==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-JAN-04 1S6U . COMPND 2 MOLECULE: COPPER-TRANSPORTING ATPASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.BANCI,I.BERTINI,R.DEL CONTE,M.D'ONOFRIO,A.ROSATO, . 76 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5028.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 57 75.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 23.7 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 . 10 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 26.3 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 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 G 0 0 97 0, 0.0 74,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 167.8 2.7 0.8 16.7 2 2 A E - 0 0 63 46,-0.1 74,-0.4 1,-0.0 2,-0.4 -0.037 360.0-113.0 -80.4-178.3 1.4 0.9 13.1 3 3 A V E -A 47 0A 30 44,-2.9 44,-2.3 72,-0.2 2,-0.4 -0.989 16.4-142.0-127.1 135.8 0.2 -2.0 10.9 4 4 A V E -A 46 0A 32 -2,-0.4 2,-0.4 42,-0.2 70,-0.4 -0.795 12.9-165.3 -89.7 132.5 1.8 -3.4 7.8 5 5 A L E -A 45 0A 5 40,-2.8 40,-2.6 -2,-0.4 2,-0.5 -0.979 5.2-156.3-113.3 135.2 -0.4 -4.5 4.8 6 6 A K E +A 44 0A 54 66,-1.4 65,-2.3 -2,-0.4 2,-0.4 -0.974 14.7 178.8-111.9 122.1 1.1 -6.7 2.1 7 7 A M E -AB 43 70A 0 36,-2.9 36,-3.0 -2,-0.5 2,-0.3 -0.990 24.8-135.3-123.6 120.5 -0.7 -6.5 -1.3 8 8 A K E -AB 42 69A 69 61,-1.5 61,-2.9 -2,-0.4 2,-0.3 -0.627 26.8-160.4 -71.0 134.5 0.5 -8.5 -4.3 9 9 A V E - B 0 68A 0 32,-1.8 2,-0.3 -2,-0.3 59,-0.2 -0.882 5.4-150.1-116.9 150.3 0.4 -6.2 -7.4 10 10 A E S S+ 0 0 102 57,-1.3 2,-1.0 -2,-0.3 3,-0.1 -0.861 73.8 10.7-113.6 150.3 0.3 -7.1 -11.1 11 11 A G S S+ 0 0 58 -2,-0.3 2,-1.9 1,-0.2 -1,-0.1 -0.020 83.1 122.6 81.4 -35.1 1.8 -5.2 -14.0 12 12 A M + 0 0 1 -2,-1.0 29,-0.2 1,-0.2 -1,-0.2 -0.437 23.6 142.9 -65.8 85.7 3.7 -2.7 -11.9 13 13 A T + 0 0 96 -2,-1.9 2,-0.3 28,-0.1 -1,-0.2 -0.427 49.6 65.5-123.0 51.1 7.2 -3.3 -13.3 14 14 A C S > S- 0 0 51 1,-0.0 4,-0.9 0, 0.0 5,-0.1 -0.963 81.4-117.0-158.3 167.9 8.6 0.2 -13.3 15 15 A H H > S+ 0 0 128 -2,-0.3 4,-2.7 2,-0.1 5,-0.2 0.703 105.0 66.6 -77.8 -22.2 9.6 2.8 -10.8 16 16 A S H > S+ 0 0 82 2,-0.2 4,-3.3 3,-0.2 5,-0.2 0.985 102.4 40.4 -65.6 -62.0 7.0 5.3 -12.1 17 17 A C H > S+ 0 0 31 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.930 120.6 46.4 -52.2 -51.2 3.7 3.5 -11.1 18 18 A T H X S+ 0 0 1 -4,-0.9 4,-3.1 2,-0.2 -1,-0.2 0.952 114.7 45.5 -57.6 -56.1 5.3 2.5 -7.8 19 19 A S H X S+ 0 0 61 -4,-2.7 4,-3.1 2,-0.2 5,-0.2 0.913 111.8 53.3 -55.0 -48.3 6.7 6.0 -7.0 20 20 A T H X S+ 0 0 83 -4,-3.3 4,-3.0 2,-0.2 -1,-0.2 0.938 113.1 42.8 -52.9 -52.0 3.4 7.7 -8.1 21 21 A I H X S+ 0 0 2 -4,-2.7 4,-3.3 -5,-0.2 5,-0.4 0.927 111.5 55.7 -60.9 -44.3 1.5 5.4 -5.7 22 22 A E H X S+ 0 0 49 -4,-3.1 4,-2.8 1,-0.2 -2,-0.2 0.932 113.0 41.8 -54.2 -48.1 4.2 6.0 -3.0 23 23 A G H X S+ 0 0 49 -4,-3.1 4,-2.3 2,-0.2 -2,-0.2 0.956 116.1 47.9 -59.0 -55.8 3.7 9.7 -3.3 24 24 A K H X S+ 0 0 123 -4,-3.0 4,-0.5 2,-0.2 -2,-0.2 0.910 117.7 41.4 -57.0 -47.1 -0.1 9.5 -3.5 25 25 A I H >< S+ 0 0 2 -4,-3.3 3,-1.9 1,-0.2 6,-0.3 0.936 111.3 56.5 -66.3 -48.0 -0.3 7.2 -0.5 26 26 A G H 3< S+ 0 0 47 -4,-2.8 -2,-0.2 -5,-0.4 -1,-0.2 0.845 101.8 59.2 -49.8 -39.3 2.4 9.2 1.4 27 27 A K H 3< S+ 0 0 179 -4,-2.3 -1,-0.3 -5,-0.1 2,-0.2 0.747 85.0 101.4 -60.5 -29.2 0.1 12.2 1.0 28 28 A L S X< S- 0 0 38 -3,-1.9 3,-1.6 -4,-0.5 2,-1.6 -0.436 81.6-118.2 -75.0 135.3 -2.7 10.6 2.9 29 29 A Q T 3 S+ 0 0 162 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 -0.461 101.2 38.0 -70.7 87.0 -3.3 11.6 6.5 30 30 A G T 3 S+ 0 0 10 -2,-1.6 18,-2.7 1,-0.5 22,-0.3 0.267 82.1 107.2 155.0 -15.7 -2.7 8.3 8.3 31 31 A V E < +C 47 0A 24 -3,-1.6 -1,-0.5 -6,-0.3 16,-0.3 -0.629 34.8 179.2 -86.9 149.7 0.2 6.4 6.6 32 32 A Q E - 0 0 102 14,-2.8 2,-0.3 1,-0.5 15,-0.2 0.624 66.6 -1.3-120.8 -34.7 3.5 6.2 8.3 33 33 A R E -C 46 0A 178 13,-2.6 13,-2.7 2,-0.0 -1,-0.5 -0.962 57.6-167.0-156.5 164.3 5.7 4.1 5.9 34 34 A I E -C 45 0A 24 -2,-0.3 11,-0.2 11,-0.2 2,-0.1 -0.969 8.5-171.7-158.3 140.3 5.3 2.4 2.6 35 35 A K E -C 44 0A 132 9,-2.9 9,-2.4 -2,-0.3 2,-0.8 -0.656 9.9-177.1-141.0 82.7 7.4 -0.1 0.6 36 36 A V E -C 43 0A 11 7,-0.3 7,-0.3 -2,-0.1 2,-0.1 -0.745 11.6-167.0 -84.5 110.9 6.1 -0.6 -2.9 37 37 A S - 0 0 41 5,-2.2 -25,-0.1 -2,-0.8 -28,-0.0 -0.428 19.3-178.0 -89.3 172.2 8.2 -3.3 -4.6 38 38 A L S > S+ 0 0 42 3,-0.1 3,-2.0 -2,-0.1 -1,-0.1 0.525 74.3 63.7-133.6 -48.2 8.2 -4.1 -8.4 39 39 A D T 3 S+ 0 0 146 1,-0.3 -2,-0.0 2,-0.1 -26,-0.0 0.917 117.9 28.7 -46.1 -61.2 10.7 -7.0 -8.8 40 40 A N T 3 S- 0 0 139 2,-0.1 -1,-0.3 -32,-0.0 -31,-0.1 0.065 111.6-124.1 -93.2 19.5 8.7 -9.4 -6.7 41 41 A Q < + 0 0 52 -3,-2.0 -32,-1.8 -29,-0.2 2,-0.3 0.818 67.2 125.7 32.3 63.9 5.5 -7.5 -7.7 42 42 A E E -A 8 0A 31 -34,-0.3 -5,-2.2 -30,-0.1 2,-0.4 -0.990 47.9-147.3-146.6 146.2 4.3 -6.8 -4.2 43 43 A A E -AC 7 36A 1 -36,-3.0 -36,-2.9 -2,-0.3 2,-0.5 -0.979 3.4-158.5-125.1 124.7 3.4 -3.6 -2.3 44 44 A T E -AC 6 35A 12 -9,-2.4 -9,-2.9 -2,-0.4 2,-0.4 -0.902 10.6-174.7 -98.1 129.5 4.0 -3.0 1.4 45 45 A I E -AC 5 34A 0 -40,-2.6 -40,-2.8 -2,-0.5 2,-0.6 -0.999 5.5-165.1-128.8 123.2 1.8 -0.2 2.9 46 46 A V E +AC 4 33A 29 -13,-2.7 -14,-2.8 -2,-0.4 -13,-2.6 -0.914 24.8 154.7-117.4 104.5 2.4 0.8 6.6 47 47 A Y E -AC 3 31A 17 -44,-2.3 -44,-2.9 -2,-0.6 -16,-0.2 -0.788 47.0-102.3-133.4 168.0 -0.4 2.8 8.2 48 48 A Q >> - 0 0 67 -18,-2.7 2,-2.2 -2,-0.2 3,-1.3 -0.835 32.4-131.7 -98.4 112.8 -2.0 3.7 11.5 49 49 A P B 34 S+d 52 0B 78 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 -0.387 98.8 43.9 -72.4 78.2 -5.3 1.7 12.1 50 50 A H T 34 S+ 0 0 160 -2,-2.2 3,-0.1 2,-0.7 -20,-0.0 -0.017 111.3 45.4-179.3 -53.0 -7.4 4.7 13.1 51 51 A L T <4 S+ 0 0 83 -3,-1.3 2,-0.2 -21,-0.2 -20,-0.1 0.914 123.5 8.7 -80.8 -46.1 -6.6 7.5 10.6 52 52 A I B < S-d 49 0B 20 -4,-1.3 -2,-0.7 -22,-0.3 2,-0.3 -0.787 70.4-145.8-133.8 169.7 -6.7 5.5 7.3 53 53 A S > - 0 0 55 -2,-0.2 4,-2.2 -4,-0.1 3,-0.2 -0.905 33.0 -98.6-139.6 162.0 -7.8 2.0 6.3 54 54 A V H > S+ 0 0 46 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.862 121.5 54.8 -43.6 -48.3 -7.1 -1.0 3.9 55 55 A E H > S+ 0 0 109 2,-0.2 4,-3.0 1,-0.2 5,-0.5 0.934 105.4 50.3 -63.9 -45.7 -9.9 0.2 1.7 56 56 A E H > S+ 0 0 76 2,-0.2 4,-2.8 3,-0.2 5,-0.3 0.975 114.7 46.7 -50.9 -57.3 -8.4 3.8 1.3 57 57 A M H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.952 121.5 34.7 -46.5 -65.4 -5.1 2.2 0.4 58 58 A K H X>S+ 0 0 61 -4,-3.2 4,-2.9 2,-0.2 5,-0.5 0.960 116.7 51.7 -59.5 -59.7 -6.6 -0.3 -2.1 59 59 A K H X5S+ 0 0 128 -4,-3.0 4,-2.3 1,-0.3 -1,-0.2 0.903 115.8 43.6 -44.8 -48.6 -9.4 1.9 -3.5 60 60 A Q H X5S+ 0 0 57 -4,-2.8 4,-0.7 -5,-0.5 -1,-0.3 0.897 120.0 42.2 -66.2 -40.8 -6.8 4.6 -4.1 61 61 A I H >X>S+ 0 0 2 -4,-2.6 3,-2.0 -5,-0.3 4,-0.8 0.995 117.2 44.4 -67.5 -65.1 -4.2 2.0 -5.5 62 62 A E H ><5S+ 0 0 83 -4,-2.9 3,-1.2 1,-0.3 -3,-0.2 0.858 104.6 67.2 -43.4 -42.1 -6.7 -0.0 -7.6 63 63 A A H 3<