==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-SEP-98 5TMP . COMPND 2 MOLECULE: PROTEIN (THYMIDYLATE KINASE); . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.LAVIE,N.OSTERMANN,I.SCHLICHTING . 210 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10494.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 165 78.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 11.0 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 . 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 . 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 . 1 0.5 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 . 13 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 45.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 5.2 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 0 0 0 2 0 0 0 2 1 0 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 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 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 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 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 R 0 0 121 0, 0.0 88,-0.0 0, 0.0 93,-0.0 0.000 360.0 360.0 360.0 127.4 34.9 110.6 -7.7 2 3 A S - 0 0 26 87,-0.4 2,-0.3 86,-0.1 92,-0.1 -0.157 360.0-154.8 -59.9 151.1 32.1 109.4 -5.4 3 4 A K - 0 0 44 89,-0.2 92,-2.3 2,-0.0 2,-0.6 -0.968 15.8-137.5-135.8 152.3 32.6 109.5 -1.6 4 5 A Y E -a 95 0A 0 -2,-0.3 130,-1.7 90,-0.2 129,-1.4 -0.921 24.0-177.7-109.8 112.1 31.4 107.8 1.5 5 6 A I E -ab 96 134A 0 90,-2.5 92,-2.8 -2,-0.6 2,-0.4 -0.934 5.5-165.5-111.8 130.0 30.7 110.1 4.4 6 7 A V E -ab 97 135A 0 128,-2.3 130,-2.9 -2,-0.5 2,-0.4 -0.935 9.5-150.5-119.9 139.5 29.5 108.8 7.8 7 8 A I E +ab 98 136A 2 90,-2.4 92,-1.9 -2,-0.4 2,-0.3 -0.899 23.5 176.5-107.7 135.0 28.1 110.6 10.7 8 9 A E E + b 0 137A 1 128,-3.3 130,-3.2 -2,-0.4 2,-0.2 -0.842 15.1 110.7-132.1 169.3 28.7 109.2 14.2 9 10 A G E - b 0 138A 0 -2,-0.3 130,-0.1 128,-0.2 3,-0.1 -0.748 63.1 -56.4 146.0 167.8 28.0 110.0 17.8 10 11 A L S > S- 0 0 4 128,-0.6 3,-1.4 -2,-0.2 2,-0.3 -0.135 72.2 -80.5 -66.1 169.8 26.0 109.1 20.9 11 12 A E T 3 S+ 0 0 31 1,-0.3 138,-0.3 2,-0.1 137,-0.2 -0.591 124.6 30.2 -72.9 134.0 22.2 108.9 20.6 12 13 A G T 3 S+ 0 0 20 -2,-0.3 -1,-0.3 136,-0.2 136,-0.1 0.625 84.1 121.8 91.0 15.0 20.9 112.4 20.9 13 14 A A S < S- 0 0 5 -3,-1.4 -2,-0.1 -4,-0.1 -3,-0.1 0.786 85.5-105.1 -80.4 -30.6 24.0 113.8 19.3 14 15 A G > + 0 0 29 -4,-0.2 4,-2.9 -5,-0.1 5,-0.2 0.680 59.8 158.8 110.8 28.0 22.2 115.5 16.5 15 16 A K H > S+ 0 0 29 -5,-0.2 4,-1.8 1,-0.2 5,-0.1 0.784 74.3 47.2 -51.2 -37.4 23.1 113.2 13.6 16 17 A T H > S+ 0 0 83 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.920 111.9 48.8 -73.8 -45.1 20.1 114.4 11.4 17 18 A T H > S+ 0 0 53 1,-0.2 4,-2.0 2,-0.2 3,-0.4 0.965 113.7 48.2 -56.8 -49.5 20.7 118.0 11.9 18 19 A A H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.865 108.6 54.1 -58.3 -38.8 24.4 117.4 11.1 19 20 A R H X S+ 0 0 71 -4,-1.8 4,-2.1 -5,-0.2 -1,-0.2 0.853 105.1 54.2 -66.2 -34.7 23.3 115.4 8.0 20 21 A N H X S+ 0 0 89 -4,-2.3 4,-2.4 -3,-0.4 -2,-0.2 0.922 108.0 49.3 -63.6 -45.9 21.2 118.4 6.8 21 22 A V H X S+ 0 0 6 -4,-2.0 4,-3.3 1,-0.2 5,-0.2 0.914 109.5 53.8 -59.3 -42.8 24.3 120.7 7.1 22 23 A V H X S+ 0 0 1 -4,-2.1 4,-3.0 1,-0.2 5,-0.2 0.924 109.2 45.8 -58.8 -48.6 26.3 118.2 5.1 23 24 A V H X S+ 0 0 26 -4,-2.1 4,-3.3 2,-0.2 5,-0.3 0.919 114.6 49.5 -61.3 -44.6 23.8 118.0 2.2 24 25 A E H X S+ 0 0 115 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.982 112.8 45.5 -58.3 -58.9 23.6 121.8 2.2 25 26 A T H X S+ 0 0 2 -4,-3.3 4,-1.6 1,-0.2 -2,-0.2 0.948 117.4 44.6 -50.4 -54.6 27.3 122.3 2.2 26 27 A L H <>S+ 0 0 0 -4,-3.0 5,-2.8 1,-0.2 -1,-0.2 0.887 111.3 51.3 -59.0 -43.8 27.8 119.6 -0.5 27 28 A E H ><5S+ 0 0 69 -4,-3.3 3,-1.1 1,-0.2 -1,-0.2 0.867 109.6 53.3 -61.9 -33.5 25.0 120.8 -2.7 28 29 A Q H 3<5S+ 0 0 153 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.819 105.7 52.5 -68.0 -34.6 26.6 124.2 -2.4 29 30 A L T 3<5S- 0 0 73 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.199 128.6 -98.1 -87.4 15.2 29.9 122.8 -3.6 30 31 A G T < 5S+ 0 0 62 -3,-1.1 2,-0.7 1,-0.2 -3,-0.2 0.459 84.9 129.7 85.7 -0.9 28.2 121.4 -6.6 31 32 A I < + 0 0 24 -5,-2.8 -1,-0.2 -6,-0.2 -2,-0.2 -0.813 16.3 144.4 -89.9 113.9 27.7 117.8 -5.2 32 33 A R + 0 0 166 -2,-0.7 2,-0.6 -3,-0.1 -1,-0.2 0.721 40.5 85.0-119.3 -40.1 24.1 116.8 -5.7 33 34 A D + 0 0 96 59,-0.1 61,-1.8 -6,-0.0 2,-0.3 -0.567 60.2 128.1 -72.5 114.0 23.9 113.1 -6.6 34 35 A M E -c 94 0A 31 -2,-0.6 2,-0.3 59,-0.2 61,-0.2 -0.990 41.2-145.3-163.9 157.7 23.9 111.0 -3.3 35 36 A V E -c 95 0A 56 59,-2.9 61,-2.7 -2,-0.3 2,-0.3 -0.907 16.7-135.7-127.5 154.1 22.1 108.3 -1.4 36 37 A F E +c 96 0A 91 -2,-0.3 2,-0.3 59,-0.2 61,-0.2 -0.787 19.4 179.1-110.8 153.6 21.5 107.8 2.4 37 38 A T E -c 97 0A 15 59,-1.8 61,-2.5 -2,-0.3 2,-0.3 -0.974 10.1-155.5-147.5 154.0 21.9 104.7 4.5 38 39 A R E -c 98 0A 94 -2,-0.3 61,-0.2 59,-0.2 62,-0.1 -0.977 23.1-103.4-134.6 149.1 21.5 103.9 8.1 39 40 A E S S+ 0 0 8 59,-2.1 2,-0.1 -2,-0.3 3,-0.1 -0.977 98.6 28.2-129.6 140.9 22.9 101.2 10.4 40 41 A P S S+ 0 0 13 0, 0.0 2,-0.3 0, 0.0 -1,-0.3 0.490 129.4 28.3 -76.7 139.5 21.9 98.8 11.6 41 42 A G + 0 0 0 -2,-0.1 39,-0.1 35,-0.1 5,-0.1 -0.974 43.9 130.8 145.6-159.7 19.6 98.6 8.6 42 43 A G S S+ 0 0 37 -2,-0.3 2,-0.3 1,-0.1 -3,-0.1 0.196 78.4 53.1 98.5 -20.9 19.4 99.6 5.0 43 44 A T S > S- 0 0 22 1,-0.1 4,-3.0 41,-0.0 5,-0.2 -0.926 93.1-103.0-140.8 164.4 18.4 96.3 3.5 44 45 A Q H > S+ 0 0 169 -2,-0.3 4,-1.4 1,-0.2 5,-0.1 0.946 125.4 40.7 -53.0 -53.1 15.6 93.8 4.2 45 46 A L H >> S+ 0 0 81 1,-0.2 4,-2.8 2,-0.2 3,-0.6 0.948 112.6 54.1 -61.5 -50.7 18.0 91.6 6.1 46 47 A A H 3> S+ 0 0 0 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.876 108.6 50.5 -52.0 -40.5 19.8 94.4 7.8 47 48 A E H 3X S+ 0 0 61 -4,-3.0 4,-2.3 2,-0.2 -1,-0.3 0.800 108.5 52.1 -68.7 -30.8 16.4 95.7 9.1 48 49 A K H < S- 0 0 86 -4,-1.9 3,-1.0 -5,-0.4 2,-0.2 -0.355 76.6-114.7 -61.0 129.4 13.8 95.5 20.2 56 57 A I T 3 S+ 0 0 71 1,-0.3 4,-0.1 2,-0.1 -1,-0.1 -0.492 101.8 2.1 -65.2 131.4 13.3 95.1 24.0 57 58 A K T > S+ 0 0 143 -2,-0.2 3,-0.8 2,-0.1 -1,-0.3 0.968 80.5 161.2 50.6 56.6 12.7 91.4 24.6 58 59 A S T < S+ 0 0 38 -3,-1.0 -1,-0.1 1,-0.3 -2,-0.1 0.624 84.8 27.9 -79.3 -14.6 13.3 90.7 20.8 59 60 A V T > S- 0 0 48 1,-0.6 3,-2.1 3,-0.3 -1,-0.3 -0.405 117.6-112.0-140.5 54.3 14.0 87.1 21.9 60 61 A G T < S- 0 0 43 -3,-0.8 -1,-0.6 1,-0.3 -2,-0.1 -0.171 82.4 -18.9 51.8-133.7 11.9 87.0 25.1 61 62 A D T 3 S+ 0 0 151 -4,-0.1 -1,-0.3 -3,-0.1 2,-0.2 0.416 103.5 116.9 -86.3 1.8 13.9 86.8 28.2 62 63 A E < - 0 0 138 -3,-2.1 2,-0.7 1,-0.1 -3,-0.3 -0.508 63.6-132.5 -71.7 136.0 17.1 85.5 26.5 63 64 A V - 0 0 123 -2,-0.2 2,-0.1 -6,-0.1 -2,-0.1 -0.823 16.2-130.7 -93.7 112.5 20.1 87.8 26.8 64 65 A I - 0 0 18 -2,-0.7 2,-0.0 1,-0.1 -5,-0.0 -0.409 31.0-120.2 -59.2 127.6 21.8 88.4 23.5 65 66 A T > - 0 0 84 -2,-0.1 4,-2.4 1,-0.1 3,-0.1 -0.333 16.3-114.5 -70.4 154.3 25.6 87.8 24.2 66 67 A D H > S+ 0 0 69 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.927 117.7 47.5 -54.6 -45.3 28.0 90.6 23.5 67 68 A K H > S+ 0 0 126 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.819 108.4 52.8 -66.9 -33.8 29.7 88.6 20.7 68 69 A A H > S+ 0 0 33 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.888 108.5 55.7 -66.8 -37.1 26.4 87.7 19.1 69 70 A E H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.953 108.9 42.5 -58.9 -54.1 25.7 91.5 19.2 70 71 A V H X S+ 0 0 1 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.930 114.1 53.0 -61.9 -42.5 28.9 92.5 17.3 71 72 A L H X S+ 0 0 99 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.889 110.5 46.1 -61.6 -39.8 28.4 89.6 14.9 72 73 A M H X S+ 0 0 37 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.918 111.4 51.9 -68.9 -41.3 24.8 90.7 14.1 73 74 A F H X S+ 0 0 18 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.918 113.8 46.3 -58.9 -40.3 25.9 94.3 13.8 74 75 A Y H X S+ 0 0 6 -4,-2.8 4,-2.8 2,-0.2 5,-0.3 0.887 107.9 52.5 -72.0 -38.8 28.6 93.0 11.3 75 76 A A H X S+ 0 0 43 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.948 112.9 48.2 -59.7 -44.2 26.2 90.8 9.3 76 77 A A H X S+ 0 0 1 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.926 112.2 49.1 -59.7 -47.0 24.0 93.9 8.9 77 78 A R H X S+ 0 0 5 -4,-2.3 4,-3.1 -5,-0.2 5,-0.2 0.968 110.8 46.6 -61.0 -54.8 27.0 96.1 7.9 78 79 A V H X S+ 0 0 31 -4,-2.8 4,-2.9 1,-0.2 5,-0.4 0.890 111.1 53.5 -60.1 -36.5 28.5 93.8 5.2 79 80 A Q H X S+ 0 0 72 -4,-2.0 4,-2.3 -5,-0.3 5,-0.4 0.951 113.9 41.4 -62.6 -46.3 25.1 93.2 3.7 80 81 A L H X>S+ 0 0 0 -4,-2.1 4,-3.2 -5,-0.2 5,-1.8 0.956 117.3 48.4 -64.9 -49.2 24.4 96.9 3.3 81 82 A V H <>S+ 0 0 4 -4,-3.1 5,-2.7 -5,-0.2 -2,-0.2 0.953 117.5 39.0 -56.6 -54.1 27.9 97.7 2.2 82 83 A E H <5S+ 0 0 120 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.904 126.7 34.1 -66.1 -42.2 28.1 95.0 -0.4 83 84 A T H <5S+ 0 0 73 -4,-2.3 -2,-0.2 -5,-0.4 -3,-0.2 0.775 136.1 10.4 -85.9 -29.4 24.6 95.3 -1.7 84 85 A V T X5S+ 0 0 52 -4,-3.2 4,-1.9 -5,-0.4 -3,-0.2 0.787 122.9 43.2-116.4 -59.9 23.9 99.0 -1.4 85 86 A I H > S+ 0 0 51 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.916 111.4 49.8 -54.6 -42.3 27.4 99.7 -5.8 88 89 A A H >X>S+ 0 0 12 -4,-1.9 5,-1.8 2,-0.2 3,-1.1 0.957 113.5 43.9 -60.6 -53.3 26.3 103.3 -5.3 89 90 A L H ><5S+ 0 0 28 -4,-2.7 3,-1.2 1,-0.3 -87,-0.4 0.901 110.7 57.0 -57.9 -41.2 29.8 104.5 -5.0 90 91 A A H 3<5S+ 0 0 84 -4,-3.5 -1,-0.3 -5,-0.3 -2,-0.2 0.712 105.2 52.1 -64.0 -20.2 30.7 102.4 -8.0 91 92 A N H <<5S- 0 0 136 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.626 123.0-105.4 -90.6 -13.2 28.0 104.3 -9.8 92 93 A G T <<5S+ 0 0 38 -3,-1.2 2,-0.2 -4,-0.8 -3,-0.2 0.271 79.2 133.0 106.8 -9.4 29.4 107.6 -8.9 93 94 A T < - 0 0 20 -5,-1.8 -1,-0.4 -6,-0.2 -59,-0.2 -0.542 55.0-128.6 -75.5 137.3 26.7 108.3 -6.4 94 95 A W E - c 0 34A 27 -61,-1.8 -59,-2.9 -2,-0.2 2,-0.5 -0.560 19.0-145.0 -83.8 154.1 27.9 109.6 -3.0 95 96 A V E -ac 4 35A 0 -92,-2.3 -90,-2.5 -61,-0.2 2,-0.6 -0.982 11.3-166.8-126.9 128.3 26.7 107.9 0.1 96 97 A I E -ac 5 36A 1 -61,-2.7 -59,-1.8 -2,-0.5 2,-0.4 -0.962 18.3-165.3-111.4 115.1 26.0 109.5 3.4 97 98 A G E -ac 6 37A 2 -92,-2.8 -90,-2.4 -2,-0.6 2,-1.0 -0.806 22.4-140.0-107.6 145.1 25.6 107.0 6.1 98 99 A D E S-ac 7 38A 37 -61,-2.5 -59,-2.1 -2,-0.4 -90,-0.1 -0.864 81.5 -18.6 -99.9 96.0 24.1 107.3 9.6 99 100 A R + 0 0 25 -92,-1.9 2,-0.2 -2,-1.0 -1,-0.1 0.243 67.7 168.4 83.8 153.2 26.6 105.2 11.6 100 101 A H >> - 0 0 2 -3,-0.1 3,-1.5 -94,-0.1 4,-0.7 -0.769 59.1 -28.9-165.8-151.3 29.1 102.6 10.5 101 102 A D H 3> S+ 0 0 0 1,-0.3 4,-2.6 -2,-0.2 3,-0.4 0.761 121.4 66.7 -55.0 -32.6 32.0 100.6 11.9 102 103 A L H 3> S+ 0 0 10 1,-0.3 4,-3.5 2,-0.2 -1,-0.3 0.887 96.8 59.9 -59.0 -32.2 33.1 103.3 14.4 103 104 A S H <>>S+ 0 0 10 -3,-1.5 4,-3.0 2,-0.2 5,-0.5 0.897 105.6 45.6 -60.7 -42.5 29.8 102.6 16.2 104 105 A T H X>S+ 0 0 0 -4,-0.7 4,-2.0 -3,-0.4 5,-1.8 0.964 114.7 48.7 -65.0 -49.9 30.8 98.9 16.7 105 106 A Q H <>S+ 0 0 37 -4,-2.6 5,-1.1 3,-0.2 -2,-0.2 0.906 119.8 37.5 -56.5 -44.7 34.2 100.0 17.9 106 107 A A H X>S+ 0 0 0 -4,-3.5 5,-1.8 3,-0.2 4,-1.2 0.976 126.6 33.1 -73.0 -55.7 32.8 102.5 20.2 107 108 A Y H <>S+ 0 0 16 -4,-3.0 5,-2.7 3,-0.2 -3,-0.2 0.939 131.4 29.5 -69.1 -51.0 29.7 100.7 21.5 108 109 A Q I > - 0 0 91 1,-0.1 4,-2.2 2,-0.1 3,-0.9 -0.190 34.2-137.1 -51.0 120.9 38.6 93.3 23.0 116 117 A Q H 3> S+ 0 0 74 1,-0.3 4,-1.1 2,-0.2 -1,-0.1 0.728 100.2 48.6 -49.8 -36.2 39.7 96.2 20.7 117 118 A H H 3> S+ 0 0 137 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.809 108.8 53.3 -80.5 -28.6 42.1 94.1 18.6 118 119 A M H <> S+ 0 0 58 -3,-0.9 4,-2.7 2,-0.2 5,-0.2 0.933 105.6 53.8 -68.3 -43.8 39.5 91.4 18.0 119 120 A L H X S+ 0 0 2 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.896 109.0 50.4 -55.5 -37.6 37.1 94.1 16.8 120 121 A A H X S+ 0 0 44 -4,-1.1 4,-2.4 -5,-0.2 5,-0.3 0.892 107.5 54.1 -66.2 -41.5 39.8 95.1 14.4 121 122 A T H X S+ 0 0 87 -4,-1.9 4,-3.6 2,-0.2 5,-0.2 0.984 110.6 44.1 -55.9 -62.2 40.2 91.6 13.2 122 123 A L H X S+ 0 0 35 -4,-2.7 4,-4.5 1,-0.2 5,-0.4 0.929 110.0 57.0 -48.0 -54.4 36.5 91.2 12.4 123 124 A R H X>S+ 0 0 32 -4,-2.6 4,-3.4 1,-0.2 5,-1.1 0.911 115.5 35.7 -46.7 -50.4 36.5 94.5 10.7 124 125 A D H X5S+ 0 0 83 -4,-2.4 4,-0.6 3,-0.2 -1,-0.2 0.916 116.1 54.6 -73.0 -38.9 39.2 93.5 8.3 125 126 A A H <5S+ 0 0 78 -4,-3.6 -2,-0.2 -5,-0.3 -1,-0.2 0.951 124.3 26.2 -56.4 -48.3 38.0 90.0 8.1 126 127 A V H <5S+ 0 0 54 -4,-4.5 -2,-0.2 -5,-0.2 -3,-0.2 0.927 140.5 17.9 -82.9 -50.5 34.6 91.3 7.1 127 128 A L H ><5S- 0 0 13 -4,-3.4 3,-1.6 -5,-0.4 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