==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 09-SEP-10 3ANV . COMPND 2 MOLECULE: D-SERINE DEHYDRATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR H.TANAKA,M.SENDA,N.VENUGOPALAN,A.YAMAMOTO,T.SENDA,T.ISHIDA,K . 374 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15354.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 69.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 10.7 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 . 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 . 1 0.3 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 . 24 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.9 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 2 1 1 1 1 1 0 1 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 3 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 . 1 0 1 5 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 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 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 2 A W > 0 0 140 0, 0.0 3,-2.2 0, 0.0 363,-0.3 0.000 360.0 360.0 360.0 11.5 18.3 55.3 36.1 2 3 A L T 3 + 0 0 124 1,-0.3 363,-0.2 363,-0.1 3,-0.1 -0.291 360.0 15.4 -57.7 132.2 19.3 58.9 37.0 3 4 A G T 3 S+ 0 0 40 361,-3.4 -1,-0.3 1,-0.3 362,-0.1 0.141 95.7 139.4 90.6 -19.1 22.9 59.6 36.0 4 5 A A < - 0 0 21 -3,-2.2 360,-2.5 359,-0.1 -1,-0.3 -0.249 57.8-114.3 -64.5 141.7 23.0 56.6 33.7 5 6 A L B > -A 363 0A 87 358,-0.2 3,-2.4 1,-0.1 4,-0.3 -0.532 27.6-119.4 -71.6 142.1 24.6 56.7 30.3 6 7 A L G > S+ 0 0 38 356,-1.7 3,-1.8 1,-0.3 -1,-0.1 0.826 111.6 58.4 -56.6 -38.0 22.1 56.3 27.4 7 8 A D G 3 S+ 0 0 97 1,-0.3 -1,-0.3 355,-0.2 4,-0.1 0.483 98.8 64.2 -73.9 0.4 23.7 53.1 26.0 8 9 A T G < S+ 0 0 71 -3,-2.4 -1,-0.3 2,-0.1 -2,-0.2 0.566 80.4 105.3 -93.2 -15.1 23.1 51.6 29.4 9 10 A L S < S- 0 0 1 -3,-1.8 2,-0.3 -4,-0.3 4,-0.1 -0.308 80.8-105.9 -70.3 151.8 19.3 51.8 29.2 10 11 A P - 0 0 60 0, 0.0 255,-0.1 0, 0.0 -1,-0.1 -0.632 60.1 -92.9 -74.6 130.9 17.1 48.7 28.6 11 12 A T S S+ 0 0 25 -2,-0.3 255,-0.2 -4,-0.1 2,-0.1 -0.681 100.8 44.8-105.6 157.9 15.9 49.0 25.0 12 13 A P S S+ 0 0 36 0, 0.0 2,-0.4 0, 0.0 254,-0.2 0.522 81.1 169.3 -75.0 147.3 13.8 49.8 23.3 13 14 A A E -B 265 0A 1 252,-2.0 252,-3.3 -2,-0.1 2,-0.6 -0.992 34.3-136.8-134.3 127.2 13.8 53.1 25.2 14 15 A L E -Bc 264 356A 0 341,-0.5 343,-3.2 -2,-0.4 2,-0.4 -0.744 31.0-169.4 -81.7 120.8 12.1 56.4 24.4 15 16 A T E -Bc 263 357A 3 248,-3.0 248,-2.2 -2,-0.6 2,-0.5 -0.923 13.6-163.5-116.5 142.0 14.6 59.2 25.1 16 17 A I E -Bc 262 358A 0 341,-2.4 343,-2.3 -2,-0.4 2,-0.9 -0.980 19.3-136.5-122.9 120.5 14.0 62.9 25.3 17 18 A D E > - c 0 359A 46 244,-2.5 4,-2.6 -2,-0.5 5,-0.2 -0.655 15.0-158.0 -72.9 106.8 16.9 65.4 25.1 18 19 A R H > S+ 0 0 80 341,-2.5 4,-2.6 -2,-0.9 5,-0.2 0.821 89.4 55.3 -59.4 -31.0 16.0 67.8 27.8 19 20 A T H > S+ 0 0 64 340,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.905 111.1 43.8 -68.4 -43.5 18.2 70.5 26.3 20 21 A T H > S+ 0 0 8 2,-0.2 4,-2.8 -3,-0.2 -2,-0.2 0.936 116.1 46.7 -65.1 -45.4 16.4 70.2 22.9 21 22 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.897 112.2 49.9 -66.5 -41.3 13.0 70.1 24.5 22 23 A R H X S+ 0 0 81 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.930 112.6 49.2 -57.8 -46.9 13.7 73.1 26.8 23 24 A R H X S+ 0 0 92 -4,-2.0 4,-3.0 -5,-0.2 -2,-0.2 0.933 109.9 49.6 -59.0 -48.8 14.9 75.0 23.8 24 25 A N H X S+ 0 0 3 -4,-2.8 4,-2.0 219,-0.3 -1,-0.2 0.920 112.5 48.9 -59.0 -41.2 11.8 74.1 21.7 25 26 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 218,-0.2 -1,-0.2 0.915 113.1 45.3 -65.1 -45.4 9.6 75.2 24.5 26 27 A E H X S+ 0 0 68 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.897 110.6 54.8 -68.0 -39.5 11.4 78.5 25.0 27 28 A R H X S+ 0 0 98 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.913 108.7 47.0 -59.1 -44.0 11.5 79.2 21.3 28 29 A M H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.894 111.0 52.9 -67.9 -35.1 7.7 78.8 20.9 29 30 A R H X S+ 0 0 95 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.887 110.6 47.4 -64.7 -37.6 7.2 81.0 24.0 30 31 A E H X S+ 0 0 91 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.897 106.8 55.6 -73.0 -39.3 9.4 83.7 22.4 31 32 A R H X S+ 0 0 45 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.943 111.1 46.3 -55.1 -48.4 7.6 83.5 19.0 32 33 A C H X>S+ 0 0 2 -4,-2.0 5,-2.3 2,-0.2 4,-1.3 0.881 110.8 51.6 -61.2 -42.5 4.4 84.2 20.8 33 34 A R H ><5S+ 0 0 162 -4,-1.9 3,-0.6 1,-0.2 -2,-0.2 0.938 109.8 50.2 -61.1 -43.1 5.9 87.1 22.8 34 35 A A H 3<5S+ 0 0 69 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.858 113.1 46.5 -64.2 -32.2 7.2 88.6 19.6 35 36 A L H 3<5S- 0 0 30 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.668 110.9-121.3 -80.7 -19.3 3.7 88.3 18.1 36 37 A G T <<5S+ 0 0 66 -4,-1.3 2,-0.3 -3,-0.6 -3,-0.2 0.733 72.7 118.8 83.3 23.9 2.0 89.7 21.1 37 38 A V < - 0 0 13 -5,-2.3 -1,-0.3 -6,-0.1 199,-0.3 -0.787 64.8-109.6-119.3 160.9 -0.2 86.6 21.6 38 39 A R E -g 236 0B 124 197,-2.9 199,-2.2 -2,-0.3 2,-0.5 -0.557 25.6-131.1 -83.8 155.7 -0.5 84.1 24.4 39 40 A L E -g 237 0B 31 197,-0.2 199,-0.2 -2,-0.2 -10,-0.0 -0.940 21.0-179.1-105.9 123.8 0.8 80.5 24.1 40 41 A R - 0 0 8 197,-3.2 23,-0.2 -2,-0.5 22,-0.1 -0.817 21.8-152.1-117.0 88.2 -1.6 77.6 25.1 41 42 A P - 0 0 3 0, 0.0 23,-2.0 0, 0.0 2,-0.4 -0.369 9.2-132.1 -64.6 135.8 0.5 74.5 24.5 42 43 A H B -h 64 0B 16 197,-2.1 3,-0.4 21,-0.2 23,-0.2 -0.739 14.3-157.6 -82.4 133.3 -1.4 71.4 23.6 43 44 A V >> + 0 0 0 21,-2.7 4,-3.4 -2,-0.4 3,-1.1 0.397 63.9 100.6 -95.2 4.2 -0.1 68.5 25.8 44 45 A K T 34 S+ 0 0 38 1,-0.3 -1,-0.2 20,-0.3 21,-0.1 0.676 71.7 65.7 -70.8 -14.7 -1.1 65.5 23.8 45 46 A T T 34 S+ 0 0 3 -3,-0.4 -1,-0.3 1,-0.1 305,-0.2 0.844 125.9 7.4 -69.6 -33.4 2.3 65.0 22.3 46 47 A H T <4 S- 0 0 2 -3,-1.1 -2,-0.2 2,-0.1 -1,-0.1 0.642 77.3-156.7-120.8 -30.7 3.9 64.1 25.6 47 48 A K < + 0 0 41 -4,-3.4 324,-2.0 1,-0.2 2,-0.4 0.787 49.4 128.9 51.2 33.3 1.0 63.9 28.1 48 49 A T > - 0 0 0 -5,-0.2 4,-2.3 322,-0.2 -1,-0.2 -0.922 66.0-136.2-120.3 147.4 3.3 64.5 31.1 49 50 A L H > S+ 0 0 52 -2,-0.4 4,-2.5 320,-0.4 5,-0.1 0.912 110.4 53.0 -56.0 -44.6 3.2 67.0 34.0 50 51 A E H > S+ 0 0 68 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.903 109.4 46.0 -63.0 -42.7 6.9 67.6 33.4 51 52 A G H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.907 111.9 53.2 -65.6 -39.4 6.4 68.4 29.7 52 53 A G H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 8,-0.2 0.891 106.0 53.8 -60.1 -39.8 3.5 70.6 30.6 53 54 A L H <>S+ 0 0 53 -4,-2.5 5,-2.9 2,-0.2 6,-0.2 0.911 112.6 43.2 -62.7 -45.4 5.8 72.5 33.1 54 55 A L H ><5S+ 0 0 33 -4,-1.9 3,-2.2 3,-0.2 -2,-0.2 0.957 113.6 48.7 -62.5 -55.2 8.3 73.2 30.3 55 56 A A H 3<5S+ 0 0 3 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.841 114.1 49.0 -55.3 -31.3 5.8 74.2 27.6 56 57 A T T ><5S- 0 0 8 -4,-1.8 3,-1.3 -5,-0.2 -1,-0.3 0.368 112.3-120.0 -92.3 0.5 4.2 76.5 30.2 57 58 A G T < 5S- 0 0 28 -3,-2.2 -3,-0.2 1,-0.2 -2,-0.1 0.822 71.2 -55.5 60.0 32.4 7.5 78.1 31.3 58 59 A G T 3 S- 0 0 19 1,-0.1 4,-2.3 307,-0.1 5,-0.1 -0.955 75.6-112.4-146.5 164.4 -9.3 63.9 26.7 68 69 A L H > S+ 0 0 6 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.794 116.3 60.1 -68.5 -27.9 -10.9 64.0 30.1 69 70 A A H > S+ 0 0 9 2,-0.2 4,-2.6 304,-0.2 5,-0.2 0.947 107.9 44.0 -67.1 -43.4 -8.2 61.7 31.4 70 71 A E H > S+ 0 0 0 303,-0.2 4,-3.1 2,-0.2 5,-0.4 0.944 112.2 53.9 -59.4 -46.6 -5.6 64.4 30.5 71 72 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.943 113.5 42.1 -53.2 -50.2 -7.9 67.1 32.0 72 73 A R H X S+ 0 0 90 -4,-2.6 4,-3.2 2,-0.2 5,-0.2 0.918 114.5 50.3 -63.4 -50.7 -8.1 65.2 35.3 73 74 A F H X S+ 0 0 58 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.911 115.0 42.6 -53.3 -51.4 -4.3 64.3 35.4 74 75 A F H <>S+ 0 0 0 -4,-3.1 5,-2.4 -5,-0.2 -2,-0.2 0.924 114.1 51.7 -69.5 -37.2 -3.2 67.9 34.7 75 76 A A H ><5S+ 0 0 10 -4,-2.7 3,-2.0 -5,-0.4 -2,-0.2 0.948 110.6 48.5 -57.5 -48.6 -5.9 69.2 37.2 76 77 A D H 3<5S+ 0 0 109 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.800 106.4 59.4 -63.1 -25.9 -4.6 66.8 39.8 77 78 A G T 3<5S- 0 0 22 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.391 125.3-101.0 -83.3 4.5 -1.1 68.0 39.0 78 79 A G T < 5S+ 0 0 39 -3,-2.0 -3,-0.2 1,-0.3 2,-0.2 0.625 74.9 140.0 88.0 13.1 -2.0 71.6 39.9 79 80 A F < + 0 0 3 -5,-2.4 2,-0.3 -6,-0.1 -1,-0.3 -0.520 24.4 178.6 -83.3 160.5 -2.5 73.0 36.4 80 81 A D E +i 61 0B 18 -20,-1.7 -18,-1.8 1,-0.2 -17,-0.2 -0.920 52.8 60.3-154.2 175.7 -5.3 75.4 35.7 81 82 A D E S+ 0 0 42 24,-0.4 -18,-2.1 -2,-0.3 2,-0.5 0.994 74.1 172.0 54.7 65.0 -6.7 77.4 32.7 82 83 A I E -ij 63 106B 0 23,-2.2 25,-3.0 -20,-0.2 2,-0.6 -0.922 23.6-157.8-112.8 125.3 -7.2 74.1 31.0 83 84 A L E -ij 64 107B 0 -20,-2.6 -18,-2.4 -2,-0.5 2,-1.1 -0.903 12.2-145.5-104.5 121.1 -9.0 73.9 27.7 84 85 A L E -i 65 0B 2 23,-3.1 2,-2.1 -2,-0.6 25,-0.5 -0.752 18.3-159.5 -78.7 101.0 -10.6 70.6 26.7 85 86 A A E + 0 0 18 -20,-2.5 -1,-0.1 -2,-1.1 23,-0.1 -0.375 57.7 85.2 -90.4 61.2 -9.9 71.0 23.0 86 87 A Y E S- 0 0 133 -2,-2.1 23,-0.8 23,-0.1 -2,-0.1 -0.983 97.7 -75.5-159.4 143.4 -12.6 68.5 21.9 87 88 A P E - j 0 109B 55 0, 0.0 23,-0.2 0, 0.0 -2,-0.1 -0.282 69.1-100.1 -47.9 119.9 -16.3 68.6 21.2 88 89 A V - 0 0 7 21,-2.8 2,-1.2 1,-0.1 23,-0.1 -0.189 36.1-118.5 -53.1 132.1 -17.6 68.7 24.8 89 90 A P > - 0 0 29 0, 0.0 3,-1.9 0, 0.0 7,-0.2 -0.633 27.6-169.6 -80.5 101.0 -18.6 65.1 25.6 90 91 A T G > S+ 0 0 57 -2,-1.2 3,-0.9 1,-0.3 4,-0.1 0.793 83.9 59.6 -65.9 -26.5 -22.3 65.5 26.3 91 92 A A G 3 S+ 0 0 101 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.655 109.9 43.2 -70.7 -16.6 -22.5 62.0 27.6 92 93 A R G X> + 0 0 78 -3,-1.9 4,-1.9 1,-0.1 3,-0.6 -0.137 69.9 131.1-120.0 37.8 -19.9 62.8 30.3 93 94 A L H <> + 0 0 18 -3,-0.9 4,-3.1 1,-0.2 5,-0.3 0.852 67.8 62.5 -65.3 -30.2 -21.1 66.2 31.5 94 95 A E H 3> S+ 0 0 86 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.907 105.9 46.3 -59.5 -41.0 -20.9 65.2 35.1 95 96 A E H <> S+ 0 0 73 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.929 112.8 49.4 -64.8 -46.8 -17.2 64.8 34.8 96 97 A C H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.935 111.6 49.3 -56.7 -44.9 -16.8 68.1 32.9 97 98 A A H X S+ 0 0 5 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.846 106.3 55.9 -67.8 -35.7 -18.8 69.9 35.6 98 99 A G H X S+ 0 0 25 -4,-1.9 4,-1.6 -5,-0.3 -1,-0.2 0.904 112.0 43.5 -60.4 -41.0 -16.7 68.4 38.3 99 100 A L H X S+ 0 0 7 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.906 110.2 55.0 -70.2 -40.0 -13.6 69.8 36.6 100 101 A A H < S+ 0 0 8 -4,-2.6 6,-0.2 1,-0.2 -2,-0.2 0.869 111.6 46.2 -61.0 -34.2 -15.4 73.2 36.0 101 102 A R H < S+ 0 0 116 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.808 114.7 45.5 -78.2 -32.5 -16.1 73.4 39.7 102 103 A R H < S+ 0 0 125 -4,-1.6 2,-0.3 -5,-0.2 -2,-0.2 0.799 107.5 67.3 -78.1 -32.5 -12.6 72.4 40.9 103 104 A L S < S- 0 0 7 -4,-2.5 3,-0.3 -5,-0.1 -23,-0.1 -0.679 71.6-140.3 -97.1 145.6 -10.8 74.7 38.5 104 105 A D S S+ 0 0 140 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.895 101.5 15.8 -55.6 -43.1 -10.6 78.4 38.3 105 106 A A + 0 0 20 -6,-0.1 -23,-2.2 -3,-0.0 2,-0.5 -0.776 65.4 163.4-145.2 98.6 -10.8 78.0 34.5 106 107 A F E -j 82 0B 7 -3,-0.3 25,-0.7 -2,-0.3 2,-0.4 -0.963 23.1-160.1-111.0 121.2 -11.9 74.9 32.7 107 108 A H E -jk 83 131B 14 -25,-3.0 -23,-3.1 -2,-0.5 2,-0.3 -0.796 6.6-167.4-105.7 143.3 -12.8 75.6 29.0 108 109 A V E - k 0 132B 0 23,-2.7 25,-2.7 -2,-0.4 2,-0.3 -0.830 9.1-142.9-122.4 165.4 -14.9 73.5 26.7 109 110 A L E +jk 87 133B 3 -23,-0.8 -21,-2.8 -25,-0.5 2,-0.3 -0.934 21.9 165.6-124.8 148.1 -15.4 73.6 22.9 110 111 A L E - k 0 134B 3 23,-1.9 25,-2.4 -2,-0.3 33,-0.0 -0.972 26.1-176.2-154.5 169.1 -18.5 73.0 20.9 111 112 A D + 0 0 31 -2,-0.3 3,-0.1 23,-0.2 44,-0.1 0.215 64.5 80.2-151.4 16.6 -20.0 73.4 17.5 112 113 A R > - 0 0 113 1,-0.1 4,-2.0 43,-0.1 3,-0.3 -0.997 65.7-141.0-133.0 133.1 -23.6 72.1 17.8 113 114 A P H > S+ 0 0 83 0, 0.0 4,-3.4 0, 0.0 5,-0.2 0.886 107.5 57.4 -58.4 -37.6 -26.7 73.8 19.2 114 115 A E H > S+ 0 0 100 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.888 104.2 52.3 -63.1 -34.7 -27.7 70.5 20.7 115 116 A A H > S+ 0 0 6 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.933 110.9 46.1 -63.0 -46.1 -24.4 70.4 22.6 116 117 A L H X S+ 0 0 17 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.932 110.9 54.3 -59.1 -44.0 -25.1 74.0 23.9 117 118 A A H X S+ 0 0 54 -4,-3.4 4,-1.8 1,-0.2 -2,-0.2 0.901 106.3 51.9 -53.6 -41.4 -28.6 72.7 24.7 118 119 A S H < S+ 0 0 23 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.884 107.4 51.8 -64.9 -37.5 -27.0 69.9 26.7 119 120 A L H >< S+ 0 0 0 -4,-1.9 3,-0.7 1,-0.2 -1,-0.2 0.862 107.0 54.1 -65.7 -36.4 -24.9 72.4 28.7 120 121 A R H 3< S+ 0 0 116 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.888 105.2 51.9 -65.7 -39.9 -28.0 74.3 29.5 121 122 A Q T 3< S+ 0 0 160 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.517 112.4 49.5 -78.6 -2.9 -29.8 71.3 31.0 122 123 A R S < S- 0 0 35 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.1 -0.486 82.3-171.6-129.4 65.2 -26.8 70.6 33.2 123 124 A P - 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