==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-OCT-12 4HS9 . COMPND 2 MOLECULE: LIPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PROTEUS MIRABILIS; . AUTHOR T.P.KORMAN . 287 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12463.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 204 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 19 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 32.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 1 1 0 1 0 1 2 1 0 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 160 0, 0.0 2,-0.2 0, 0.0 282,-0.2 0.000 360.0 360.0 360.0 75.7 -8.0 22.4 2.7 2 2 A S - 0 0 67 34,-0.1 35,-0.1 281,-0.1 34,-0.1 -0.681 360.0 -95.6 -90.4 154.6 -11.2 20.6 1.4 3 3 A T - 0 0 13 -2,-0.2 35,-0.2 1,-0.1 280,-0.1 -0.383 15.3-141.2 -70.0 146.2 -11.0 17.6 -0.9 4 4 A K S S+ 0 0 123 278,-0.1 -1,-0.1 2,-0.1 283,-0.1 0.914 92.1 46.0 -62.8 -48.1 -11.2 17.9 -4.6 5 5 A Y S S- 0 0 41 282,-2.2 68,-0.2 1,-0.1 33,-0.1 -0.740 99.2 -99.8-103.2 144.0 -13.2 14.7 -4.8 6 6 A P - 0 0 4 0, 0.0 68,-3.0 0, 0.0 2,-0.4 -0.287 31.9-122.3 -61.6 146.8 -16.2 13.9 -2.6 7 7 A I E -ab 39 74A 0 31,-2.9 33,-2.1 66,-0.2 2,-0.5 -0.807 21.2-163.5 -90.4 132.3 -15.8 11.6 0.4 8 8 A V E -ab 40 75A 0 66,-2.9 68,-2.7 -2,-0.4 2,-0.4 -0.972 7.8-151.6-120.0 110.1 -18.0 8.5 0.5 9 9 A L E -ab 41 76A 0 31,-2.9 33,-3.0 -2,-0.5 2,-0.4 -0.715 20.0-163.3 -77.0 129.9 -18.3 6.8 3.9 10 10 A V E +ab 42 77A 0 66,-2.7 68,-1.8 -2,-0.4 2,-0.3 -0.979 18.8 156.9-128.4 130.1 -18.9 3.1 3.4 11 11 A H E -a 43 0A 5 31,-1.9 33,-2.7 -2,-0.4 3,-0.1 -0.909 37.9-131.2-141.9 167.6 -20.2 0.5 5.8 12 12 A G S S+ 0 0 0 66,-0.3 31,-0.1 -2,-0.3 2,-0.0 -0.026 79.9 88.3-113.4 27.8 -21.9 -2.9 5.5 13 13 A L > - 0 0 58 32,-0.1 3,-1.9 33,-0.1 32,-0.2 -0.425 55.8-175.8-122.5 65.4 -24.8 -2.6 7.9 14 14 A A T 3 S+ 0 0 47 30,-2.3 32,-0.3 1,-0.3 30,-0.1 -0.246 73.9 37.7 -58.1 138.9 -27.6 -1.1 5.8 15 15 A G T 3> S+ 0 0 23 30,-0.1 4,-2.7 28,-0.0 5,-0.3 0.227 83.2 116.0 97.8 -11.0 -30.6 -0.5 8.0 16 16 A F H <>>S+ 0 0 12 -3,-1.9 4,-3.0 1,-0.2 5,-0.6 0.917 76.3 43.8 -57.8 -52.2 -28.3 0.6 11.0 17 17 A S H >5S+ 0 0 52 1,-0.2 4,-1.2 3,-0.2 -1,-0.2 0.891 116.2 48.4 -68.0 -30.0 -29.5 4.2 11.1 18 18 A E H 45S+ 0 0 144 2,-0.2 -2,-0.2 1,-0.1 -1,-0.2 0.915 121.7 33.8 -72.7 -43.1 -33.2 3.2 10.8 19 19 A I H <5S+ 0 0 114 -4,-2.7 -2,-0.2 1,-0.1 -3,-0.2 0.895 127.7 35.5 -79.2 -40.6 -33.0 0.4 13.5 20 20 A V H <5S- 0 0 29 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.834 100.5-127.4 -90.4 -36.2 -30.5 2.0 15.9 21 21 A G S <> S- 0 0 8 -16,-0.0 3,-1.5 2,-0.0 4,-0.6 -0.635 100.7-145.3 -88.4 80.9 -20.1 6.7 11.5 26 26 A Y T 34 - 0 0 81 -2,-1.8 -2,-0.1 232,-1.7 246,-0.0 -0.332 67.8 -16.4 -69.8 120.6 -21.1 8.5 14.6 27 27 A G T 3> S+ 0 0 27 -2,-0.3 4,-1.3 1,-0.1 -1,-0.3 0.385 109.5 107.4 77.7 -4.0 -20.5 12.2 14.4 28 28 A I H <> S+ 0 0 0 -3,-1.5 4,-2.8 2,-0.2 5,-0.2 0.927 70.8 47.7 -81.7 -47.8 -18.1 11.9 11.4 29 29 A A H X S+ 0 0 26 -4,-0.6 4,-2.9 1,-0.2 5,-0.2 0.902 113.4 53.2 -62.2 -41.5 -20.0 13.1 8.3 30 30 A D H > S+ 0 0 124 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.877 110.4 45.1 -56.0 -50.3 -21.0 16.3 10.4 31 31 A A H X S+ 0 0 26 -4,-1.3 4,-1.1 2,-0.2 -2,-0.2 0.892 113.8 49.9 -64.7 -39.4 -17.4 17.0 11.4 32 32 A L H <>S+ 0 0 0 -4,-2.8 5,-1.7 1,-0.2 3,-0.4 0.924 111.7 47.4 -66.1 -40.7 -16.2 16.5 7.8 33 33 A T H ><5S+ 0 0 69 -4,-2.9 3,-2.3 -5,-0.2 -2,-0.2 0.899 105.1 59.4 -67.9 -33.4 -18.9 18.7 6.4 34 34 A Q H 3<5S+ 0 0 168 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.826 104.2 55.7 -60.2 -28.4 -18.0 21.5 9.1 35 35 A D T 3<5S- 0 0 63 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.350 125.9-102.9 -90.0 3.0 -14.6 21.4 7.5 36 36 A G T < 5S+ 0 0 52 -3,-2.3 -3,-0.2 1,-0.3 2,-0.1 0.342 74.5 134.9 99.2 0.6 -15.9 22.1 3.9 37 37 A H < - 0 0 7 -5,-1.7 2,-0.6 -35,-0.1 -1,-0.3 -0.448 59.3-118.7 -82.5 146.3 -15.7 18.5 2.4 38 38 A Q - 0 0 116 -35,-0.2 -31,-2.9 -33,-0.1 2,-0.4 -0.844 40.7-169.4 -78.4 127.0 -18.5 17.0 0.3 39 39 A V E +a 7 0A 27 -2,-0.6 2,-0.3 -33,-0.2 -31,-0.2 -0.970 16.4 173.0-134.1 130.7 -19.6 13.9 2.2 40 40 A F E -a 8 0A 51 -33,-2.1 -31,-2.9 -2,-0.4 2,-0.4 -0.917 20.0-142.1-122.5 155.5 -22.0 10.9 1.2 41 41 A T E -a 9 0A 61 -2,-0.3 2,-0.6 -33,-0.2 -31,-0.2 -0.982 7.2-163.6-128.1 125.0 -22.7 7.8 3.1 42 42 A A E -a 10 0A 0 -33,-3.0 -31,-1.9 -2,-0.4 2,-0.7 -0.920 4.6-167.2-104.9 113.4 -23.2 4.4 1.4 43 43 A S E -a 11 0A 54 -2,-0.6 2,-0.2 -33,-0.2 -31,-0.2 -0.899 15.0-166.5-101.7 113.3 -24.9 1.8 3.6 44 44 A L - 0 0 7 -33,-2.7 -30,-2.3 -2,-0.7 2,-0.1 -0.657 29.5 -82.0-106.7 159.5 -24.5 -1.6 2.0 45 45 A S > - 0 0 38 -2,-0.2 3,-0.8 -32,-0.2 -32,-0.1 -0.303 27.0-158.3 -59.8 127.2 -26.2 -4.9 2.7 46 46 A A T 3 S+ 0 0 11 -32,-0.3 113,-0.2 1,-0.2 -1,-0.1 0.808 89.1 56.6 -67.2 -33.5 -24.8 -7.0 5.7 47 47 A F T 3 S+ 0 0 133 111,-0.1 -1,-0.2 110,-0.1 2,-0.2 0.178 94.4 81.3 -93.1 13.2 -26.3 -10.3 4.4 48 48 A N S < S- 0 0 59 -3,-0.8 111,-0.2 1,-0.1 2,-0.1 -0.628 84.5 -88.2-112.3 174.0 -24.7 -10.3 1.0 49 49 A S > - 0 0 48 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.305 38.3-110.8 -74.0 164.4 -21.4 -11.3 -0.5 50 50 A N H > S+ 0 0 2 2,-0.2 4,-2.1 1,-0.2 37,-0.1 0.897 119.6 53.6 -60.3 -40.2 -18.5 -8.8 -0.7 51 51 A E H > S+ 0 0 42 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.918 108.4 48.6 -61.2 -43.9 -18.9 -8.8 -4.6 52 52 A V H > S+ 0 0 53 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.887 110.5 50.9 -68.1 -40.4 -22.6 -7.9 -4.3 53 53 A R H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.882 109.3 52.9 -60.5 -39.1 -21.9 -5.1 -1.8 54 54 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.909 108.6 48.9 -63.3 -40.0 -19.3 -3.8 -4.3 55 55 A K H X S+ 0 0 118 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.878 111.0 49.6 -65.8 -38.5 -21.9 -3.8 -7.1 56 56 A Q H X S+ 0 0 60 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.900 110.6 52.3 -62.3 -42.7 -24.4 -1.9 -4.8 57 57 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.887 106.9 51.4 -63.5 -41.3 -21.6 0.5 -4.1 58 58 A W H X S+ 0 0 27 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.925 108.2 51.5 -62.9 -41.8 -20.9 1.1 -7.8 59 59 A Q H X S+ 0 0 113 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.925 111.0 49.6 -60.5 -39.9 -24.5 1.9 -8.4 60 60 A F H X S+ 0 0 58 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.919 114.1 43.7 -59.1 -48.5 -24.4 4.4 -5.5 61 61 A V H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.886 109.0 55.8 -68.8 -45.0 -21.2 6.1 -6.8 62 62 A Q H X S+ 0 0 80 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.924 109.2 51.2 -54.0 -38.7 -22.3 6.3 -10.5 63 63 A T H X S+ 0 0 84 -4,-1.5 4,-1.0 -5,-0.3 -2,-0.2 0.957 112.7 41.0 -66.5 -49.3 -25.4 8.0 -9.2 64 64 A I H X S+ 0 0 20 -4,-1.8 4,-3.2 1,-0.2 5,-0.3 0.866 110.5 58.5 -69.6 -31.6 -23.5 10.7 -7.2 65 65 A L H X S+ 0 0 20 -4,-3.1 4,-1.4 1,-0.2 6,-0.4 0.865 99.6 58.9 -65.6 -32.1 -20.9 11.2 -9.9 66 66 A Q H < S+ 0 0 132 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.894 115.4 35.5 -60.7 -37.6 -23.6 12.2 -12.4 67 67 A E H < S+ 0 0 174 -4,-1.0 -2,-0.2 -3,-0.2 -1,-0.2 0.882 118.4 45.4 -88.8 -35.9 -24.6 15.0 -10.0 68 68 A T H < S- 0 0 37 -4,-3.2 -3,-0.2 1,-0.1 -2,-0.2 0.736 88.2-147.5 -79.1 -17.0 -21.3 16.2 -8.5 69 69 A Q < + 0 0 160 -4,-1.4 -3,-0.1 -5,-0.3 -4,-0.1 0.736 58.6 128.9 46.3 34.6 -19.7 16.2 -12.1 70 70 A T - 0 0 33 -5,-0.3 2,-2.9 -6,-0.2 -4,-0.1 0.342 59.5-143.5 -96.4 0.2 -16.5 15.3 -10.2 71 71 A K S S+ 0 0 134 -6,-0.4 2,-0.3 -66,-0.1 -1,-0.1 -0.191 71.7 42.3 74.4 -55.9 -15.2 12.2 -12.0 72 72 A K - 0 0 35 -2,-2.9 2,-0.3 24,-0.1 24,-0.2 -0.849 61.4-148.4-128.6 164.8 -13.9 10.5 -8.8 73 73 A V E - c 0 96A 0 22,-1.3 24,-2.9 -2,-0.3 25,-1.2 -0.911 14.8-136.2-124.6 151.1 -14.6 9.7 -5.2 74 74 A N E -bc 7 98A 0 -68,-3.0 -66,-2.9 -2,-0.3 2,-0.4 -0.958 28.1-152.4-102.8 117.8 -12.5 9.2 -2.0 75 75 A F E -bc 8 99A 0 23,-3.0 25,-2.6 -2,-0.6 2,-0.5 -0.727 15.2-173.2 -95.0 140.1 -13.8 6.2 -0.2 76 76 A I E +bc 9 100A 1 -68,-2.7 -66,-2.7 -2,-0.4 2,-0.3 -0.954 19.2 178.5-127.0 111.4 -13.5 5.8 3.6 77 77 A G E -bc 10 101A 0 23,-2.8 25,-2.8 -2,-0.5 2,-0.4 -0.836 17.1-156.7-116.2 150.4 -14.7 2.4 4.7 78 78 A H E > - c 0 102A 0 -68,-1.8 3,-2.8 -2,-0.3 -66,-0.3 -0.955 61.4 -27.9-121.7 149.3 -14.9 0.5 8.0 79 79 A S T 3 S+ 0 0 10 23,-1.6 26,-1.8 -2,-0.4 4,-0.3 -0.362 138.7 2.5 57.6-115.7 -15.0 -3.2 8.7 80 80 A Q T >> S+ 0 0 11 -2,-0.2 3,-1.3 24,-0.2 4,-1.2 0.716 117.9 84.8 -72.1 -17.4 -16.6 -4.9 5.6 81 81 A G H <> S+ 0 0 0 -3,-2.8 4,-2.0 1,-0.3 3,-0.4 0.889 80.8 57.4 -53.6 -43.4 -16.8 -1.6 3.9 82 82 A P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.3 0.749 99.7 59.2 -61.3 -29.7 -13.3 -1.6 2.4 83 83 A L H <> S+ 0 0 1 -3,-1.3 4,-1.8 -4,-0.3 -2,-0.2 0.940 107.9 45.2 -65.5 -44.6 -13.9 -4.8 0.6 84 84 A A H X S+ 0 0 0 -4,-1.2 4,-1.9 -3,-0.4 -1,-0.2 0.896 113.5 50.9 -61.7 -41.4 -16.8 -3.2 -1.4 85 85 A C H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.890 107.9 52.4 -60.3 -42.2 -14.6 -0.2 -2.0 86 86 A R H X S+ 0 0 3 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.842 106.3 54.5 -61.1 -38.3 -11.8 -2.4 -3.2 87 87 A Y H X S+ 0 0 20 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.911 111.3 43.7 -60.1 -48.8 -14.2 -4.0 -5.7 88 88 A V H X S+ 0 0 0 -4,-1.9 4,-3.2 1,-0.2 -2,-0.2 0.934 114.8 49.5 -67.7 -44.6 -15.2 -0.6 -7.1 89 89 A A H < S+ 0 0 1 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.875 111.9 48.6 -60.7 -40.5 -11.5 0.5 -7.3 90 90 A A H < S+ 0 0 15 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.878 122.6 32.7 -64.5 -42.9 -10.4 -2.7 -9.0 91 91 A N H < S+ 0 0 71 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.707 132.6 26.3 -75.8 -40.8 -13.2 -2.5 -11.6 92 92 A Y >< + 0 0 72 -4,-3.2 3,-2.0 -5,-0.2 4,-0.2 -0.414 66.5 157.2-132.4 60.6 -13.6 1.2 -12.1 93 93 A P G > S+ 0 0 28 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.772 70.5 63.7 -63.2 -34.0 -10.3 2.8 -11.2 94 94 A D G 3 S+ 0 0 119 1,-0.2 -5,-0.1 -3,-0.1 96,-0.0 0.640 104.0 49.6 -66.1 -11.7 -10.9 5.9 -13.2 95 95 A S G < S+ 0 0 21 -3,-2.0 -22,-1.3 -7,-0.2 2,-0.5 0.291 100.9 74.0-102.4 -2.3 -13.9 6.7 -10.9 96 96 A V E < +c 73 0A 0 -3,-1.5 -22,-0.2 -24,-0.2 3,-0.1 -0.955 46.4 177.8-122.9 115.5 -11.9 6.2 -7.6 97 97 A A E S- 0 0 3 -24,-2.9 95,-1.9 -2,-0.5 2,-0.3 0.877 72.6 -10.1 -78.1 -37.6 -9.4 8.7 -6.2 98 98 A S E -cd 74 192A 0 -25,-1.2 -23,-3.0 93,-0.2 2,-0.4 -0.992 47.3-147.5-159.6 157.0 -8.6 6.7 -3.1 99 99 A V E -cd 75 193A 0 93,-2.3 95,-2.7 -2,-0.3 2,-0.5 -0.983 16.0-171.4-128.2 118.1 -9.6 3.9 -0.8 100 100 A T E -cd 76 194A 0 -25,-2.6 -23,-2.8 -2,-0.4 2,-0.5 -0.960 8.5-158.3-111.1 120.7 -9.0 4.4 2.9 101 101 A S E -cd 77 195A 0 93,-2.7 95,-2.8 -2,-0.5 2,-0.6 -0.893 4.2-166.6-104.1 121.1 -9.6 1.2 5.0 102 102 A I E S-cd 78 196A 4 -25,-2.8 -23,-1.6 -2,-0.5 95,-0.2 -0.946 78.7 -26.7-109.4 112.7 -10.3 1.7 8.7 103 103 A N S S- 0 0 0 93,-2.2 -24,-0.3 -2,-0.6 -1,-0.2 0.920 93.8-177.2 47.4 46.9 -10.1 -1.6 10.6 104 104 A G - 0 0 0 92,-0.4 2,-1.9 136,-0.4 3,-0.3 -0.506 37.6-124.8 -74.8 150.1 -11.0 -3.4 7.4 105 105 A V > + 0 0 0 -26,-1.8 3,-0.6 1,-0.2 135,-0.2 -0.356 53.4 152.9 -87.0 60.9 -11.4 -7.1 7.3 106 106 A N T 3 S+ 0 0 0 -2,-1.9 -1,-0.2 133,-0.4 134,-0.2 0.706 76.4 18.4 -71.2 -24.2 -8.8 -7.3 4.5 107 107 A H T 3 S- 0 0 55 132,-0.5 -1,-0.3 1,-0.3 59,-0.1 0.152 123.3 -84.1-126.9 18.6 -7.6 -10.8 5.2 108 108 A G < - 0 0 4 -3,-0.6 2,-0.5 131,-0.2 128,-0.4 -0.060 37.5 -88.3 99.8 160.3 -10.5 -12.1 7.2 109 109 A S > - 0 0 1 51,-2.6 4,-2.1 48,-0.2 53,-0.3 -0.926 16.1-153.6-111.7 121.4 -11.8 -12.2 10.8 110 110 A E H > S+ 0 0 45 -2,-0.5 4,-2.2 1,-0.2 -1,-0.1 0.799 100.4 55.0 -60.1 -29.0 -10.7 -15.0 13.2 111 111 A I H > S+ 0 0 1 123,-0.6 4,-2.9 2,-0.2 -1,-0.2 0.867 104.9 51.1 -76.1 -34.2 -13.9 -14.4 15.1 112 112 A A H > S+ 0 0 1 122,-0.3 4,-2.1 48,-0.2 -2,-0.2 0.909 110.5 50.6 -64.7 -39.6 -16.0 -15.0 11.9 113 113 A D H X S+ 0 0 47 -4,-2.1 4,-1.7 47,-0.2 -2,-0.2 0.912 111.6 47.9 -59.5 -50.3 -14.0 -18.2 11.4 114 114 A L H X S+ 0 0 25 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.901 109.6 51.5 -60.7 -43.9 -14.7 -19.3 15.0 115 115 A Y H X S+ 0 0 7 -4,-2.9 4,-2.5 1,-0.2 5,-0.2 0.928 107.9 53.6 -60.0 -40.6 -18.5 -18.5 14.7 116 116 A R H X S+ 0 0 91 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.916 106.7 51.0 -59.1 -43.9 -18.6 -20.6 11.5 117 117 A R H <>S+ 0 0 113 -4,-1.7 5,-2.7 2,-0.2 4,-0.4 0.879 110.1 51.8 -63.1 -34.9 -17.1 -23.6 13.4 118 118 A I H ><5S+ 0 0 23 -4,-2.0 3,-1.1 2,-0.2 -2,-0.2 0.913 108.4 48.3 -65.6 -49.6 -19.7 -23.1 16.1 119 119 A I H 3<5S+ 0 0 49 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.831 110.4 53.5 -62.2 -30.6 -22.6 -23.2 13.7 120 120 A R T 3<5S- 0 0 131 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.568 112.9-123.6 -81.7 -4.3 -21.1 -26.3 12.1 121 121 A K T < 5 + 0 0 187 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.877 48.8 168.3 62.3 39.5 -21.0 -27.9 15.6 122 122 A D < - 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