==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-MAR-06 2GA7 . COMPND 2 MOLECULE: COPPER-TRANSPORTING ATPASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.BANCI,I.BERTINI,F.CANTINI,N.DELLAMALVA,A.ROSATO, . 77 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4742.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 58 75.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 22.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.3 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), 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 . 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 . 11 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 16.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.3 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 0 0 0 1 0 1 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 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 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 1 A N 0 0 219 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 140.4 8.6 1.2 17.4 2 2 A D - 0 0 60 46,-0.1 2,-0.7 1,-0.0 46,-0.2 -0.471 360.0-110.9-101.6 163.1 6.9 0.2 14.0 3 3 A S E -A 47 0A 46 44,-2.6 44,-1.7 -2,-0.2 2,-0.7 -0.833 29.9-156.3 -89.8 113.8 7.8 -1.3 10.6 4 4 A T E -A 46 0A 91 -2,-0.7 2,-0.3 42,-0.2 42,-0.2 -0.835 16.6-175.2 -91.8 111.9 7.4 1.4 7.9 5 5 A A E -A 45 0A 7 40,-1.8 40,-2.0 -2,-0.7 2,-0.4 -0.819 14.8-150.5-104.7 153.2 6.8 -0.3 4.5 6 6 A T E -A 44 0A 37 -2,-0.3 68,-2.2 68,-0.2 2,-0.4 -0.979 6.0-169.2-117.4 133.0 6.6 1.3 1.0 7 7 A F E -AB 43 73A 0 36,-2.8 36,-2.2 -2,-0.4 2,-0.8 -0.992 15.0-147.9-115.8 123.3 4.5 -0.2 -1.8 8 8 A I E -AB 42 72A 50 64,-3.2 64,-2.1 -2,-0.4 2,-1.1 -0.835 13.0-161.9-103.1 98.5 5.1 1.5 -5.2 9 9 A I - 0 0 0 32,-1.0 2,-1.9 -2,-0.8 62,-0.1 -0.684 13.3-173.9 -90.9 87.0 1.9 1.3 -7.2 10 10 A D + 0 0 53 -2,-1.1 60,-2.3 60,-0.1 2,-0.4 -0.641 36.8 145.7 -80.1 80.9 2.5 1.9 -10.9 11 11 A G > - 0 0 0 -2,-1.9 4,-0.5 58,-0.3 6,-0.3 -0.972 55.7 -27.8-130.3 117.0 -1.3 1.9 -11.4 12 12 A M T 4 S- 0 0 117 -2,-0.4 -1,-0.0 2,-0.1 0, 0.0 -0.182 81.3 -83.5 68.5-169.4 -3.1 4.1 -14.1 13 13 A H T 4 S+ 0 0 169 -3,-0.1 -1,-0.1 1,-0.0 -2,-0.0 0.773 128.3 44.2 -99.6 -34.8 -1.5 7.5 -15.3 14 14 A C T 4 S- 0 0 60 1,-0.1 -2,-0.1 27,-0.0 -1,-0.0 0.836 85.0-154.6 -70.8 -38.6 -2.9 9.7 -12.4 15 15 A K >< + 0 0 27 -4,-0.5 3,-2.8 26,-0.1 4,-0.2 0.352 51.0 135.4 61.3 5.6 -2.0 7.1 -9.7 16 16 A S T >> + 0 0 60 1,-0.3 3,-1.9 2,-0.2 4,-0.9 0.806 53.1 86.4 -39.2 -36.2 -4.8 8.8 -7.6 17 17 A C H 3> + 0 0 16 1,-0.3 4,-2.3 -6,-0.3 -1,-0.3 0.662 68.1 76.5 -30.1 -39.8 -5.6 5.1 -7.0 18 18 A V H <> S+ 0 0 0 -3,-2.8 4,-2.0 2,-0.2 -1,-0.3 0.867 96.4 44.0 -52.0 -45.5 -3.1 5.2 -4.0 19 19 A S H <> S+ 0 0 46 -3,-1.9 4,-1.9 2,-0.3 -1,-0.2 0.908 109.1 55.8 -75.9 -34.6 -5.6 7.0 -1.7 20 20 A N H < S+ 0 0 85 -4,-0.9 4,-0.4 1,-0.2 -2,-0.2 0.924 114.9 42.2 -55.2 -41.1 -8.5 4.7 -2.8 21 21 A I H >X S+ 0 0 1 -4,-2.3 4,-1.9 1,-0.2 3,-1.3 0.850 104.5 64.0 -70.2 -38.6 -6.0 2.0 -1.6 22 22 A E H 3X S+ 0 0 53 -4,-2.0 4,-3.1 1,-0.3 -2,-0.2 0.834 91.9 66.0 -59.8 -34.1 -4.9 4.0 1.6 23 23 A S H 3< S+ 0 0 88 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.819 107.9 39.4 -56.1 -37.2 -8.6 3.7 2.8 24 24 A T H X4 S+ 0 0 69 -3,-1.3 3,-1.4 -4,-0.4 -2,-0.2 0.897 115.7 51.6 -74.9 -47.2 -7.9 -0.1 3.1 25 25 A L H >< S+ 0 0 0 -4,-1.9 3,-0.9 1,-0.3 -2,-0.2 0.868 108.6 50.3 -58.8 -42.2 -4.3 0.2 4.4 26 26 A S T 3< S+ 0 0 58 -4,-3.1 -1,-0.3 1,-0.2 -2,-0.1 0.228 103.6 62.8 -82.6 9.7 -5.3 2.6 7.2 27 27 A A T < S+ 0 0 76 -3,-1.4 -1,-0.2 -5,-0.1 2,-0.2 0.258 73.4 116.0-116.2 3.7 -8.2 0.3 8.4 28 28 A L S X S- 0 0 53 -3,-0.9 2,-1.7 -4,-0.1 3,-0.9 -0.506 74.6-117.1 -86.2 148.1 -6.2 -2.8 9.4 29 29 A Q T 3 S+ 0 0 181 1,-0.2 -1,-0.1 -2,-0.2 -3,-0.0 -0.149 108.4 45.6 -80.5 45.1 -6.1 -4.0 13.1 30 30 A Y T 3 S+ 0 0 73 -2,-1.7 18,-1.8 1,-0.1 2,-0.3 0.092 86.8 103.1-172.5 28.7 -2.3 -3.4 13.5 31 31 A V E < -C 47 0A 37 -3,-0.9 16,-0.3 16,-0.2 3,-0.1 -0.985 36.0-177.3-136.7 138.1 -1.4 0.1 11.9 32 32 A S E S+ 0 0 100 14,-2.2 2,-0.3 -2,-0.3 15,-0.2 0.599 71.0 19.6-112.2 -19.9 -0.6 3.6 13.4 33 33 A S E -C 46 0A 47 13,-1.4 13,-2.8 2,-0.0 2,-0.4 -0.987 52.8-152.7-151.8 152.0 -0.1 5.9 10.3 34 34 A I E +C 45 0A 47 -2,-0.3 11,-0.2 11,-0.2 -11,-0.0 -0.931 18.6 169.4-119.6 139.8 -1.0 6.0 6.6 35 35 A V + 0 0 69 9,-2.8 10,-0.1 -2,-0.4 -1,-0.0 -0.185 11.8 166.0-153.1 38.4 1.3 8.0 4.4 36 36 A V - 0 0 28 7,-0.2 2,-0.3 8,-0.1 7,-0.3 -0.083 24.8-147.8 -66.7 165.7 0.6 7.5 0.6 37 37 A S B >> +D 42 0A 35 5,-3.2 5,-3.1 1,-0.1 4,-0.7 -0.923 15.9 176.7-140.0 110.1 1.8 9.6 -2.5 38 38 A L T 45S+ 0 0 75 -2,-0.3 -20,-0.1 3,-0.2 -1,-0.1 0.880 74.5 57.8 -91.5 -43.8 -0.5 9.8 -5.5 39 39 A E T 45S+ 0 0 117 -24,-0.1 -1,-0.2 -23,-0.1 -23,-0.1 0.861 121.8 35.1 -53.5 -35.6 1.2 12.1 -8.1 40 40 A N T 45S- 0 0 85 -25,-0.1 -2,-0.2 2,-0.1 -24,-0.1 0.877 111.0-100.6 -76.1-106.5 4.0 9.6 -7.9 41 41 A R T <5S+ 0 0 112 -4,-0.7 -32,-1.0 -31,-0.1 2,-0.4 -0.033 71.7 130.2 171.4 37.9 3.0 5.9 -7.4 42 42 A S E < -AD 8 37A 17 -5,-3.1 -5,-3.2 -34,-0.3 2,-0.4 -0.929 34.3-178.5-125.5 145.7 3.5 5.4 -3.6 43 43 A A E -A 7 0A 0 -36,-2.2 -36,-2.8 -2,-0.4 2,-0.4 -0.961 15.2-176.9-136.8 117.9 1.7 4.0 -0.6 44 44 A I E -A 6 0A 35 -2,-0.4 -9,-2.8 -38,-0.2 2,-0.3 -0.916 3.3-179.2-118.6 142.7 3.6 4.2 2.7 45 45 A V E -AC 5 34A 0 -40,-2.0 -40,-1.8 -2,-0.4 2,-0.5 -0.996 25.7-140.4-147.2 140.5 2.3 2.8 6.0 46 46 A V E +AC 4 33A 29 -13,-2.8 -14,-2.2 -2,-0.3 -13,-1.4 -0.934 55.1 115.3-101.0 118.1 3.4 2.5 9.7 47 47 A Y E -AC 3 31A 2 -44,-1.7 -44,-2.6 -2,-0.5 2,-0.6 -0.916 65.6 -56.7-167.4-175.3 2.4 -0.9 11.1 48 48 A N + 0 0 86 -18,-1.8 2,-0.3 -2,-0.2 -46,-0.1 -0.755 63.8 135.8 -93.1 120.1 3.4 -4.4 12.5 49 49 A A + 0 0 13 -2,-0.6 2,-0.3 2,-0.0 4,-0.1 -0.980 22.5 75.5-162.0 154.9 5.7 -6.5 10.3 50 50 A S S S+ 0 0 91 2,-1.5 2,-1.2 -2,-0.3 26,-0.1 -0.898 103.5 38.6 145.0 -87.8 8.9 -8.8 10.3 51 51 A S S S+ 0 0 116 -2,-0.3 2,-0.3 2,-0.1 26,-0.0 -0.011 121.6 56.7 -72.5 30.6 7.9 -12.3 11.7 52 52 A V S S- 0 0 88 -2,-1.2 -2,-1.5 0, 0.0 3,-0.0 -0.907 106.1 -87.2-163.2 141.8 4.6 -11.8 9.8 53 53 A T > - 0 0 83 -2,-0.3 3,-1.3 1,-0.2 4,-0.2 -0.441 25.3-165.8 -67.8 115.6 4.1 -11.1 6.0 54 54 A P G > S+ 0 0 10 0, 0.0 3,-1.8 0, 0.0 4,-0.4 0.843 83.9 80.8 -64.2 -30.2 4.2 -7.4 5.0 55 55 A E G 3> + 0 0 50 1,-0.3 4,-0.7 2,-0.2 -2,-0.1 0.553 69.3 87.5 -50.8 -16.9 2.7 -8.5 1.6 56 56 A S G X4 S+ 0 0 41 -3,-1.3 3,-1.2 1,-0.2 -1,-0.3 0.927 85.8 48.7 -39.6 -58.5 -0.6 -8.5 3.6 57 57 A L T X> S+ 0 0 1 -3,-1.8 3,-1.8 1,-0.3 4,-0.6 0.787 95.2 73.8 -67.0 -27.7 -1.1 -4.8 2.8 58 58 A R H >> S+ 0 0 79 -4,-0.4 4,-2.1 1,-0.3 3,-1.4 0.856 82.7 70.7 -51.5 -35.2 -0.4 -5.5 -0.9 59 59 A K H S+ 0 0 8 -3,-1.8 4,-0.6 -4,-0.3 -1,-0.3 0.893 109.4 37.5 -56.5 -41.8 -5.4 -3.6 -0.8 61 61 A I H XX S+ 0 0 1 -3,-1.4 4,-2.0 -4,-0.6 3,-1.1 0.943 114.9 53.9 -70.8 -50.7 -3.9 -2.8 -4.2 62 62 A E H 3< S+ 0 0 61 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.780 105.7 54.5 -62.0 -29.5 -4.6 -6.3 -5.6 63 63 A A H 3< S+ 0 0 86 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.719 110.5 42.9 -79.8 -24.2 -8.3 -6.1 -4.7 64 64 A V H << S+ 0 0 57 -3,-1.1 -2,-0.2 -4,-0.6 -1,-0.2 0.765 136.7 9.4 -90.7 -30.6 -9.1 -2.8 -6.5 65 65 A S S >X S- 0 0 20 -4,-2.0 4,-1.8 4,-0.1 3,-1.5 -0.434 77.6-169.7-148.8 71.5 -7.1 -3.6 -9.7 66 66 A P T 34 S+ 0 0 98 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.326 77.8 8.3 -63.6 140.3 -5.9 -7.3 -9.9 67 67 A G T 34 S+ 0 0 100 2,-0.2 3,-0.1 1,-0.1 -5,-0.1 0.404 124.7 71.1 69.4 -1.4 -3.4 -8.1 -12.7 68 68 A L T <4 S+ 0 0 109 -3,-1.5 2,-0.5 1,-0.1 -1,-0.1 0.830 71.9 73.6-109.4 -61.1 -3.2 -4.3 -13.5 69 69 A Y < - 0 0 37 -4,-1.8 2,-2.2 -8,-0.2 -58,-0.3 -0.498 67.2-144.9 -79.6 119.8 -1.3 -2.3 -10.8 70 70 A R + 0 0 197 -60,-2.3 2,-0.1 -2,-0.5 -1,-0.1 -0.104 30.6 179.9 -71.0 37.9 2.5 -2.9 -11.0 71 71 A V - 0 0 7 -2,-2.2 2,-0.4 -62,-0.1 -62,-0.3 -0.261 10.5-163.5 -66.5 122.3 2.9 -2.6 -7.2 72 72 A S E -B 8 0A 73 -64,-2.1 -64,-3.2 -2,-0.1 2,-0.4 -0.858 8.9-148.1-107.8 128.7 6.5 -3.1 -6.0 73 73 A I E -B 7 0A 39 -2,-0.4 2,-1.0 -66,-0.2 -66,-0.2 -0.827 16.1-139.3-112.0 138.2 7.3 -3.8 -2.2 74 74 A T + 0 0 82 -68,-2.2 2,-0.3 -2,-0.4 -68,-0.2 -0.804 58.0 130.7 -84.8 94.5 10.1 -3.0 0.1 75 75 A S - 0 0 56 -2,-1.0 2,-0.1 -70,-0.1 -22,-0.0 -0.919 48.5-155.9-147.3 173.5 10.4 -6.3 2.0 76 76 A E 0 0 193 -2,-0.3 -2,-0.0 -26,-0.1 0, 0.0 -0.657 360.0 360.0-157.9 76.4 12.8 -9.1 3.2 77 77 A V 0 0 131 -2,-0.1 -26,-0.0 -26,-0.0 -2,-0.0 -0.754 360.0 360.0-171.8 360.0 11.0 -12.5 3.8