==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE, METAL BINDING PROTEIN 23-JUN-06 2HF9 . COMPND 2 MOLECULE: PROBABLE HYDROGENASE NICKEL INCORPORATION . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR R.GASPER,A.SCRIMA,A.WITTINGHOFER . 420 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17550.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 320 76.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 72 17.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 42 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 133 31.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.4 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 3 1 0 0 3 1 0 2 2 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 8 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 11 A K 0 0 187 0, 0.0 3,-0.3 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 134.9 -0.8 11.9 3.5 2 12 A D > + 0 0 126 1,-0.2 4,-1.8 2,-0.1 3,-0.4 0.199 360.0 113.3 -98.4 14.2 -1.7 8.2 2.9 3 13 A I H > S+ 0 0 95 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.869 75.1 46.5 -54.4 -46.6 -3.3 9.0 -0.4 4 14 A L H > S+ 0 0 48 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.758 109.1 53.7 -74.0 -27.7 -0.7 7.2 -2.6 5 15 A K H > S+ 0 0 103 -3,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.884 112.1 44.8 -73.4 -40.7 -0.6 4.0 -0.5 6 16 A A H X S+ 0 0 34 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.864 112.8 52.2 -68.5 -39.5 -4.3 3.6 -0.7 7 17 A N H X S+ 0 0 10 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.910 106.4 53.1 -61.3 -44.9 -4.2 4.3 -4.5 8 18 A K H X S+ 0 0 88 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.883 106.7 52.6 -60.4 -42.1 -1.5 1.7 -5.1 9 19 A R H X S+ 0 0 153 -4,-1.5 4,-1.6 1,-0.2 -1,-0.2 0.913 113.0 44.3 -56.9 -45.4 -3.7 -1.0 -3.4 10 20 A L H X S+ 0 0 56 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.846 110.7 54.8 -71.5 -35.2 -6.6 -0.1 -5.6 11 21 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.901 108.2 48.6 -61.9 -43.8 -4.4 0.0 -8.7 12 22 A D H X S+ 0 0 84 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.872 111.3 50.5 -65.6 -37.4 -3.1 -3.5 -8.0 13 23 A K H X S+ 0 0 134 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.877 109.6 51.0 -65.8 -40.7 -6.7 -4.7 -7.6 14 24 A N H X S+ 0 0 12 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.920 110.6 48.7 -59.4 -47.8 -7.6 -3.0 -10.9 15 25 A R H X S+ 0 0 48 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.898 111.2 49.9 -61.2 -43.4 -4.7 -4.8 -12.7 16 26 A K H X S+ 0 0 91 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.916 111.2 49.0 -60.9 -44.4 -5.7 -8.1 -11.2 17 27 A L H X S+ 0 0 50 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.911 113.4 46.9 -61.4 -44.1 -9.4 -7.6 -12.3 18 28 A L H <>S+ 0 0 3 -4,-2.5 5,-2.8 1,-0.2 3,-0.5 0.926 112.3 49.2 -63.3 -46.5 -8.2 -6.7 -15.8 19 29 A N H ><5S+ 0 0 42 -4,-2.9 3,-0.9 1,-0.2 -2,-0.2 0.843 105.7 58.6 -60.4 -37.1 -5.8 -9.7 -16.0 20 30 A K H 3<5S+ 0 0 126 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.832 114.1 37.3 -60.0 -36.1 -8.6 -12.0 -14.8 21 31 A H T 3<5S- 0 0 61 -4,-1.2 -1,-0.2 -3,-0.5 83,-0.2 0.259 116.1-112.2-103.5 8.8 -10.7 -10.9 -17.8 22 32 A G T < 5 + 0 0 48 -3,-0.9 2,-0.4 -4,-0.2 -3,-0.2 0.867 64.4 150.0 65.3 40.7 -7.7 -10.7 -20.3 23 33 A V < - 0 0 1 -5,-2.8 2,-0.6 -8,-0.1 -1,-0.2 -0.891 36.1-154.0-107.3 132.0 -7.9 -7.0 -20.7 24 34 A V E -a 106 0A 11 81,-2.5 83,-2.6 -2,-0.4 2,-0.4 -0.944 19.1-157.7-105.4 122.1 -4.7 -4.9 -21.4 25 35 A A E -a 107 0A 0 -2,-0.6 101,-1.8 81,-0.2 102,-1.7 -0.819 9.2-163.4-110.2 141.8 -5.1 -1.3 -20.2 26 36 A F E -ab 108 127A 0 81,-2.8 83,-3.1 -2,-0.4 2,-0.7 -0.979 11.2-147.6-127.3 128.8 -3.3 1.8 -21.2 27 37 A D E -ab 109 128A 0 100,-2.7 102,-3.5 -2,-0.4 2,-0.8 -0.862 13.8-159.0 -96.5 111.3 -3.1 5.2 -19.4 28 38 A F E +ab 110 129A 0 81,-3.3 83,-2.5 -2,-0.7 2,-0.2 -0.841 20.5 169.8 -95.6 105.9 -2.9 8.1 -21.9 29 39 A M E + b 0 130A 0 100,-3.4 102,-3.0 -2,-0.8 2,-0.3 -0.682 8.9 124.1-107.3 164.3 -1.4 11.2 -20.2 30 40 A G E - b 0 131A 0 82,-0.5 84,-1.7 84,-0.5 102,-0.2 -0.957 53.6 -64.0 168.4-179.0 -0.3 14.5 -21.6 31 41 A A S > S- 0 0 0 100,-1.1 3,-1.3 -2,-0.3 2,-0.4 -0.162 75.8 -63.7 -76.5 178.5 -0.4 18.2 -21.8 32 42 A I T 3 S- 0 0 9 1,-0.2 -1,-0.2 81,-0.2 211,-0.1 -0.551 120.6 -4.4 -69.5 123.0 -3.5 20.2 -22.8 33 43 A G T 3 S+ 0 0 27 -2,-0.4 -1,-0.2 -3,-0.1 99,-0.1 0.661 83.9 140.9 71.7 20.2 -4.4 19.4 -26.5 34 44 A S S < S- 0 0 0 -3,-1.3 -2,-0.1 97,-0.2 98,-0.1 0.779 79.2 -92.9 -63.3 -29.1 -1.3 17.2 -27.1 35 45 A G S > S+ 0 0 14 -4,-0.2 4,-2.5 312,-0.1 5,-0.2 0.560 78.3 139.2 125.3 19.7 -3.3 14.8 -29.2 36 46 A K H > S+ 0 0 12 -5,-0.2 4,-2.5 2,-0.2 5,-0.2 0.911 77.9 43.4 -57.7 -49.5 -4.5 12.0 -26.7 37 47 A T H > S+ 0 0 7 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.938 113.8 49.6 -66.6 -46.7 -8.0 11.8 -28.2 38 48 A L H > S+ 0 0 66 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.887 112.7 49.1 -58.9 -39.9 -6.9 11.8 -31.8 39 49 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.929 112.1 47.4 -62.4 -47.3 -4.4 9.1 -31.0 40 50 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.917 111.2 52.1 -61.3 -43.8 -7.0 7.0 -29.2 41 51 A E H X S+ 0 0 10 -4,-3.1 4,-2.4 2,-0.2 -2,-0.2 0.928 111.6 45.8 -56.1 -49.9 -9.4 7.5 -32.2 42 52 A K H X S+ 0 0 64 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.883 112.3 51.4 -62.7 -41.0 -6.7 6.4 -34.7 43 53 A L H X S+ 0 0 0 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.913 109.7 49.7 -62.6 -44.9 -5.8 3.4 -32.5 44 54 A I H >X S+ 0 0 1 -4,-2.9 4,-2.0 1,-0.2 3,-0.8 0.966 111.0 49.7 -54.5 -56.0 -9.5 2.3 -32.2 45 55 A D H 3< S+ 0 0 56 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.843 117.5 39.9 -51.2 -40.0 -9.9 2.5 -36.0 46 56 A N H 3< S+ 0 0 80 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.577 123.0 36.4 -95.6 -8.3 -6.8 0.5 -36.7 47 57 A L H XX S+ 0 0 7 -4,-1.4 4,-2.7 -3,-0.8 3,-1.6 0.512 87.7 90.8-118.1 -10.4 -7.1 -2.2 -34.0 48 58 A K T 3< S+ 0 0 116 -4,-2.0 -3,-0.1 1,-0.3 -2,-0.1 0.687 82.2 61.0 -66.9 -18.7 -10.9 -2.8 -33.8 49 59 A D T 34 S+ 0 0 135 -4,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.728 118.3 28.9 -74.2 -23.4 -10.7 -5.6 -36.4 50 60 A K T <4 S+ 0 0 124 -3,-1.6 2,-0.3 1,-0.2 -2,-0.2 0.702 125.8 36.3-108.4 -31.8 -8.4 -7.5 -34.0 51 61 A Y < - 0 0 23 -4,-2.7 2,-0.6 -7,-0.1 -1,-0.2 -0.945 69.5-126.3-130.6 147.2 -9.5 -6.4 -30.6 52 62 A K - 0 0 102 -2,-0.3 53,-3.4 -3,-0.1 54,-2.2 -0.835 41.8-156.4 -86.8 123.4 -12.7 -5.4 -28.8 53 63 A I E -c 106 0A 12 -2,-0.6 22,-1.4 20,-0.3 2,-0.3 -0.876 19.5-177.8-117.9 133.8 -11.9 -2.0 -27.4 54 64 A A E -cd 107 75A 0 52,-2.6 54,-2.5 -2,-0.4 2,-0.3 -0.897 11.2-155.9-118.9 154.8 -13.3 0.1 -24.4 55 65 A C E -cd 108 76A 0 20,-3.2 22,-2.5 -2,-0.3 2,-0.5 -0.957 14.0-157.5-128.9 150.8 -12.4 3.6 -23.3 56 66 A I E -cd 109 77A 0 52,-2.2 54,-3.1 -2,-0.3 2,-0.6 -0.997 17.6-166.1-119.1 120.7 -12.5 5.6 -20.1 57 67 A A E -cd 110 78A 2 20,-1.9 22,-2.8 -2,-0.5 2,-0.5 -0.926 6.1-174.6-113.7 108.5 -12.5 9.3 -20.9 58 68 A G E + d 0 79A 3 52,-2.3 2,-0.3 -2,-0.6 22,-0.2 -0.899 23.7 120.3-106.6 128.0 -11.8 11.6 -18.0 59 69 A D E > S- d 0 80A 13 20,-2.0 22,-1.9 -2,-0.5 3,-0.6 -0.952 73.5 -88.0-165.8 171.4 -12.0 15.4 -18.1 60 70 A V T 3 S+ 0 0 38 1,-0.3 2,-0.6 -2,-0.3 22,-0.4 0.936 131.7 21.7 -50.5 -53.3 -13.8 18.4 -16.5 61 71 A I T > S- 0 0 46 293,-0.3 3,-0.8 1,-0.1 4,-0.4 -0.892 81.4-176.3-115.7 96.2 -16.5 18.0 -19.2 62 72 A A T <> + 0 0 1 -2,-0.6 4,-2.2 -3,-0.6 3,-0.4 0.682 64.8 80.4 -70.2 -20.0 -16.0 14.4 -20.3 63 73 A K H 3> S+ 0 0 120 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.830 80.8 64.7 -60.4 -37.3 -18.6 14.3 -23.0 64 74 A F H <> S+ 0 0 34 -3,-0.8 4,-1.1 1,-0.2 -1,-0.2 0.926 115.2 28.5 -53.6 -50.8 -16.4 16.0 -25.7 65 75 A D H > S+ 0 0 6 -3,-0.4 4,-2.3 -4,-0.4 -1,-0.2 0.821 117.6 58.4 -83.0 -32.8 -13.9 13.2 -25.9 66 76 A A H X S+ 0 0 3 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.944 107.4 48.3 -57.5 -49.1 -16.4 10.4 -24.9 67 77 A E H X S+ 0 0 116 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.865 110.3 52.4 -60.8 -39.1 -18.6 11.4 -27.9 68 78 A R H < S+ 0 0 77 -4,-1.1 4,-0.5 -5,-0.3 -1,-0.2 0.924 112.2 44.1 -61.5 -46.6 -15.5 11.3 -30.2 69 79 A M H ><>S+ 0 0 0 -4,-2.3 5,-1.2 1,-0.2 3,-0.7 0.832 108.4 60.1 -68.6 -33.7 -14.5 7.8 -29.0 70 80 A E H ><5S+ 0 0 103 -4,-2.3 3,-1.7 1,-0.2 -1,-0.2 0.874 98.2 55.7 -61.6 -42.0 -18.1 6.6 -29.3 71 81 A K T 3<5S+ 0 0 140 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.660 100.6 61.5 -69.7 -13.9 -18.4 7.3 -33.0 72 82 A H T < 5S- 0 0 32 -3,-0.7 -1,-0.3 -4,-0.5 -2,-0.2 0.404 123.8-100.4 -91.2 0.9 -15.3 5.2 -33.7 73 83 A G T < 5S+ 0 0 63 -3,-1.7 2,-0.3 1,-0.3 -20,-0.3 0.729 77.5 130.5 90.6 24.9 -17.1 2.1 -32.3 74 84 A A < - 0 0 9 -5,-1.2 2,-0.5 -4,-0.1 -1,-0.3 -0.810 60.9-117.5-104.3 149.8 -15.7 1.8 -28.7 75 85 A K E -d 54 0A 122 -22,-1.4 -20,-3.2 -2,-0.3 2,-0.4 -0.758 40.5-160.6 -79.3 129.8 -17.7 1.4 -25.5 76 86 A V E -d 55 0A 12 -2,-0.5 -20,-0.2 -22,-0.2 -10,-0.0 -0.956 22.9-164.8-124.4 131.4 -17.0 4.5 -23.4 77 87 A V E -d 56 0A 10 -22,-2.5 -20,-1.9 -2,-0.4 2,-0.3 -0.964 22.6-150.5-106.1 113.9 -17.3 5.3 -19.8 78 88 A P E -d 57 0A 66 0, 0.0 2,-0.4 0, 0.0 -20,-0.2 -0.623 8.0-162.9 -83.1 145.1 -17.1 9.1 -19.3 79 89 A L E -d 58 0A 31 -22,-2.8 -20,-2.0 -2,-0.3 2,-0.8 -0.937 10.7-151.6-129.6 108.8 -15.7 10.5 -16.0 80 90 A N E -d 59 0A 114 -2,-0.4 -20,-0.2 -22,-0.2 -19,-0.1 -0.720 15.3-168.1 -76.8 112.7 -16.4 14.1 -15.1 81 91 A T > - 0 0 13 -22,-1.9 3,-1.8 -2,-0.8 -21,-0.2 0.391 7.9-162.6 -94.3 1.6 -13.3 14.8 -13.1 82 92 A G T 3 - 0 0 39 -22,-0.4 -1,-0.2 -23,-0.3 -22,-0.0 -0.250 67.8 -21.0 55.0-130.2 -14.3 18.2 -11.5 83 93 A K T 3 S+ 0 0 146 -23,-0.0 -1,-0.3 2,-0.0 2,-0.2 0.414 103.2 120.8 -93.7 1.5 -11.4 20.1 -10.1 84 94 A E < - 0 0 105 -3,-1.8 -3,-0.1 1,-0.1 -24,-0.0 -0.464 54.9-151.8 -68.3 132.6 -9.1 17.0 -9.8 85 95 A a S S+ 0 0 17 -2,-0.2 2,-0.3 27,-0.0 32,-0.2 0.143 76.2 25.9 -93.5 19.3 -5.9 17.3 -11.8 86 96 A H S S- 0 0 15 -5,-0.2 2,-0.2 31,-0.2 27,-0.1 -0.959 76.6-113.6-167.8 153.7 -5.7 13.5 -12.3 87 97 A L - 0 0 0 -2,-0.3 2,-0.3 34,-0.1 34,-0.1 -0.588 35.9-153.6 -80.8 160.5 -7.7 10.3 -12.5 88 98 A D > - 0 0 40 -2,-0.2 4,-2.1 35,-0.1 5,-0.2 -0.875 28.8-105.5-131.2 169.2 -7.1 7.8 -9.7 89 99 A A H > S+ 0 0 0 33,-0.5 4,-3.0 -2,-0.3 5,-0.1 0.825 115.6 59.7 -61.9 -32.8 -7.4 4.0 -9.3 90 100 A H H > S+ 0 0 90 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.956 109.3 39.6 -60.7 -54.7 -10.6 4.4 -7.2 91 101 A L H > S+ 0 0 67 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.894 117.4 50.6 -64.1 -40.6 -12.6 6.2 -9.9 92 102 A V H X S+ 0 0 3 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.897 105.5 57.5 -62.5 -42.5 -11.2 4.0 -12.6 93 103 A G H X S+ 0 0 14 -4,-3.0 4,-0.6 1,-0.2 -2,-0.2 0.911 109.6 44.0 -52.8 -46.7 -12.1 0.9 -10.5 94 104 A H H >< S+ 0 0 90 -4,-1.8 3,-0.6 1,-0.2 4,-0.5 0.824 107.8 58.1 -70.5 -33.8 -15.7 2.0 -10.4 95 105 A A H >< S+ 0 0 2 -4,-1.9 3,-1.5 1,-0.2 -1,-0.2 0.891 99.4 60.7 -59.7 -38.6 -15.6 2.8 -14.2 96 106 A L H >< S+ 0 0 3 -4,-2.1 3,-1.3 1,-0.3 -1,-0.2 0.760 92.9 65.0 -59.5 -28.1 -14.6 -0.8 -14.7 97 107 A E T << S+ 0 0 136 -3,-0.6 -1,-0.3 -4,-0.6 -2,-0.2 0.743 96.9 56.6 -67.3 -23.7 -18.0 -1.9 -13.1 98 108 A D T < S+ 0 0 113 -3,-1.5 2,-0.4 -4,-0.5 -1,-0.2 0.366 98.6 79.0 -88.6 3.5 -19.7 -0.2 -16.1 99 109 A L S < S- 0 0 16 -3,-1.3 2,-1.1 -4,-0.1 3,-0.1 -0.886 77.5-131.9-113.6 143.2 -17.8 -2.4 -18.6 100 110 A N > - 0 0 96 -2,-0.4 3,-2.0 1,-0.2 -3,-0.1 -0.789 25.3-172.0 -88.2 95.1 -18.3 -6.0 -19.7 101 111 A L G > S+ 0 0 13 -2,-1.1 3,-0.7 1,-0.3 -1,-0.2 0.624 79.0 64.0 -69.9 -14.6 -14.7 -7.1 -19.3 102 112 A D G 3 S+ 0 0 107 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.452 106.3 45.8 -84.4 -2.3 -15.4 -10.5 -20.9 103 113 A E G < S+ 0 0 101 -3,-2.0 2,-0.4 -51,-0.0 -1,-0.2 0.052 103.7 78.8-121.7 22.0 -16.3 -8.6 -24.1 104 114 A I < + 0 0 14 -3,-0.7 -51,-0.2 -83,-0.2 3,-0.1 -0.992 40.2 170.9-131.9 137.4 -13.2 -6.3 -24.0 105 115 A D S S+ 0 0 56 -53,-3.4 -81,-2.5 -2,-0.4 2,-0.4 0.703 73.5 34.8-108.6 -39.2 -9.6 -7.0 -25.0 106 116 A L E -ac 24 53A 0 -54,-2.2 -52,-2.6 -83,-0.2 2,-0.5 -0.961 61.1-162.5-123.4 137.9 -8.1 -3.5 -24.8 107 117 A L E -ac 25 54A 2 -83,-2.6 -81,-2.8 -2,-0.4 2,-0.6 -0.978 3.8-167.8-120.3 120.4 -8.8 -0.5 -22.5 108 118 A F E -ac 26 55A 0 -54,-2.5 -52,-2.2 -2,-0.5 2,-0.6 -0.936 5.8-167.2-106.4 118.8 -7.7 3.0 -23.4 109 119 A I E -ac 27 56A 1 -83,-3.1 -81,-3.3 -2,-0.6 2,-0.9 -0.927 9.3-153.7-107.5 118.2 -8.0 5.5 -20.5 110 120 A E E -ac 28 57A 9 -54,-3.1 -52,-2.3 -2,-0.6 -81,-0.2 -0.823 18.3-156.4 -90.4 108.7 -7.6 9.2 -21.4 111 121 A N - 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