==== 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 20-MAR-07 2EJU . COMPND 2 MOLECULE: N(2),N(2)-DIMETHYLGUANOSINE TRNA METHYLTRANSFERAS . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR IHSANAWATI,M.SHIROUZU,Y.BESSHO,S.YOKOYAMA,RIKEN STRUCTURAL . 372 3 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16420.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 264 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 16.1 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 . 4 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 29 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 112 30.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 0 0 1 4 1 2 0 2 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 PARALLEL BRIDGES PER LADDER . 3 2 1 1 3 1 0 0 0 1 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 2 0 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 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 L 0 0 101 0, 0.0 2,-0.3 0, 0.0 11,-0.0 0.000 360.0 360.0 360.0 141.6 18.2 90.9 50.4 2 4 A I E -A 13 0A 69 11,-2.5 11,-2.6 2,-0.0 2,-0.3 -0.955 360.0-112.9-130.7 148.4 21.6 89.3 50.5 3 5 A E E +A 12 0A 89 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.610 37.3 170.9 -82.1 135.3 24.5 89.2 48.0 4 6 A V E -A 11 0A 37 7,-2.6 7,-2.8 -2,-0.3 2,-0.4 -0.994 20.5-143.8-143.9 145.5 25.4 85.8 46.6 5 7 A Q E +A 10 0A 133 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.916 18.1 172.3-115.0 138.2 27.7 84.8 43.8 6 8 A E E > -A 9 0A 2 3,-2.7 3,-1.9 -2,-0.4 289,-0.1 -0.914 67.0 -41.3-143.7 112.7 27.2 81.9 41.3 7 9 A G T 3 S- 0 0 14 -2,-0.3 287,-0.1 1,-0.3 -1,-0.0 -0.452 123.7 -24.9 65.9-139.5 29.6 81.6 38.4 8 10 A K T 3 S+ 0 0 126 285,-0.2 2,-0.3 -2,-0.1 -1,-0.3 0.455 120.2 99.9 -83.8 0.3 30.4 85.0 37.0 9 11 A A E < -A 6 0A 0 -3,-1.9 -3,-2.7 46,-0.1 2,-0.5 -0.702 53.0-165.0 -96.3 140.4 27.0 86.3 38.3 10 12 A K E +A 5 0A 93 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.981 24.7 169.5-119.1 114.4 26.5 88.4 41.5 11 13 A I E -A 4 0A 0 -7,-2.8 -7,-2.6 -2,-0.5 2,-0.4 -0.847 33.6-124.0-127.4 165.0 22.8 88.4 42.5 12 14 A L E -A 3 0A 22 -2,-0.3 -9,-0.2 -9,-0.2 73,-0.1 -0.894 27.5-170.3-106.4 132.8 20.7 89.5 45.4 13 15 A I E -A 2 0A 24 -11,-2.6 -11,-2.5 -2,-0.4 2,-0.1 -0.956 32.0 -97.1-124.6 146.4 18.4 86.9 46.9 14 16 A P - 0 0 17 0, 0.0 2,-0.5 0, 0.0 9,-0.1 -0.381 36.5-130.5 -62.2 131.3 15.6 87.4 49.5 15 17 A K 0 0 155 -2,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.740 360.0 360.0 -87.2 124.7 16.7 86.6 53.1 16 18 A A 0 0 99 -2,-0.5 -1,-0.1 3,-0.1 3,-0.0 -0.166 360.0 360.0-159.8 360.0 14.4 84.3 55.0 17 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 18 23 A D 0 0 199 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -22.6 8.5 80.7 52.3 19 24 A S - 0 0 53 1,-0.1 3,-0.2 4,-0.0 -3,-0.1 -0.563 360.0-131.6 -84.9 147.2 10.7 83.0 50.3 20 25 A P S S+ 0 0 70 0, 0.0 2,-0.4 0, 0.0 58,-0.2 0.789 98.9 27.9 -67.3 -27.8 9.2 85.7 48.1 21 26 A V S S- 0 0 9 56,-0.1 2,-0.1 57,-0.1 32,-0.0 -0.968 90.5-124.4-138.7 120.0 11.5 84.7 45.2 22 27 A F + 0 0 81 -2,-0.4 31,-0.7 -3,-0.2 2,-0.3 -0.364 33.8 163.2 -70.9 137.2 12.9 81.2 44.9 23 28 A Y - 0 0 35 -2,-0.1 3,-0.1 29,-0.1 -2,-0.0 -0.935 14.1-170.6-152.7 126.3 16.6 80.4 44.6 24 29 A N > - 0 0 44 -2,-0.3 3,-1.6 350,-0.3 -2,-0.0 -0.946 9.5-166.4-123.1 110.5 18.2 77.0 45.1 25 30 A P G > S+ 0 0 66 0, 0.0 3,-2.1 0, 0.0 4,-0.3 0.797 88.6 69.6 -64.6 -25.4 22.1 77.0 45.3 26 31 A R G > S+ 0 0 164 1,-0.3 3,-0.6 2,-0.1 4,-0.3 0.722 92.6 60.8 -64.0 -17.9 22.0 73.2 44.9 27 32 A M G <> S+ 0 0 19 -3,-1.6 4,-2.2 1,-0.2 -1,-0.3 0.298 73.3 95.7 -91.6 9.6 20.8 73.9 41.3 28 33 A A H <> S+ 0 0 0 -3,-2.1 4,-2.5 1,-0.2 267,-0.3 0.851 82.8 55.2 -65.3 -33.2 24.0 75.8 40.5 29 34 A L H <> S+ 0 0 9 -3,-0.6 4,-2.3 -4,-0.3 -1,-0.2 0.909 105.5 50.2 -64.5 -44.4 25.3 72.5 39.0 30 35 A N H > S+ 0 0 0 -4,-0.3 4,-2.0 1,-0.2 5,-0.2 0.951 111.6 49.3 -58.4 -48.9 22.2 72.3 36.7 31 36 A R H X S+ 0 0 2 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.899 108.5 53.4 -57.6 -43.9 22.9 75.9 35.7 32 37 A D H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.925 105.7 53.9 -57.2 -47.0 26.6 75.0 35.0 33 38 A I H X S+ 0 0 1 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.936 110.5 44.7 -55.3 -51.5 25.7 72.1 32.8 34 39 A V H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.903 111.7 54.1 -62.6 -38.7 23.5 74.2 30.5 35 40 A V H X S+ 0 0 0 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.930 109.6 47.9 -59.7 -44.4 26.1 77.0 30.5 36 41 A V H < S+ 0 0 0 -4,-2.8 3,-0.4 1,-0.2 4,-0.2 0.924 112.2 49.3 -61.7 -45.2 28.7 74.4 29.3 37 42 A L H >X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 3,-2.0 0.909 106.8 54.2 -61.7 -44.4 26.4 73.1 26.6 38 43 A L H 3X S+ 0 0 1 -4,-2.8 4,-1.9 1,-0.3 -1,-0.2 0.759 100.1 62.0 -63.1 -24.5 25.6 76.6 25.3 39 44 A N H 3< S+ 0 0 31 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.543 111.3 40.3 -77.8 -6.2 29.3 77.2 24.9 40 45 A I H <4 S+ 0 0 35 -3,-2.0 -2,-0.2 -4,-0.2 -1,-0.1 0.798 122.8 35.2-103.6 -51.8 29.3 74.3 22.4 41 46 A L H < S- 0 0 49 -4,-2.4 -3,-0.2 2,-0.0 -2,-0.2 0.718 88.3-152.5 -78.8 -24.2 26.0 74.8 20.5 42 47 A N < - 0 0 86 -4,-1.9 -3,-0.1 -5,-0.3 -4,-0.1 0.832 13.1-168.5 57.3 42.2 26.2 78.7 20.5 43 48 A P - 0 0 7 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.399 8.2-157.3 -63.7 137.3 22.5 79.5 20.4 44 49 A K S S+ 0 0 93 1,-0.2 24,-2.3 22,-0.2 23,-2.1 0.935 76.1 40.3 -81.1 -51.3 22.0 83.3 19.7 45 50 A I E S+b 68 0B 18 22,-0.2 83,-2.4 21,-0.2 84,-1.5 -0.906 77.5 174.9-104.9 116.8 18.5 84.0 20.9 46 51 A V E -bc 69 129B 0 22,-2.6 24,-2.5 -2,-0.6 2,-0.4 -0.895 20.6-147.6-128.3 156.3 17.6 82.3 24.2 47 52 A L E -bc 70 130B 0 82,-2.3 84,-2.8 -2,-0.3 2,-0.9 -0.972 11.0-166.8-127.9 129.4 14.9 82.1 26.8 48 53 A D E > -bc 71 131B 0 22,-2.9 24,-2.2 -2,-0.4 3,-0.5 -0.886 22.4-173.3-108.1 90.8 14.9 81.6 30.5 49 54 A A T 3 S+ 0 0 1 82,-1.4 2,-0.3 -2,-0.9 -1,-0.1 0.727 74.7 23.8 -62.5 -33.2 11.2 81.0 30.8 50 55 A L T 3 S+ 0 0 3 81,-0.4 -1,-0.3 23,-0.1 23,-0.2 -0.720 74.9 159.8-136.2 80.7 10.8 80.8 34.6 51 56 A S X - 0 0 0 21,-2.6 3,-3.2 -3,-0.5 2,-0.6 0.630 14.0-177.6 -83.0 -18.0 13.8 82.7 35.9 52 57 A A T 3 S+ 0 0 0 20,-0.4 30,-0.3 1,-0.3 -1,-0.2 -0.358 85.7 10.5 57.1-103.7 12.8 83.6 39.5 53 58 A T T 3 S- 0 0 0 -31,-0.7 -1,-0.3 -2,-0.6 32,-0.2 0.660 107.1-118.5 -78.3 -15.6 15.8 85.7 40.6 54 59 A G S <> S+ 0 0 0 -3,-3.2 4,-2.6 320,-0.1 5,-0.2 0.443 71.8 135.3 92.3 3.0 17.0 85.7 37.0 55 60 A I H > + 0 0 0 -4,-0.5 4,-2.5 319,-0.3 5,-0.2 0.848 68.5 51.5 -52.0 -42.4 20.3 83.8 37.8 56 61 A R H > S+ 0 0 0 -5,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.981 113.8 40.4 -62.0 -60.0 20.0 81.5 34.8 57 62 A G H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.875 114.5 55.1 -57.3 -38.9 19.4 84.1 32.1 58 63 A I H X S+ 0 0 2 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.936 110.1 45.0 -61.2 -45.4 22.0 86.3 33.7 59 64 A R H X S+ 0 0 0 -4,-2.5 4,-3.0 -5,-0.2 -1,-0.2 0.857 108.9 57.3 -67.5 -32.1 24.6 83.6 33.6 60 65 A F H X S+ 0 0 0 -4,-2.4 4,-1.3 1,-0.2 6,-0.4 0.953 111.9 42.7 -60.2 -45.5 23.5 82.8 30.0 61 66 A A H < S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.899 121.2 39.5 -67.0 -42.7 24.3 86.5 29.2 62 67 A L H < S+ 0 0 46 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.789 126.9 29.7 -80.2 -28.0 27.6 86.6 31.2 63 68 A E H < S+ 0 0 17 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.371 109.9 54.8-118.5 6.5 29.0 83.1 30.3 64 69 A T S < S- 0 0 9 -4,-1.3 -25,-0.1 -5,-0.2 -28,-0.1 -0.885 82.6-105.9-135.9 168.0 27.8 82.0 26.9 65 70 A P S S+ 0 0 48 0, 0.0 -4,-0.1 0, 0.0 -26,-0.1 0.431 70.5 135.8 -72.2 0.9 27.8 83.3 23.2 66 71 A A - 0 0 1 -6,-0.4 -22,-0.2 1,-0.1 -21,-0.2 -0.252 35.9-170.6 -52.8 135.7 24.1 84.1 23.5 67 72 A E S S+ 0 0 111 -23,-2.1 41,-2.9 1,-0.3 2,-0.5 0.747 72.5 34.2-100.6 -32.7 23.4 87.5 22.0 68 73 A E E S-bd 45 108B 41 -24,-2.3 -22,-2.6 39,-0.2 2,-0.5 -0.970 70.8-172.3-129.6 116.2 19.8 88.1 23.0 69 74 A V E -bd 46 109B 0 39,-2.9 41,-2.9 -2,-0.5 2,-0.4 -0.933 5.7-163.2-116.1 123.0 18.6 86.8 26.4 70 75 A W E -bd 47 110B 18 -24,-2.5 -22,-2.9 -2,-0.5 2,-0.4 -0.870 3.2-168.6-104.2 132.8 15.0 86.8 27.6 71 76 A L E +bd 48 111B 1 39,-3.3 41,-3.4 -2,-0.4 2,-0.3 -0.978 13.7 179.4-119.0 132.7 14.2 86.4 31.3 72 77 A N E + d 0 112B 1 -24,-2.2 -21,-2.6 -2,-0.4 -20,-0.4 -0.987 14.4 158.1-140.1 147.9 10.6 85.8 32.3 73 78 A D E - d 0 113B 1 39,-1.3 41,-1.4 -2,-0.3 -23,-0.1 -0.951 34.8-140.1-162.7 143.8 8.5 85.1 35.4 74 79 A I S S+ 0 0 86 -2,-0.3 2,-0.3 39,-0.2 41,-0.1 0.731 78.3 93.7 -79.0 -21.8 4.8 85.6 36.3 75 80 A S > - 0 0 32 1,-0.1 4,-2.7 39,-0.1 5,-0.1 -0.567 65.7-149.8 -79.5 131.1 5.6 86.9 39.8 76 81 A E H > S+ 0 0 99 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.884 101.3 52.6 -62.3 -40.9 5.8 90.6 40.3 77 82 A D H > S+ 0 0 87 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.903 111.1 46.3 -61.4 -43.4 8.3 90.1 43.1 78 83 A A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.932 111.2 52.4 -65.6 -45.8 10.5 87.9 40.8 79 84 A Y H X S+ 0 0 2 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.918 109.6 48.8 -56.3 -47.0 10.2 90.5 38.0 80 85 A E H X S+ 0 0 94 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.904 114.4 45.3 -61.8 -40.9 11.4 93.3 40.3 81 86 A L H X S+ 0 0 11 -4,-1.9 4,-3.1 2,-0.2 5,-0.2 0.858 108.3 57.9 -70.4 -36.0 14.3 91.3 41.6 82 87 A M H X S+ 0 0 0 -4,-2.8 4,-2.0 -30,-0.3 -2,-0.2 0.930 107.2 47.2 -59.3 -46.8 15.2 90.2 38.0 83 88 A K H X S+ 0 0 22 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.915 113.7 48.5 -61.7 -43.2 15.6 93.8 36.9 84 89 A R H X S+ 0 0 151 -4,-1.7 4,-0.6 1,-0.2 -2,-0.2 0.936 112.2 47.1 -64.3 -46.7 17.7 94.6 40.0 85 90 A N H < S+ 0 0 0 -4,-3.1 4,-0.4 1,-0.2 3,-0.3 0.829 109.6 54.5 -66.9 -30.3 20.0 91.6 39.5 86 91 A V H >X S+ 0 0 0 -4,-2.0 3,-1.7 1,-0.2 4,-1.3 0.944 108.0 48.0 -67.7 -46.1 20.4 92.4 35.8 87 92 A M H 3< S+ 0 0 61 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.604 103.6 64.2 -70.8 -7.3 21.6 95.9 36.5 88 93 A L T 3< S+ 0 0 74 -4,-0.6 -1,-0.3 -3,-0.3 -2,-0.2 0.637 113.9 31.4 -87.0 -15.1 23.9 94.5 39.1 89 94 A N T <4 S+ 0 0 31 -3,-1.7 2,-0.3 -4,-0.4 -2,-0.2 0.481 122.2 44.1-119.0 -8.4 25.8 92.6 36.4 90 95 A F < - 0 0 38 -4,-1.3 2,-0.2 -5,-0.1 -1,-0.2 -0.977 66.6-141.5-138.8 150.4 25.4 95.0 33.4 91 96 A D + 0 0 154 -2,-0.3 2,-0.2 -3,-0.1 -3,-0.1 -0.535 54.8 68.0-101.5 174.0 25.6 98.7 32.8 92 97 A G S S- 0 0 54 -2,-0.2 2,-0.7 -5,-0.1 -2,-0.1 -0.581 89.1 -42.2 111.9-176.7 23.4 100.8 30.5 93 98 A E - 0 0 154 -2,-0.2 2,-1.4 11,-0.0 11,-0.4 -0.829 40.2-155.4 -99.2 112.7 19.8 101.9 30.5 94 99 A L - 0 0 28 -2,-0.7 2,-0.6 9,-0.1 9,-0.2 -0.723 21.5-156.6 -84.7 93.7 17.3 99.3 31.4 95 100 A R E -E 102 0B 167 7,-2.1 7,-2.9 -2,-1.4 2,-0.4 -0.640 9.9-164.4 -79.8 118.6 14.3 100.8 29.6 96 101 A E E +E 101 0B 93 -2,-0.6 2,-0.3 5,-0.3 5,-0.2 -0.845 19.1 160.6-110.9 141.2 11.0 99.7 31.0 97 102 A S - 0 0 62 3,-2.6 3,-0.2 -2,-0.4 -2,-0.0 -0.856 69.1 -19.5-158.7 116.1 7.5 99.9 29.5 98 103 A K S S- 0 0 220 -2,-0.3 15,-0.1 1,-0.2 3,-0.1 0.907 128.3 -37.2 51.8 59.5 4.4 97.9 30.6 99 104 A G S S+ 0 0 22 1,-0.1 14,-2.0 13,-0.1 2,-0.4 0.698 120.6 96.9 73.0 19.5 5.9 95.0 32.4 100 105 A R E - F 0 112B 71 -3,-0.2 -3,-2.6 12,-0.2 2,-0.4 -0.976 49.1-170.8-144.2 126.5 8.9 94.7 30.1 101 106 A A E -EF 96 111B 0 10,-2.5 10,-3.2 -2,-0.4 2,-0.4 -0.971 8.1-167.7-120.1 130.8 12.4 96.1 30.5 102 107 A I E -EF 95 110B 56 -7,-2.9 -7,-2.1 -2,-0.4 2,-0.5 -0.968 10.7-168.7-126.4 133.4 15.0 96.0 27.8 103 108 A L E - F 0 109B 7 6,-2.6 6,-2.2 -2,-0.4 2,-0.9 -0.971 7.3-161.6-117.5 118.8 18.8 96.7 27.8 104 109 A K E + F 0 108B 177 -2,-0.5 4,-0.2 -11,-0.4 -11,-0.0 -0.512 41.7 126.2-102.5 68.7 20.5 97.0 24.4 105 110 A G S S- 0 0 44 2,-1.4 -13,-0.1 -2,-0.9 -15,-0.0 0.023 85.7 -53.2 -99.9-152.6 24.2 96.5 25.2 106 111 A E S S+ 0 0 197 1,-0.1 2,-0.4 -2,-0.0 -2,-0.0 0.915 140.4 31.1 -51.6 -40.9 26.8 94.1 23.7 107 112 A K S S- 0 0 40 -39,-0.0 -2,-1.4 -38,-0.0 2,-0.6 -0.906 92.4-128.3-115.4 144.1 24.1 91.6 24.6 108 113 A T E -dF 68 104B 37 -41,-2.9 -39,-2.9 -2,-0.4 2,-0.5 -0.855 23.8-165.4 -97.4 123.7 20.4 92.4 24.5 109 114 A I E -dF 69 103B 3 -6,-2.2 -6,-2.6 -2,-0.6 2,-0.5 -0.930 5.3-169.0-113.6 128.6 18.6 91.5 27.7 110 115 A V E -dF 70 102B 3 -41,-2.9 -39,-3.3 -2,-0.5 2,-0.6 -0.964 2.8-165.5-119.2 116.0 14.8 91.4 27.9 111 116 A I E -dF 71 101B 0 -10,-3.2 -10,-2.5 -2,-0.5 2,-0.4 -0.904 14.7-171.9-103.8 119.9 13.2 91.1 31.3 112 117 A N 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-2,-0.5 -18,-0.3 -0.509 17.2-150.0 -74.6 136.6 14.5 69.8 17.1 229 234 A K E - I 0 209B 60 -20,-2.8 -20,-2.6 -2,-0.2 2,-0.8 -0.928 11.9-132.0-110.6 129.3 14.5 68.3 13.6 230 235 A D E + I 0 208B 54 -2,-0.5 -22,-0.2 -22,-0.2 2,-0.1 -0.692 62.1 63.8 -87.9 108.7 12.5 69.9 10.8 231 236 A G S > S- 0 0 8 -24,-2.2 4,-1.8 -2,-0.8 5,-0.1 -0.464 72.1-115.6 148.5 138.8 10.3 67.5 8.8 232 237 A A H > S+ 0 0 41 1,-0.2 4,-2.6 2,-0.2 3,-0.3 0.931 118.5 49.9 -54.7 -50.4 7.3 65.2 8.8 233 238 A R H > S+ 0 0 124 1,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.870 108.5 53.3 -58.0 -39.1 9.6 62.2 8.0 234 239 A K H > S+ 0 0 52 1,-0.2 4,-1.4 2,-0.2 -24,-0.4 0.842 108.7 50.0 -65.5 -32.6 11.9 63.3 10.8 235 240 A G H X S+ 0 0 3 -4,-1.8 4,-2.3 -3,-0.3 -2,-0.2 0.910 110.3 50.4 -70.2 -41.7 8.9 63.2 13.1 236 241 A D H X S+ 0 0 97 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.942 111.1 47.6 -59.7 -49.8 8.0 59.7 11.8 237 242 A E H < S+ 0 0 108 -4,-2.9 -1,-0.2 1,-0.2 4,-0.2 0.803 110.2 54.2 -62.1 -31.1 11.5 58.5 12.4 238 243 A T H >< S+ 0 0 6 -4,-1.4 3,-1.6 -5,-0.2 -1,-0.2 0.928 107.0 48.9 -70.2 -45.7 11.5 60.0 15.9 239 244 A L H >< S+ 0 0 42 -4,-2.3 3,-1.9 1,-0.3 -2,-0.2 0.837 102.4 64.4 -62.8 -31.2 8.2 58.2 16.9 240 245 A E T 3< S+ 0 0 138 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.602 93.9 62.0 -68.3 -9.9 9.8 55.0 15.6 241 246 A K T < S+ 0 0 69 -3,-1.6 32,-2.8 -4,-0.2 33,-0.3 0.377 85.0 99.2 -96.0 3.4 12.4 55.3 18.4 242 247 A L E < +L 272 0D 1 -3,-1.9 17,-1.8 30,-0.2 2,-0.3 -0.446 48.4 144.5 -82.9 162.5 9.7 55.1 21.1 243 248 A G E -LM 271 258D 0 28,-2.2 28,-2.7 15,-0.3 2,-0.3 -0.957 37.2 -97.2-173.7-168.8 9.0 51.8 22.8 244 249 A Y E - M 0 257D 18 13,-2.7 13,-2.2 -2,-0.3 2,-0.4 -0.892 18.7-137.9-133.2 161.4 8.1 49.9 26.0 245 250 A I E -LM 268 256D 0 23,-2.4 23,-2.6 -2,-0.3 2,-0.4 -0.955 6.9-161.8-123.3 139.3 9.8 48.1 28.8 246 251 A Y E - M 0 255D 12 9,-2.2 9,-2.1 -2,-0.4 2,-0.4 -0.949 13.7-168.0-116.5 138.1 8.8 44.8 30.4 247 252 A F E - M 0 254D 22 19,-0.4 2,-0.8 -2,-0.4 7,-0.2 -0.993 16.6-146.0-134.9 130.6 10.2 44.0 33.8 248 253 A D >> - 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E +M 243 0D 130 -2,-0.4 -15,-0.3 -15,-0.2 2,-0.2 -0.716 50.5 88.2 -85.6 127.8 10.2 49.0 19.9 259 264 A G S S- 0 0 22 -17,-1.8 -2,-0.1 -2,-0.5 -19,-0.0 -0.736 82.6 -96.5 156.3 155.9 6.9 50.4 18.6 260 265 A F S S+ 0 0 120 -2,-0.2 -17,-0.1 1,-0.1 -1,-0.1 0.831 111.2 27.4 -64.5 -32.7 4.3 53.0 19.1 261 266 A L S S- 0 0 119 -3,-0.1 -17,-0.1 -19,-0.1 2,-0.1 -0.952 85.3-118.3-129.6 149.0 2.1 50.6 21.1 262 267 A P - 0 0 46 0, 0.0 -2,-0.0 0, 0.0 7,-0.0 -0.420 12.5-157.2 -80.9 162.5 3.1 47.5 23.2 263 268 A T + 0 0 109 -2,-0.1 -4,-0.0 2,-0.1 -2,-0.0 0.266 68.6 57.3-124.5 11.2 1.8 44.1 22.3 264 269 A R S > S- 0 0 105 1,-0.0 3,-0.5 0, 0.0 0, 0.0 -0.949 88.2 -90.0-138.6 157.8 2.1 42.2 25.6 265 270 A P T 3 S+ 0 0 103 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.212 100.2 27.5 -68.7 159.2 0.7 42.8 29.1 266 271 A N T 3 S+ 0 0 137 1,-0.2 -19,-0.4 -20,-0.1 2,-0.2 0.788 78.7 167.4 63.8 33.9 2.3 44.8 31.9 267 272 A A < - 0 0 19 -3,-0.5 2,-0.4 -21,-0.1 -21,-0.2 -0.503 25.3-144.6 -79.5 146.9 4.2 47.1 29.5 268 273 A Y E 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283 A D > - 0 0 62 -65,-2.5 4,-2.5 -2,-0.3 5,-0.3 -0.908 31.2-151.9 -98.9 103.9 25.1 62.8 21.6 279 284 A E H > S+ 0 0 142 -2,-0.9 4,-1.8 1,-0.2 -1,-0.2 0.866 89.4 48.1 -45.4 -49.1 28.5 61.2 22.2 280 285 A K H > S+ 0 0 136 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.933 113.0 46.5 -62.2 -48.0 30.5 63.8 20.4 281 286 A I H > S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.922 112.5 49.3 -62.8 -45.0 28.8 66.8 22.1 282 287 A V H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.849 108.2 55.2 -64.0 -32.2 29.1 65.3 25.6 283 288 A S H X S+ 0 0 44 -4,-1.8 4,-1.3 -5,-0.3 -1,-0.2 0.945 109.9 45.8 -64.8 -45.5 32.8 64.6 24.9 284 289 A K H X S+ 0 0 94 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.842 106.5 61.4 -64.4 -34.3 33.3 68.3 24.0 285 290 A M H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.898 99.7 53.0 -60.7 -42.8 31.3 69.3 27.1 286 291 A V H X S+ 0 0 6 -4,-1.7 4,-0.9 1,-0.2 -1,-0.2 0.932 113.2 44.5 -58.9 -43.9 33.8 67.6 29.5 287 292 A K H X S+ 0 0 123 -4,-1.3 4,-1.2 2,-0.2 3,-0.4 0.910 113.9 49.4 -66.1 -44.5 36.6 69.5 27.8 288 293 A 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298 303 A K H > S+ 0 0 115 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.940 114.6 42.2 -57.9 -51.1 34.4 69.7 40.3 299 304 A Q H > S+ 0 0 85 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.886 113.5 53.9 -64.2 -38.8 30.9 68.4 40.6 300 305 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.935 111.4 44.6 -60.7 -47.7 30.2 69.4 37.0 301 306 A L H X S+ 0 0 23 -4,-2.7 4,-2.9 -5,-0.2 5,-0.3 0.877 110.3 54.5 -65.3 -39.8 33.2 67.5 35.7 302 307 A K H X S+ 0 0 153 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.899 114.2 41.0 -61.8 -41.8 32.5 64.4 37.8 303 308 A L H X S+ 0 0 12 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.931 117.2 47.4 -71.8 -46.8 29.0 64.1 36.4 304 309 A L H X S+ 0 0 2 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.876 111.8 50.1 -63.3 -38.9 30.0 65.0 32.9 305 310 A K H X S+ 0 0 101 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.901 110.1 51.3 -67.6 -38.8 32.9 62.5 32.9 306 311 A M H X S+ 0 0 55 -4,-1.5 4,-1.2 -5,-0.3 -2,-0.2 0.953 114.3 42.5 -60.5 -50.7 30.6 59.8 34.2 307 312 A I H < S+ 0 0 8 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.835 111.2 56.9 -65.8 -34.1 28.1 60.4 31.5 308 313 A D H < S+ 0 0 45 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.891 114.8 36.5 -65.9 -39.2 30.8 60.7 28.9 309 314 A Q H < S+ 0 0 79 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.598 94.6 112.3 -88.8 -11.5 32.3 57.3 29.7 310 315 A E S < S- 0 0 16 -4,-1.2 2,-0.2 -5,-0.2 40,-0.1 -0.397 76.1-116.1 -66.0 132.2 28.8 55.8 30.3 311 316 A L - 0 0 33 38,-0.4 2,-1.1 -2,-0.1 -1,-0.1 -0.521 24.0-135.9 -67.5 130.6 27.7 53.2 27.7 312 317 A D + 0 0 53 -2,-0.2 -1,-0.1 46,-0.1 -33,-0.0 -0.763 56.6 122.3 -95.6 95.3 24.7 54.6 25.9 313 318 A I S S- 0 0 54 -2,-1.1 2,-0.2 2,-0.2 -39,-0.1 -0.978 71.4 -80.8-148.0 148.8 22.3 51.6 25.8 314 319 A P S S- 0 0 28 0, 0.0 -41,-0.1 0, 0.0 -2,-0.0 -0.359 86.4 -32.5 -61.8 123.7 18.8 51.1 27.1 315 320 A L - 0 0 3 -2,-0.2 2,-0.3 -129,-0.1 44,-0.2 -0.001 64.3-132.8 66.7-169.0 18.7 50.4 30.8 316 321 A F - 0 0 4 42,-0.1 2,-0.5 2,-0.0 42,-0.2 -0.963 17.1 -94.5-168.7 179.0 21.1 48.5 33.1 317 322 A Y E -N 357 0E 18 40,-2.2 40,-2.2 -2,-0.3 2,-0.8 -0.957 24.7-148.5-116.8 126.7 21.4 45.8 35.8 318 323 A D E > -N 356 0E 10 -2,-0.5 4,-2.9 38,-0.2 5,-0.3 -0.848 5.2-158.2 -96.5 110.2 21.6 46.7 39.4 319 324 A T H > S+ 0 0 5 36,-1.7 4,-1.8 -2,-0.8 -1,-0.2 0.891 90.8 45.0 -53.8 -47.1 23.8 44.2 41.2 320 325 A H H > S+ 0 0 117 35,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.946 116.0 45.0 -64.9 -50.2 22.3 44.9 44.6 321 326 A A H > S+ 0 0 15 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.918 114.4 47.6 -61.9 -45.7 18.7 44.9 43.5 322 327 A I H X S+ 0 0 1 -4,-2.9 4,-2.6 1,-0.2 5,-0.3 0.877 107.7 57.5 -64.7 -35.6 19.0 41.8 41.4 323 328 A G H X>S+ 0 0 7 -4,-1.8 5,-2.4 -5,-0.3 4,-1.1 0.911 110.0 44.8 -59.6 -40.9 20.8 40.1 44.2 324 329 A R H <5S+ 0 0 166 -4,-1.8 -2,-0.2 3,-0.2 -1,-0.2 0.895 112.9 49.0 -70.0 -42.8 17.7 40.7 46.4 325 330 A R H <5S+ 0 0 69 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.897 119.7 37.1 -65.2 -41.6 15.2 39.6 43.8 326 331 A L H <5S- 0 0 53 -4,-2.6 -1,-0.2 -75,-0.2 -2,-0.2 0.622 106.4-127.0 -85.5 -14.3 17.0 36.4 43.0 327 332 A K T <5 + 0 0 170 -4,-1.1 2,-0.3 -5,-0.3 -3,-0.2 0.948 63.5 131.3 66.6 49.8 18.0 35.8 46.6 328 333 A I < - 0 0 52 -5,-2.4 -1,-0.2 -6,-0.2 2,-0.2 -0.929 60.8-112.3-132.6 157.9 21.7 35.4 45.8 329 334 A E - 0 0 130 -2,-0.3 43,-1.5 -3,-0.1 2,-0.3 -0.605 40.1-161.5 -83.3 148.7 25.0 36.7 47.0 330 335 A T B -P 371 0F 39 -2,-0.2 41,-0.2 41,-0.2 2,-0.1 -0.885 15.5-112.8-134.1 165.3 26.9 39.0 44.6 331 336 A K - 0 0 73 39,-1.8 2,-0.1 -2,-0.3 41,-0.1 -0.327 47.5 -83.0 -86.6 171.8 30.3 40.4 43.8 332 337 A K > - 0 0 145 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.416 37.1-115.9 -75.0 153.4 31.3 44.1 43.9 333 338 A V H > S+ 0 0 21 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.910 114.4 52.9 -54.2 -49.0 30.5 46.4 41.0 334 339 A E H > S+ 0 0 117 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.888 111.5 47.5 -56.0 -41.8 34.2 47.1 40.2 335 340 A E H > S+ 0 0 102 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.896 110.4 51.5 -67.2 -42.7 34.9 43.3 40.0 336 341 A I H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.889 109.3 49.7 -63.7 -40.7 31.8 42.6 37.9 337 342 A I H X S+ 0 0 8 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.936 111.0 49.6 -64.2 -45.7 32.8 45.3 35.3 338 343 A S H X S+ 0 0 42 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.928 112.9 47.8 -57.3 -46.7 36.3 43.9 35.1 339 344 A A H X S+ 0 0 23 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.914 110.7 50.1 -62.1 -45.5 35.0 40.4 34.6 340 345 A L H <>S+ 0 0 0 -4,-2.6 5,-2.5 1,-0.2 3,-0.4 0.925 112.2 47.5 -60.5 -45.1 32.5 41.4 31.9 341 346 A R H ><5S+ 0 0 134 -4,-2.5 3,-1.8 1,-0.2 -1,-0.2 0.901 107.9 56.0 -63.4 -40.2 35.2 43.3 30.0 342 347 A E H 3<5S+ 0 0 171 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.796 104.8 53.6 -62.4 -27.7 37.5 40.3 30.3 343 348 A Q T 3<5S- 0 0 91 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.452 128.4 -99.2 -85.4 -1.6 34.8 38.2 28.7 344 349 A G T < 5S+ 0 0 69 -3,-1.8 2,-0.3 1,-0.3 -3,-0.2 0.607 80.8 128.6 96.2 12.8 34.7 40.6 25.8 345 350 A Y < - 0 0 77 -5,-2.5 -1,-0.3 -6,-0.2 2,-0.3 -0.786 61.1-116.4-106.0 148.1 31.6 42.6 26.8 346 351 A E + 0 0 123 -2,-0.3 14,-1.7 -5,-0.0 15,-0.6 -0.600 44.5 165.9 -76.0 136.1 31.2 46.4 27.0 347 352 A A E +O 359 0E 2 -2,-0.3 2,-0.3 12,-0.2 12,-0.2 -0.937 6.6 159.0-157.9 132.2 30.5 47.4 30.6 348 353 A T E -O 358 0E 16 10,-2.3 10,-2.4 -2,-0.3 2,-0.1 -0.928 40.2-100.7-145.4 168.0 30.5 50.7 32.5 349 354 A R E -O 357 0E 100 -2,-0.3 -38,-0.4 8,-0.2 2,-0.3 -0.346 39.1-139.5 -80.9 172.2 29.1 52.3 35.6 350 355 A T E > -O 353 0E 3 6,-0.6 3,-1.2 3,-0.6 6,-0.3 -0.999 17.0-137.2-139.8 143.4 26.1 54.7 35.2 351 356 A H T 3 S+ 0 0 30 -2,-0.3 -44,-0.1 1,-0.2 -1,-0.1 0.624 98.6 76.2 -70.1 -13.8 25.2 58.0 36.7 352 357 A F T 3 S- 0 0 3 1,-0.3 -1,-0.2 -134,-0.1 -164,-0.2 0.749 113.7 -0.4 -70.2 -23.6 21.6 56.6 37.1 353 358 A S E X - O 0 350E 16 -3,-1.2 3,-1.1 3,-0.1 -3,-0.6 -0.925 59.1-132.9-166.8 140.2 22.6 54.5 40.1 354 359 A P E 3 S+ 0 0 112 0, 0.0 -1,-0.1 0, 0.0 -21,-0.1 0.772 111.9 41.4 -66.5 -27.9 25.8 53.8 42.1 355 360 A T E 3 S+ 0 0 47 -3,-0.1 -36,-1.7 -6,-0.1 -35,-0.3 0.246 94.9 108.1-104.3 11.4 25.2 50.1 42.0 356 361 A G E < -N 318 0E 1 -3,-1.1 -6,-0.6 -6,-0.3 2,-0.4 -0.649 50.0-160.0 -93.4 148.3 24.1 49.9 38.4 357 362 A I E -NO 317 349E 0 -40,-2.2 -40,-2.2 -2,-0.3 2,-0.5 -0.984 7.4-150.8-131.2 123.7 26.0 48.5 35.5 358 363 A K E + O 0 348E 2 -10,-2.4 -10,-2.3 -2,-0.4 2,-0.3 -0.774 34.5 157.6 -87.7 129.0 25.5 49.3 31.8 359 364 A T E - O 0 347E 9 -2,-0.5 -12,-0.2 -12,-0.2 -2,-0.0 -0.999 52.8-140.0-155.9 155.3 26.5 46.4 29.6 360 365 A S S S+ 0 0 47 -14,-1.7 -13,-0.1 -2,-0.3 -1,-0.1 0.621 74.0 112.5 -85.3 -15.3 26.0 44.7 26.2 361 366 A A S S- 0 0 2 -15,-0.6 -2,-0.1 1,-0.1 -21,-0.0 -0.248 76.2-108.5 -61.5 141.5 26.0 41.3 28.0 362 367 A P >> - 0 0 71 0, 0.0 4,-2.1 0, 0.0 3,-0.6 -0.334 33.1-106.4 -67.7 154.7 22.8 39.3 28.0 363 368 A Y H 3> S+ 0 0 14 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.881 119.3 52.1 -48.4 -47.4 21.0 39.1 31.4 364 369 A E H 3> S+ 0 0 132 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.856 108.1 50.7 -63.4 -34.9 22.0 35.4 31.9 365 370 A V H <> S+ 0 0 29 -3,-0.6 4,-1.7 2,-0.2 -1,-0.2 0.901 110.0 51.8 -68.3 -38.4 25.7 36.2 31.3 366 371 A F H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.912 109.4 48.8 -62.0 -45.5 25.4 39.1 33.8 367 372 A I H X S+ 0 0 8 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.896 110.2 50.2 -62.7 -43.0 23.9 36.8 36.5 368 373 A E H < S+ 0 0 142 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.854 113.5 48.4 -64.6 -32.5 26.5 34.1 36.0 369 374 A T H < S+ 0 0 7 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.870 111.9 45.9 -76.1 -38.8 29.2 36.8 36.3 370 375 A I H < S+ 0 0 0 -4,-2.4 -39,-1.8 -5,-0.1 -2,-0.2 0.771 84.5 113.3 -77.3 -25.7 27.9 38.5 39.5 371 376 A K B < P 330 0F 113 -4,-1.8 -41,-0.2 -41,-0.2 -48,-0.0 -0.218 360.0 360.0 -52.2 127.1 27.2 35.3 41.4 372 377 A R 0 0 213 -43,-1.5 -1,-0.1 -41,-0.1 -42,-0.1 0.939 360.0 360.0 -55.0 360.0 29.6 34.9 44.4 373 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 374 501 A X 0 0 52 0, 0.0 -321,-0.4 0, 0.0 -350,-0.3 0.000 360.0 360.0 360.0 360.0 15.4 78.8 37.9