==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-JAN-02 1KVJ . COMPND 2 MOLECULE: COPPER-TRANSPORTING ATPASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.M.DE SILVA,G.VEGLIA,S.J.OPELLA . 79 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4616.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 55 69.6 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 . 18 22.8 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 . 0 0.0 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 . 6 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 26.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 5.1 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 2 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 . 0 0 0 1 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 M 0 0 214 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -65.3 12.1 -19.4 -6.9 2 2 A D + 0 0 110 1,-0.1 4,-0.1 2,-0.1 0, 0.0 -0.570 360.0 150.6-120.7 72.7 9.9 -17.7 -4.3 3 3 A P S S- 0 0 112 0, 0.0 -1,-0.1 0, 0.0 34,-0.0 0.732 99.2 -18.5 -70.8 -19.9 8.7 -14.4 -5.8 4 4 A S S > S+ 0 0 52 -3,-0.2 3,-1.6 47,-0.0 -2,-0.1 0.080 76.2 164.3-177.4 40.7 5.6 -14.8 -3.5 5 5 A M T 3 S+ 0 0 164 1,-0.3 -3,-0.0 0, 0.0 0, 0.0 0.833 91.6 5.5 -39.2 -40.7 5.4 -18.5 -2.4 6 6 A G T 3 S+ 0 0 30 -4,-0.1 49,-0.4 2,-0.0 -1,-0.3 -0.147 116.7 81.0-142.0 47.3 3.0 -17.5 0.3 7 7 A V < - 0 0 14 -3,-1.6 2,-0.3 46,-0.2 46,-0.3 -0.852 57.4-137.3-141.2 176.8 2.1 -13.7 -0.1 8 8 A N E -A 52 0A 89 44,-3.9 44,-4.0 -2,-0.2 2,-0.3 -0.906 12.9-125.1-135.8 166.0 -0.2 -11.5 -2.2 9 9 A S E -A 51 0A 62 42,-0.3 2,-0.4 -2,-0.3 42,-0.3 -0.842 19.3-172.6-114.4 150.7 0.1 -8.1 -4.1 10 10 A V E -A 50 0A 0 40,-3.5 40,-2.8 -2,-0.3 2,-0.5 -0.983 9.9-155.4-144.2 130.2 -2.1 -5.0 -3.8 11 11 A T E -A 49 0A 28 -2,-0.4 65,-1.8 38,-0.3 2,-0.6 -0.907 9.9-165.2-109.2 122.3 -2.2 -1.8 -5.9 12 12 A I E -AB 48 75A 0 36,-3.7 36,-3.3 -2,-0.5 63,-0.3 -0.903 16.7-135.7-109.6 121.6 -3.5 1.4 -4.3 13 13 A S E -AB 47 74A 28 61,-1.1 61,-2.8 -2,-0.6 2,-0.3 -0.522 31.7-171.2 -70.7 133.3 -4.4 4.5 -6.5 14 14 A V E + B 0 73A 5 32,-3.0 2,-0.3 -2,-0.2 59,-0.2 -0.886 12.8 176.3-127.0 161.1 -3.0 7.6 -4.8 15 15 A E E + B 0 72A 105 57,-0.7 57,-0.8 -2,-0.3 29,-0.1 -0.994 58.0 40.7-157.8 158.7 -3.3 11.4 -5.4 16 16 A G S S+ 0 0 63 -2,-0.3 -1,-0.1 55,-0.1 27,-0.1 0.746 88.7 97.3 73.9 21.0 -2.2 14.7 -3.9 17 17 A M + 0 0 1 26,-0.2 2,-2.8 25,-0.1 5,-0.3 0.034 31.7 136.5-128.9 28.9 1.3 13.3 -3.2 18 18 A T + 0 0 93 4,-0.1 2,-0.3 26,-0.1 3,-0.1 -0.112 52.4 90.4 -71.6 49.2 3.3 14.6 -6.3 19 19 A C S > S- 0 0 64 -2,-2.8 3,-3.8 1,-0.1 4,-0.4 -0.912 89.5-114.1-150.6 118.5 6.3 15.5 -4.0 20 20 A N T >> S+ 0 0 138 -2,-0.3 4,-2.3 1,-0.3 3,-1.6 0.669 111.9 70.3 -15.0 -51.5 9.3 13.2 -3.0 21 21 A S H 3> S+ 0 0 50 1,-0.3 4,-0.6 2,-0.2 -1,-0.3 0.691 94.8 55.8 -52.1 -14.5 8.0 13.2 0.6 22 22 A C H <> S+ 0 0 7 -3,-3.8 4,-0.9 -5,-0.3 -1,-0.3 0.801 109.8 42.6 -91.6 -24.8 5.1 11.1 -0.5 23 23 A V H <> S+ 0 0 46 -3,-1.6 4,-1.6 -4,-0.4 5,-0.3 0.848 118.6 43.3 -87.8 -35.0 7.2 8.3 -2.0 24 24 A W H X S+ 0 0 148 -4,-2.3 4,-1.0 2,-0.2 -3,-0.2 0.805 118.7 45.6 -81.8 -22.7 9.7 8.1 0.7 25 25 A T H X S+ 0 0 28 -4,-0.6 4,-0.8 -5,-0.4 -2,-0.2 0.787 119.6 39.7 -87.6 -24.7 7.0 8.4 3.4 26 26 A I H X>S+ 0 0 1 -4,-0.9 4,-2.2 2,-0.2 5,-0.6 0.776 118.2 47.5 -92.8 -26.5 4.7 5.7 1.7 27 27 A E H X5S+ 0 0 62 -4,-1.6 4,-1.4 2,-0.2 5,-0.3 0.908 115.7 45.0 -78.8 -40.2 7.6 3.4 0.7 28 28 A Q H X5S+ 0 0 71 -4,-1.0 4,-1.0 -5,-0.3 -2,-0.2 0.878 119.7 43.3 -70.4 -33.8 9.1 3.7 4.2 29 29 A Q H <5S+ 0 0 56 -4,-0.8 4,-0.4 2,-0.2 -2,-0.2 0.986 124.0 31.4 -75.9 -62.2 5.6 3.2 5.7 30 30 A I H >X5S+ 0 0 0 -4,-2.2 3,-1.8 1,-0.2 4,-0.6 0.971 117.8 57.0 -60.9 -50.5 4.2 0.3 3.5 31 31 A G H 3> -C 47 0A 23 5,-1.2 4,-1.7 -2,-0.3 5,-0.9 -0.678 17.9-161.0-153.2 94.3 5.1 6.6 -7.6 43 43 A L T 45S+ 0 0 14 1,-0.2 -26,-0.2 -2,-0.2 -27,-0.1 0.756 100.1 39.6 -46.8 -25.2 4.1 10.2 -6.8 44 44 A E T 45S+ 0 0 135 1,-0.1 -1,-0.2 3,-0.1 -26,-0.1 0.856 113.0 49.8 -96.9 -38.5 3.8 10.8 -10.6 45 45 A E T 45S- 0 0 88 2,-0.1 -2,-0.2 1,-0.1 -1,-0.1 0.611 103.5-136.1 -74.6 -4.2 2.2 7.5 -11.7 46 46 A K T <5 + 0 0 54 -4,-1.7 -32,-3.0 1,-0.2 2,-0.3 0.840 65.3 103.2 56.7 34.9 -0.3 8.2 -8.9 47 47 A N E < -AC 13 42A 29 -5,-0.9 -5,-1.2 -34,-0.3 2,-0.5 -0.998 53.1-159.2-148.2 151.3 -0.3 4.6 -7.6 48 48 A A E +AC 12 41A 0 -36,-3.3 -36,-3.7 -2,-0.3 2,-0.4 -0.895 20.3 171.5-130.8 103.3 1.2 2.5 -4.8 49 49 A T E +AC 11 40A 29 -9,-3.1 -9,-3.7 -2,-0.5 -38,-0.3 -0.931 8.8 152.5-116.5 134.7 1.3 -1.3 -5.5 50 50 A I E -AC 10 39A 0 -40,-2.8 -40,-3.5 -2,-0.4 2,-0.4 -0.863 38.1-112.1-144.9-178.7 3.1 -3.8 -3.2 51 51 A I E +AC 9 38A 9 -13,-2.2 -13,-0.7 -42,-0.3 -14,-0.4 -0.924 35.8 172.4-121.6 145.4 3.1 -7.4 -2.0 52 52 A Y E -A 8 0A 14 -44,-4.0 -44,-3.9 -2,-0.4 -16,-0.2 -0.967 40.1 -91.3-149.2 165.8 2.2 -8.6 1.5 53 53 A D >> - 0 0 18 -18,-0.6 4,-2.9 -2,-0.3 3,-0.6 -0.711 27.8-174.1 -84.5 107.1 1.6 -11.6 3.6 54 54 A P T 34 S+ 0 0 52 0, 0.0 -1,-0.2 0, 0.0 -47,-0.1 0.594 80.8 71.8 -75.1 -9.1 -2.2 -12.4 3.5 55 55 A K T 34 S+ 0 0 140 -49,-0.4 -48,-0.1 1,-0.1 3,-0.1 0.875 123.4 5.7 -74.2 -36.0 -1.5 -15.1 6.1 56 56 A L T <4 S+ 0 0 111 -3,-0.6 2,-0.2 -21,-0.1 -1,-0.1 0.553 136.6 31.9-121.4 -17.2 -0.9 -12.5 8.9 57 57 A Q < - 0 0 26 -4,-2.9 -5,-0.1 -22,-0.1 -1,-0.0 -0.744 61.3-171.5-131.6-179.4 -1.8 -9.2 7.1 58 58 A T >> - 0 0 60 -2,-0.2 3,-1.9 -3,-0.1 4,-1.1 -0.977 48.5 -75.9-164.2 173.5 -4.2 -8.0 4.3 59 59 A P H 3> S+ 0 0 26 0, 0.0 4,-0.5 0, 0.0 16,-0.1 0.409 116.8 74.4 -62.8 8.3 -5.2 -5.0 2.1 60 60 A K H 3> S+ 0 0 116 2,-0.2 4,-0.6 3,-0.1 5,-0.1 0.789 98.6 42.3 -90.7 -28.3 -6.8 -3.4 5.2 61 61 A T H <> S+ 0 0 3 -3,-1.9 4,-2.3 2,-0.2 5,-0.2 0.807 112.2 54.2 -85.8 -27.7 -3.4 -2.5 6.8 62 62 A L H X S+ 0 0 2 -4,-1.1 4,-1.1 2,-0.2 -2,-0.2 0.842 113.1 44.0 -72.1 -27.6 -2.2 -1.3 3.4 63 63 A Q H X S+ 0 0 56 -4,-0.5 4,-1.1 -5,-0.2 -2,-0.2 0.711 116.3 47.1 -86.7 -20.2 -5.3 0.9 3.3 64 64 A E H X S+ 0 0 80 -4,-0.6 4,-1.3 2,-0.2 -2,-0.2 0.716 112.0 49.9 -91.3 -22.2 -4.6 1.8 6.9 65 65 A A H X S+ 0 0 2 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.799 116.1 41.9 -85.3 -27.7 -0.9 2.5 6.2 66 66 A I H X>S+ 0 0 0 -4,-1.1 4,-1.7 -5,-0.2 5,-1.4 0.850 117.8 46.8 -85.2 -32.7 -1.9 4.7 3.2 67 67 A D H <5S+ 0 0 124 -4,-1.1 -2,-0.2 2,-0.2 -3,-0.2 0.858 112.5 51.9 -74.4 -32.3 -4.7 6.3 5.2 68 68 A D H <5S+ 0 0 96 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.929 106.8 51.7 -70.5 -43.4 -2.3 6.7 8.2 69 69 A M H <5S- 0 0 47 -4,-1.6 -2,-0.2 2,-0.1 -1,-0.2 0.951 116.3-113.3 -59.9 -46.7 0.4 8.5 6.0 70 70 A G T <5 + 0 0 54 -4,-1.7 2,-0.4 1,-0.3 -3,-0.2 0.753 68.3 126.9 114.5 51.4 -2.2 11.0 4.7 71 71 A F < - 0 0 30 -5,-1.4 -1,-0.3 -54,-0.0 2,-0.1 -0.991 68.6-101.8-139.3 130.2 -2.7 10.4 0.9 72 72 A D E -B 15 0A 120 -57,-0.8 -57,-0.7 -2,-0.4 2,-0.5 -0.258 46.6-165.6 -49.9 111.3 -6.0 9.7 -1.0 73 73 A A E +B 14 0A 25 -59,-0.2 2,-0.3 -2,-0.1 -59,-0.2 -0.902 21.5 171.3-109.8 127.3 -5.9 5.9 -1.4 74 74 A V E -B 13 0A 94 -61,-2.8 -61,-1.1 -2,-0.5 -60,-0.1 -0.650 18.1-161.6-131.7 76.4 -8.2 4.1 -3.8 75 75 A I E -B 12 0A 24 -2,-0.3 -63,-0.2 -63,-0.3 4,-0.1 -0.287 9.5-174.6 -58.7 138.4 -7.1 0.5 -4.1 76 76 A H + 0 0 96 -65,-1.8 -1,-0.1 2,-0.1 -64,-0.1 -0.215 57.3 84.3-130.1 45.1 -8.4 -1.4 -7.2 77 77 A N S S+ 0 0 77 -66,-0.2 -67,-0.1 0, 0.0 -65,-0.1 0.800 99.0 21.8-109.9 -66.2 -7.3 -5.0 -6.6 78 78 A P 0 0 73 0, 0.0 -2,-0.1 0, 0.0 -68,-0.0 0.801 360.0 360.0 -75.0 -28.5 -9.7 -7.0 -4.4 79 79 A D 0 0 170 -4,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.956 360.0 360.0-116.8 360.0 -12.6 -4.6 -5.2