.3 19,-0.2 145,-0.9 -0.941 23.7-117.5-151.1 168.7 -7.0 -10.8 11.5 96 98 A G - 0 0 0 17,-1.5 6,-0.1 5,-0.6 3,-0.1 -0.456 21.5-124.9-103.7 174.2 -5.1 -14.0 11.5 97 99 A S S S+ 0 0 43 -2,-0.2 2,-0.3 142,-0.1 5,-0.1 0.561 104.4 36.4 -84.7 -16.0 -3.7 -16.5 9.0 98 100 A L S > S- 0 0 105 3,-0.3 3,-1.7 15,-0.1 -2,-0.1 -0.958 89.6-115.0-136.3 150.7 -5.7 -19.2 10.8 99 101 A D T 3 S+ 0 0 77 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.742 109.5 67.3 -66.4 -20.5 -9.1 -19.1 12.4 100 102 A G T 3 S+ 0 0 57 13,-0.1 2,-0.3 2,-0.1 11,-0.3 0.343 106.9 33.2 -80.6 4.8 -7.6 -19.7 15.9 101 103 A Q < + 0 0 52 -3,-1.7 -5,-0.6 12,-0.1 -3,-0.3 -0.973 64.5 95.7-151.3 166.2 -5.8 -16.3 16.0 102 104 A G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 0.016 55.3 106.9 142.1 -33.3 -6.2 -12.8 14.8 103 105 A S - 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