==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 11-MAY-11 3RYX . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.W.SNYDER,S.BAI,A.HEROUX,G.W.WHITESIDES . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12102.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 63.2 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 22.1 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 . 33 12.8 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 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 3 B H 0 0 160 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 128.2 33.1 -2.0 5.8 2 4 B H - 0 0 82 1,-0.2 2,-0.2 7,-0.0 0, 0.0 -0.455 360.0 -43.4-126.1-144.2 31.0 -0.4 8.6 3 5 B W + 0 0 68 -2,-0.2 2,-0.2 2,-0.0 -1,-0.2 -0.527 69.7 135.5 -85.8 160.5 28.8 -2.2 11.2 4 6 B G - 0 0 10 5,-2.4 10,-0.1 2,-0.2 58,-0.1 -0.763 61.8 -81.2-166.8-148.4 26.6 -5.2 10.4 5 7 B Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.313 81.8 108.8-121.6 8.8 25.7 -8.7 11.6 6 8 B G S > S- 0 0 40 4,-0.1 4,-1.5 1,-0.1 3,-0.3 -0.197 84.4 -99.4 -76.5 175.4 28.5 -10.8 10.3 7 9 B K T 4 S+ 0 0 175 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.857 123.2 46.5 -60.6 -29.9 31.3 -12.5 12.4 8 10 B H T 4 S+ 0 0 151 1,-0.2 -1,-0.2 4,-0.0 -3,-0.0 0.777 130.9 15.7 -87.9 -21.5 33.6 -9.7 11.5 9 11 B N T 4 S+ 0 0 54 -3,-0.3 -5,-2.4 -6,-0.1 -2,-0.2 0.240 96.5 122.2-137.4 14.4 31.4 -6.7 12.1 10 12 B G S >X S- 0 0 3 -4,-1.5 3,-2.7 -5,-0.2 4,-0.8 0.088 81.9 -67.2 -81.0-174.6 28.5 -8.0 14.1 11 13 B P T 34 S+ 0 0 26 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.733 126.8 62.6 -47.6 -35.1 27.1 -7.1 17.6 12 14 B E T 34 S+ 0 0 139 1,-0.2 3,-0.1 2,-0.1 -5,-0.1 0.660 107.7 45.1 -65.1 -19.2 30.3 -8.3 19.5 13 15 B H T X4 S+ 0 0 64 -3,-2.7 3,-2.0 1,-0.1 4,-0.4 0.607 86.8 90.2 -95.6 -17.0 32.3 -5.7 17.6 14 16 B W G >X S+ 0 0 6 -4,-0.8 4,-2.3 -3,-0.4 3,-1.0 0.767 72.0 69.6 -57.2 -31.8 30.0 -2.7 18.0 15 17 B H G 34 S+ 0 0 66 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.686 87.3 69.0 -63.5 -18.6 31.4 -1.4 21.2 16 18 B K G <4 S+ 0 0 130 -3,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.890 116.9 21.5 -72.1 -36.2 34.7 -0.4 19.5 17 19 B D T <4 S+ 0 0 134 -3,-1.0 -2,-0.2 -4,-0.4 -1,-0.2 0.678 136.7 38.0 -95.5 -19.4 33.1 2.3 17.5 18 20 B F >< - 0 0 59 -4,-2.3 3,-2.6 1,-0.1 -1,-0.2 -0.757 64.4-179.5-131.1 78.9 30.0 2.8 19.8 19 21 B P G > S+ 0 0 102 0, 0.0 3,-1.8 0, 0.0 -4,-0.1 0.706 74.8 78.3 -60.6 -15.9 31.3 2.4 23.4 20 22 B I G > S+ 0 0 66 1,-0.3 3,-2.6 179,-0.2 -5,-0.1 0.670 70.2 89.2 -64.8 -13.5 27.7 3.0 24.7 21 23 B A G < S+ 0 0 6 -3,-2.6 -1,-0.3 1,-0.3 -6,-0.1 0.780 90.9 43.0 -49.6 -34.2 27.2 -0.7 23.6 22 24 B K G < S+ 0 0 139 -3,-1.8 -1,-0.3 -4,-0.1 -2,-0.2 -0.039 97.1 126.9 -99.5 27.2 28.4 -1.6 27.1 23 25 B G S < S- 0 0 13 -3,-2.6 3,-0.5 1,-0.1 -3,-0.0 0.041 72.8 -99.5 -77.4-170.2 26.2 1.1 28.7 24 26 B E S S+ 0 0 123 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.543 111.5 36.7 -94.2 -8.8 23.6 0.9 31.4 25 27 B R S S+ 0 0 48 224,-0.1 -1,-0.2 168,-0.1 2,-0.2 -0.284 78.3 156.2-138.3 53.2 20.4 0.8 29.5 26 28 B Q - 0 0 4 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.484 33.0-102.9 -82.3 149.9 21.1 -1.2 26.4 27 29 B S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.891 77.6 40.8-120.8 158.8 18.5 -3.1 24.4 28 30 B P + 0 0 0 0, 0.0 218,-2.7 0, 0.0 2,-0.3 0.593 66.4 177.2 -77.4 177.7 17.1 -5.7 23.7 29 31 B V - 0 0 1 216,-0.3 77,-1.3 -2,-0.2 2,-0.4 -0.922 36.0 -99.7-136.6 160.7 16.8 -7.6 26.9 30 32 B D E -a 106 0A 29 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.740 32.9-139.5 -78.3 132.0 15.3 -10.9 28.1 31 33 B I E -a 107 0A 0 75,-2.7 77,-2.5 -2,-0.4 2,-0.8 -0.894 12.0-159.0 -93.8 101.7 11.9 -10.3 29.6 32 34 B D >> - 0 0 67 -2,-0.8 4,-2.0 75,-0.2 3,-1.2 -0.780 1.5-161.0 -82.5 109.5 11.7 -12.7 32.7 33 35 B T T 34 S+ 0 0 50 -2,-0.8 -1,-0.2 1,-0.3 222,-0.0 0.766 87.5 57.7 -69.2 -22.1 7.9 -13.0 33.2 34 36 B H T 34 S+ 0 0 168 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.721 114.9 37.8 -80.3 -17.8 8.4 -14.2 36.9 35 37 B T T <4 S+ 0 0 109 -3,-1.2 -2,-0.2 2,-0.1 -1,-0.2 0.676 86.9 101.9-106.7 -24.2 10.3 -11.0 37.7 36 38 B A S < S- 0 0 19 -4,-2.0 2,-0.6 218,-0.1 218,-0.2 -0.459 72.3-130.1 -63.2 130.7 8.5 -8.3 35.7 37 39 B K E -c 254 0B 156 216,-1.8 218,-2.3 -2,-0.1 2,-0.1 -0.758 10.5-124.9 -88.3 123.4 6.3 -6.4 38.2 38 40 B Y E -c 255 0B 105 -2,-0.6 218,-0.2 216,-0.2 220,-0.1 -0.432 24.4-161.1 -59.3 133.0 2.7 -5.8 37.4 39 41 B D > - 0 0 34 216,-3.0 3,-2.8 -2,-0.1 -1,-0.1 -0.733 12.4-172.7-121.2 86.6 2.0 -2.0 37.6 40 42 B P T 3 S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.662 83.5 67.3 -57.3 -12.5 -1.7 -1.3 38.0 41 43 B S T 3 S+ 0 0 90 -3,-0.1 215,-0.1 2,-0.1 -3,-0.0 0.703 75.7 104.9 -77.7 -20.3 -0.9 2.5 37.7 42 44 B L < - 0 0 29 -3,-2.8 3,-0.1 213,-0.2 38,-0.0 -0.369 69.0-133.2 -54.8 137.0 0.2 2.0 34.0 43 45 B K - 0 0 117 37,-0.7 2,-0.1 1,-0.1 39,-0.1 -0.476 27.3 -87.5 -83.6 160.9 -2.4 3.3 31.6 44 46 B P - 0 0 112 0, 0.0 36,-1.7 0, 0.0 2,-0.1 -0.465 50.0-109.7 -58.7 141.1 -3.8 1.6 28.5 45 47 B L E -D 79 0B 16 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.483 25.4-145.6 -67.2 148.1 -1.7 2.3 25.4 46 48 B S E -D 78 0B 48 32,-2.9 32,-2.1 -2,-0.1 2,-0.7 -0.968 16.1-175.3-116.4 111.1 -3.4 4.6 22.9 47 49 B V E -D 77 0B 32 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.932 1.8-178.5-112.0 104.4 -2.4 3.7 19.3 48 50 B S E +D 76 0B 37 28,-3.0 28,-2.2 -2,-0.7 3,-0.2 -0.805 24.7 141.8-109.8 90.1 -3.9 6.2 16.9 49 51 B Y > + 0 0 2 -2,-0.7 3,-1.9 26,-0.2 130,-0.2 0.247 34.6 107.2-109.2 4.8 -3.0 5.1 13.4 50 52 B D T 3 S+ 0 0 100 1,-0.3 -1,-0.1 24,-0.1 25,-0.1 0.853 87.4 41.0 -58.0 -32.0 -6.2 5.9 11.5 51 53 B Q T 3 S+ 0 0 121 23,-0.4 24,-0.3 -3,-0.2 -1,-0.3 0.120 84.2 145.3-101.5 23.2 -4.6 8.9 9.8 52 54 B A < - 0 0 24 -3,-1.9 2,-0.4 22,-0.3 123,-0.1 -0.268 33.6-160.2 -60.3 138.4 -1.3 7.2 9.1 53 55 B T - 0 0 46 16,-0.3 16,-3.3 122,-0.1 2,-0.2 -0.865 5.0-165.0-124.7 96.2 0.4 8.2 5.8 54 56 B S E +E 68 0B 1 -2,-0.4 121,-0.7 122,-0.3 14,-0.3 -0.526 11.5 173.9 -76.0 150.0 3.0 5.7 4.6 55 57 B L E - 0 0 72 12,-3.2 118,-2.4 1,-0.4 2,-0.3 0.705 49.4 -5.9-121.5 -44.9 5.3 7.0 1.9 56 58 B R E -EF 67 172B 85 11,-1.2 11,-3.1 116,-0.3 -1,-0.4 -0.985 46.0-135.2-163.3 151.3 8.1 4.6 0.9 57 59 B I E -EF 66 171B 0 114,-2.4 114,-2.4 -2,-0.3 2,-0.4 -0.985 27.3-172.2-121.2 138.0 9.8 1.4 1.7 58 60 B L E -EF 65 170B 31 7,-2.3 7,-2.5 -2,-0.4 2,-0.8 -0.994 25.2-143.9-137.9 131.1 13.7 1.3 1.7 59 61 B N E -E 64 0B 0 110,-2.9 109,-2.9 -2,-0.4 5,-0.2 -0.861 21.7-178.9 -87.1 113.0 16.3 -1.5 2.0 60 62 B N - 0 0 36 3,-2.2 4,-0.1 -2,-0.8 -1,-0.1 0.308 51.9-100.8-100.6 11.5 19.0 0.2 4.1 61 63 B G S S+ 0 0 14 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.333 117.5 52.8 87.3 -7.4 21.4 -2.7 4.1 62 64 B H S S- 0 0 51 1,-0.6 2,-0.2 -58,-0.1 -1,-0.1 0.604 125.1 -26.4-124.6 -27.4 20.4 -3.9 7.6 63 65 B A S S- 0 0 2 -5,-0.1 -3,-2.2 165,-0.1 -1,-0.6 -0.852 70.6 -92.9-155.9-171.5 16.7 -4.2 7.4 64 66 B F E -E 59 0B 0 -2,-0.2 29,-0.5 29,-0.2 2,-0.5 -0.977 34.3-153.3-114.3 141.5 13.9 -2.6 5.3 65 67 B N E -EG 58 92B 21 -7,-2.5 -7,-2.3 -2,-0.4 2,-0.6 -0.926 9.1-153.0-109.7 132.3 12.0 0.5 6.7 66 68 B V E -EG 57 91B 0 25,-2.7 25,-2.1 -2,-0.5 2,-0.3 -0.930 29.0-153.0 -95.1 119.2 8.5 1.5 5.8 67 69 B E E -EG 56 90B 48 -11,-3.1 -12,-3.2 -2,-0.6 -11,-1.2 -0.714 9.8-158.9-104.3 148.8 8.6 5.2 6.3 68 70 B F E -E 54 0B 8 21,-2.4 2,-0.8 -2,-0.3 -14,-0.2 -0.841 31.8 -98.9-119.6 155.1 5.7 7.6 7.2 69 71 B D + 0 0 45 -16,-3.3 6,-0.4 -2,-0.3 -16,-0.3 -0.674 43.6 169.3 -69.9 110.4 4.9 11.3 6.9 70 72 B D + 0 0 40 -2,-0.8 -1,-0.1 1,-0.1 17,-0.1 0.094 44.5 106.9-110.8 17.4 5.7 12.6 10.4 71 73 B S S S+ 0 0 81 2,-0.0 2,-0.3 56,-0.0 -1,-0.1 0.484 89.7 24.5 -74.6 -11.3 5.5 16.4 9.6 72 74 B Q S S- 0 0 104 -3,-0.2 2,-1.8 3,-0.1 3,-0.3 -0.941 99.6 -85.7-144.4 173.7 2.2 16.4 11.6 73 75 B D S S+ 0 0 84 -2,-0.3 3,-0.2 1,-0.2 -22,-0.1 -0.205 78.9 124.9 -75.0 45.8 0.4 14.5 14.5 74 76 B K S S+ 0 0 61 -2,-1.8 2,-0.8 1,-0.2 -23,-0.4 0.976 72.2 23.9 -67.0 -85.8 -1.2 11.9 12.1 75 77 B A S S+ 0 0 6 -6,-0.4 13,-3.1 -24,-0.3 2,-0.3 -0.755 86.5 169.1 -89.6 110.1 -0.1 8.4 13.4 76 78 B V E -DH 48 87B 5 -28,-2.2 -28,-3.0 -2,-0.8 2,-0.4 -0.945 33.9-149.0-130.0 150.3 0.7 8.7 17.1 77 79 B L E +DH 47 86B 0 9,-2.8 9,-2.2 -2,-0.3 2,-0.3 -0.957 32.4 157.8-110.0 130.3 1.4 6.6 20.2 78 80 B K E +D 46 0B 88 -32,-2.1 -32,-2.9 -2,-0.4 7,-0.1 -0.897 35.9 29.7-143.0 169.3 0.2 8.1 23.6 79 81 B G E > S+D 45 0B 21 5,-0.4 3,-2.2 3,-0.3 -34,-0.3 -0.304 73.6 83.1 74.9-158.0 -0.7 6.8 27.0 80 82 B G T 3 S- 0 0 2 -36,-1.7 -37,-0.7 1,-0.3 -1,-0.1 -0.360 121.1 -20.9 49.8-129.0 0.8 3.7 28.7 81 83 B P T 3 S+ 0 0 41 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.489 116.9 107.5 -84.2 0.2 4.1 4.7 30.3 82 84 B L < - 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I 0 116B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.2 -0.863 0.4-148.5-126.0 162.6 11.6 -6.0 11.4 94 96 B H E + I 0 115B 4 21,-2.0 21,-2.2 -2,-0.3 2,-0.3 -0.976 30.7 168.2-123.1 141.5 14.4 -8.2 12.7 95 97 B W E - I 0 114B 0 -2,-0.4 146,-1.2 19,-0.2 145,-0.7 -0.937 24.0-116.3-154.9 168.3 14.4 -11.9 11.7 96 98 B G - 0 0 0 17,-1.4 6,-0.1 5,-0.6 3,-0.1 -0.425 24.1-120.1-103.8 173.6 16.3 -15.1 11.7 97 99 B S S S+ 0 0 40 142,-0.2 2,-0.3 -2,-0.1 5,-0.1 0.591 105.8 30.9 -81.0 -17.1 17.7 -17.6 9.3 98 100 B L S > S- 0 0 107 3,-0.3 3,-1.7 15,-0.1 -2,-0.2 -0.957 90.7-109.3-139.6 153.5 15.5 -20.2 11.0 99 101 B D T 3 S+ 0 0 76 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.728 110.9 65.3 -62.4 -20.8 12.1 -20.0 12.7 100 102 B G T 3 S+ 0 0 56 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.340 107.6 36.5 -85.0 3.8 13.6 -20.6 16.2 101 103 B Q < + 0 0 46 -3,-1.7 -5,-0.6 12,-0.1 -3,-0.3 -0.974 67.7 91.3-147.5 159.4 15.5 -17.4 16.2 102 104 B G + 0 0 0 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 0.013 56.0 104.2 145.5 -34.3 15.1 -13.8 14.9 103 105 B S - 0 0 2 9,-2.1 -1,-0.6 11,-0.3 12,-0.1 -0.314 54.3-150.8 -74.8 158.3 13.5 -11.7 17.7 104 106 B E S S+ 0 0 1 -10,-0.1 -1,-0.1 138,-0.1 2,-0.1 0.846 84.1 53.5 -93.6 -60.1 15.7 -9.2 19.6 105 107 B H S S- 0 0 0 -77,-0.1 7,-0.4 140,-0.1 2,-0.3 -0.497 76.5-158.6 -66.5 150.3 13.7 -9.3 22.9 106 108 B T E -a 30 0A 13 -77,-1.3 -75,-2.7 5,-0.1 2,-0.5 -0.878 10.9-139.3-125.3 157.9 13.1 -12.8 24.3 107 109 B V E > S-aB 31 110A 17 3,-2.0 3,-2.1 -2,-0.3 -75,-0.2 -0.969 88.3 -18.0-121.5 113.9 10.4 -13.9 26.8 108 110 B D T 3 S- 0 0 68 -77,-2.5 -1,-0.1 -2,-0.5 -76,-0.1 0.890 128.6 -56.0 52.5 39.4 11.7 -16.3 29.5 109 111 B K T 3 S+ 0 0 165 1,-0.3 2,-0.4 -78,-0.1 -1,-0.3 0.436 107.3 138.9 70.9 5.7 14.7 -16.9 27.1 110 112 B K B < -B 107 0A 119 -3,-2.1 -3,-2.0 -9,-0.0 2,-0.4 -0.675 41.3-150.7 -76.4 127.8 12.1 -17.9 24.3 111 113 B K - 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