==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-AUG-09 3ITC . COMPND 2 MOLECULE: RENAL DIPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR; . AUTHOR T.T.NGUYEN,J.A.CUMMINGS,C.-L.TSAI,D.P.BARONDEAU,F.M.RAUSHEL . 392 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15214.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 281 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 14 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 156 39.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 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 1 1 0 1 1 2 4 1 0 2 0 1 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 1 3 2 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 PARALLEL BRIDGES PER LADDER . 3 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 1 0 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 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 0 142 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 170.2 -14.7 -4.0 -43.7 2 2 A T > - 0 0 81 1,-0.1 4,-2.3 4,-0.0 5,-0.1 -0.320 360.0-109.7 -72.4 171.4 -16.8 -7.1 -43.8 3 3 A S H > S+ 0 0 37 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.834 122.3 54.2 -69.2 -33.4 -19.3 -7.6 -41.0 4 4 A L H > S+ 0 0 48 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.915 108.9 47.3 -63.2 -38.5 -17.1 -10.4 -39.8 5 5 A E H > S+ 0 0 89 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.947 113.5 48.3 -69.0 -45.1 -14.1 -8.1 -39.6 6 6 A K H X S+ 0 0 60 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.926 109.0 53.9 -64.8 -44.6 -16.2 -5.5 -37.8 7 7 A A H X S+ 0 0 0 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.904 107.5 51.1 -56.0 -43.9 -17.5 -8.2 -35.4 8 8 A R H X S+ 0 0 113 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.916 109.8 49.2 -62.9 -39.1 -13.9 -9.1 -34.6 9 9 A E H X S+ 0 0 85 -4,-1.8 4,-0.9 1,-0.2 -1,-0.2 0.907 110.5 50.1 -66.8 -39.3 -13.0 -5.5 -33.9 10 10 A L H >X S+ 0 0 29 -4,-2.5 4,-2.5 1,-0.2 3,-0.6 0.897 108.9 52.9 -62.6 -39.8 -16.0 -5.1 -31.6 11 11 A L H 3< S+ 0 0 8 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.734 99.8 62.4 -71.7 -22.8 -15.1 -8.2 -29.7 12 12 A R H 3< S+ 0 0 188 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.857 113.9 34.7 -69.1 -29.7 -11.6 -6.9 -29.1 13 13 A E H << S+ 0 0 117 -4,-0.9 -2,-0.2 -3,-0.6 -1,-0.1 0.866 137.4 18.1 -88.1 -40.3 -13.1 -4.0 -27.1 14 14 A F S < S- 0 0 45 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.1 -0.814 86.0-168.6-134.6 86.5 -16.1 -5.8 -25.5 15 15 A P - 0 0 15 0, 0.0 2,-0.3 0, 0.0 45,-0.2 -0.139 30.5 -76.9 -75.8 173.5 -15.6 -9.6 -25.6 16 16 A V E -a 60 0A 0 43,-3.1 45,-2.7 42,-0.1 46,-1.9 -0.536 26.5-157.6 -76.8 133.2 -18.0 -12.3 -24.9 17 17 A V E -a 62 0A 1 341,-2.4 300,-0.7 -2,-0.3 2,-0.4 -0.951 22.4-156.3 -95.7 103.6 -18.9 -13.3 -21.4 18 18 A D E -ab 63 317A 0 44,-2.6 46,-2.4 -2,-0.7 300,-0.3 -0.719 5.8-154.4 -90.4 131.6 -20.0 -16.9 -22.0 19 19 A G E + 0 0 0 298,-2.3 2,-0.2 -2,-0.4 299,-0.2 0.619 69.7 21.5 -85.1 -10.6 -22.4 -18.1 -19.4 20 20 A H E + 0 0 0 297,-0.2 300,-1.8 46,-0.1 301,-0.5 -0.705 53.4 160.8-164.5 110.4 -22.0 -21.9 -19.5 21 21 A N E -ac 65 321A 0 43,-1.5 45,-2.8 -2,-0.2 301,-0.2 -0.999 22.3-156.6-130.4 130.2 -19.2 -24.2 -20.7 22 22 A D > + 0 0 10 299,-2.7 4,-2.4 -2,-0.4 3,-0.4 0.051 51.2 126.2 -97.1 25.3 -18.9 -27.9 -19.6 23 23 A L H > S+ 0 0 0 298,-0.3 4,-2.7 1,-0.2 5,-0.2 0.881 71.3 57.6 -47.1 -44.0 -15.2 -28.4 -20.3 24 24 A P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.951 108.7 44.9 -56.8 -46.9 -14.6 -29.6 -16.7 25 25 A W H > S+ 0 0 43 -3,-0.4 4,-2.7 41,-0.3 5,-0.3 0.903 111.7 52.9 -62.6 -40.0 -17.2 -32.4 -17.1 26 26 A A H X S+ 0 0 11 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.913 109.7 48.4 -63.1 -38.8 -15.8 -33.3 -20.4 27 27 A L H X S+ 0 0 1 -4,-2.7 4,-2.0 -5,-0.2 6,-1.9 0.873 111.2 51.3 -65.2 -37.9 -12.3 -33.6 -18.9 28 28 A R H X S+ 0 0 58 -4,-2.2 4,-1.4 4,-0.3 -2,-0.2 0.934 116.9 39.3 -59.2 -49.7 -13.7 -35.7 -16.1 29 29 A E H < S+ 0 0 106 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.893 122.0 39.9 -75.1 -40.5 -15.4 -38.1 -18.6 30 30 A Q H < S- 0 0 78 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.926 140.5 -0.9 -77.3 -42.4 -12.7 -38.2 -21.2 31 31 A V H >< S- 0 0 27 -4,-2.0 3,-1.5 -5,-0.3 -3,-0.2 0.189 89.8-114.4-136.5 13.8 -9.5 -38.4 -19.2 32 32 A R T 3< S- 0 0 179 -4,-1.4 -4,-0.3 -5,-0.3 3,-0.1 0.894 82.6 -51.2 40.9 49.8 -10.6 -38.2 -15.5 33 33 A Y T 3 S+ 0 0 16 -6,-1.9 2,-1.6 1,-0.2 -1,-0.3 0.724 90.3 148.3 69.1 22.1 -8.9 -34.9 -15.1 34 34 A D X - 0 0 83 -3,-1.5 3,-1.7 -7,-0.4 4,-0.4 -0.682 27.5-172.2 -82.2 91.2 -5.5 -35.8 -16.6 35 35 A L G > S+ 0 0 5 -2,-1.6 3,-1.1 1,-0.3 -1,-0.2 0.742 74.5 62.8 -66.8 -26.9 -5.0 -32.3 -17.9 36 36 A D G > S+ 0 0 117 1,-0.2 3,-0.8 2,-0.1 -1,-0.3 0.741 97.1 61.2 -63.9 -24.6 -1.8 -33.1 -19.9 37 37 A A G < S+ 0 0 40 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.588 119.5 25.2 -78.8 -10.4 -3.9 -35.5 -22.0 38 38 A R G < S- 0 0 45 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.1 -0.303 85.4-178.7-139.8 46.0 -6.2 -32.7 -23.2 39 39 A D X - 0 0 48 -3,-0.8 3,-1.9 1,-0.2 -3,-0.1 -0.302 17.8-155.4 -59.5 119.0 -3.8 -29.7 -22.8 40 40 A I T 3 S+ 0 0 2 1,-0.3 12,-2.6 -5,-0.1 13,-0.5 0.562 89.9 71.8 -81.0 0.1 -5.8 -26.6 -23.8 41 41 A A T 3 S+ 0 0 68 10,-0.1 -1,-0.3 11,-0.1 2,-0.2 0.510 102.2 58.6 -82.5 -1.9 -2.6 -24.8 -24.7 42 42 A A S < S- 0 0 41 -3,-1.9 2,-0.7 -4,-0.1 10,-0.2 -0.715 108.8 -80.8-115.0 167.9 -2.7 -27.2 -27.6 43 43 A D + 0 0 116 -2,-0.2 3,-0.3 1,-0.1 -4,-0.1 -0.543 44.2 171.9 -74.9 114.5 -5.2 -27.9 -30.3 44 44 A Q >> + 0 0 19 -2,-0.7 4,-2.7 1,-0.2 3,-2.1 0.116 35.7 123.9-109.1 21.3 -7.9 -30.1 -28.9 45 45 A S T 34 + 0 0 65 1,-0.3 -1,-0.2 2,-0.2 -2,-0.0 0.784 68.2 61.4 -60.8 -23.4 -10.3 -29.9 -31.9 46 46 A A T 34 S+ 0 0 87 -3,-0.3 -1,-0.3 1,-0.1 -2,-0.1 0.728 123.2 16.9 -71.1 -18.0 -10.3 -33.6 -32.2 47 47 A H T <4 S+ 0 0 88 -3,-2.1 2,-0.3 1,-0.2 -2,-0.2 0.677 121.4 35.1-124.6 -29.5 -11.8 -34.1 -28.8 48 48 A L < - 0 0 6 -4,-2.7 -1,-0.2 1,-0.1 -4,-0.0 -0.934 57.3-133.3-140.9 152.8 -13.4 -30.8 -27.4 49 49 A H S S+ 0 0 32 -2,-0.3 285,-2.1 284,-0.1 2,-0.4 0.659 91.5 64.6 -74.2 -20.6 -15.2 -27.7 -28.4 50 50 A T + 0 0 0 283,-0.2 2,-0.3 -6,-0.1 -3,-0.1 -0.923 46.0 134.9-116.7 136.6 -12.8 -25.7 -26.3 51 51 A D > - 0 0 2 -2,-0.4 4,-2.1 -8,-0.1 5,-0.2 -0.909 59.1 -98.3-156.2 175.0 -9.1 -24.8 -26.1 52 52 A L H > S+ 0 0 8 -12,-2.6 4,-2.0 -2,-0.3 5,-0.2 0.897 118.2 50.0 -64.4 -40.0 -7.2 -21.6 -25.4 53 53 A A H > S+ 0 0 66 -13,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.894 112.0 47.2 -68.3 -37.7 -6.5 -20.7 -29.1 54 54 A R H > S+ 0 0 25 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.839 108.2 55.7 -72.5 -32.5 -10.1 -21.1 -30.1 55 55 A L H X>S+ 0 0 0 -4,-2.1 5,-2.4 2,-0.2 4,-0.6 0.927 110.8 45.7 -61.9 -42.2 -11.4 -19.1 -27.2 56 56 A R H ><5S+ 0 0 95 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.955 112.4 49.6 -62.4 -48.0 -9.2 -16.2 -28.3 57 57 A S H 3<5S+ 0 0 77 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.862 109.9 54.0 -58.4 -34.0 -10.3 -16.6 -31.9 58 58 A G H 3<5S- 0 0 0 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.556 112.6-117.6 -77.5 -12.4 -13.8 -16.6 -30.7 59 59 A G T <<5 + 0 0 15 -3,-1.3 -43,-3.1 -4,-0.6 2,-0.5 0.782 53.6 163.5 79.4 26.5 -13.5 -13.4 -28.8 60 60 A V E < +a 16 0A 4 -5,-2.4 -1,-0.2 -45,-0.2 -43,-0.2 -0.703 12.3 168.0 -83.2 123.2 -14.2 -14.9 -25.4 61 61 A G E + 0 0 7 -45,-2.7 56,-2.3 -2,-0.5 2,-0.3 0.499 67.2 19.6-110.2 -14.5 -13.2 -12.6 -22.6 62 62 A A E -ad 17 117A 0 -46,-1.9 -44,-2.6 54,-0.3 2,-0.4 -0.964 64.3-163.9-153.7 147.0 -14.8 -14.3 -19.7 63 63 A Q E -ad 18 118A 0 54,-3.0 56,-2.9 -2,-0.3 2,-0.9 -0.992 17.5-147.3-137.7 124.4 -16.1 -17.8 -19.1 64 64 A Y E - d 0 119A 6 -46,-2.4 -43,-1.5 -2,-0.4 2,-0.5 -0.860 27.7-150.2 -83.6 108.7 -18.4 -19.2 -16.5 65 65 A W E -ad 21 120A 4 54,-2.9 56,-2.1 -2,-0.9 2,-0.2 -0.744 13.5-128.6 -81.1 121.8 -16.9 -22.7 -16.2 66 66 A S E - d 0 121A 0 -45,-2.8 -41,-0.3 -2,-0.5 56,-0.2 -0.538 17.9-166.9 -73.9 134.1 -19.6 -25.2 -15.2 67 67 A V + 0 0 0 54,-2.5 16,-0.2 -2,-0.2 17,-0.2 -0.149 32.9 164.0-113.6 35.4 -18.9 -27.5 -12.2 68 68 A Y - 0 0 28 53,-0.3 2,-0.3 54,-0.1 56,-0.1 -0.150 15.0-177.6 -39.6 139.5 -21.8 -29.7 -13.1 69 69 A V - 0 0 2 54,-0.5 57,-0.1 55,-0.1 58,-0.1 -0.948 35.3 -86.9-141.1 161.2 -22.1 -33.1 -11.6 70 70 A R - 0 0 86 -2,-0.3 3,-0.4 1,-0.1 9,-0.1 -0.334 21.9-152.6 -71.6 148.6 -24.7 -35.9 -12.2 71 71 A S S S+ 0 0 37 1,-0.2 -1,-0.1 -2,-0.0 5,-0.1 0.365 88.4 64.1 -99.6 7.0 -27.9 -35.8 -10.2 72 72 A D S S+ 0 0 97 2,-0.1 -1,-0.2 4,-0.0 -2,-0.1 0.146 92.5 69.5-113.3 17.1 -28.4 -39.6 -10.4 73 73 A L S S- 0 0 88 -3,-0.4 3,-0.4 -4,-0.0 -4,-0.0 -0.955 81.3-106.8-135.4 152.8 -25.3 -40.8 -8.5 74 74 A P S S+ 0 0 125 0, 0.0 -4,-0.1 0, 0.0 -2,-0.1 -0.352 94.2 42.5 -71.3 164.7 -24.2 -40.7 -5.0 75 75 A G > + 0 0 48 3,-0.1 4,-2.3 1,-0.0 5,-0.2 0.787 59.2 154.9 73.2 36.0 -21.4 -38.4 -3.8 76 76 A A H > S+ 0 0 20 -3,-0.4 4,-2.1 1,-0.2 5,-0.1 0.839 72.3 53.3 -61.8 -32.7 -22.5 -35.3 -5.7 77 77 A V H > S+ 0 0 37 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.975 109.2 48.2 -70.2 -49.2 -20.7 -32.9 -3.2 78 78 A T H > S+ 0 0 87 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.934 112.9 48.3 -51.5 -48.7 -17.4 -34.8 -3.6 79 79 A A H X S+ 0 0 11 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.865 107.8 55.3 -64.7 -33.9 -17.7 -34.7 -7.4 80 80 A T H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.911 107.4 49.7 -63.6 -40.7 -18.6 -30.9 -7.3 81 81 A L H X S+ 0 0 76 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.842 109.7 52.0 -65.1 -32.5 -15.3 -30.3 -5.3 82 82 A E H X S+ 0 0 83 -4,-1.8 4,-2.0 -5,-0.2 -2,-0.2 0.874 108.7 50.7 -70.8 -36.2 -13.5 -32.3 -7.9 83 83 A Q H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.922 111.5 47.0 -64.7 -45.3 -15.0 -30.2 -10.7 84 84 A I H X S+ 0 0 8 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.927 109.5 53.8 -62.1 -43.1 -14.0 -27.0 -8.9 85 85 A D H X S+ 0 0 83 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.899 105.2 56.0 -59.1 -38.5 -10.5 -28.4 -8.4 86 86 A C H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.946 108.7 45.8 -57.2 -49.0 -10.4 -29.0 -12.2 87 87 A V H X S+ 0 0 2 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.928 111.9 51.0 -63.4 -45.2 -11.1 -25.4 -12.9 88 88 A R H X S+ 0 0 89 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.924 110.5 49.6 -56.2 -43.2 -8.6 -24.2 -10.3 89 89 A R H X S+ 0 0 84 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.906 108.6 52.7 -66.6 -38.2 -5.9 -26.4 -11.8 90 90 A L H X S+ 0 0 5 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.933 110.2 47.7 -60.8 -44.6 -6.7 -25.1 -15.3 91 91 A I H >< S+ 0 0 15 -4,-2.5 3,-0.5 1,-0.2 7,-0.2 0.947 112.8 49.6 -60.9 -44.5 -6.3 -21.5 -14.1 92 92 A D H 3< S+ 0 0 106 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.817 110.3 49.8 -67.0 -31.0 -3.0 -22.4 -12.4 93 93 A R H 3< S+ 0 0 81 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.738 118.5 37.5 -74.4 -24.2 -1.6 -24.2 -15.5 94 94 A H XX + 0 0 8 -4,-1.5 4,-2.8 -3,-0.5 3,-1.5 -0.412 62.3 148.2-129.1 57.4 -2.4 -21.3 -17.9 95 95 A P T 34 S+ 0 0 75 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.771 71.3 64.6 -68.1 -21.3 -1.8 -18.0 -16.1 96 96 A G T 34 S+ 0 0 52 1,-0.1 3,-0.1 -3,-0.1 -2,-0.1 0.830 119.9 20.7 -65.3 -28.4 -0.7 -16.3 -19.3 97 97 A E T <4 S+ 0 0 70 -3,-1.5 19,-3.3 1,-0.1 2,-0.3 0.683 119.3 56.3-115.6 -25.5 -4.2 -16.7 -20.7 98 98 A L E < -e 116 0A 1 -4,-2.8 2,-0.4 -7,-0.2 19,-0.2 -0.904 52.0-172.9-120.2 144.8 -6.6 -17.3 -17.7 99 99 A R E -e 117 0A 62 17,-2.1 19,-2.8 -2,-0.3 11,-0.1 -0.994 29.4-119.6-133.6 123.4 -7.3 -15.2 -14.6 100 100 A A E -e 118 0A 34 -2,-0.4 2,-0.4 17,-0.2 19,-0.2 -0.331 33.3-164.6 -61.7 137.9 -9.5 -16.4 -11.7 101 101 A A + 0 0 2 17,-2.3 19,-0.2 1,-0.1 3,-0.1 -0.988 28.9 160.7-131.2 131.7 -12.4 -14.0 -11.3 102 102 A L + 0 0 73 -2,-0.4 2,-0.3 17,-0.1 -1,-0.1 0.520 68.9 32.5-114.3 -18.2 -14.8 -13.7 -8.3 103 103 A T S > S- 0 0 42 1,-0.1 4,-1.7 267,-0.0 3,-0.2 -0.867 82.6-104.1-139.6 167.2 -16.3 -10.3 -8.8 104 104 A A H > S+ 0 0 6 -2,-0.3 4,-1.9 1,-0.2 5,-0.2 0.900 121.7 56.6 -61.7 -38.3 -17.3 -7.9 -11.5 105 105 A A H > S+ 0 0 68 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.888 104.0 53.0 -62.5 -31.5 -14.2 -5.9 -10.8 106 106 A D H > S+ 0 0 40 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.886 105.6 55.4 -70.2 -39.0 -12.0 -9.0 -11.5 107 107 A M H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.930 110.2 44.0 -64.0 -42.4 -13.8 -9.4 -14.8 108 108 A E H X S+ 0 0 65 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.874 110.7 55.2 -70.7 -34.9 -12.8 -5.8 -15.7 109 109 A A H X S+ 0 0 30 -4,-2.3 4,-1.9 1,-0.2 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0.682 80.3 -41.3 93.6 17.8 -44.9 -27.0 -7.9 168 168 A G S S+ 0 0 0 30,-0.1 -10,-1.7 31,-0.0 2,-0.4 -0.964 124.5 2.1 130.0-111.5 -41.9 -24.7 -8.5 169 169 A L B -L 157 0B 6 -2,-0.4 -12,-0.2 26,-0.3 2,-0.1 -0.904 68.2-143.6-106.5 135.9 -39.9 -24.0 -5.4 170 170 A S > - 0 0 14 -14,-2.2 4,-2.5 -2,-0.4 5,-0.2 -0.276 41.2 -88.5 -79.0-178.6 -40.8 -25.4 -2.0 171 171 A A H > S+ 0 0 28 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.916 134.6 46.5 -58.9 -42.8 -40.4 -23.5 1.2 172 172 A F H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.872 107.6 58.2 -64.1 -39.0 -36.8 -24.7 1.5 173 173 A G H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.907 106.2 49.1 -54.6 -47.7 -36.3 -23.8 -2.2 174 174 A R H X S+ 0 0 99 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.906 108.4 52.9 -64.4 -35.4 -37.3 -20.3 -1.4 175 175 A E H X S+ 0 0 28 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.880 106.1 54.2 -65.9 -36.2 -34.8 -20.3 1.5 176 176 A V H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.955 108.8 48.6 -61.6 -48.2 -32.1 -21.4 -0.9 177 177 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 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