==== 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 29-JAN-09 2ZYV . COMPND 2 MOLECULE: TYROSINE-ESTER SULFOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR T.TERAMOTO,Y.SAKAKIBARA,M.-C.LIU,M.SUIKO,M.KIMURA,Y.KAKUTA . 289 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12700.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 66.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 3.1 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 . 1 0.3 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 . 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 . 17 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 4 2 2 0 0 1 1 2 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 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 0 PARALLEL BRIDGES PER LADDER . 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 6 X D 0 0 146 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 107.6 -25.4 -58.2 6.5 2 7 X V + 0 0 32 80,-0.1 3,-0.4 2,-0.1 16,-0.2 0.659 360.0 83.8 -71.6 -13.9 -27.3 -54.8 6.2 3 8 X F S S+ 0 0 36 1,-0.2 140,-0.3 142,-0.0 139,-0.1 -0.473 85.2 14.3 -94.6 157.0 -24.7 -53.2 8.5 4 9 X R S S+ 0 0 51 138,-2.8 142,-0.4 140,-0.4 -1,-0.2 0.595 81.4 149.4 62.1 19.1 -21.3 -51.6 7.9 5 10 X R - 0 0 96 -3,-0.4 -1,-0.2 138,-0.3 2,-0.1 -0.322 53.1 -93.6 -76.2 161.8 -21.6 -51.4 4.1 6 11 X E - 0 0 149 1,-0.1 11,-0.3 139,-0.1 -1,-0.1 -0.432 47.2-102.9 -67.3 148.5 -19.9 -48.7 1.9 7 12 X L - 0 0 39 9,-0.1 2,-0.4 -2,-0.1 9,-0.2 -0.303 30.5-137.8 -69.0 158.1 -22.0 -45.6 1.1 8 13 X V E -A 15 0A 62 7,-3.1 7,-2.5 5,-0.1 2,-0.2 -0.987 19.4-113.4-124.7 129.5 -23.7 -45.3 -2.3 9 14 X D E -A 14 0A 108 -2,-0.4 2,-0.5 5,-0.2 7,-0.0 -0.403 30.2-175.3 -63.0 128.9 -23.8 -42.0 -4.3 10 15 X V E > S-A 13 0A 9 3,-2.5 3,-2.3 -2,-0.2 -1,-0.0 -0.973 74.7 -31.5-127.0 112.4 -27.2 -40.6 -4.8 11 16 X E T 3 S- 0 0 111 -2,-0.5 -1,-0.1 1,-0.3 96,-0.0 0.870 130.0 -41.8 42.3 46.7 -27.3 -37.5 -7.0 12 17 X G T 3 S+ 0 0 52 1,-0.2 -1,-0.3 153,-0.0 -3,-0.1 0.303 120.9 101.6 93.0 -6.9 -23.8 -36.6 -5.8 13 18 X I E < S-A 10 0A 13 -3,-2.3 -3,-2.5 152,-0.1 2,-0.5 -0.926 72.9-120.0-118.2 131.9 -24.2 -37.4 -2.1 14 19 X P E +A 9 0A 18 0, 0.0 150,-2.7 0, 0.0 151,-0.5 -0.577 44.2 168.1 -71.6 120.0 -23.1 -40.5 -0.2 15 20 X L E -A 8 0A 0 -7,-2.5 -7,-3.1 -2,-0.5 148,-0.0 -0.869 43.8 -75.7-125.4 162.9 -26.1 -42.2 1.3 16 21 X F >> - 0 0 9 -2,-0.3 4,-2.1 -9,-0.2 3,-0.9 -0.277 46.9-116.4 -53.6 141.4 -26.8 -45.6 3.0 17 22 X W H 3> S+ 0 0 29 -11,-0.3 4,-2.1 1,-0.3 -1,-0.1 0.811 114.2 51.6 -50.7 -37.3 -27.0 -48.4 0.4 18 23 X S H 3> S+ 0 0 0 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.773 106.6 52.4 -79.4 -27.4 -30.6 -49.1 1.2 19 24 X I H X4 S+ 0 0 0 -3,-0.9 3,-0.5 2,-0.2 7,-0.2 0.930 111.1 47.9 -67.4 -47.4 -31.7 -45.5 0.8 20 25 X A H >< S+ 0 0 22 -4,-2.1 3,-1.5 1,-0.2 4,-0.2 0.918 108.8 54.8 -57.4 -42.5 -30.0 -45.4 -2.7 21 26 X E H 3< S+ 0 0 115 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.773 117.9 34.6 -64.5 -27.4 -31.8 -48.7 -3.6 22 27 X H T XX S+ 0 0 53 -4,-0.9 4,-1.1 -3,-0.5 3,-1.0 -0.002 79.9 126.3-114.3 26.8 -35.2 -47.2 -2.7 23 28 X W H X> + 0 0 20 -3,-1.5 4,-3.0 1,-0.3 3,-0.5 0.849 66.0 60.0 -58.7 -38.3 -34.5 -43.6 -3.9 24 29 X S H 3> S+ 0 0 83 1,-0.3 4,-1.7 -4,-0.2 -1,-0.3 0.855 103.3 53.6 -59.5 -32.0 -37.5 -43.4 -6.3 25 30 X Q H <4 S+ 0 0 42 -3,-1.0 -1,-0.3 2,-0.2 -2,-0.2 0.820 112.5 44.7 -70.9 -32.5 -39.8 -43.9 -3.2 26 31 X V H X< S+ 0 0 0 -4,-1.1 3,-2.2 -3,-0.5 -2,-0.2 0.954 111.6 49.8 -75.5 -52.4 -38.1 -41.1 -1.4 27 32 X E H 3< S+ 0 0 85 -4,-3.0 84,-0.5 1,-0.3 85,-0.3 0.808 112.1 49.6 -60.6 -27.9 -38.0 -38.6 -4.3 28 33 X S T 3< S+ 0 0 82 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.308 80.5 142.9 -90.8 9.2 -41.8 -39.2 -5.0 29 34 X F < - 0 0 4 -3,-2.2 2,-0.8 1,-0.1 83,-0.4 -0.244 49.5-132.5 -52.6 133.2 -42.7 -38.7 -1.3 30 35 X E - 0 0 150 58,-0.1 -1,-0.1 82,-0.1 2,-0.1 -0.810 23.2-166.3 -95.2 104.5 -46.0 -36.9 -0.9 31 36 X A - 0 0 10 -2,-0.8 82,-0.0 4,-0.0 80,-0.0 -0.311 10.5-137.6 -75.8 170.0 -45.8 -34.0 1.5 32 37 X R > - 0 0 68 66,-0.1 3,-2.0 -2,-0.1 84,-0.1 -0.946 23.1-111.9-130.0 151.8 -48.9 -32.3 3.0 33 38 X P T 3 S+ 0 0 90 0, 0.0 86,-0.3 0, 0.0 -1,-0.0 0.789 115.7 45.8 -57.9 -29.7 -49.4 -28.5 3.5 34 39 X D T 3 S+ 0 0 76 84,-0.1 2,-0.1 2,-0.1 -3,-0.0 0.265 82.7 122.2 -99.3 9.5 -49.4 -28.7 7.3 35 40 X D < - 0 0 1 -3,-2.0 84,-0.7 62,-0.1 2,-0.6 -0.469 53.9-145.9 -61.7 140.5 -46.3 -31.1 7.6 36 41 X I E -bc 99 119B 9 62,-2.6 64,-3.0 -2,-0.1 2,-0.6 -0.972 12.5-153.0-108.6 120.7 -43.5 -29.6 9.7 37 42 X L E -bc 100 120B 0 82,-2.0 84,-3.4 -2,-0.6 2,-0.6 -0.833 5.6-159.9 -94.7 121.5 -40.1 -30.7 8.3 38 43 X I E -bc 101 121B 0 62,-3.7 64,-2.2 -2,-0.6 2,-0.5 -0.921 19.4-174.3 -96.0 119.0 -37.2 -30.9 10.8 39 44 X S E +bc 102 122B 0 82,-2.8 84,-1.9 -2,-0.6 2,-0.3 -0.961 12.2 150.3-123.1 126.4 -34.1 -30.7 8.7 40 45 X T E - c 0 123B 0 62,-1.9 84,-0.1 -2,-0.5 3,-0.1 -0.996 48.7-111.9-148.6 152.3 -30.6 -31.1 10.0 41 46 X Y S > S- 0 0 0 82,-0.7 3,-1.0 -2,-0.3 5,-0.2 -0.674 70.4 -78.1 -69.5 142.9 -27.1 -32.3 9.1 42 47 X P T 3 S+ 0 0 3 0, 0.0 92,-0.1 0, 0.0 -1,-0.1 -0.093 115.6 17.0 -47.4 143.4 -26.6 -35.4 11.3 43 48 X K T 3 S+ 0 0 22 90,-0.1 90,-0.1 -3,-0.1 91,-0.1 0.665 89.8 116.0 74.2 20.3 -25.8 -34.8 15.0 44 49 X S S < S- 0 0 0 -3,-1.0 144,-0.2 79,-0.1 -1,-0.1 0.423 99.6 -71.5-104.1 2.1 -26.9 -31.2 14.9 45 50 X G S > S+ 0 0 10 -4,-0.1 4,-2.6 78,-0.1 5,-0.3 0.584 82.6 140.5 118.6 20.4 -29.9 -31.4 17.4 46 51 X T H > S+ 0 0 7 -5,-0.2 4,-2.5 1,-0.2 5,-0.2 0.925 77.1 43.4 -57.1 -49.4 -32.5 -33.3 15.4 47 52 X T H > S+ 0 0 12 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.900 112.6 54.1 -66.7 -41.1 -33.7 -35.4 18.3 48 53 X W H > S+ 0 0 38 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.957 114.2 39.4 -56.9 -54.7 -33.7 -32.4 20.6 49 54 X V H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.860 112.6 56.8 -68.9 -33.7 -35.9 -30.3 18.3 50 55 X S H X S+ 0 0 2 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.906 109.2 46.5 -61.0 -41.8 -38.1 -33.3 17.4 51 56 X E H X S+ 0 0 4 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.926 111.4 51.9 -65.1 -45.6 -38.9 -33.9 21.1 52 57 X I H X S+ 0 0 2 -4,-2.2 4,-2.7 -5,-0.2 -2,-0.2 0.951 111.4 47.4 -53.7 -50.2 -39.6 -30.1 21.5 53 58 X L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.910 112.0 48.4 -61.0 -44.7 -42.0 -30.2 18.6 54 59 X D H X S+ 0 0 5 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.895 111.6 50.6 -64.4 -38.1 -43.8 -33.3 19.8 55 60 X L H <>S+ 0 0 1 -4,-2.8 5,-3.4 2,-0.2 6,-0.4 0.918 110.9 49.5 -61.9 -44.0 -44.1 -31.7 23.3 56 61 X I H ><5S+ 0 0 7 -4,-2.7 3,-1.4 1,-0.2 -2,-0.2 0.928 110.7 49.5 -57.7 -47.9 -45.6 -28.5 21.7 57 62 X Y H 3<5S+ 0 0 50 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.726 116.9 42.5 -65.6 -22.4 -48.1 -30.6 19.7 58 63 X N T ><5S- 0 0 30 -4,-1.1 3,-1.5 -3,-0.3 -1,-0.3 0.116 115.0-112.4-110.7 16.1 -49.1 -32.4 22.9 59 64 X N T < 5S- 0 0 96 -3,-1.4 -3,-0.2 1,-0.3 3,-0.1 0.786 72.0 -57.1 58.7 33.7 -49.1 -29.4 25.2 60 65 X G T 3 - 0 0 52 -3,-1.5 4,-1.7 -6,-0.4 -1,-0.2 -0.604 26.5-166.6 -77.6 102.5 -47.8 -33.7 28.2 62 67 X A T 4 S+ 0 0 20 -2,-1.0 4,-0.2 1,-0.2 -1,-0.2 0.832 84.1 52.2 -58.7 -40.2 -44.9 -36.1 29.0 63 68 X E T >4 S+ 0 0 136 1,-0.2 3,-1.6 2,-0.2 -1,-0.2 0.920 107.3 51.3 -66.4 -43.1 -47.0 -39.3 29.0 64 69 X K G >4 S+ 0 0 116 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.874 106.6 55.2 -60.2 -37.2 -48.4 -38.6 25.6 65 70 X C G 3< S+ 0 0 1 -4,-1.7 -1,-0.3 1,-0.3 3,-0.2 0.509 101.4 60.7 -76.4 -1.4 -44.9 -38.0 24.3 66 71 X K G < + 0 0 89 -3,-1.6 -1,-0.3 -4,-0.2 -2,-0.2 0.284 69.5 104.7-103.2 7.4 -44.1 -41.5 25.7 67 72 X R S < S- 0 0 129 -3,-1.5 2,-0.3 1,-0.1 -1,-0.1 0.760 97.9 -14.4 -56.4 -30.4 -46.7 -43.2 23.4 68 73 X D S S- 0 0 69 -3,-0.2 -1,-0.1 -4,-0.2 2,-0.0 -0.972 88.8 -67.5-162.5 173.0 -43.7 -44.4 21.3 69 74 X A >> - 0 0 4 -2,-0.3 4,-2.1 1,-0.1 3,-2.1 -0.329 49.6-112.5 -64.2 151.2 -40.0 -43.9 20.6 70 75 X I H 3> S+ 0 0 4 162,-2.2 4,-3.1 1,-0.3 -1,-0.1 0.840 116.1 62.6 -55.4 -35.8 -39.0 -40.6 19.0 71 76 X Y H 34 S+ 0 0 44 1,-0.2 5,-0.5 2,-0.2 -1,-0.3 0.588 111.1 38.3 -72.2 -9.1 -38.1 -42.4 15.7 72 77 X K H <4 S+ 0 0 92 -3,-2.1 -1,-0.2 3,-0.1 -2,-0.2 0.684 116.0 50.9-102.6 -32.6 -41.7 -43.5 15.3 73 78 X R H < S+ 0 0 8 -4,-2.1 26,-0.4 1,-0.3 -2,-0.2 0.886 126.8 25.2 -69.7 -38.4 -43.3 -40.3 16.6 74 79 X V S < S- 0 0 3 -4,-3.1 -1,-0.3 -5,-0.2 26,-0.2 -0.833 95.1-144.3-129.3 85.6 -41.1 -38.2 14.2 75 80 X P - 0 0 0 0, 0.0 26,-2.7 0, 0.0 2,-1.1 -0.247 12.8-126.6 -62.4 139.4 -40.2 -40.6 11.3 76 81 X F B > -d 101 0B 31 -5,-0.5 3,-1.1 1,-0.2 11,-0.3 -0.767 31.1-155.3 -82.1 97.0 -36.8 -40.3 9.6 77 82 X M T 3 S+ 0 0 0 24,-2.3 11,-0.5 -2,-1.1 -1,-0.2 0.849 80.9 36.7 -50.8 -57.1 -38.3 -39.9 6.1 78 83 X E T 3 S+ 0 0 0 23,-0.3 2,-1.0 9,-0.2 -1,-0.3 0.566 87.6 108.9 -79.2 -9.9 -35.5 -41.2 3.8 79 84 X L < + 0 0 28 -3,-1.1 8,-2.4 7,-0.1 2,-0.4 -0.590 39.0 160.0 -76.2 105.2 -34.3 -44.0 6.1 80 85 X I E +F 86 0C 4 -2,-1.0 6,-0.2 6,-0.2 -58,-0.1 -0.998 7.4 168.4-126.2 124.2 -35.4 -47.2 4.4 81 86 X I E >> -F 85 0C 11 4,-3.1 3,-2.3 -2,-0.4 4,-2.1 -0.973 39.6-113.4-137.0 119.3 -33.7 -50.4 5.4 82 87 X P T 34 S+ 0 0 59 0, 0.0 -80,-0.1 0, 0.0 4,-0.1 -0.287 99.9 7.8 -61.9 137.2 -35.2 -53.8 4.3 83 88 X G T 34 S+ 0 0 87 1,-0.1 3,-0.1 3,-0.0 0, 0.0 0.309 131.6 57.0 80.5 -6.3 -36.5 -55.8 7.2 84 89 X I T <4 S- 0 0 66 -3,-2.3 2,-0.3 1,-0.3 -1,-0.1 0.768 107.5 -20.5-121.4 -55.4 -35.9 -52.9 9.6 85 90 X T E < -F 81 0C 45 -4,-2.1 -4,-3.1 4,-0.0 -1,-0.3 -0.994 32.6-163.3-161.3 154.1 -37.6 -49.6 8.8 86 91 X N E > -F 80 0C 38 -2,-0.3 4,-2.3 -6,-0.2 -6,-0.2 -0.783 5.1-172.6-145.3 100.3 -39.3 -47.5 6.1 87 92 X G H > S+ 0 0 0 -8,-2.4 4,-2.4 -11,-0.3 -9,-0.2 0.846 86.1 55.0 -63.6 -35.2 -39.7 -43.8 6.9 88 93 X V H > S+ 0 0 3 -11,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.943 111.6 42.9 -64.1 -47.6 -41.7 -43.1 3.7 89 94 X E H > S+ 0 0 78 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.890 111.7 55.0 -68.2 -37.9 -44.3 -45.8 4.5 90 95 X M H < S+ 0 0 50 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.935 114.0 41.3 -57.0 -47.6 -44.4 -44.8 8.2 91 96 X L H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.883 107.7 60.3 -68.4 -39.8 -45.2 -41.2 7.2 92 97 X N H 3< S+ 0 0 61 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.845 110.8 43.0 -54.7 -35.4 -47.7 -42.3 4.5 93 98 X N T 3< S+ 0 0 133 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.299 94.5 103.4 -95.5 6.1 -49.7 -44.0 7.2 94 99 X M S < S- 0 0 37 -3,-1.7 4,-0.1 -5,-0.1 2,-0.1 -0.780 70.4-123.5 -97.2 132.8 -49.5 -41.2 9.7 95 100 X P - 0 0 105 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.388 47.3 -70.0 -67.4 147.3 -52.3 -38.7 10.4 96 101 X S S S+ 0 0 53 1,-0.1 -61,-0.1 2,-0.1 2,-0.1 -0.395 106.9 59.8 -70.5 156.0 -51.8 -35.0 10.0 97 102 X P S S- 0 0 70 0, 0.0 2,-0.3 0, 0.0 -62,-0.1 0.469 79.9-171.3 -79.7 131.8 -50.3 -32.8 11.3 98 103 X R - 0 0 1 -4,-0.1 -62,-2.6 -2,-0.1 2,-0.5 -0.675 21.3-150.0 -93.2 143.5 -47.1 -34.7 10.7 99 104 X I E -b 36 0B 7 -26,-0.4 2,-0.4 -2,-0.3 -62,-0.2 -0.970 23.8-164.6-105.9 125.1 -43.6 -34.0 12.1 100 105 X V E -b 37 0B 0 -64,-3.0 -62,-3.7 -2,-0.5 2,-0.4 -0.928 7.8-153.8-119.3 133.3 -41.1 -35.2 9.5 101 106 X K E +bd 38 76B 15 -26,-2.7 -24,-2.3 -2,-0.4 -23,-0.3 -0.863 21.4 162.6-104.5 139.8 -37.3 -35.7 10.0 102 107 X T E -b 39 0B 0 -64,-2.2 -62,-1.9 -2,-0.4 -26,-0.0 -0.991 33.3-169.4-146.3 155.9 -34.7 -35.5 7.3 103 108 X H + 0 0 13 -2,-0.3 -64,-0.1 -64,-0.2 -1,-0.1 0.173 49.0 135.2-115.8 12.1 -31.0 -35.1 6.8 104 109 X L - 0 0 0 1,-0.1 5,-0.1 -63,-0.1 -2,-0.1 -0.380 60.4-116.6 -68.6 135.0 -31.2 -34.6 3.1 105 110 X P >> - 0 0 4 0, 0.0 3,-2.1 0, 0.0 4,-0.7 -0.323 38.6-103.5 -56.6 152.0 -29.1 -31.8 1.5 106 111 X V G >4 S+ 0 0 14 1,-0.3 3,-1.2 64,-0.2 -2,-0.1 0.839 119.8 57.1 -50.3 -44.7 -31.5 -29.2 -0.1 107 112 X Q G 34 S+ 0 0 105 1,-0.3 -1,-0.3 -96,-0.0 -3,-0.0 0.606 109.5 47.0 -66.4 -14.8 -31.0 -30.3 -3.6 108 113 X L G <4 S+ 0 0 5 -3,-2.1 -1,-0.3 2,-0.1 -2,-0.2 0.492 80.7 118.7-102.8 -7.2 -32.1 -33.9 -2.7 109 114 X L S << S- 0 0 10 -3,-1.2 5,-0.1 -4,-0.7 -82,-0.0 -0.361 80.2 -98.3 -62.1 135.4 -35.2 -33.0 -0.7 110 115 X P > - 0 0 2 0, 0.0 3,-1.7 0, 0.0 4,-0.5 -0.320 31.1-127.3 -53.8 135.1 -38.4 -34.5 -2.4 111 116 X S T >> S+ 0 0 56 -84,-0.5 4,-2.5 1,-0.3 3,-0.7 0.705 99.0 78.8 -65.4 -20.0 -39.9 -31.7 -4.5 112 117 X S H 3> S+ 0 0 20 -83,-0.4 4,-2.4 -85,-0.3 -1,-0.3 0.792 87.4 59.1 -57.0 -32.5 -43.4 -32.1 -2.8 113 118 X F H <4>S+ 0 0 1 -3,-1.7 5,-2.1 2,-0.2 -1,-0.3 0.892 109.8 42.2 -63.3 -39.9 -42.1 -30.2 0.2 114 119 X W H X45S+ 0 0 35 -3,-0.7 3,-1.4 -4,-0.5 -2,-0.2 0.920 114.1 51.6 -70.6 -44.8 -41.4 -27.2 -2.0 115 120 X K H 3<5S+ 0 0 169 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.848 112.9 45.4 -62.9 -35.5 -44.7 -27.6 -4.0 116 121 X N T 3<5S- 0 0 50 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.422 103.9-133.4 -85.4 -1.6 -46.7 -27.7 -0.7 117 122 X D T < 5 - 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