==== 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 LIGASE 07-JUL-09 3A4I . COMPND 2 MOLECULE: GMP SYNTHASE [GLUTAMINE-HYDROLYZING] SUBUNIT B; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR S.MARUOKA,S.HORITA,W.C.LEE,K.NAGATA,M.TANOKURA . 572 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25968.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 415 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 59 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 6.8 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 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 47 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 202 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.1 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 2 0 0 1 1 2 2 0 0 0 4 0 2 0 0 0 2 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 4 1 3 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 PARALLEL BRIDGES PER LADDER . 4 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 2 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 0 147 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 151.0 -21.1 39.5 16.1 2 2 A D > + 0 0 77 1,-0.1 4,-2.1 2,-0.1 5,-0.1 -0.836 360.0 173.0-134.6 95.2 -18.3 39.8 18.7 3 3 A W H > S+ 0 0 26 -2,-0.4 4,-2.7 2,-0.2 5,-0.2 0.830 80.2 58.8 -73.7 -35.2 -14.9 38.6 17.6 4 4 A G H > S+ 0 0 32 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.956 111.3 42.7 -56.1 -48.3 -13.0 39.8 20.7 5 5 A R H > S+ 0 0 153 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.919 112.7 53.4 -64.1 -45.2 -15.3 37.7 22.8 6 6 A F H X S+ 0 0 27 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.934 112.8 44.0 -52.1 -50.6 -15.0 34.8 20.4 7 7 A V H X S+ 0 0 13 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.932 112.9 50.0 -64.0 -49.0 -11.2 34.9 20.5 8 8 A E H X S+ 0 0 111 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.944 115.8 44.1 -57.1 -46.2 -11.0 35.3 24.3 9 9 A E H X S+ 0 0 95 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.913 115.0 46.5 -65.1 -46.4 -13.4 32.3 24.8 10 10 A K H X S+ 0 0 24 -4,-2.8 4,-2.8 -5,-0.2 -1,-0.2 0.885 111.0 52.4 -65.4 -41.2 -11.7 30.1 22.2 11 11 A V H X S+ 0 0 8 -4,-2.9 4,-2.9 2,-0.2 -1,-0.2 0.926 111.0 47.7 -59.0 -45.0 -8.2 30.8 23.5 12 12 A R H X S+ 0 0 109 -4,-2.0 4,-2.8 -5,-0.3 -2,-0.2 0.922 111.5 51.2 -60.8 -46.7 -9.4 29.9 27.0 13 13 A E H X S+ 0 0 90 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.909 112.0 45.9 -57.0 -46.8 -11.0 26.7 25.6 14 14 A I H X S+ 0 0 2 -4,-2.8 4,-3.0 2,-0.2 5,-0.4 0.947 113.2 49.3 -63.0 -48.9 -7.8 25.7 23.9 15 15 A R H X S+ 0 0 129 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.899 113.1 48.1 -54.5 -45.3 -5.7 26.5 27.0 16 16 A E H < S+ 0 0 154 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.831 115.7 43.7 -67.0 -33.9 -8.1 24.4 29.1 17 17 A T H < S+ 0 0 63 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.937 121.9 35.9 -76.7 -46.5 -8.0 21.5 26.7 18 18 A V H >< S+ 0 0 2 -4,-3.0 3,-2.0 1,-0.2 -2,-0.2 0.836 78.8 172.7 -78.4 -36.8 -4.3 21.3 26.0 19 19 A G T 3< S- 0 0 39 -4,-2.3 -1,-0.2 -5,-0.4 -2,-0.1 -0.413 74.0 -21.1 58.7-125.3 -2.9 22.3 29.4 20 20 A D T 3 S+ 0 0 142 -2,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.360 114.1 105.7 -96.5 7.1 0.8 21.9 29.4 21 21 A S S < S- 0 0 13 -3,-2.0 2,-0.3 1,-0.1 100,-0.1 -0.169 72.7-104.8 -78.3 174.2 0.9 19.5 26.4 22 22 A K - 0 0 84 98,-0.3 100,-2.5 26,-0.1 101,-1.2 -0.734 28.4-160.0 -96.3 151.2 2.0 20.2 22.8 23 23 A A E -ab 48 123A 0 24,-2.4 26,-3.0 -2,-0.3 2,-0.4 -0.903 4.3-152.1-123.9 158.9 -0.4 20.6 19.9 24 24 A I E -ab 49 124A 0 99,-2.1 101,-3.2 -2,-0.3 2,-0.3 -0.956 9.8-174.7-131.3 146.8 0.3 20.3 16.2 25 25 A I E -ab 50 125A 2 24,-2.2 26,-3.3 -2,-0.4 2,-0.7 -0.998 24.1-131.2-139.4 140.4 -1.3 21.8 13.1 26 26 A A E -a 51 0A 32 99,-0.5 2,-0.6 -2,-0.3 26,-0.2 -0.833 25.1-150.7 -87.2 119.7 -0.8 21.3 9.4 27 27 A L E +a 52 0A 7 24,-2.8 26,-0.5 -2,-0.7 39,-0.0 -0.819 23.8 170.3 -91.9 120.7 -0.4 24.7 7.8 28 28 A S - 0 0 73 -2,-0.6 -1,-0.1 2,-0.2 3,-0.1 0.612 53.5-113.0 -96.3 -15.3 -1.6 24.9 4.1 29 29 A G S S+ 0 0 0 1,-0.4 -2,-0.1 37,-0.1 23,-0.0 0.179 78.8 130.8 90.7 -11.1 -1.4 28.7 3.7 30 30 A G S > S- 0 0 9 1,-0.1 4,-2.1 137,-0.1 -1,-0.4 -0.262 72.4-113.6 -74.5 159.0 -5.2 28.5 3.4 31 31 A V H > S+ 0 0 6 130,-0.2 4,-2.4 2,-0.2 5,-0.2 0.900 110.7 52.9 -61.7 -39.3 -7.4 30.9 5.4 32 32 A D H > S+ 0 0 37 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.971 114.7 37.1 -63.9 -56.0 -9.0 28.1 7.6 33 33 A S H > S+ 0 0 14 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.886 116.2 55.3 -66.6 -35.5 -5.8 26.5 8.8 34 34 A S H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.922 110.8 44.8 -60.7 -45.6 -4.0 29.9 9.1 35 35 A T H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.932 113.4 48.9 -64.5 -47.3 -6.8 31.2 11.4 36 36 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.885 111.2 52.2 -58.9 -40.4 -6.9 28.1 13.5 37 37 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.946 108.0 49.4 -62.8 -47.2 -3.1 28.3 13.9 38 38 A V H X S+ 0 0 2 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.921 112.3 48.9 -61.2 -43.1 -3.1 31.9 15.0 39 39 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.928 112.9 46.5 -59.2 -49.0 -5.8 31.1 17.7 40 40 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.890 112.0 51.7 -61.9 -39.7 -3.9 28.1 18.9 41 41 A H H X S+ 0 0 35 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.892 107.9 51.1 -63.4 -42.3 -0.7 30.1 19.0 42 42 A K H < S+ 0 0 112 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.894 115.5 46.1 -58.2 -38.7 -2.5 32.9 21.0 43 43 A A H < S+ 0 0 7 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.947 134.0 5.7 -68.1 -54.5 -3.6 30.1 23.4 44 44 A I H >< S- 0 0 9 -4,-3.1 3,-1.9 1,-0.2 -3,-0.2 0.344 81.3-159.2-125.8 4.2 -0.4 28.0 23.9 45 45 A G G >< S+ 0 0 23 -4,-2.2 3,-2.4 -5,-0.3 32,-0.3 -0.186 75.5 6.4 58.9-133.0 2.5 29.9 22.2 46 46 A D G 3 S+ 0 0 107 1,-0.3 -1,-0.3 30,-0.1 -5,-0.1 0.592 118.1 75.4 -61.6 -11.3 5.5 27.8 21.4 47 47 A R G < S+ 0 0 84 -3,-1.9 -24,-2.4 -6,-0.1 2,-0.6 0.626 79.3 85.1 -78.4 -11.0 3.7 24.6 22.5 48 48 A L E < S-a 23 0A 1 -3,-2.4 29,-0.6 -26,-0.2 2,-0.6 -0.828 70.1-160.2 -81.5 120.0 1.8 24.9 19.2 49 49 A H E -ac 24 77A 21 -26,-3.0 -24,-2.2 -2,-0.6 2,-0.6 -0.911 3.4-160.3-104.4 116.0 3.9 23.2 16.5 50 50 A A E -ac 25 78A 0 27,-2.4 29,-3.3 -2,-0.6 2,-0.6 -0.867 4.2-156.8-100.7 120.0 2.9 24.4 13.0 51 51 A V E -ac 26 79A 1 -26,-3.3 -24,-2.8 -2,-0.6 2,-0.6 -0.855 9.0-173.5-103.0 118.7 4.0 22.1 10.2 52 52 A F E -ac 27 80A 3 27,-2.8 29,-2.9 -2,-0.6 2,-0.6 -0.944 10.1-157.7-112.5 114.2 4.3 23.5 6.7 53 53 A V E - c 0 81A 8 -2,-0.6 2,-0.9 -26,-0.5 29,-0.2 -0.827 9.5-149.1 -97.3 118.0 5.0 20.9 4.0 54 54 A N E - c 0 82A 13 27,-3.1 29,-1.9 -2,-0.6 30,-0.1 -0.753 17.0-179.0 -80.0 101.4 6.7 22.0 0.7 55 55 A T - 0 0 8 -2,-0.9 33,-0.2 27,-0.1 32,-0.2 0.687 46.0-114.5 -78.5 -16.1 5.1 19.4 -1.6 56 56 A G S S+ 0 0 0 31,-0.1 -2,-0.1 -3,-0.1 -1,-0.0 0.290 102.9 85.5 93.5 -4.9 7.0 20.8 -4.6 57 57 A F + 0 0 0 115,-0.0 115,-3.0 2,-0.0 116,-0.1 0.050 59.6 118.7-115.1 21.8 3.7 21.9 -6.1 58 58 A L - 0 0 15 113,-0.2 3,-0.1 1,-0.1 -4,-0.0 -0.397 68.6 -90.1 -88.9 167.1 3.2 25.3 -4.5 59 59 A R > - 0 0 38 1,-0.1 3,-2.0 -2,-0.1 -1,-0.1 -0.298 53.9 -77.6 -74.9 161.5 3.0 28.7 -6.2 60 60 A K T 3 S+ 0 0 115 129,-0.4 -1,-0.1 1,-0.3 0, 0.0 -0.372 118.9 3.2 -54.7 125.5 5.9 30.9 -7.0 61 61 A G T 3> S+ 0 0 39 -2,-0.1 4,-2.1 -3,-0.1 -1,-0.3 0.339 98.1 113.2 79.7 -8.6 6.9 32.7 -3.8 62 62 A E H <> S+ 0 0 15 -3,-2.0 4,-2.8 2,-0.2 5,-0.2 0.934 74.1 49.9 -67.1 -45.7 4.3 30.9 -1.6 63 63 A P H > S+ 0 0 14 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.941 113.0 48.3 -57.3 -43.7 6.8 28.9 0.6 64 64 A E H > S+ 0 0 125 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.910 112.9 48.6 -58.5 -43.7 8.7 32.2 1.2 65 65 A F H X S+ 0 0 45 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.907 111.0 48.8 -65.6 -43.6 5.5 34.0 2.1 66 66 A V H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 5,-0.5 0.933 113.8 46.8 -65.4 -45.6 4.2 31.3 4.5 67 67 A V H X>S+ 0 0 26 -4,-2.6 4,-2.6 -5,-0.2 5,-1.4 0.970 114.2 47.3 -58.3 -52.3 7.5 31.1 6.3 68 68 A K H <>S+ 0 0 97 -4,-2.6 5,-2.1 -5,-0.2 6,-0.2 0.892 116.4 44.7 -54.8 -44.5 7.8 35.0 6.6 69 69 A T H <>S+ 0 0 0 -4,-2.6 5,-2.0 3,-0.2 -1,-0.2 0.964 125.4 27.3 -70.1 -51.9 4.2 35.3 7.8 70 70 A F H <5S+ 0 0 0 -4,-2.8 6,-2.7 -5,-0.2 -3,-0.2 0.903 132.0 30.6 -86.0 -40.6 4.1 32.5 10.3 71 71 A R T X5S+ 0 0 101 -4,-2.6 4,-0.8 -5,-0.5 -3,-0.2 0.964 130.0 31.6 -78.1 -56.0 7.7 32.2 11.5 72 72 A D T 4 + 0 0 6 -29,-1.9 4,-1.7 -2,-0.9 3,-0.4 0.127 27.0 121.2-114.2 17.7 9.3 17.0 0.9 84 84 A Q H > S+ 0 0 58 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.880 72.6 51.3 -52.2 -49.6 9.6 17.7 -2.8 85 85 A D H > S+ 0 0 126 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.879 108.9 53.3 -58.0 -39.2 11.6 14.6 -3.7 86 86 A R H > S+ 0 0 101 -3,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.914 113.2 41.5 -63.2 -43.6 9.1 12.4 -2.0 87 87 A F H X S+ 0 0 0 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.926 118.2 44.3 -71.8 -46.3 6.1 13.8 -3.8 88 88 A F H >< S+ 0 0 29 -4,-2.8 3,-0.8 1,-0.2 4,-0.3 0.954 114.9 49.3 -64.8 -46.1 7.7 14.0 -7.3 89 89 A S H >< S+ 0 0 53 -4,-2.5 3,-1.3 -5,-0.3 -1,-0.2 0.893 108.6 53.8 -59.6 -39.6 9.3 10.5 -6.9 90 90 A A H 3< S+ 0 0 30 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.755 106.7 52.9 -64.3 -25.0 5.9 9.0 -5.8 91 91 A L T X< S+ 0 0 1 -4,-1.1 3,-2.1 -3,-0.8 89,-0.4 0.388 75.5 139.1 -96.4 3.4 4.2 10.4 -8.9 92 92 A K T < S- 0 0 148 -3,-1.3 3,-0.1 -4,-0.3 89,-0.1 -0.243 80.3 -2.7 -54.7 126.6 6.6 8.8 -11.4 93 93 A G T 3 S+ 0 0 56 1,-0.2 2,-0.5 87,-0.1 -1,-0.3 0.375 96.6 133.4 76.2 -1.6 4.7 7.5 -14.4 94 94 A V < + 0 0 25 -3,-2.1 86,-0.5 1,-0.2 -1,-0.2 -0.707 16.3 158.0 -90.6 124.1 1.3 8.3 -13.0 95 95 A T + 0 0 89 -2,-0.5 83,-0.5 84,-0.1 -1,-0.2 0.619 41.2 102.2-115.3 -22.2 -1.1 10.0 -15.5 96 96 A D > - 0 0 66 1,-0.1 4,-2.6 81,-0.1 5,-0.2 -0.550 64.7-144.2 -70.0 123.0 -4.6 9.3 -14.0 97 97 A P H > S+ 0 0 13 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.875 98.8 49.5 -55.9 -43.5 -5.9 12.4 -12.2 98 98 A E H > S+ 0 0 91 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.905 112.5 48.1 -62.7 -42.0 -7.6 10.4 -9.5 99 99 A E H > S+ 0 0 83 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.882 109.1 54.1 -64.4 -41.9 -4.5 8.3 -8.8 100 100 A K H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.949 111.1 45.3 -55.8 -49.2 -2.3 11.5 -8.7 101 101 A R H X S+ 0 0 96 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.911 112.9 50.8 -62.8 -40.7 -4.6 13.0 -6.1 102 102 A K H X S+ 0 0 147 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.920 111.7 46.7 -62.8 -44.9 -4.7 9.7 -4.1 103 103 A I H X S+ 0 0 16 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.914 111.1 51.4 -65.7 -44.5 -0.9 9.4 -4.1 104 104 A I H X S+ 0 0 8 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.923 110.5 49.7 -60.3 -42.2 -0.4 13.0 -3.1 105 105 A G H X S+ 0 0 37 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.925 112.3 47.5 -57.4 -48.6 -2.9 12.5 -0.1 106 106 A R H X S+ 0 0 126 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.912 112.8 47.8 -58.6 -50.8 -1.0 9.4 1.0 107 107 A V H X S+ 0 0 3 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.884 109.6 53.5 -63.5 -40.9 2.5 11.0 0.8 108 108 A F H X S+ 0 0 61 -4,-2.5 4,-3.1 -5,-0.2 5,-0.2 0.939 110.2 46.7 -57.9 -47.4 1.2 14.1 2.7 109 109 A I H X S+ 0 0 94 -4,-2.1 4,-3.2 1,-0.2 5,-0.2 0.921 111.7 52.1 -61.4 -42.6 -0.1 11.9 5.5 110 110 A E H X S+ 0 0 75 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.916 113.4 43.8 -56.3 -49.7 3.2 9.9 5.5 111 111 A V H X S+ 0 0 4 -4,-2.6 4,-2.1 2,-0.2 5,-0.2 0.930 115.8 46.7 -64.4 -47.6 5.3 13.2 5.8 112 112 A F H X S+ 0 0 25 -4,-3.1 4,-3.0 -5,-0.2 5,-0.2 0.929 112.6 50.1 -64.5 -43.6 3.0 14.7 8.4 113 113 A E H X S+ 0 0 96 -4,-3.2 4,-2.4 -5,-0.2 -1,-0.2 0.908 108.8 52.8 -58.2 -45.5 2.9 11.5 10.5 114 114 A E H X S+ 0 0 83 -4,-2.1 4,-1.0 -5,-0.2 -1,-0.2 0.921 114.4 41.2 -58.7 -47.5 6.8 11.2 10.4 115 115 A V H >X S+ 0 0 25 -4,-2.1 4,-1.8 1,-0.2 3,-0.5 0.933 113.0 54.3 -66.5 -47.0 7.2 14.8 11.7 116 116 A A H 3X>S+ 0 0 18 -4,-3.0 4,-2.4 1,-0.2 5,-0.6 0.880 101.9 58.4 -56.7 -38.1 4.3 14.5 14.3 117 117 A K H 3<5S+ 0 0 150 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.885 108.1 45.5 -62.9 -36.1 5.9 11.4 15.8 118 118 A K H <<5S+ 0 0 164 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.827 111.1 53.6 -73.1 -33.9 9.1 13.4 16.6 119 119 A I H <5S- 0 0 9 -4,-1.8 -2,-0.2 1,-0.0 -1,-0.2 0.879 91.0-152.5 -70.0 -37.7 7.1 16.3 18.0 120 120 A G T <5 + 0 0 48 -4,-2.4 -98,-0.3 -5,-0.2 -3,-0.1 0.870 27.0 170.4 69.5 37.7 5.2 14.1 20.4 121 121 A A < - 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