==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 16-APR-07 2PJD . COMPND 2 MOLECULE: RIBOSOMAL RNA SMALL SUBUNIT METHYLTRANSFERASE C; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.SUNITA,E.PURTA,M.DURAWA,K.L.TKACZUK,J.M.BUJNICKI, . 334 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15008.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 230 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 12.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 10.2 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 . 2 0.6 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 . 21 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 23.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 3 1 0 1 0 3 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 1 1 4 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 0 1 1 1 0 2 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 0 0 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 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 3 A A 0 0 40 0, 0.0 9,-0.1 0, 0.0 28,-0.0 0.000 360.0 360.0 360.0 139.4 5.0 23.2 52.2 2 4 A F + 0 0 85 4,-0.1 5,-0.1 26,-0.1 27,-0.0 0.818 360.0 81.0 -44.9 -65.3 7.4 25.1 50.1 3 5 A T S > S- 0 0 32 1,-0.1 4,-2.1 3,-0.1 5,-0.1 -0.011 76.9-120.5 -59.5 154.8 7.4 23.8 46.4 4 6 A P H > S+ 0 0 93 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.888 115.3 55.8 -59.1 -39.0 4.9 24.6 43.7 5 7 A A H > S+ 0 0 21 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.936 109.5 45.8 -61.4 -44.2 4.1 20.9 43.4 6 8 A S H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.858 107.4 57.3 -68.4 -33.3 3.3 20.8 47.1 7 9 A E H X S+ 0 0 104 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.922 104.2 54.6 -60.5 -41.2 1.2 24.0 46.7 8 10 A V H >< S+ 0 0 4 -4,-2.3 3,-1.2 1,-0.2 4,-0.2 0.969 109.6 45.2 -55.0 -53.5 -0.9 22.2 44.1 9 11 A L H >< S+ 0 0 2 -4,-1.8 3,-3.4 1,-0.3 -1,-0.2 0.939 105.5 61.5 -57.7 -46.1 -1.6 19.4 46.5 10 12 A L H >< S+ 0 0 43 -4,-2.7 3,-1.6 1,-0.3 -1,-0.3 0.787 92.8 65.9 -50.4 -30.0 -2.4 21.9 49.3 11 13 A R T << S+ 0 0 134 -4,-1.3 -1,-0.3 -3,-1.2 -2,-0.2 0.551 106.3 42.5 -72.0 -4.9 -5.2 23.1 47.0 12 14 A H T X> S+ 0 0 60 -3,-3.4 3,-1.7 -4,-0.2 4,-0.6 -0.003 74.7 132.1-126.9 29.8 -6.9 19.7 47.5 13 15 A S H X> + 0 0 43 -3,-1.6 3,-1.3 1,-0.3 4,-0.8 0.819 64.4 64.4 -47.9 -43.7 -6.2 19.4 51.3 14 16 A D H 34 S+ 0 0 76 1,-0.3 3,-0.3 2,-0.2 4,-0.3 0.772 97.6 55.5 -55.3 -30.6 -9.7 18.4 52.0 15 17 A D H <4 S+ 0 0 62 -3,-1.7 -1,-0.3 1,-0.2 3,-0.2 0.692 107.0 48.1 -79.7 -18.1 -9.4 15.2 50.0 16 18 A F H X< S+ 0 0 2 -3,-1.3 3,-1.8 -4,-0.6 22,-0.6 0.574 82.9 96.7 -99.2 -8.2 -6.4 13.9 51.9 17 19 A E T 3< S+ 0 0 85 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.1 0.803 94.6 29.7 -53.1 -39.3 -7.7 14.4 55.4 18 20 A Q T 3 S+ 0 0 152 -4,-0.3 -1,-0.3 -3,-0.2 2,-0.2 0.221 101.6 114.3-105.8 15.7 -9.0 10.9 56.0 19 21 A S < - 0 0 18 -3,-1.8 19,-2.3 17,-0.2 20,-1.6 -0.578 63.0-141.3 -91.0 148.7 -6.4 9.2 53.8 20 22 A R E -a 39 0A 85 18,-0.2 56,-2.0 -2,-0.2 57,-1.4 -0.845 40.7-165.6-105.2 93.0 -3.6 6.9 54.7 21 23 A I E -ab 40 77A 0 18,-2.2 20,-2.6 -2,-0.9 2,-0.6 -0.613 27.4-158.6 -94.5 138.5 -1.0 8.3 52.3 22 24 A L E -ab 41 78A 0 55,-2.9 57,-2.3 -2,-0.3 2,-0.4 -0.961 18.6-155.7-107.8 122.2 2.3 7.1 51.0 23 25 A F E +ab 42 79A 0 18,-3.4 20,-1.9 -2,-0.6 2,-0.3 -0.851 26.6 148.6 -98.8 131.7 4.5 9.9 49.7 24 26 A A E +ab 43 80A 1 55,-2.2 57,-2.9 -2,-0.4 2,-0.4 -0.928 25.4 56.4-151.6 174.9 7.2 9.2 47.1 25 27 A G E S+ b 0 81A 4 18,-0.5 2,-1.7 -2,-0.3 20,-0.3 -0.792 107.2 0.1 101.7-146.0 9.1 10.6 44.2 26 28 A D - 0 0 26 55,-2.5 2,-2.1 -2,-0.4 3,-0.2 -0.622 69.6-171.2 -82.1 85.5 11.1 13.9 44.3 27 29 A L + 0 0 2 -2,-1.7 26,-0.1 1,-0.2 -1,-0.1 -0.432 19.8 158.6 -83.6 72.2 10.4 14.7 47.9 28 30 A Q + 0 0 109 -2,-2.1 2,-0.2 2,-0.0 -1,-0.2 0.703 58.9 24.0 -64.9 -29.1 11.9 18.2 47.9 29 31 A D S S- 0 0 13 -3,-0.2 24,-0.1 -28,-0.0 4,-0.1 -0.578 87.5 -97.2-125.9-165.7 10.1 19.8 50.9 30 32 A D S >> S+ 0 0 76 -2,-0.2 3,-1.4 1,-0.2 4,-1.4 0.154 77.3 116.8-107.4 21.7 8.5 18.6 54.0 31 33 A L H 3> S+ 0 0 3 1,-0.3 4,-2.9 2,-0.2 3,-0.4 0.889 72.8 64.1 -54.8 -36.8 4.8 18.5 53.0 32 34 A P H 34 S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.876 106.6 43.7 -57.9 -29.3 4.9 14.7 53.6 33 35 A A H <4 S+ 0 0 35 -3,-1.4 -2,-0.2 1,-0.1 7,-0.1 0.758 123.2 35.8 -84.3 -21.6 5.5 15.4 57.3 34 36 A R H < S+ 0 0 59 -4,-1.4 -3,-0.2 -3,-0.4 -1,-0.1 0.740 81.4 110.7-105.1 -28.0 3.0 18.2 57.6 35 37 A L S < S- 0 0 18 -4,-2.9 2,-0.5 -5,-0.2 -25,-0.0 -0.247 75.4-112.9 -54.4 132.2 -0.1 17.4 55.4 36 38 A D + 0 0 114 2,-0.0 2,-0.3 4,-0.0 -17,-0.2 -0.570 58.0 149.0 -71.4 118.5 -3.1 16.6 57.5 37 39 A T - 0 0 30 -2,-0.5 -20,-0.2 -19,-0.1 3,-0.2 -0.894 63.7-114.3-144.3 166.0 -3.8 12.9 56.9 38 40 A A S S- 0 0 57 -19,-2.3 2,-0.3 -22,-0.6 -18,-0.2 0.832 105.6 -17.2 -72.7 -30.5 -5.2 9.9 58.7 39 41 A A E -a 20 0A 19 -20,-1.6 -18,-2.2 -3,-0.0 -1,-0.4 -0.929 68.4-149.8-168.9 146.6 -1.7 8.6 58.4 40 42 A S E +a 21 0A 19 -2,-0.3 2,-0.3 -20,-0.2 -18,-0.2 -0.986 14.1 173.2-131.0 139.9 1.4 9.4 56.4 41 43 A R E -a 22 0A 61 -20,-2.6 -18,-3.4 -2,-0.4 2,-0.3 -0.920 8.3-165.3-134.6 162.9 4.4 7.4 55.1 42 44 A A E -ac 23 61A 1 18,-2.3 20,-2.6 -2,-0.3 2,-0.4 -0.999 11.3-171.2-149.6 149.8 7.3 8.1 52.8 43 45 A H E +ac 24 62A 8 -20,-1.9 -18,-0.5 -2,-0.3 2,-0.3 -0.982 18.1 174.6-139.5 128.9 9.9 6.3 50.9 44 46 A T E - c 0 63A 4 18,-2.6 20,-1.8 -2,-0.4 -18,-0.1 -0.948 37.0-150.4-137.2 153.0 12.8 8.1 49.2 45 47 A Q S S+ 0 0 4 -2,-0.3 183,-3.0 -20,-0.3 2,-0.5 0.217 80.5 89.8 -99.5 10.8 15.9 7.3 47.3 46 48 A Q B > -G 227 0B 30 181,-0.2 4,-2.1 1,-0.1 181,-0.2 -0.949 62.4-157.5-116.0 119.8 17.5 10.6 48.6 47 49 A F H > S+ 0 0 18 179,-4.0 4,-2.5 -2,-0.5 204,-0.2 0.853 92.7 49.9 -60.5 -42.2 19.4 10.6 51.9 48 50 A H H > S+ 0 0 50 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.915 111.0 49.8 -68.4 -37.5 19.0 14.3 52.6 49 51 A H H > S+ 0 0 11 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.915 111.0 50.5 -65.4 -39.6 15.3 14.2 52.0 50 52 A W H X S+ 0 0 81 -4,-2.1 4,-3.0 2,-0.2 5,-0.4 0.907 106.5 55.6 -64.2 -39.8 15.1 11.2 54.3 51 53 A Q H X S+ 0 0 57 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.968 112.2 42.7 -54.7 -52.1 17.1 13.2 56.9 52 54 A V H X S+ 0 0 83 -4,-2.4 4,-0.9 1,-0.2 -2,-0.2 0.935 118.6 42.4 -60.6 -49.6 14.5 15.9 56.8 53 55 A L H >X S+ 0 0 2 -4,-2.9 4,-3.4 1,-0.2 3,-0.5 0.920 111.7 51.3 -69.5 -42.0 11.5 13.7 56.8 54 56 A S H 3X S+ 0 0 24 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.803 97.3 68.6 -67.9 -26.0 12.5 11.1 59.4 55 57 A R H 3< S+ 0 0 89 -4,-1.4 -1,-0.2 -5,-0.4 -2,-0.2 0.944 118.8 22.6 -55.3 -44.4 13.4 13.8 61.9 56 58 A Q H << S+ 0 0 160 -4,-0.9 -2,-0.2 -3,-0.5 -1,-0.2 0.836 134.8 37.0 -89.5 -37.9 9.6 14.6 62.1 57 59 A X H >< S- 0 0 22 -4,-3.4 3,-2.0 1,-0.2 -3,-0.2 0.507 82.7-166.0 -97.8 -5.0 8.1 11.2 60.9 58 60 A G G >< S- 0 0 37 -4,-2.7 3,-1.9 -5,-0.3 -1,-0.2 -0.230 72.7 -4.7 56.0-136.1 10.5 8.7 62.5 59 61 A D G 3 S+ 0 0 115 1,-0.3 -1,-0.3 -18,-0.0 -5,-0.1 0.439 120.6 79.5 -70.3 -0.9 10.2 5.2 61.0 60 62 A N G < S+ 0 0 62 -3,-2.0 -18,-2.3 -6,-0.1 2,-0.5 0.624 89.4 65.3 -78.9 -13.2 7.2 6.3 58.9 61 63 A A E < S-c 42 0A 2 -3,-1.9 2,-0.3 -20,-0.2 -18,-0.2 -0.949 74.6-172.3-110.6 129.1 9.8 7.8 56.6 62 64 A R E -c 43 0A 50 -20,-2.6 -18,-2.6 -2,-0.5 2,-0.4 -0.913 14.2-157.4-125.6 152.0 12.2 5.3 54.8 63 65 A F E +c 44 0A 57 -2,-0.3 2,-0.3 -20,-0.2 -18,-0.2 -0.988 36.0 111.5-127.8 131.9 15.3 5.5 52.6 64 66 A S - 0 0 35 -20,-1.8 164,-0.1 -2,-0.4 3,-0.1 -0.919 67.8-103.8 176.8 162.4 16.6 2.8 50.2 65 67 A L S S+ 0 0 23 -2,-0.3 2,-0.5 1,-0.2 -1,-0.1 0.961 108.4 36.4 -64.2 -49.5 17.1 2.1 46.6 66 68 A V S S- 0 0 47 -3,-0.1 -1,-0.2 162,-0.1 2,-0.1 -0.905 80.3-133.2-113.5 125.4 14.0 -0.2 46.4 67 69 A A - 0 0 3 -2,-0.5 2,-0.2 -3,-0.1 -24,-0.0 -0.457 28.1-152.1 -69.7 146.8 10.7 0.3 48.3 68 70 A T > - 0 0 66 -2,-0.1 4,-1.4 1,-0.1 3,-0.4 -0.737 29.9 -99.4-119.2 168.3 9.5 -2.9 50.0 69 71 A A H > S+ 0 0 67 1,-0.3 4,-0.9 -2,-0.2 3,-0.3 0.870 125.0 49.7 -53.0 -43.0 6.1 -4.3 50.9 70 72 A D H 4 S+ 0 0 98 1,-0.2 3,-0.4 2,-0.2 -1,-0.3 0.859 104.2 57.2 -66.0 -37.9 6.6 -3.1 54.5 71 73 A D H 4 S+ 0 0 14 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.810 116.3 38.8 -61.4 -29.3 7.6 0.4 53.4 72 74 A V H >< S+ 0 0 5 -4,-1.4 3,-0.6 -3,-0.3 -1,-0.2 0.529 87.3 129.8-100.9 -9.3 4.3 0.6 51.6 73 75 A A T 3< + 0 0 41 -4,-0.9 3,-0.1 -3,-0.4 -3,-0.1 -0.029 69.0 13.1 -56.3 148.5 1.9 -1.1 54.1 74 76 A D T 3 S+ 0 0 121 1,-0.2 2,-0.4 2,-0.0 -1,-0.2 0.839 90.1 128.1 56.3 37.5 -1.4 0.3 55.3 75 77 A C < + 0 0 9 -3,-0.6 -1,-0.2 1,-0.1 -54,-0.2 -0.992 33.9 179.6-122.3 128.3 -1.5 3.1 52.7 76 78 A D S S+ 0 0 69 -56,-2.0 29,-2.4 -2,-0.4 2,-0.3 0.311 71.0 48.2-108.2 4.8 -4.6 3.5 50.5 77 79 A T E -bd 21 105A 2 -57,-1.4 -55,-2.9 27,-0.2 2,-0.5 -0.998 62.7-156.1-148.8 138.2 -3.2 6.4 48.6 78 80 A L E -bd 22 106A 0 27,-2.8 29,-2.5 -2,-0.3 2,-0.6 -0.973 4.2-170.9-116.0 130.3 -0.0 7.2 46.7 79 81 A I E -bd 23 107A 0 -57,-2.3 -55,-2.2 -2,-0.5 2,-0.5 -0.979 15.6-171.8-118.9 109.8 1.1 10.8 46.2 80 82 A Y E -bd 24 108A 0 27,-2.6 29,-2.3 -2,-0.6 2,-0.7 -0.939 17.2-147.1-112.3 123.9 4.0 10.7 43.8 81 83 A Y E -bd 25 109A 6 -57,-2.9 -55,-2.5 -2,-0.5 29,-0.2 -0.802 28.4-123.1 -89.5 112.8 6.1 13.8 43.0 82 84 A W - 0 0 7 27,-2.9 29,-0.3 -2,-0.7 34,-0.1 -0.318 26.4-138.6 -62.0 126.6 7.3 13.5 39.4 83 85 A P - 0 0 0 0, 0.0 28,-0.1 0, 0.0 -1,-0.1 -0.275 21.3-106.4 -78.7 172.0 11.2 13.6 39.1 84 86 A K S S+ 0 0 111 1,-0.1 2,-0.5 -2,-0.0 -2,-0.1 0.828 100.3 58.2 -68.1 -34.5 13.2 15.4 36.5 85 87 A N S > S- 0 0 67 1,-0.1 4,-1.7 30,-0.0 3,-0.4 -0.879 70.9-144.2-110.7 130.5 14.3 12.3 34.6 86 88 A K H > S+ 0 0 92 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.857 97.4 55.0 -53.5 -50.3 12.0 9.7 33.0 87 89 A P H > S+ 0 0 70 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.894 109.4 51.3 -56.7 -33.9 14.0 6.5 33.7 88 90 A E H > S+ 0 0 22 -3,-0.4 4,-2.6 1,-0.2 -2,-0.2 0.932 110.7 47.2 -65.9 -44.9 14.0 7.5 37.4 89 91 A A H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.879 111.9 50.5 -64.4 -38.1 10.2 7.9 37.3 90 92 A Q H X S+ 0 0 76 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.964 111.7 47.8 -63.4 -50.1 9.7 4.6 35.5 91 93 A F H X S+ 0 0 2 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.937 116.4 43.7 -54.6 -52.5 11.9 2.7 38.1 92 94 A Q H X S+ 0 0 13 -4,-2.6 4,-3.0 -5,-0.2 5,-0.2 0.917 114.8 46.0 -64.4 -46.2 10.1 4.3 41.0 93 95 A L H X S+ 0 0 1 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.871 113.9 47.6 -68.2 -34.9 6.5 4.0 39.8 94 96 A X H X S+ 0 0 26 -4,-2.4 4,-2.0 -5,-0.3 -1,-0.2 0.942 114.2 48.9 -68.2 -43.7 6.9 0.3 38.6 95 97 A N H < S+ 0 0 5 -4,-2.1 4,-0.4 -5,-0.3 -2,-0.2 0.974 119.0 38.1 -56.6 -56.5 8.6 -0.4 42.0 96 98 A L H >X S+ 0 0 3 -4,-3.0 4,-1.7 1,-0.2 3,-1.4 0.914 117.1 47.5 -64.0 -48.1 5.8 1.3 44.0 97 99 A L H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.787 103.4 64.3 -66.9 -25.7 2.8 0.2 41.9 98 100 A S T 3< S+ 0 0 20 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.677 113.3 34.0 -71.4 -13.9 4.0 -3.4 41.8 99 101 A L T <4 S+ 0 0 63 -3,-1.4 -2,-0.2 -4,-0.4 -1,-0.2 0.664 94.5 91.3-113.3 -26.4 3.5 -3.4 45.7 100 102 A L S < S- 0 0 0 -4,-1.7 3,-0.1 1,-0.1 -24,-0.1 -0.475 84.8 -97.3 -74.3 148.0 0.5 -1.3 46.5 101 103 A P > - 0 0 71 0, 0.0 3,-1.7 0, 0.0 44,-0.2 -0.178 39.8 -96.5 -61.3 152.4 -2.9 -3.0 46.6 102 104 A V T 3 S+ 0 0 92 1,-0.3 44,-0.2 44,-0.1 3,-0.1 -0.526 115.7 39.8 -67.3 139.0 -5.4 -3.0 43.6 103 105 A G T 3 S+ 0 0 23 42,-2.6 -1,-0.3 1,-0.3 43,-0.1 0.256 78.7 140.6 101.4 -13.2 -7.7 -0.1 44.4 104 106 A T < - 0 0 5 -3,-1.7 41,-2.5 41,-0.2 -1,-0.3 -0.400 55.9-118.9 -63.9 139.4 -5.1 2.3 45.8 105 107 A D E -dE 77 144A 39 -29,-2.4 -27,-2.8 39,-0.2 2,-0.5 -0.651 28.3-153.8 -78.1 138.0 -5.7 6.0 44.7 106 108 A I E -dE 78 143A 0 37,-3.8 37,-2.1 -2,-0.3 2,-0.4 -0.961 14.5-178.9-118.3 130.1 -2.8 7.3 42.7 107 109 A F E -dE 79 142A 28 -29,-2.5 -27,-2.6 -2,-0.5 2,-0.4 -0.982 4.6-169.9-123.9 134.7 -2.0 11.0 42.5 108 110 A V E -dE 80 141A 1 33,-2.5 33,-2.8 -2,-0.4 2,-0.4 -0.996 6.9-178.8-128.9 124.6 0.9 12.3 40.4 109 111 A V E +dE 81 140A 0 -29,-2.3 -27,-2.9 -2,-0.4 2,-0.3 -0.974 20.9 112.2-128.6 136.8 2.1 15.9 40.6 110 112 A G E - E 0 139A 7 29,-2.0 29,-3.3 -2,-0.4 2,-0.4 -0.975 58.0 -65.2-174.5-170.2 4.8 17.6 38.7 111 113 A E E > > - 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N 0 327E 37 -2,-0.3 3,-1.4 25,-0.2 25,-0.2 -0.366 43.8-127.2 -58.1 138.4 31.3 25.8 35.5 303 305 A A T 3 S+ 0 0 42 23,-2.4 -1,-0.1 1,-0.3 24,-0.1 0.651 102.9 69.1 -64.5 -18.4 33.0 29.2 35.9 304 306 A F T 3 S+ 0 0 167 22,-0.3 -1,-0.3 2,-0.1 23,-0.1 0.783 82.4 91.0 -71.4 -29.2 29.7 31.0 36.2 305 307 A L S < S- 0 0 11 -3,-1.4 2,-0.6 1,-0.1 -32,-0.1 -0.281 87.9-108.0 -70.6 158.6 29.0 29.5 39.6 306 308 A P S > S+ 0 0 41 0, 0.0 4,-1.3 0, 0.0 5,-0.1 -0.044 77.3 114.9 -77.3 30.2 30.1 31.1 43.0 307 309 A Y H > + 0 0 7 -2,-0.6 4,-2.9 1,-0.2 5,-0.2 0.893 67.2 61.2 -70.5 -38.8 32.9 28.9 44.2 308 310 A P H > S+ 0 0 33 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.925 107.8 43.1 -54.2 -48.6 35.8 31.4 44.0 309 311 A D H > S+ 0 0 124 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.911 115.4 48.5 -65.5 -41.1 34.3 33.8 46.5 310 312 A V H X S+ 0 0 9 -4,-1.3 4,-2.3 1,-0.2 -1,-0.2 0.881 112.5 51.3 -63.7 -37.5 33.3 31.0 48.9 311 313 A L H X>S+ 0 0 2 -4,-2.9 4,-3.1 2,-0.2 5,-0.7 0.933 110.1 46.7 -64.5 -50.3 36.8 29.6 48.5 312 314 A D H X5S+ 0 0 60 -4,-2.9 4,-1.8 -5,-0.2 -2,-0.2 0.944 112.7 51.2 -59.3 -44.4 38.5 32.8 49.3 313 315 A E H <5S+ 0 0 127 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.895 120.0 34.2 -57.9 -43.9 36.2 33.3 52.3 314 316 A T H <5S+ 0 0 38 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.918 134.2 20.9 -81.9 -47.7 36.9 29.8 53.7 315 317 A F H <5S- 0 0 33 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.491 99.6-117.8-100.9 -7.7 40.5 29.1 52.8 316 318 A G S <