==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 18-MAY-11 3S3D . COMPND 2 MOLECULE: CYTOCHROME C OXIDASE SUBUNIT 1; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR V.M.LUNA,J.A.FEE,A.A.DENIZ,C.D.STOUT . 754 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26516.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 601 79.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 33 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 94 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 386 51.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.7 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 3 1 2 2 1 0 0 1 2 1 0 1 0 0 1 1 1 0 2 0 1 1 1 0 0 4 RESIDUES PER ALPHA HELIX . 2 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 8 A I 0 0 236 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -7.8 -60.5 40.5 -30.4 2 9 A S > - 0 0 11 1,-0.1 4,-0.7 2,-0.0 0, 0.0 -0.983 360.0-171.2-111.8 114.0 -59.5 42.5 -27.2 3 10 A R H >>>S+ 0 0 210 -2,-0.4 4,-2.0 2,-0.3 3,-0.8 0.894 97.9 64.1 -58.8 -44.4 -59.2 46.5 -27.3 4 11 A V H 3>5S+ 0 0 6 1,-0.3 4,-1.0 2,-0.2 7,-0.3 0.824 100.6 48.2 -48.0 -36.5 -57.7 45.8 -23.8 5 12 A Y H 345S+ 0 0 44 1,-0.1 -1,-0.3 2,-0.1 -2,-0.3 0.848 110.4 55.6 -69.3 -27.9 -55.0 44.0 -25.9 6 13 A E H <<5S+ 0 0 140 -3,-0.8 -2,-0.2 -4,-0.7 -3,-0.1 0.769 119.3 25.2 -83.4 -33.0 -54.9 47.2 -28.1 7 14 A A H <5S+ 0 0 54 -4,-2.0 -3,-0.2 1,-0.2 -1,-0.2 0.675 139.5 34.2 -92.1 -28.1 -54.2 50.0 -25.6 8 15 A Y >X< + 0 0 62 -4,-1.0 4,-0.6 -5,-0.5 3,-0.6 -0.691 66.7 144.7-120.5 72.6 -52.6 47.4 -23.3 9 16 A P H 3> S+ 0 0 27 0, 0.0 4,-2.1 0, 0.0 3,-0.3 0.724 72.4 71.3 -71.2 -23.4 -51.0 44.9 -25.8 10 17 A E H 3> S+ 0 0 3 1,-0.2 4,-1.5 2,-0.2 -5,-0.1 0.653 88.7 62.3 -63.9 -19.6 -48.3 44.7 -23.1 11 18 A K H <> S+ 0 0 2 -3,-0.6 4,-2.3 -7,-0.3 -1,-0.2 0.921 104.8 43.6 -69.0 -46.6 -51.0 42.8 -21.1 12 19 A K H X S+ 0 0 75 -4,-0.6 4,-2.3 -3,-0.3 5,-0.2 0.962 112.3 51.8 -64.1 -52.4 -51.1 40.0 -23.7 13 20 A A H X S+ 0 0 0 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.895 111.5 49.6 -48.5 -45.5 -47.3 39.8 -24.0 14 21 A T H X S+ 0 0 0 -4,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.890 107.1 54.0 -63.5 -43.0 -47.2 39.6 -20.2 15 22 A L H X S+ 0 0 18 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.908 105.6 53.2 -58.3 -42.9 -49.8 36.8 -20.1 16 23 A Y H X S+ 0 0 97 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.845 108.1 50.5 -63.4 -35.3 -47.7 34.7 -22.6 17 24 A F H X S+ 0 0 2 -4,-1.5 4,-2.7 -5,-0.2 -1,-0.2 0.964 114.1 44.6 -63.5 -50.5 -44.7 35.0 -20.4 18 25 A L H X S+ 0 0 4 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.874 113.2 49.8 -62.8 -40.8 -46.6 33.9 -17.4 19 26 A V H X S+ 0 0 49 -4,-3.0 4,-2.2 2,-0.2 5,-0.2 0.985 113.6 44.4 -63.9 -54.4 -48.4 31.1 -19.1 20 27 A L H X S+ 0 0 19 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.896 114.8 54.0 -54.3 -41.2 -45.2 29.7 -20.5 21 28 A G H X S+ 0 0 2 -4,-2.7 4,-1.7 -5,-0.2 -2,-0.2 0.926 109.8 42.3 -57.7 -53.8 -43.7 30.2 -17.1 22 29 A F H X S+ 0 0 6 -4,-3.0 4,-1.5 2,-0.2 -1,-0.2 0.762 110.2 58.0 -71.9 -24.8 -46.3 28.3 -15.1 23 30 A L H X S+ 0 0 73 -4,-2.2 4,-2.5 -5,-0.2 3,-0.4 0.955 106.6 48.5 -65.8 -48.9 -46.4 25.5 -17.6 24 31 A A H X S+ 0 0 9 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.881 109.2 54.6 -54.4 -41.4 -42.7 25.0 -17.1 25 32 A L H X S+ 0 0 3 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.840 109.5 47.0 -62.1 -36.7 -43.3 25.0 -13.3 26 33 A I H X S+ 0 0 17 -4,-1.5 4,-1.3 -3,-0.4 -2,-0.2 0.969 114.9 43.4 -71.9 -52.8 -45.9 22.2 -13.7 27 34 A V H < S+ 0 0 70 -4,-2.5 4,-0.5 1,-0.2 3,-0.3 0.885 119.3 45.4 -58.7 -41.5 -43.8 19.9 -15.9 28 35 A G H >< S+ 0 0 0 -4,-2.7 3,-1.2 -5,-0.3 4,-0.3 0.932 109.5 54.7 -65.5 -45.4 -40.8 20.6 -13.7 29 36 A S H >< S+ 0 0 7 -4,-2.1 3,-1.4 1,-0.3 -1,-0.2 0.655 87.1 77.9 -72.4 -19.0 -42.6 20.1 -10.5 30 37 A L T 3X S+ 0 0 61 -4,-1.3 4,-0.7 -3,-0.3 -1,-0.3 0.868 93.3 52.9 -54.1 -40.1 -43.9 16.6 -11.3 31 38 A F H <> S+ 0 0 2 -3,-1.2 4,-1.8 -4,-0.5 -1,-0.3 0.612 90.5 84.9 -70.1 -14.0 -40.5 15.2 -10.5 32 39 A G H X> S+ 0 0 18 -3,-1.4 4,-1.7 -4,-0.3 3,-0.7 0.965 89.7 41.8 -51.8 -66.5 -40.6 16.9 -7.2 33 40 A P H 3> S+ 0 0 9 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.864 111.7 55.5 -52.2 -47.1 -42.6 14.3 -5.2 34 41 A F H 3X S+ 0 0 31 -4,-0.7 4,-2.6 1,-0.2 10,-0.4 0.867 110.6 46.6 -54.3 -38.9 -40.7 11.4 -6.7 35 42 A Q H <>S+ 0 0 34 -4,-2.5 3,-2.5 2,-0.2 5,-2.1 0.945 104.8 60.7 -65.0 -51.3 -39.7 10.0 -1.8 38 45 A N H ><5S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.3 -1,-0.2 0.909 108.5 45.5 -37.8 -49.5 -36.3 9.1 -3.1 39 46 A Y T 3<5S+ 0 0 19 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.573 104.9 61.2 -78.6 -6.7 -34.9 10.9 -0.1 40 47 A G T < 5S- 0 0 7 -3,-2.5 -1,-0.3 -4,-0.3 -2,-0.2 0.327 122.4-109.4 -90.1 6.0 -37.5 9.2 2.0 41 48 A N T < 5S+ 0 0 52 -3,-1.5 2,-0.5 -4,-0.5 -3,-0.2 0.624 81.2 127.0 71.8 18.0 -35.8 5.9 1.0 42 49 A V < - 0 0 63 -5,-2.1 2,-1.0 418,-0.1 -1,-0.3 -0.903 55.6-142.1-105.4 129.5 -38.8 5.0 -1.2 43 50 A D + 0 0 71 -2,-0.5 4,-0.2 404,-0.2 -9,-0.1 -0.711 33.5 158.5 -93.9 93.9 -38.1 4.1 -4.9 44 51 A A >> + 0 0 16 -2,-1.0 4,-1.4 -10,-0.4 3,-1.0 0.563 44.6 99.5 -88.0 -7.5 -41.1 5.5 -6.9 45 52 A Y H 3> S+ 0 0 14 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.723 71.7 56.8 -63.9 -35.8 -39.3 5.6 -10.3 46 53 A P H 3> S+ 0 0 86 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.882 109.2 52.1 -61.0 -32.3 -40.5 2.5 -12.0 47 54 A L H <> S+ 0 0 69 -3,-1.0 4,-2.0 2,-0.2 3,-0.3 0.964 113.8 41.2 -62.6 -52.4 -44.0 3.9 -11.4 48 55 A L H X S+ 0 0 5 -4,-1.4 4,-3.3 1,-0.2 7,-0.2 0.808 110.1 58.6 -64.4 -33.2 -43.0 7.3 -13.0 49 56 A K H < S+ 0 0 99 -4,-3.0 -1,-0.2 2,-0.2 -2,-0.2 0.856 107.7 48.5 -62.7 -34.7 -41.1 5.4 -15.7 50 57 A R H < S+ 0 0 184 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.897 116.7 40.0 -72.4 -44.6 -44.4 3.7 -16.6 51 58 A L H < S+ 0 0 102 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.988 130.1 30.7 -64.7 -57.9 -46.4 7.0 -16.7 52 59 A L S >< S+ 0 0 49 -4,-3.3 3,-1.7 1,-0.2 -1,-0.3 -0.756 70.1 179.4-106.8 85.9 -43.6 8.9 -18.4 53 60 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.703 76.8 67.2 -57.5 -22.9 -41.8 6.2 -20.6 54 61 A F T 3 S+ 0 0 73 -3,-0.1 2,-0.5 -4,-0.0 -5,-0.1 0.659 74.8 99.4 -75.1 -20.4 -39.3 8.9 -21.8 55 62 A V < - 0 0 4 -3,-1.7 3,-0.1 -7,-0.2 63,-0.1 -0.591 49.3-179.6 -70.9 120.0 -37.7 9.4 -18.4 56 63 A Q - 0 0 104 -2,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.722 55.7 -7.2-100.3 -26.9 -34.5 7.3 -18.4 57 64 A S > - 0 0 19 1,-0.1 4,-1.5 -12,-0.0 -1,-0.2 -0.960 69.4 -96.5-159.2 174.1 -33.0 7.8 -15.0 58 65 A Y H > S+ 0 0 5 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.872 120.9 55.4 -62.4 -38.1 -33.3 9.7 -11.7 59 66 A Y H > S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.769 102.5 52.5 -74.0 -28.9 -30.7 12.2 -12.9 60 67 A Q H > S+ 0 0 1 2,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.891 110.1 52.0 -68.7 -40.3 -32.6 13.1 -16.1 61 68 A G H X S+ 0 0 0 -4,-1.5 4,-3.1 1,-0.2 -2,-0.2 0.959 109.9 46.9 -54.7 -54.8 -35.5 13.8 -13.8 62 69 A L H X S+ 0 0 30 -4,-2.4 4,-2.6 1,-0.2 64,-0.3 0.774 110.2 53.2 -58.6 -32.2 -33.5 16.0 -11.6 63 70 A T H X S+ 0 0 1 -4,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.902 113.0 44.2 -71.3 -39.8 -32.1 17.8 -14.6 64 71 A L H X S+ 0 0 5 -4,-2.2 4,-1.8 2,-0.2 5,-0.4 0.871 114.0 50.2 -72.0 -37.8 -35.6 18.4 -15.8 65 72 A H H X S+ 0 0 27 -4,-3.1 4,-1.5 2,-0.2 5,-0.4 0.954 116.0 42.1 -61.2 -50.8 -36.7 19.5 -12.2 66 73 A G H X>S+ 0 0 11 -4,-2.6 4,-2.2 3,-0.2 5,-0.8 0.954 117.7 43.5 -62.5 -53.3 -33.8 21.9 -11.9 67 74 A V H X>S+ 0 0 13 -4,-2.6 5,-2.4 1,-0.2 4,-1.2 0.935 116.8 41.6 -65.4 -51.9 -33.9 23.5 -15.3 68 75 A L H <>S+ 0 0 17 -4,-1.8 5,-2.7 -5,-0.2 -1,-0.2 0.837 125.3 35.6 -67.6 -32.1 -37.7 24.0 -15.8 69 76 A N H <>S+ 0 0 24 -4,-1.5 5,-1.1 -5,-0.4 -2,-0.2 0.933 127.7 27.7 -87.4 -53.7 -38.3 25.2 -12.3 70 77 A A H <5S+ 0 0 13 -4,-2.2 -3,-0.2 -5,-0.4 -2,-0.1 0.749 135.2 27.0 -86.1 -25.4 -35.2 27.2 -11.2 71 78 A I T XX S+ 0 0 0 -4,-1.9 4,-2.2 3,-0.2 3,-0.7 0.952 121.1 37.2 -66.2 -49.2 -43.3 39.4 -16.9 81 88 A I H 3X S+ 0 0 0 -4,-2.8 4,-1.4 1,-0.2 -2,-0.2 0.893 115.6 49.6 -77.2 -41.2 -43.1 41.1 -13.5 82 89 A M H 3< S+ 0 0 1 -4,-4.1 -1,-0.2 -5,-0.3 -3,-0.1 0.286 121.7 35.0 -88.9 15.7 -40.1 43.3 -14.0 83 90 A V H <> S+ 0 0 2 -3,-0.7 4,-1.1 -5,-0.2 -2,-0.2 0.561 120.0 44.4-121.3 -49.4 -41.3 44.7 -17.3 84 91 A Y H >X S+ 0 0 1 -4,-2.2 4,-2.8 -5,-0.4 3,-0.6 0.959 111.8 51.4 -64.5 -52.7 -45.1 44.8 -16.8 85 92 A L H 3X S+ 0 0 0 -4,-1.4 4,-1.9 -5,-0.4 5,-0.2 0.911 111.9 45.8 -53.4 -49.3 -45.1 46.4 -13.3 86 93 A P H 3> S+ 0 0 0 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.769 113.8 53.4 -66.3 -20.6 -42.8 49.2 -14.3 87 94 A A H S+ 0 0 0 -4,-1.1 5,-1.8 -3,-0.6 4,-0.8 0.920 109.5 44.2 -74.9 -45.4 -45.0 49.6 -17.4 88 95 A R H <5S+ 0 0 37 -4,-2.8 -3,-0.2 3,-0.2 -1,-0.1 0.807 113.4 52.7 -70.3 -26.1 -48.3 49.9 -15.5 89 96 A E H <5S+ 0 0 59 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.858 115.4 37.8 -77.7 -39.9 -46.7 52.3 -13.0 90 97 A L H <5S- 0 0 20 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.548 105.6-134.4 -80.0 -9.1 -45.3 54.7 -15.6 91 98 A N T <5 + 0 0 103 -4,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.887 62.4 129.0 48.0 46.5 -48.5 54.1 -17.5 92 99 A M < - 0 0 36 -5,-1.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.757 61.9-108.9-118.9 169.4 -46.4 53.7 -20.6 93 100 A R - 0 0 103 -2,-0.3 2,-0.1 -3,-0.1 3,-0.1 -0.885 27.3-125.8-103.5 132.2 -46.2 51.0 -23.3 94 101 A P - 0 0 1 0, 0.0 2,-0.5 0, 0.0 62,-0.1 -0.458 47.2 -87.1 -65.4 140.3 -43.1 48.7 -23.6 95 102 A N > - 0 0 70 60,-0.3 4,-2.3 1,-0.2 5,-0.1 -0.364 50.0-157.0 -52.3 105.9 -41.5 48.7 -27.0 96 103 A M H > S+ 0 0 33 -2,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.763 82.6 58.4 -69.8 -28.9 -43.9 46.0 -28.3 97 104 A G H > S+ 0 0 53 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.970 112.3 40.5 -58.7 -55.9 -41.7 44.7 -31.1 98 105 A L H > S+ 0 0 46 2,-0.2 4,-2.2 1,-0.2 3,-0.4 0.912 109.8 58.6 -60.6 -47.1 -38.8 43.9 -28.7 99 106 A M H X S+ 0 0 2 -4,-2.3 4,-1.4 1,-0.3 3,-0.5 0.943 109.4 44.2 -51.3 -51.0 -41.1 42.6 -26.0 100 107 A W H X S+ 0 0 68 -4,-2.0 4,-1.7 1,-0.2 -1,-0.3 0.760 108.7 58.4 -67.9 -23.9 -42.4 39.9 -28.4 101 108 A L H X S+ 0 0 87 -4,-1.3 4,-2.2 -3,-0.4 -1,-0.2 0.870 105.5 50.0 -68.6 -35.6 -38.9 39.2 -29.7 102 109 A S H X S+ 0 0 1 -4,-2.2 4,-1.9 -3,-0.5 -2,-0.2 0.809 108.4 52.7 -73.0 -30.2 -37.9 38.3 -26.1 103 110 A W H X S+ 0 0 22 -4,-1.4 4,-2.4 -5,-0.2 -1,-0.2 0.913 112.0 44.4 -70.8 -44.4 -40.8 36.0 -25.7 104 111 A W H X S+ 0 0 137 -4,-1.7 4,-4.1 2,-0.2 5,-0.4 0.884 111.3 53.2 -65.9 -41.3 -40.0 34.1 -28.9 105 112 A M H X S+ 0 0 42 -4,-2.2 4,-3.4 1,-0.2 5,-0.2 0.962 114.1 43.6 -56.1 -49.6 -36.3 33.9 -28.0 106 113 A A H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.865 118.0 45.5 -61.3 -41.0 -37.3 32.4 -24.7 107 114 A F H X S+ 0 0 69 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.899 118.9 39.5 -71.5 -44.6 -39.9 30.2 -26.4 108 115 A I H X S+ 0 0 86 -4,-4.1 4,-3.3 2,-0.2 5,-0.2 0.936 116.1 52.6 -68.2 -47.1 -37.6 29.0 -29.2 109 116 A G H X S+ 0 0 1 -4,-3.4 4,-1.5 -5,-0.4 36,-0.2 0.845 110.9 47.4 -57.9 -40.0 -34.6 28.8 -26.8 110 117 A L H X S+ 0 0 29 -4,-1.8 4,-2.9 -5,-0.2 -1,-0.2 0.952 113.8 46.5 -61.6 -52.2 -36.6 26.6 -24.4 111 118 A V H X S+ 0 0 63 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.904 111.0 52.2 -60.5 -45.8 -37.9 24.3 -27.3 112 119 A V H < S+ 0 0 46 -4,-3.3 -1,-0.2 1,-0.2 29,-0.2 0.871 118.5 37.5 -56.5 -39.2 -34.3 24.0 -28.7 113 120 A A H X S+ 0 0 9 -4,-1.5 4,-1.2 -5,-0.2 -2,-0.2 0.760 107.0 66.4 -88.5 -24.4 -33.0 23.0 -25.3 114 121 A A H X S+ 0 0 20 -4,-2.9 4,-3.1 2,-0.2 5,-0.3 0.906 94.6 60.4 -58.0 -42.3 -36.1 20.9 -24.4 115 122 A L H X S+ 0 0 114 -4,-1.6 4,-3.0 1,-0.2 6,-0.2 0.951 105.7 41.4 -57.9 -60.0 -35.3 18.4 -27.1 116 123 A P H 4>S+ 0 0 8 0, 0.0 5,-3.5 0, 0.0 6,-0.8 0.799 116.9 51.9 -59.8 -27.2 -31.9 17.2 -25.9 117 124 A L H ><5S+ 0 0 5 -4,-1.2 3,-1.3 4,-0.2 -2,-0.2 0.939 112.8 42.7 -71.7 -45.8 -33.1 17.2 -22.3 118 125 A L H 3<5S+ 0 0 71 -4,-3.1 -1,-0.2 1,-0.3 -3,-0.2 0.849 112.3 54.3 -70.9 -31.8 -36.2 15.1 -23.2 119 126 A A T 3<5S- 0 0 64 -4,-3.0 -1,-0.3 -5,-0.3 -2,-0.2 0.296 115.7-115.8 -82.6 11.2 -34.1 12.8 -25.4 120 127 A N T < 5S+ 0 0 16 -3,-1.3 3,-0.3 -5,-0.2 -3,-0.2 0.814 82.5 122.9 55.5 39.1 -31.7 12.2 -22.5 121 128 A E S S- 0 0 2 -2,-1.8 5,-0.5 1,-0.1 4,-0.4 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