==== 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 OXIDOREDUCTASE 01-MAR-04 1SIQ . COMPND 2 MOLECULE: GLUTARYL-COA DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.WANG,Z.FU,R.PASCHKE,S.GOODMAN,F.E.FRERMAN,J.J.KIM . 390 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17015.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 304 77.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 . 23 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 165 42.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 3.3 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 1 0 1 1 3 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 1 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 3 0 0 1 0 1 0 0 1 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 0 0 0 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 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 3 A E 0 0 252 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.7 -15.5 28.3 -1.9 2 4 A F - 0 0 145 6,-0.0 2,-0.5 2,-0.0 6,-0.1 -0.606 360.0-171.3 -80.5 130.7 -16.3 31.4 -3.9 3 5 A D > - 0 0 80 -2,-0.4 3,-2.2 3,-0.2 6,-0.2 -0.964 12.6-157.7-122.0 108.6 -13.4 33.5 -5.0 4 6 A W T 3 S+ 0 0 62 -2,-0.5 -1,-0.1 1,-0.3 4,-0.1 0.676 90.9 66.0 -61.9 -16.7 -14.6 36.8 -6.5 5 7 A Q T 3 S+ 0 0 114 1,-0.3 -1,-0.3 2,-0.1 259,-0.0 0.577 123.1 13.4 -81.0 -9.1 -11.2 37.1 -8.3 6 8 A D S X S+ 0 0 30 -3,-2.2 3,-1.8 3,-0.1 -1,-0.3 -0.318 73.5 176.6-164.9 67.8 -12.0 34.1 -10.4 7 9 A P T 3 S+ 0 0 25 0, 0.0 -4,-0.2 0, 0.0 -2,-0.1 0.824 83.6 33.6 -43.1 -53.5 -15.8 33.2 -10.0 8 10 A L T 3 S- 0 0 106 -4,-0.1 -4,-0.1 -6,-0.1 -6,-0.0 0.138 113.2-110.7 -98.6 20.4 -15.9 30.3 -12.5 9 11 A V X + 0 0 58 -3,-1.8 3,-0.7 -6,-0.2 4,-0.1 0.947 45.1 173.7 53.5 62.6 -12.4 29.0 -11.7 10 12 A L G > S+ 0 0 4 1,-0.2 3,-2.6 2,-0.2 4,-0.5 0.861 70.5 74.9 -63.3 -34.3 -10.6 29.8 -15.0 11 13 A E G > S+ 0 0 69 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.826 89.2 54.2 -47.0 -44.3 -7.4 28.7 -13.3 12 14 A E G < S+ 0 0 157 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.2 0.417 102.4 60.6 -76.0 4.0 -8.2 25.0 -13.5 13 15 A Q G < S+ 0 0 106 -3,-2.6 -1,-0.3 -4,-0.1 2,-0.2 0.501 91.5 84.4-104.3 -9.8 -8.7 25.4 -17.3 14 16 A L S < S- 0 0 16 -3,-1.3 2,-0.1 -4,-0.5 291,-0.0 -0.653 77.5-121.3 -96.7 152.1 -5.1 26.6 -17.9 15 17 A T > - 0 0 59 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.441 30.4-108.0 -83.9 162.3 -2.0 24.4 -18.4 16 18 A T H > S+ 0 0 116 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.867 121.3 51.8 -59.3 -35.5 1.0 24.6 -16.1 17 19 A D H > S+ 0 0 106 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.922 109.4 48.3 -66.4 -45.3 2.9 26.3 -18.9 18 20 A E H > S+ 0 0 6 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.920 113.3 47.4 -61.5 -44.9 0.2 28.9 -19.5 19 21 A I H X S+ 0 0 38 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.914 112.8 49.7 -62.8 -42.5 -0.0 29.7 -15.8 20 22 A L H X S+ 0 0 111 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.922 111.4 48.7 -62.4 -45.2 3.7 29.9 -15.6 21 23 A I H X S+ 0 0 43 -4,-2.9 4,-2.5 2,-0.2 5,-0.3 0.947 111.6 49.8 -59.8 -50.5 3.9 32.3 -18.6 22 24 A R H X S+ 0 0 17 -4,-2.7 4,-3.0 1,-0.2 -2,-0.2 0.951 113.3 44.1 -54.3 -56.4 1.2 34.5 -17.2 23 25 A D H X S+ 0 0 61 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.899 112.3 52.2 -58.9 -44.1 2.7 34.9 -13.7 24 26 A T H X S+ 0 0 90 -4,-2.4 4,-1.4 -5,-0.2 -1,-0.2 0.945 114.9 41.9 -58.4 -47.8 6.2 35.4 -15.0 25 27 A F H X S+ 0 0 4 -4,-2.5 4,-3.0 -5,-0.2 -2,-0.2 0.903 109.1 59.1 -66.9 -40.9 5.0 38.2 -17.3 26 28 A R H X S+ 0 0 72 -4,-3.0 4,-2.8 -5,-0.3 5,-0.3 0.916 104.0 52.5 -52.6 -46.7 2.7 39.7 -14.6 27 29 A T H X S+ 0 0 71 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.899 110.5 47.2 -56.8 -45.0 5.8 40.2 -12.5 28 30 A Y H X>S+ 0 0 23 -4,-1.4 4,-3.2 2,-0.2 5,-0.9 0.938 112.2 50.0 -63.2 -47.3 7.5 42.0 -15.2 29 31 A C H X>S+ 0 0 0 -4,-3.0 5,-2.4 1,-0.2 4,-0.9 0.899 115.2 42.2 -58.7 -44.3 4.5 44.2 -15.9 30 32 A Q H <5S+ 0 0 83 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.862 121.8 40.0 -73.5 -35.3 4.0 45.2 -12.3 31 33 A E H <5S+ 0 0 135 -4,-2.3 -2,-0.2 -5,-0.3 -3,-0.2 0.868 131.3 19.9 -82.6 -38.2 7.7 45.7 -11.6 32 34 A R H <5S+ 0 0 100 -4,-3.2 4,-0.2 -5,-0.2 -3,-0.2 0.775 128.8 36.2-104.7 -32.3 8.8 47.5 -14.8 33 35 A L T >X S+ 0 0 46 -3,-1.5 4,-1.8 -4,-0.2 -2,-0.2 0.696 95.5 80.0 -99.6 -17.2 6.5 54.3 -15.7 37 39 A I H X S+ 0 0 0 -4,-1.6 4,-2.7 -3,-0.3 5,-0.4 0.810 79.9 64.1 -60.5 -38.2 2.9 54.6 -16.8 38 40 A L H X S+ 0 0 44 -4,-0.6 4,-1.6 1,-0.2 -1,-0.2 0.959 116.6 26.8 -52.7 -59.7 1.8 57.6 -14.8 39 41 A L H > S+ 0 0 99 -4,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.808 117.3 62.0 -74.9 -30.3 4.1 60.1 -16.3 40 42 A A H X>S+ 0 0 1 -4,-1.8 5,-2.6 1,-0.2 4,-0.5 0.955 111.6 38.2 -58.7 -50.6 4.3 58.2 -19.6 41 43 A N H <5S+ 0 0 8 -4,-2.7 3,-0.4 3,-0.2 -1,-0.2 0.855 116.4 53.0 -68.5 -36.8 0.6 58.7 -20.2 42 44 A R H <5S+ 0 0 98 -4,-1.6 -2,-0.2 -5,-0.4 -1,-0.2 0.884 121.7 28.7 -69.0 -38.5 0.6 62.2 -18.8 43 45 A N H <5S- 0 0 103 -4,-2.9 -1,-0.2 2,-0.1 -2,-0.2 0.239 108.8-114.1-108.0 14.1 3.4 63.5 -21.0 44 46 A E T <5 + 0 0 48 -4,-0.5 2,-0.5 -3,-0.4 -3,-0.2 0.956 58.9 157.3 53.3 59.1 2.8 61.2 -24.0 45 47 A V < - 0 0 58 -5,-2.6 2,-0.6 -6,-0.2 -1,-0.2 -0.958 26.7-166.5-119.3 121.5 6.1 59.3 -23.7 46 48 A F - 0 0 24 -2,-0.5 2,-0.9 167,-0.1 167,-0.1 -0.929 18.3-139.4-106.2 122.5 6.6 55.9 -25.2 47 49 A H > - 0 0 53 -2,-0.6 3,-2.2 165,-0.2 4,-0.4 -0.722 6.0-159.3 -86.1 106.0 9.7 54.1 -24.0 48 50 A R T >> S+ 0 0 62 -2,-0.9 3,-1.4 1,-0.3 4,-0.8 0.805 88.6 70.8 -49.5 -34.1 11.3 52.3 -26.9 49 51 A E H 3> S+ 0 0 90 1,-0.3 4,-3.1 2,-0.2 3,-0.5 0.808 81.1 73.8 -54.8 -34.3 13.1 50.1 -24.4 50 52 A I H <> S+ 0 0 0 -3,-2.2 4,-2.3 1,-0.3 -1,-0.3 0.854 96.0 49.0 -49.6 -40.6 9.8 48.5 -23.5 51 53 A I H <> S+ 0 0 0 -3,-1.4 4,-1.2 -4,-0.4 -1,-0.3 0.852 111.2 49.4 -70.3 -34.7 9.9 46.6 -26.9 52 54 A S H X S+ 0 0 42 -4,-0.8 4,-2.3 -3,-0.5 -2,-0.2 0.933 111.1 50.2 -68.5 -45.7 13.5 45.5 -26.2 53 55 A E H X S+ 0 0 24 -4,-3.1 4,-1.8 1,-0.2 -2,-0.2 0.933 111.5 46.2 -58.3 -49.4 12.6 44.3 -22.7 54 56 A M H <>S+ 0 0 0 -4,-2.3 5,-2.2 1,-0.2 6,-0.6 0.800 109.8 58.3 -64.8 -25.7 9.6 42.3 -24.0 55 57 A G H ><5S+ 0 0 5 -4,-1.2 3,-1.1 69,-0.2 -2,-0.2 0.923 104.2 48.5 -68.6 -44.4 11.9 41.0 -26.7 56 58 A E H 3<5S+ 0 0 157 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.867 109.1 54.3 -62.6 -37.2 14.4 39.6 -24.1 57 59 A L T 3<5S- 0 0 74 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.618 111.0-126.8 -71.7 -12.6 11.5 37.9 -22.3 58 60 A G T < 5S+ 0 0 29 -3,-1.1 12,-0.5 -4,-0.4 -3,-0.2 0.776 71.0 129.2 71.6 27.6 10.5 36.3 -25.6 59 61 A V < + 0 0 11 -5,-2.2 2,-0.3 64,-0.1 -4,-0.2 0.640 39.5 101.6 -86.9 -17.2 7.0 37.6 -25.5 60 62 A L S S- 0 0 1 -6,-0.6 10,-0.3 63,-0.5 36,-0.1 -0.545 100.8 -6.7 -74.4 127.2 7.0 39.1 -29.0 61 63 A G S > S+ 0 0 2 -2,-0.3 3,-1.1 34,-0.3 10,-0.4 0.947 81.9 174.3 53.4 52.8 5.2 36.9 -31.6 62 64 A P T 3 + 0 0 2 0, 0.0 10,-3.1 0, 0.0 9,-0.9 0.743 68.5 55.0 -62.7 -29.3 4.7 34.1 -29.0 63 65 A T T 3 S+ 0 0 41 8,-0.3 2,-0.2 7,-0.1 11,-0.1 0.611 83.8 106.0 -83.1 -10.2 2.6 31.8 -31.1 64 66 A I < - 0 0 4 -3,-1.1 7,-0.7 1,-0.1 2,-0.6 -0.479 67.7-135.8 -72.8 137.7 5.2 31.7 -33.9 65 67 A K E -A 70 0A 143 -2,-0.2 2,-0.1 6,-0.1 5,-0.1 -0.845 65.3 -12.9 -97.7 119.5 7.1 28.5 -34.2 66 68 A G E > S+A 69 0A 42 3,-0.6 3,-1.9 -2,-0.6 5,-0.1 -0.384 85.6 95.6 90.2-170.7 10.8 28.9 -34.8 67 69 A Y T 3 S- 0 0 55 1,-0.3 56,-0.2 -2,-0.1 3,-0.1 0.712 123.6 -56.6 56.7 23.4 12.8 32.0 -35.7 68 70 A G T 3 S+ 0 0 71 1,-0.3 -1,-0.3 55,-0.1 2,-0.3 0.610 104.9 134.9 86.0 12.6 13.5 32.6 -32.1 69 71 A C E < -A 66 0A 20 -3,-1.9 -3,-0.6 1,-0.1 -1,-0.3 -0.659 63.5-121.7 -97.2 152.5 9.9 32.7 -31.0 70 72 A A E -A 65 0A 59 -12,-0.5 -7,-0.1 -10,-0.3 -5,-0.1 0.832 28.0-147.2 -59.1 -39.3 8.3 31.0 -28.0 71 73 A G + 0 0 34 -9,-0.9 -8,-0.3 -7,-0.7 -6,-0.1 0.922 39.5 158.8 68.6 42.6 5.8 28.9 -30.0 72 74 A V - 0 0 36 -10,-3.1 -1,-0.1 1,-0.2 -3,-0.0 -0.340 42.5 -81.7 -92.0 176.9 3.3 29.0 -27.2 73 75 A S > - 0 0 29 -2,-0.1 4,-1.7 1,-0.1 -1,-0.2 -0.209 33.6-113.0 -75.1 166.6 -0.5 28.5 -27.3 74 76 A S H > S+ 0 0 5 234,-0.3 4,-2.4 1,-0.2 5,-0.1 0.860 119.4 56.2 -67.0 -36.2 -3.1 31.1 -28.3 75 77 A V H > S+ 0 0 0 233,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.896 104.6 52.5 -62.8 -39.4 -4.4 31.0 -24.8 76 78 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.913 108.3 51.0 -62.2 -41.1 -0.9 31.9 -23.6 77 79 A Y H X S+ 0 0 5 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.920 110.8 48.5 -61.2 -44.4 -1.0 34.8 -26.0 78 80 A G H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.913 109.7 51.7 -61.9 -43.7 -4.3 35.9 -24.6 79 81 A L H X S+ 0 0 0 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.870 109.5 50.9 -60.5 -38.6 -3.0 35.7 -21.1 80 82 A L H X S+ 0 0 4 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.919 109.4 49.7 -65.8 -44.3 -0.1 37.9 -22.0 81 83 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.896 108.3 54.3 -60.9 -41.8 -2.3 40.5 -23.6 82 84 A R H X S+ 0 0 18 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.889 109.3 46.6 -61.4 -41.8 -4.5 40.6 -20.5 83 85 A E H < S+ 0 0 0 -4,-1.7 4,-0.4 2,-0.2 -1,-0.2 0.849 113.0 49.8 -70.8 -33.3 -1.5 41.2 -18.2 84 86 A L H >X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 3,-1.1 0.930 113.2 44.3 -71.1 -45.6 -0.2 44.0 -20.4 85 87 A E H 3< S+ 0 0 0 -4,-2.6 4,-0.2 1,-0.3 -1,-0.2 0.752 97.3 73.1 -71.2 -23.6 -3.5 45.8 -20.7 86 88 A R T 3< S+ 0 0 19 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.805 110.5 35.3 -58.4 -25.1 -4.0 45.4 -17.0 87 89 A V T <4 S- 0 0 0 -3,-1.1 2,-0.3 -4,-0.4 -2,-0.2 0.908 138.7 -28.4 -89.9 -60.0 -1.3 48.1 -17.0 88 90 A D X - 0 0 0 -4,-2.2 4,-1.9 1,-0.1 -1,-0.2 -0.917 37.7-138.7-166.1 135.1 -2.2 50.1 -20.1 89 91 A S H > S+ 0 0 0 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.828 105.2 60.3 -61.4 -35.6 -3.9 49.7 -23.5 90 92 A G H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.927 106.5 46.6 -58.9 -45.0 -1.2 51.8 -25.2 91 93 A Y H > S+ 0 0 0 1,-0.2 4,-1.5 -3,-0.2 -2,-0.2 0.914 112.8 48.4 -63.7 -44.3 1.4 49.3 -24.1 92 94 A R H X S+ 0 0 1 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.852 107.4 58.0 -65.9 -32.4 -0.6 46.3 -25.2 93 95 A S H X S+ 0 0 2 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.917 103.2 51.8 -61.4 -45.1 -1.3 48.1 -28.6 94 96 A A H X S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.890 113.8 44.9 -59.4 -39.1 2.5 48.3 -29.2 95 97 A M H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 5,-0.3 0.843 109.5 54.0 -74.3 -36.5 2.8 44.6 -28.6 96 98 A S H X>S+ 0 0 5 -4,-2.6 4,-2.6 2,-0.2 5,-1.1 0.931 110.6 48.0 -62.0 -46.2 -0.3 43.6 -30.6 97 99 A V H X>S+ 0 0 10 -4,-2.4 5,-1.2 3,-0.2 4,-1.2 0.970 113.4 45.6 -58.1 -57.9 1.1 45.5 -33.6 98 100 A Q H <>S+ 0 0 0 -4,-1.9 5,-2.3 -5,-0.2 4,-0.2 0.908 123.9 34.5 -52.8 -48.3 4.6 43.9 -33.3 99 101 A S H <>S+ 0 0 5 -4,-2.5 5,-1.4 3,-0.2 -2,-0.2 0.962 132.2 19.3 -75.1 -57.9 3.2 40.4 -32.8 100 102 A S H <5S+ 0 0 5 -4,-2.6 -3,-0.2 -5,-0.3 147,-0.2 0.761 130.0 38.4 -90.5 -27.3 0.0 40.1 -34.9 101 103 A L T <>S+ 0 0 0 0, 0.0 4,-3.2 0, 0.0 5,-0.7 0.904 113.0 50.4 -61.1 -41.4 2.1 38.5 -41.8 106 108 A I H X5S+ 0 0 0 -4,-1.4 4,-0.6 1,-0.2 -2,-0.2 0.857 114.7 47.0 -63.0 -33.0 5.8 38.2 -42.5 107 109 A Y H <5S+ 0 0 75 -4,-1.8 -1,-0.2 -5,-0.2 -3,-0.2 0.889 122.7 31.1 -75.5 -41.6 5.5 34.7 -41.1 108 110 A A H <5S+ 0 0 50 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.1 0.815 134.9 22.9 -89.3 -33.5 2.4 33.6 -43.1 109 111 A Y H <5S+ 0 0 44 -4,-3.2 124,-2.3 -5,-0.3 125,-0.3 0.451 101.7 98.2-114.1 -4.1 2.6 35.6 -46.3 110 112 A G S < - 0 0 38 117,-0.2 4,-2.2 119,-0.2 5,-0.1 -0.491 35.9-107.9 -85.6 163.6 9.1 34.5 -48.4 112 114 A E H > S+ 0 0 82 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.852 121.5 57.2 -61.6 -33.4 11.6 32.3 -46.4 113 115 A E H > S+ 0 0 113 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.934 107.0 47.2 -61.7 -46.8 14.2 35.0 -47.1 114 116 A Q H >>S+ 0 0 3 2,-0.2 4,-2.9 1,-0.2 5,-0.5 0.893 112.8 49.2 -63.3 -41.4 12.0 37.7 -45.4 115 117 A R H X5S+ 0 0 44 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.986 112.3 46.8 -61.1 -57.2 11.3 35.4 -42.5 116 118 A Q H <5S+ 0 0 116 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.878 118.8 43.8 -49.9 -42.4 14.9 34.6 -41.9 117 119 A K H <5S+ 0 0 90 -4,-2.4 4,-0.3 -5,-0.2 -1,-0.2 0.863 127.0 21.0 -75.7 -39.6 15.8 38.2 -42.3 118 120 A Y H X5S+ 0 0 3 -4,-2.9 4,-2.5 -5,-0.2 3,-0.4 0.866 107.3 66.4-101.8 -42.5 13.1 39.9 -40.2 119 121 A L H X S+ 0 0 40 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.894 114.5 43.6 -54.5 -40.4 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