==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 29-JUN-11 3B1B . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: CHLAMYDOMONAS REINHARDTII; . AUTHOR S.SHIMIZU,A.TAKENAKA . 622 4 7 4 3 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25181.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 370 59.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 152 24.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 0.3 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 . 45 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 4 0 0 0 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 . 2 2 0 4 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 0 PARALLEL BRIDGES PER LADDER . 8 4 2 5 2 3 4 0 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 . 2 6 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 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 21 A a 0 0 63 0, 0.0 275,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 114.6 10.9 87.4 1.1 2 22 A I - 0 0 6 312,-2.4 2,-0.5 273,-0.1 273,-0.2 -0.759 360.0-123.9-114.0 168.0 12.7 84.2 2.3 3 23 A Y B -A 274 0A 74 271,-2.2 271,-2.0 -2,-0.3 5,-0.1 -0.957 19.5-121.1-116.0 130.8 16.0 82.6 1.2 4 24 A K > - 0 0 49 -2,-0.5 3,-2.1 269,-0.2 4,-0.2 -0.278 46.9 -87.8 -54.3 143.6 16.6 79.1 -0.1 5 25 A F T 3 S+ 0 0 11 266,-0.3 17,-0.6 1,-0.3 18,-0.2 -0.396 121.1 33.7 -53.0 122.9 19.0 77.0 1.9 6 26 A G T 3 S+ 0 0 22 -2,-0.2 -1,-0.3 15,-0.1 14,-0.2 0.386 109.5 68.3 105.6 -3.8 22.4 77.9 0.4 7 27 A T < + 0 0 52 -3,-2.1 -2,-0.2 -4,-0.1 -3,-0.1 0.274 60.2 139.0-129.4 10.3 21.6 81.5 -0.4 8 28 A S > - 0 0 4 -4,-0.2 3,-2.1 1,-0.1 277,-0.0 -0.373 52.4-137.2 -65.4 131.8 21.3 83.1 3.0 9 29 A P T 3 S+ 0 0 30 0, 0.0 273,-0.2 0, 0.0 -1,-0.1 0.713 104.2 57.8 -63.0 -21.3 22.9 86.6 3.1 10 30 A D T 3 S+ 0 0 14 271,-0.1 2,-0.1 272,-0.1 -2,-0.1 0.363 81.2 130.8 -84.4 5.9 24.4 85.8 6.5 11 31 A S < - 0 0 27 -3,-2.1 198,-0.2 1,-0.1 270,-0.1 -0.353 42.6-168.0 -65.4 135.2 26.2 82.7 5.0 12 32 A K + 0 0 107 196,-2.1 197,-0.2 -2,-0.1 -1,-0.1 0.235 47.8 125.7-100.6 10.2 30.0 82.4 5.7 13 33 A A - 0 0 47 195,-0.1 2,-0.4 1,-0.0 77,-0.1 -0.322 52.1-142.1 -67.0 150.1 30.4 79.7 3.1 14 34 A T - 0 0 138 76,-0.0 2,-0.4 2,-0.0 -2,-0.1 -0.903 13.6-158.1-109.0 146.4 33.0 80.1 0.3 15 35 A V - 0 0 68 -2,-0.4 2,-0.5 2,-0.0 4,-0.1 -0.974 10.9-163.5-129.0 123.5 32.3 78.9 -3.2 16 36 A S S S- 0 0 102 -2,-0.4 18,-0.4 2,-0.1 2,-0.1 -0.914 71.5 -1.1 -97.0 130.4 34.7 78.0 -6.0 17 37 A G S S- 0 0 28 -2,-0.5 16,-0.2 16,-0.3 17,-0.1 -0.390 115.7 -7.2 86.7-169.2 32.9 78.0 -9.3 18 38 A D S S- 0 0 76 14,-2.5 2,-0.1 -2,-0.1 -2,-0.1 -0.247 71.3-114.5 -67.3 142.5 29.3 78.7 -10.1 19 39 A H + 0 0 151 -4,-0.1 2,-0.3 -12,-0.0 -1,-0.1 -0.457 41.4 170.4 -70.5 150.1 26.8 79.1 -7.2 20 40 A W + 0 0 40 -14,-0.2 2,-0.3 -2,-0.1 9,-0.0 -0.972 13.1 178.6-154.8 165.5 24.0 76.5 -6.9 21 41 A D - 0 0 16 -2,-0.3 5,-0.4 -14,-0.0 3,-0.3 -0.907 43.5-100.6-157.2-179.8 21.3 75.4 -4.5 22 42 A H S > S+ 0 0 5 -17,-0.6 3,-2.5 -2,-0.3 272,-0.2 0.232 77.8 119.0 -97.2 15.2 18.5 72.7 -4.3 23 43 A G T 3 S+ 0 0 6 1,-0.3 581,-2.2 -18,-0.2 -1,-0.2 0.837 91.2 24.3 -50.8 -40.9 15.7 75.1 -5.3 24 44 A L T > S- 0 0 33 -3,-0.3 3,-2.6 579,-0.2 -1,-0.3 -0.021 114.1-110.0-113.8 29.0 14.9 73.1 -8.4 25 45 A N T < S- 0 0 3 -3,-2.5 271,-2.6 1,-0.3 -3,-0.1 0.822 79.5 -51.0 47.5 35.8 16.3 69.8 -7.0 26 46 A G T > S+ 0 0 4 -5,-0.4 3,-1.7 269,-0.2 -1,-0.3 0.387 105.6 122.6 88.0 -1.6 19.1 70.0 -9.5 27 47 A E T < S+ 0 0 80 -3,-2.6 -2,-0.1 1,-0.3 -5,-0.0 0.817 81.8 45.1 -58.3 -30.6 17.1 70.6 -12.7 28 48 A N T 3 S+ 0 0 76 1,-0.1 2,-1.9 -4,-0.0 -1,-0.3 0.048 75.7 130.6-101.0 21.8 19.0 73.8 -13.3 29 49 A W < + 0 0 3 -3,-1.7 13,-0.5 -5,-0.1 2,-0.4 -0.556 23.1 134.0 -86.0 78.3 22.5 72.5 -12.5 30 50 A E + 0 0 151 -2,-1.9 2,-0.3 11,-0.1 10,-0.1 -0.997 34.9 100.8-121.1 127.9 24.4 73.8 -15.6 31 51 A G - 0 0 13 -2,-0.4 8,-2.7 8,-0.2 2,-0.3 -0.983 60.2 -95.0 174.6-176.2 27.6 75.4 -14.6 32 52 A K B -C 38 0B 123 -2,-0.3 -14,-2.5 6,-0.3 6,-0.2 -0.953 27.3-129.3-134.2 145.1 31.4 75.2 -14.3 33 53 A D > - 0 0 49 4,-2.5 3,-1.9 -2,-0.3 -16,-0.3 -0.180 47.4 -81.1 -81.4-175.3 33.7 74.4 -11.4 34 54 A G T 3 S+ 0 0 56 -18,-0.4 -17,-0.2 1,-0.3 -1,-0.0 0.737 131.7 52.3 -63.2 -24.8 36.6 76.5 -10.2 35 55 A A T 3 S- 0 0 82 2,-0.1 -1,-0.3 -19,-0.1 3,-0.1 0.340 120.1-107.9 -93.4 3.8 38.8 75.1 -13.0 36 56 A G S < S+ 0 0 41 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.524 71.2 143.5 82.8 6.5 36.3 75.9 -15.7 37 57 A N - 0 0 99 1,-0.1 -4,-2.5 -5,-0.0 -1,-0.3 -0.627 53.8-113.1 -76.9 138.0 35.2 72.4 -16.3 38 58 A A B -C 32 0B 68 -2,-0.3 -6,-0.3 -6,-0.2 -1,-0.1 -0.489 26.4-115.8 -70.5 134.4 31.5 71.9 -17.1 39 59 A W - 0 0 22 -8,-2.7 -8,-0.2 -2,-0.2 205,-0.2 -0.317 15.3-149.9 -56.4 152.0 29.3 70.1 -14.6 40 60 A V >> + 0 0 50 203,-2.6 4,-2.6 1,-0.1 3,-0.7 0.202 63.5 113.4-112.8 13.5 27.9 66.9 -16.0 41 61 A b T 34 S+ 0 0 2 202,-0.3 -1,-0.1 1,-0.2 -11,-0.1 0.894 87.5 32.1 -50.7 -46.3 24.6 66.9 -13.9 42 62 A K T 34 S+ 0 0 114 -13,-0.5 -1,-0.2 -3,-0.2 -2,-0.1 0.511 125.5 42.5 -94.8 -5.2 22.4 67.4 -17.0 43 63 A T T <4 S+ 0 0 111 -3,-0.7 -2,-0.2 -4,-0.0 -1,-0.1 0.713 87.3 93.6-114.7 -29.4 24.5 65.5 -19.6 44 64 A G < - 0 0 22 -4,-2.6 3,-0.2 1,-0.1 194,-0.0 -0.234 54.6-155.0 -64.1 154.6 25.7 62.3 -17.9 45 65 A R S S+ 0 0 149 1,-0.1 258,-0.2 192,-0.0 -1,-0.1 0.286 88.7 63.8-114.4 9.8 23.8 59.0 -18.3 46 66 A K S S+ 0 0 48 191,-0.1 201,-0.3 2,-0.0 2,-0.2 -0.353 76.8 149.7-120.9 47.7 25.1 57.5 -15.0 47 67 A Q - 0 0 3 252,-0.3 251,-0.2 -3,-0.2 193,-0.1 -0.512 36.2-102.2 -85.9 152.4 23.6 60.1 -12.7 48 68 A S S S+ 0 0 0 191,-0.5 2,-0.2 -2,-0.2 251,-0.1 -0.878 78.6 44.3-116.3 157.7 22.4 59.5 -9.1 49 69 A P - 0 0 0 0, 0.0 249,-2.5 0, 0.0 2,-0.3 0.567 66.8-170.5 -81.5 177.1 20.0 59.2 -7.3 50 70 A I B -d 298 0C 2 247,-0.2 101,-1.6 -2,-0.2 2,-1.0 -0.848 33.2-113.3-126.2 160.8 17.8 56.7 -8.9 51 71 A N E -e 151 0D 9 247,-0.6 101,-0.2 -2,-0.3 249,-0.1 -0.859 44.4-132.3 -90.2 99.6 14.3 55.4 -8.4 52 72 A V E -e 152 0D 0 99,-2.8 101,-3.0 -2,-1.0 102,-0.2 -0.363 23.3-123.4 -64.2 123.8 15.2 51.8 -7.4 53 73 A P > - 0 0 43 0, 0.0 5,-2.0 0, 0.0 6,-0.1 -0.292 13.8-154.0 -70.5 148.7 13.0 49.3 -9.4 54 74 A Q I > >S+ 0 0 103 3,-0.2 5,-2.3 4,-0.2 3,-1.4 0.882 77.5 88.2 -75.2 -45.3 10.8 46.6 -7.9 55 75 A Y I 3 5S- 0 0 180 1,-0.3 3,-0.1 3,-0.1 98,-0.0 -0.369 114.9 -19.1 -64.4 116.2 11.1 44.6 -11.2 56 76 A Q I 3 5S+ 0 0 89 -2,-0.3 -1,-0.3 1,-0.2 7,-0.2 0.637 138.3 56.5 61.4 19.0 14.1 42.2 -11.1 57 77 A V I X 5S+ 0 0 9 -3,-1.4 3,-1.8 5,-0.1 5,-0.3 0.305 112.6 21.3-132.7 -85.5 15.8 44.2 -8.3 58 78 A L I 3 > - 0 0 25 -2,-0.5 3,-2.9 1,-0.1 4,-0.6 -0.302 24.1-113.9 -57.1 140.5 27.0 36.6 -4.5 67 87 A N G >4 S+ 0 0 97 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.853 116.4 53.1 -41.8 -47.7 27.6 36.4 -0.8 68 88 A G G 34 S+ 0 0 56 1,-0.3 -1,-0.3 60,-0.2 -2,-0.1 0.600 107.7 50.6 -69.0 -11.8 31.4 36.4 -1.3 69 89 A L G <4 S+ 0 0 8 -3,-2.9 40,-0.6 40,-0.1 -1,-0.3 0.423 85.4 120.7-106.0 1.0 31.3 39.5 -3.5 70 90 A Q << - 0 0 11 -3,-1.4 2,-0.1 -4,-0.6 37,-0.0 -0.316 69.1-110.5 -71.5 142.9 29.3 41.6 -1.0 71 91 A T - 0 0 7 37,-0.1 2,-0.4 38,-0.1 37,-0.2 -0.434 32.8-150.9 -64.3 145.4 30.5 44.8 0.4 72 92 A Q E -G 107 0E 107 35,-2.1 35,-2.3 -2,-0.1 2,-0.4 -0.993 3.3-151.2-126.4 131.2 31.3 44.5 4.1 73 93 A W E -G 106 0E 13 -2,-0.4 2,-0.4 33,-0.2 33,-0.2 -0.889 13.7-179.3-111.4 133.7 31.1 47.4 6.6 74 94 A S E +G 105 0E 58 31,-3.0 31,-2.0 -2,-0.4 149,-0.1 -0.839 16.2 162.8-128.2 88.4 33.2 47.9 9.8 75 95 A Y - 0 0 21 -2,-0.4 148,-0.3 29,-0.2 2,-0.1 -0.913 13.6-173.6-116.0 111.8 32.2 51.0 11.6 76 96 A P - 0 0 63 0, 0.0 146,-0.3 0, 0.0 28,-0.1 -0.455 47.4 -66.8 -85.9 174.2 33.2 51.5 15.3 77 97 A D - 0 0 73 144,-0.2 2,-0.4 -2,-0.1 144,-0.2 -0.261 42.5-132.0 -57.3 140.4 31.9 54.6 17.2 78 98 A L E -I 220 0F 1 142,-3.1 142,-3.0 -3,-0.1 2,-0.4 -0.810 29.5-166.4 -84.9 139.2 33.1 58.0 16.2 79 99 A M E -I 219 0F 78 -2,-0.4 2,-0.3 140,-0.2 140,-0.2 -0.996 10.9-145.0-140.0 124.8 34.2 59.9 19.4 80 100 A S - 0 0 3 138,-2.6 137,-3.0 -2,-0.4 138,-0.2 -0.732 10.1-164.9 -92.2 143.1 35.0 63.5 19.9 81 101 A N S S- 0 0 110 -2,-0.3 135,-0.3 135,-0.3 -1,-0.1 0.244 70.9 -82.1-101.8 7.1 37.7 64.9 22.2 82 102 A G S S+ 0 0 22 132,-0.5 134,-0.1 133,-0.3 131,-0.1 0.064 126.4 30.0 116.1 -22.5 36.1 68.3 22.0 83 103 A T S S+ 0 0 86 130,-0.1 -3,-0.1 132,-0.1 3,-0.0 0.383 99.5 80.3-138.0 -3.4 37.6 69.4 18.7 84 104 A S S S+ 0 0 7 130,-0.2 15,-2.4 1,-0.1 16,-0.6 0.526 90.4 46.8 -95.0 -11.7 38.2 66.1 16.8 85 105 A V E S-J 98 0G 0 129,-0.3 129,-3.1 13,-0.2 2,-0.3 -0.999 72.0-173.1-127.7 135.3 34.6 65.5 15.4 86 106 A Q E -JK 97 213G 15 11,-2.9 11,-2.0 -2,-0.4 2,-0.5 -0.873 21.6-146.2-127.7 152.3 32.7 68.4 13.7 87 107 A V E -JK 96 212G 0 125,-2.4 125,-2.2 -2,-0.3 2,-0.4 -0.998 26.8-161.5-118.6 123.3 29.2 69.0 12.4 88 108 A I E -JK 95 211G 28 7,-3.7 7,-2.6 -2,-0.5 2,-0.6 -0.875 20.4-161.2-113.2 135.8 29.3 71.3 9.4 89 109 A N E +JK 94 210G 0 121,-2.9 120,-1.3 -2,-0.4 121,-1.3 -0.975 18.5 171.1-106.4 108.1 26.5 73.4 7.8 90 110 A N - 0 0 54 3,-1.5 4,-0.1 -2,-0.6 118,-0.1 0.230 58.0-101.3-100.4 11.9 27.9 74.2 4.3 91 111 A G S S+ 0 0 1 2,-0.4 3,-0.1 119,-0.1 117,-0.1 0.378 118.1 59.1 84.9 -4.1 24.7 75.6 2.9 92 112 A H S S- 0 0 39 1,-0.5 2,-0.3 -71,-0.1 -1,-0.1 0.533 116.0 -16.6-131.0 -19.0 24.0 72.4 1.0 93 113 A T - 0 0 7 177,-0.1 -3,-1.5 52,-0.1 2,-0.5 -0.944 64.8 -98.4-169.3 174.2 23.8 69.7 3.8 94 114 A I E -J 89 0G 0 50,-0.3 50,-1.2 -2,-0.3 2,-0.3 -0.986 51.9-175.0-106.1 123.5 24.6 69.0 7.4 95 115 A Q E -JL 88 143G 19 -7,-2.6 -7,-3.7 -2,-0.5 2,-0.4 -0.927 21.7-143.8-129.0 142.3 27.9 67.0 7.3 96 116 A V E +JL 87 142G 0 46,-3.2 46,-1.8 -2,-0.3 2,-0.3 -0.919 24.9 171.2-106.7 133.4 30.0 65.2 9.9 97 117 A Q E -J 86 0G 72 -11,-2.0 -11,-2.9 -2,-0.4 2,-0.3 -0.882 15.6-152.2-131.2 167.5 33.8 65.3 9.6 98 118 A W E -J 85 0G 37 42,-0.3 -13,-0.2 -2,-0.3 -14,-0.1 -0.987 13.7-160.7-145.9 149.3 36.6 64.2 11.9 99 119 A T S S+ 0 0 104 -15,-2.4 2,-0.2 -2,-0.3 -14,-0.1 0.115 71.9 76.8-120.8 14.6 40.2 65.4 12.3 100 120 A Y S S- 0 0 70 -16,-0.6 2,-1.7 0, 0.0 -2,-0.1 -0.738 98.5 -86.9-112.7 169.7 41.6 62.3 14.1 101 121 A N - 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