==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 15-JAN-11 3QC8 . COMPND 2 MOLECULE: TRANSITIONAL ENDOPLASMIC RETICULUM ATPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.H.KIM,W.KANG,S.W.SUH,J.K.YANG . 250 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12851.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 65.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 22.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 16 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.8 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 2 1 1 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 . 2 0 2 0 2 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 2 0 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 1 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 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 23 A P 0 0 90 0, 0.0 2,-0.3 0, 0.0 80,-0.2 0.000 360.0 360.0 360.0 154.6 0.3 -6.7 26.8 2 24 A N E -A 80 0A 53 78,-1.9 78,-2.3 25,-0.0 2,-0.4 -0.849 360.0-126.5-107.8 147.2 -1.7 -9.1 24.7 3 25 A R E +A 79 0A 155 -2,-0.3 2,-0.3 76,-0.2 76,-0.2 -0.773 30.2 178.6 -98.9 126.4 -0.4 -10.7 21.4 4 26 A L E -A 78 0A 2 74,-2.6 74,-2.3 -2,-0.4 2,-0.3 -0.944 30.6-113.8-130.8 150.3 -2.5 -10.4 18.2 5 27 A I E -Ab 77 59A 56 53,-1.4 55,-3.2 -2,-0.3 2,-0.3 -0.603 37.3-119.0 -76.6 136.1 -2.3 -11.5 14.6 6 28 A V E + b 0 60A 1 70,-2.5 69,-2.3 -2,-0.3 2,-0.3 -0.613 37.9 175.1 -82.6 133.6 -2.0 -8.6 12.1 7 29 A D E - b 0 61A 44 53,-2.9 55,-2.0 -2,-0.3 52,-0.0 -0.856 37.1 -76.1-132.8 167.7 -4.8 -8.3 9.5 8 30 A E - 0 0 68 -2,-0.3 55,-0.2 53,-0.2 2,-0.2 -0.236 54.4 -98.9 -70.0 156.5 -5.7 -5.8 6.8 9 31 A A - 0 0 14 53,-0.4 3,-0.2 52,-0.2 -1,-0.1 -0.455 26.1-175.0 -78.0 146.3 -7.3 -2.5 7.7 10 32 A I S S+ 0 0 99 1,-0.3 2,-0.8 -2,-0.2 -1,-0.2 0.799 88.8 49.8 -94.0 -55.3 -11.0 -1.7 7.4 11 33 A N S S- 0 0 60 1,-0.1 -1,-0.3 50,-0.1 52,-0.2 -0.808 80.7-153.6 -82.1 111.5 -10.4 1.9 8.3 12 34 A E + 0 0 127 -2,-0.8 2,-0.3 -3,-0.2 -1,-0.1 0.192 51.9 124.3 -70.8 20.0 -7.7 3.0 6.0 13 35 A D > - 0 0 30 1,-0.1 3,-1.1 50,-0.0 50,-0.4 -0.611 63.4-134.5 -87.2 143.6 -6.5 5.8 8.5 14 36 A N T 3 S+ 0 0 23 -2,-0.3 -1,-0.1 1,-0.2 49,-0.0 0.764 103.9 49.6 -61.7 -27.5 -2.8 5.9 9.6 15 37 A S T 3 S+ 0 0 6 32,-0.1 33,-3.5 47,-0.0 2,-0.4 0.456 96.2 90.7 -92.2 -3.7 -3.8 6.4 13.3 16 38 A V E < +c 48 0A 1 -3,-1.1 47,-0.5 31,-0.2 2,-0.4 -0.813 40.5 173.4-105.3 137.7 -6.3 3.7 13.6 17 39 A V E -cD 49 62A 0 31,-2.0 33,-1.9 -2,-0.4 2,-0.4 -0.970 24.1-148.2-123.6 140.5 -6.1 -0.0 14.6 18 40 A S E -cD 50 61A 5 43,-2.3 43,-2.2 -2,-0.4 2,-0.3 -0.911 16.3-179.9-115.0 148.2 -9.4 -1.9 14.9 19 41 A L E -c 51 0A 1 31,-2.3 33,-1.2 -2,-0.4 2,-0.1 -0.940 39.7 -96.4-132.0 153.7 -10.5 -4.8 17.2 20 42 A S E >> -c 52 0A 2 39,-0.4 4,-2.3 -2,-0.3 3,-0.7 -0.475 39.4-117.4 -64.7 141.9 -13.8 -6.7 17.6 21 43 A Q H 3> S+ 0 0 42 31,-0.9 4,-3.4 1,-0.3 5,-0.3 0.899 115.5 58.0 -56.2 -38.9 -15.9 -5.1 20.4 22 44 A P H 3> S+ 0 0 72 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.901 108.6 46.1 -52.4 -43.6 -15.7 -8.5 22.3 23 45 A K H <> S+ 0 0 2 -3,-0.7 4,-2.6 2,-0.2 -2,-0.2 0.890 112.3 50.4 -65.9 -44.5 -11.9 -8.2 22.2 24 46 A M H X>S+ 0 0 0 -4,-2.3 5,-2.9 2,-0.2 4,-1.1 0.919 110.8 48.4 -57.0 -48.2 -12.0 -4.6 23.3 25 47 A D H ><5S+ 0 0 98 -4,-3.4 3,-0.6 3,-0.2 -2,-0.2 0.953 113.5 50.6 -56.1 -47.9 -14.3 -5.4 26.3 26 48 A E H 3<5S+ 0 0 109 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.852 115.3 38.6 -58.2 -45.6 -11.9 -8.2 27.1 27 49 A L H 3<5S- 0 0 38 -4,-2.6 -1,-0.3 2,-0.1 -2,-0.2 0.497 112.2-119.6 -85.2 -5.1 -8.7 -6.0 27.0 28 50 A Q T <<5 + 0 0 174 -4,-1.1 2,-0.5 -3,-0.6 -3,-0.2 0.953 56.8 158.6 66.2 52.1 -10.6 -3.2 28.7 29 51 A L < - 0 0 5 -5,-2.9 2,-0.4 -8,-0.2 -1,-0.2 -0.916 30.9-147.2-108.4 134.1 -10.1 -0.8 25.8 30 52 A F > - 0 0 14 -2,-0.5 3,-2.7 4,-0.1 19,-0.2 -0.839 33.9 -94.7-103.4 133.8 -12.4 2.1 25.3 31 53 A R T 3 S+ 0 0 53 -2,-0.4 19,-0.2 1,-0.3 3,-0.1 -0.184 116.1 22.5 -46.1 128.4 -13.2 3.4 21.8 32 54 A G T 3 S+ 0 0 11 17,-2.3 -1,-0.3 1,-0.3 2,-0.1 0.416 90.2 145.4 86.9 1.5 -10.8 6.3 21.0 33 55 A D < - 0 0 29 -3,-2.7 16,-2.4 16,-0.4 2,-0.4 -0.488 52.1-123.4 -63.7 143.4 -8.2 5.0 23.6 34 56 A T E -E 48 0A 13 14,-0.2 49,-2.1 49,-0.2 2,-0.3 -0.720 33.6-167.0 -85.8 137.3 -4.6 5.5 22.6 35 57 A V E -EF 47 82A 0 12,-2.8 12,-1.9 -2,-0.4 2,-0.5 -0.940 19.6-132.0-129.3 151.3 -2.7 2.2 22.6 36 58 A L E -EF 46 81A 15 45,-2.7 45,-1.6 -2,-0.3 2,-0.4 -0.900 26.2-165.5-103.9 128.8 0.9 1.4 22.4 37 59 A L E -EF 45 80A 0 8,-3.3 8,-2.1 -2,-0.5 2,-0.4 -0.916 5.2-162.5-116.3 143.5 1.7 -1.3 19.9 38 60 A K E +EF 44 79A 79 41,-2.1 41,-2.1 -2,-0.4 6,-0.2 -0.988 17.4 158.8-128.5 135.3 4.9 -3.3 19.6 39 61 A G - 0 0 25 4,-2.2 3,-0.3 -2,-0.4 32,-0.2 0.158 47.9 -28.9-120.8-122.1 6.1 -5.2 16.6 40 62 A K S > S+ 0 0 98 30,-2.2 3,-3.0 1,-0.2 -1,-0.3 -0.483 112.3 21.1-100.6 166.2 9.5 -6.4 15.4 41 63 A K T 3 S- 0 0 182 1,-0.3 -1,-0.2 -2,-0.2 3,-0.1 0.775 128.4 -63.9 48.5 38.4 13.0 -5.0 16.0 42 64 A R T 3 S+ 0 0 221 -3,-0.3 -1,-0.3 1,-0.2 2,-0.2 0.651 92.3 158.2 65.0 17.2 11.9 -3.1 19.0 43 65 A R < - 0 0 53 -3,-3.0 -4,-2.2 27,-0.2 2,-0.3 -0.472 19.8-167.1 -79.3 142.0 9.6 -1.0 16.8 44 66 A E E - E 0 38A 33 -6,-0.2 2,-0.3 25,-0.2 -6,-0.2 -0.920 10.0-172.7-129.7 157.8 6.8 0.8 18.5 45 67 A A E - E 0 37A 3 -8,-2.1 -8,-3.3 -2,-0.3 2,-0.5 -0.989 14.8-147.2-147.6 147.1 3.6 2.7 17.4 46 68 A V E + E 0 36A 5 -2,-0.3 2,-0.2 -10,-0.2 -10,-0.2 -0.988 33.7 157.4-119.3 122.6 0.9 4.8 19.1 47 69 A C E - E 0 35A 3 -12,-1.9 -12,-2.8 -2,-0.5 2,-0.5 -0.796 43.0-107.6-134.0 176.0 -2.6 4.5 17.6 48 70 A I E -cE 16 34A 6 -33,-3.5 -31,-2.0 -2,-0.2 2,-0.3 -0.941 33.4-138.4-104.2 125.8 -6.3 4.9 18.4 49 71 A V E -c 17 0A 0 -16,-2.4 -17,-2.3 -2,-0.5 -16,-0.4 -0.708 23.5-177.8 -84.7 142.5 -8.3 1.7 18.8 50 72 A L E -c 18 0A 8 -33,-1.9 -31,-2.3 -2,-0.3 2,-0.1 -0.920 30.6 -97.2-133.8 159.5 -11.8 1.5 17.3 51 73 A S E -c 19 0A 40 -2,-0.3 2,-0.3 -33,-0.2 -31,-0.2 -0.405 37.5-160.4 -74.9 151.7 -14.5 -1.2 17.3 52 74 A D E -c 20 0A 18 -33,-1.2 -31,-0.9 2,-0.1 -1,-0.0 -0.923 23.0-136.0-136.8 152.7 -14.8 -3.4 14.3 53 75 A D + 0 0 168 -2,-0.3 -33,-0.1 -33,-0.1 -1,-0.1 0.641 68.6 110.7 -88.2 -17.6 -17.6 -5.6 12.9 54 76 A T - 0 0 56 1,-0.1 -2,-0.1 2,-0.1 -35,-0.0 0.048 64.3-135.5 -48.7 165.7 -15.5 -8.7 12.1 55 77 A C S S+ 0 0 117 -35,-0.1 2,-0.1 -33,-0.0 -1,-0.1 0.906 75.1 88.5 -93.4 -53.1 -15.8 -12.0 14.2 56 78 A S - 0 0 66 1,-0.2 3,-0.4 2,-0.1 -36,-0.3 -0.352 49.1-173.7 -55.8 120.2 -12.3 -13.2 15.0 57 79 A D S S+ 0 0 48 1,-0.2 -1,-0.2 -2,-0.1 -3,-0.0 0.384 74.9 77.0 -88.9 -4.6 -11.2 -11.5 18.2 58 80 A E S S+ 0 0 93 -54,-0.1 -53,-1.4 -39,-0.0 2,-0.3 0.072 87.6 65.9 -96.5 23.1 -7.7 -12.9 17.8 59 81 A K E -b 5 0A 78 -3,-0.4 2,-0.4 -55,-0.2 -39,-0.4 -0.982 63.8-146.6-146.1 145.5 -6.6 -10.4 15.1 60 82 A I E -b 6 0A 0 -55,-3.2 -53,-2.9 -2,-0.3 2,-0.5 -0.951 16.6-141.6-117.7 134.9 -5.9 -6.7 14.9 61 83 A R E +bD 7 18A 36 -43,-2.2 -43,-2.3 -2,-0.4 2,-0.3 -0.886 33.0 150.0-100.7 131.9 -6.6 -4.7 11.8 62 84 A M E - D 0 17A 0 -55,-2.0 -53,-0.4 -2,-0.5 -45,-0.1 -0.981 38.7-108.1-157.7 152.7 -4.2 -1.9 10.7 63 85 A N >> - 0 0 5 -47,-0.5 4,-2.4 -50,-0.4 3,-0.6 -0.225 39.6 -94.2 -86.5 170.7 -3.0 -0.3 7.4 64 86 A R H 3> S+ 0 0 116 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.797 121.5 59.0 -50.4 -40.4 0.3 -0.6 5.6 65 87 A V H 3> S+ 0 0 11 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.912 110.4 40.6 -59.7 -46.1 1.6 2.6 7.2 66 88 A V H <> S+ 0 0 3 -3,-0.6 4,-1.4 2,-0.2 -2,-0.2 0.913 113.7 55.2 -70.1 -39.5 1.2 1.2 10.8 67 89 A R H <>S+ 0 0 21 -4,-2.4 5,-2.9 1,-0.2 -2,-0.2 0.888 109.5 46.5 -60.2 -40.5 2.5 -2.2 9.6 68 90 A N H ><5S+ 0 0 84 -4,-2.6 3,-1.4 3,-0.2 -1,-0.2 0.897 108.3 53.5 -69.9 -41.8 5.7 -0.6 8.3 69 91 A N H 3<5S+ 0 0 10 -4,-1.9 -1,-0.2 1,-0.3 -25,-0.2 0.811 115.7 42.6 -62.1 -24.2 6.3 1.5 11.4 70 92 A L T 3<5S- 0 0 0 -4,-1.4 -30,-2.2 2,-0.2 -1,-0.3 0.383 108.7-128.3 -95.8 -6.2 6.1 -1.7 13.3 71 93 A R T < 5 + 0 0 103 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.879 66.0 127.9 58.2 39.3 8.2 -3.7 10.7 72 94 A V < - 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