==== 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 21-FEB-09 3GC5 . COMPND 2 MOLECULE: QUEUINE TRNA-RIBOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ZYMOMONAS MOBILIS; . AUTHOR T.RITSCHEL,A.HEINE,G.KLEBE . 368 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14810.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 259 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 7.9 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 . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 18 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 35.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 3.3 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 0 2 5 1 0 2 0 2 1 0 1 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 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 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 11 A R 0 0 164 0, 0.0 22,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 164.2 8.6 -10.6 25.8 2 12 A P - 0 0 51 0, 0.0 3,-0.2 0, 0.0 180,-0.0 -0.381 360.0-104.7 -78.2 166.1 9.9 -8.7 28.8 3 13 A R S S- 0 0 70 1,-0.3 20,-0.5 19,-0.2 2,-0.3 0.911 102.3 -10.6 -54.6 -46.2 9.2 -5.0 29.5 4 14 A F E +A 22 0A 25 18,-0.2 2,-0.3 19,-0.1 -1,-0.3 -0.892 64.9 161.5-159.5 126.7 12.8 -4.3 28.4 5 15 A S E -A 21 0A 45 16,-1.7 16,-2.9 -2,-0.3 2,-0.5 -0.877 14.8-165.1-147.0 119.2 15.9 -6.3 27.6 6 16 A F E -A 20 0A 26 -2,-0.3 2,-0.4 14,-0.3 14,-0.2 -0.908 11.4-176.5-102.8 125.1 18.9 -5.1 25.6 7 17 A S E -A 19 0A 59 12,-2.6 12,-2.3 -2,-0.5 2,-0.6 -0.992 18.3-147.0-124.2 126.8 21.3 -7.8 24.4 8 18 A I E +A 18 0A 45 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.871 17.8 177.1 -94.7 116.0 24.5 -7.1 22.5 9 19 A A E + 0 0 86 8,-2.1 2,-0.3 -2,-0.6 9,-0.2 0.716 64.8 6.2 -90.2 -26.7 25.1 -10.0 20.0 10 20 A A E -A 17 0A 25 7,-1.8 7,-2.5 2,-0.0 2,-0.3 -0.993 59.7-161.4-161.0 152.8 28.3 -8.7 18.4 11 21 A R E -A 16 0A 132 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.960 9.6-177.1-138.0 149.7 30.9 -5.9 18.7 12 22 A E E > S-A 15 0A 39 3,-2.1 3,-2.2 -2,-0.3 2,-0.1 -0.845 71.7 -49.7-147.7 109.3 33.5 -4.2 16.5 13 23 A G T 3 S- 0 0 77 -2,-0.3 -1,-0.1 1,-0.3 248,-0.1 -0.451 124.3 -21.4 61.1-127.0 35.6 -1.5 18.2 14 24 A K T 3 S+ 0 0 94 246,-0.6 -1,-0.3 -2,-0.1 2,-0.2 0.549 118.5 103.0 -86.9 -11.5 33.1 0.8 19.8 15 25 A A E < -A 12 0A 1 -3,-2.2 -3,-2.1 245,-0.2 2,-0.3 -0.426 50.1-173.6 -76.2 146.2 30.3 -0.4 17.5 16 26 A R E -A 11 0A 5 247,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.984 13.2-164.8-137.5 149.4 27.6 -2.8 18.7 17 27 A T E +A 10 0A 8 -7,-2.5 -8,-2.1 -2,-0.3 -7,-1.8 -0.991 35.1 108.1-135.6 141.3 24.8 -4.8 17.2 18 28 A G E -AB 8 29A 7 11,-1.9 11,-2.8 -2,-0.4 2,-0.3 -0.878 53.3 -79.2-176.0-155.1 22.0 -6.4 19.1 19 29 A T E -AB 7 28A 47 -12,-2.3 -12,-2.6 -2,-0.3 2,-0.5 -0.990 11.8-150.0-139.8 148.3 18.3 -6.3 20.1 20 30 A I E -AB 6 27A 0 7,-2.6 7,-2.8 -2,-0.3 2,-0.5 -0.989 21.6-156.4-111.4 121.5 16.0 -4.6 22.4 21 31 A E E +AB 5 26A 70 -16,-2.9 -16,-1.7 -2,-0.5 2,-0.3 -0.889 20.8 164.8 -99.2 130.1 13.1 -6.8 23.4 22 32 A M E > -AB 4 25A 0 3,-1.9 3,-1.3 -2,-0.5 -19,-0.2 -0.876 51.9 -97.6-132.1 168.4 9.9 -5.0 24.6 23 33 A K T 3 S+ 0 0 87 -20,-0.5 3,-0.1 159,-0.3 -20,-0.1 0.876 122.3 44.8 -59.1 -37.2 6.3 -6.2 25.0 24 34 A R T 3 S- 0 0 104 1,-0.2 2,-0.3 -21,-0.2 -1,-0.3 0.431 125.7 -52.1 -89.5 -0.9 5.2 -4.8 21.6 25 35 A G E < -B 22 0A 1 -3,-1.3 -3,-1.9 62,-0.2 2,-0.4 -0.875 57.1 -69.1 155.5 173.3 8.2 -6.1 19.7 26 36 A V E -B 21 0A 41 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.816 33.7-155.3 -98.2 135.6 11.8 -6.5 19.0 27 37 A I E -B 20 0A 0 -7,-2.8 -7,-2.6 -2,-0.4 2,-0.4 -0.963 10.6-143.6-112.5 117.1 14.0 -3.6 17.9 28 38 A R E -B 19 0A 78 -2,-0.5 -9,-0.2 -9,-0.2 27,-0.1 -0.677 32.3-106.6 -80.5 131.4 17.2 -4.5 16.0 29 39 A T E S+B 18 0A 0 -11,-2.8 -11,-1.9 -2,-0.4 2,-0.2 -0.925 100.5 45.7-118.0 144.9 20.2 -2.3 16.8 30 40 A P S S- 0 0 0 0, 0.0 2,-0.4 0, 0.0 235,-0.2 0.456 92.6-174.1 -63.8 139.9 21.6 -0.0 15.5 31 41 A A E -c 265 0B 3 233,-2.1 235,-1.6 -2,-0.2 2,-0.5 -0.925 26.1-153.5-117.0 139.9 18.1 1.2 14.8 32 42 A F E -c 266 0B 2 -2,-0.4 23,-0.3 233,-0.2 24,-0.3 -0.976 14.8-154.5-109.9 129.3 16.7 4.1 12.8 33 43 A M E -c 267 0B 0 233,-2.7 235,-0.7 -2,-0.5 24,-0.2 -0.904 11.0-137.7-104.4 109.0 13.3 5.4 14.0 34 44 A P - 0 0 0 0, 0.0 24,-2.7 0, 0.0 2,-0.5 -0.366 28.9-115.4 -58.7 148.2 11.2 7.2 11.4 35 45 A V B +d 58 0B 8 233,-0.4 7,-0.5 22,-0.2 24,-0.2 -0.770 32.1 178.5 -99.7 127.4 9.6 10.3 12.8 36 46 A G > + 0 0 3 22,-3.4 3,-1.6 -2,-0.5 24,-0.3 -0.477 11.9 165.2-123.2 61.4 5.8 10.5 13.2 37 47 A T T 3 S+ 0 0 22 1,-0.3 23,-0.5 22,-0.2 27,-0.2 0.764 76.1 36.5 -57.4 -41.4 5.3 13.9 14.8 38 48 A A T 3 S- 0 0 39 2,-0.7 -1,-0.3 21,-0.1 3,-0.1 -0.135 131.8 -80.9-106.6 45.1 1.5 14.3 14.3 39 49 A A S < S+ 0 0 13 -3,-1.6 2,-0.3 1,-0.1 -2,-0.2 0.797 112.3 81.2 61.3 35.9 0.6 10.7 14.8 40 50 A T S S- 0 0 59 -4,-0.2 2,-0.7 5,-0.0 -2,-0.7 -0.929 79.8-127.9-160.0 138.8 1.7 9.8 11.2 41 51 A V > - 0 0 4 3,-0.5 3,-2.3 -2,-0.3 -5,-0.2 -0.866 63.0 -97.6 -81.1 113.8 5.0 9.2 9.5 42 52 A K T 3 S- 0 0 86 -2,-0.7 -1,-0.1 -7,-0.5 3,-0.1 -0.072 95.8 -4.5 -56.4 129.0 4.3 11.7 6.8 43 53 A A T 3 S+ 0 0 40 1,-0.1 2,-0.4 291,-0.1 -1,-0.3 0.508 112.0 100.9 71.1 12.7 2.8 10.3 3.6 44 54 A L < - 0 0 13 -3,-2.3 -3,-0.5 290,-0.1 -1,-0.1 -0.985 66.1-133.7-125.9 137.1 3.1 6.7 4.7 45 55 A K >> - 0 0 135 -2,-0.4 4,-2.2 1,-0.1 3,-1.0 -0.524 35.6-112.8 -67.2 147.8 0.7 4.1 6.0 46 56 A P H 3> S+ 0 0 35 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.865 118.4 58.4 -52.9 -36.7 2.0 2.2 9.0 47 57 A E H 3> S+ 0 0 136 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.873 106.0 49.1 -63.0 -31.2 2.2 -1.0 7.0 48 58 A T H <> S+ 0 0 30 -3,-1.0 4,-1.5 2,-0.2 -1,-0.2 0.914 108.3 53.3 -72.5 -41.1 4.4 0.8 4.5 49 59 A V H <>S+ 0 0 2 -4,-2.2 5,-1.4 1,-0.2 3,-0.4 0.932 112.9 44.3 -56.0 -46.5 6.7 2.0 7.4 50 60 A R H ><5S+ 0 0 80 -4,-2.6 3,-2.3 1,-0.2 -2,-0.2 0.913 107.0 59.3 -67.8 -40.2 6.9 -1.6 8.6 51 61 A A H 3<5S+ 0 0 80 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.788 98.5 59.4 -57.2 -29.9 7.5 -2.9 5.1 52 62 A T T 3<5S- 0 0 18 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.629 127.5 -96.9 -72.7 -12.2 10.6 -0.7 4.8 53 63 A G T < 5 + 0 0 18 -3,-2.3 -3,-0.2 -4,-0.3 -2,-0.1 0.320 70.0 150.6 115.4 -7.6 12.1 -2.5 7.8 54 64 A A < - 0 0 0 -5,-1.4 -1,-0.3 1,-0.1 3,-0.1 -0.399 22.3-178.1 -67.8 140.3 11.3 -0.1 10.7 55 65 A D S S+ 0 0 7 -23,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.550 71.3 16.3-103.9 -18.1 10.9 -1.8 14.1 56 66 A I - 0 0 1 -24,-0.3 -1,-0.3 31,-0.1 2,-0.3 -0.981 64.4-154.7-159.7 144.4 10.0 1.4 16.1 57 67 A I E - e 0 89B 3 31,-1.3 33,-2.5 -2,-0.3 2,-0.4 -0.872 19.8-118.4-123.5 161.9 8.9 4.9 15.3 58 68 A L E -de 35 90B 2 -24,-2.7 -22,-3.4 -2,-0.3 2,-0.3 -0.881 23.9-173.6-103.4 135.6 9.2 8.2 17.1 59 69 A G E - e 0 91B 2 31,-2.8 33,-2.2 -2,-0.4 2,-0.5 -0.768 19.9-128.5-114.8 161.5 6.3 10.3 18.4 60 70 A N E > - e 0 92B 5 -23,-0.5 4,-1.9 -24,-0.3 5,-0.3 -0.943 6.7-155.6-120.5 124.8 6.5 13.8 20.0 61 71 A T H > S+ 0 0 0 31,-1.3 4,-2.3 -2,-0.5 5,-0.2 0.932 96.1 54.6 -52.8 -46.7 4.9 15.0 23.3 62 72 A Y H > S+ 0 0 10 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.963 111.8 38.0 -62.5 -54.2 4.9 18.6 22.1 63 73 A H H >> S+ 0 0 45 1,-0.2 4,-2.7 2,-0.2 3,-0.7 0.956 119.0 47.7 -65.6 -42.4 3.0 18.2 18.9 64 74 A L H 3<>S+ 0 0 0 -4,-1.9 5,-2.5 1,-0.3 -1,-0.2 0.854 105.9 57.1 -73.1 -28.7 0.6 15.6 20.1 65 75 A M H 3<5S+ 0 0 21 -4,-2.3 5,-0.4 -5,-0.3 -1,-0.3 0.818 114.1 41.9 -66.4 -25.9 -0.3 17.5 23.3 66 76 A L H <<5S+ 0 0 51 -4,-1.1 -2,-0.2 -3,-0.7 -1,-0.2 0.878 118.9 44.1 -83.4 -45.8 -1.3 20.4 21.1 67 77 A R T <5S- 0 0 198 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.1 -0.927 133.3 -5.1-152.4 116.9 -3.2 18.4 18.4 68 78 A P T 5S- 0 0 35 0, 0.0 -3,-0.1 0, 0.0 4,-0.1 -0.996 105.1-118.5 -90.0 -2.0 -5.1 16.2 18.9 69 79 A G >< - 0 0 14 -5,-2.5 4,-2.2 -6,-0.2 -4,-0.2 0.023 10.0-112.1 109.7 140.6 -4.4 16.3 22.7 70 80 A A H > S+ 0 0 1 -5,-0.4 4,-2.4 2,-0.2 5,-0.1 0.938 116.3 48.0 -73.1 -44.2 -2.9 13.7 25.1 71 81 A E H > S+ 0 0 98 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.895 111.4 52.7 -62.3 -38.7 -6.1 13.1 27.0 72 82 A R H > S+ 0 0 162 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.924 108.7 48.9 -61.5 -49.6 -8.0 12.8 23.8 73 83 A I H <>S+ 0 0 0 -4,-2.2 5,-2.9 1,-0.2 4,-0.4 0.934 111.0 50.4 -61.1 -38.8 -5.7 10.2 22.5 74 84 A A H ><5S+ 0 0 37 -4,-2.4 3,-1.4 1,-0.2 -1,-0.2 0.927 108.0 52.5 -63.5 -40.2 -5.9 8.2 25.7 75 85 A K H 3<5S+ 0 0 193 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.824 108.3 52.9 -63.0 -30.5 -9.7 8.3 25.6 76 86 A L T 3<5S- 0 0 92 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.474 133.5 -87.6 -84.6 0.5 -9.5 6.9 22.0 77 87 A G T < 5S- 0 0 53 -3,-1.4 4,-0.4 -4,-0.4 -3,-0.2 0.505 72.4 -69.5 114.9 4.5 -7.3 4.1 23.1 78 88 A G >< - 0 0 10 -5,-2.9 4,-2.4 -6,-0.2 57,-0.2 -0.112 60.0 -71.0 96.8 166.8 -3.8 5.4 23.0 79 89 A L H > S+ 0 0 2 55,-2.6 4,-2.6 1,-0.2 6,-0.3 0.874 124.8 57.4 -67.0 -37.0 -1.4 6.3 20.2 80 90 A H H >>S+ 0 0 9 54,-0.5 4,-1.5 1,-0.2 5,-1.5 0.951 114.0 38.9 -60.3 -48.5 -0.8 2.8 18.8 81 91 A S H 45S+ 0 0 88 -4,-0.4 -2,-0.2 2,-0.2 -1,-0.2 0.901 114.3 55.6 -66.9 -42.9 -4.5 2.2 18.3 82 92 A F H <5S+ 0 0 91 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.936 120.7 27.0 -56.7 -50.9 -5.2 5.7 17.0 83 93 A M H <5S- 0 0 30 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.563 107.0-116.3 -95.7 -7.1 -2.6 5.6 14.2 84 94 A G T <5S+ 0 0 52 -4,-1.5 2,-0.5 -5,-0.3 -3,-0.2 0.783 70.4 129.9 78.9 30.2 -2.5 1.9 13.6 85 95 A W < + 0 0 8 -5,-1.5 -1,-0.2 -6,-0.3 -2,-0.2 -0.976 29.2 178.9-115.6 113.4 1.1 1.2 14.6 86 96 A D + 0 0 115 -2,-0.5 -1,-0.1 -3,-0.1 3,-0.1 0.381 54.3 83.8 -99.8 2.8 1.2 -1.8 17.0 87 97 A R S S- 0 0 68 1,-0.2 -62,-0.2 -7,-0.1 -31,-0.1 -0.302 95.2 -53.8 -96.7 179.6 5.0 -2.0 17.4 88 98 A P - 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0 0 1 -5,-2.2 -1,-0.3 -8,-0.1 -247,-0.3 -0.652 20.6-179.8 -83.9 141.1 25.5 4.8 19.2 264 277 A D + 0 0 0 -20,-3.0 -233,-2.1 -2,-0.3 2,-0.3 0.540 61.9 40.4-111.9 -18.4 22.7 2.3 18.9 265 278 A M E +cj 31 245B 0 -21,-1.4 -19,-2.6 -235,-0.2 2,-0.3 -0.995 56.7 177.7-145.6 145.8 19.6 4.4 18.1 266 279 A F E -cj 32 246B 0 -235,-1.6 -233,-2.7 -2,-0.3 2,-0.3 -0.972 9.0-173.6-143.4 153.2 18.7 7.3 15.8 267 280 A D E +c 33 0B 20 -21,-0.7 2,-0.3 -18,-0.7 -19,-0.2 -0.982 15.6 157.9-146.8 145.8 15.9 9.5 14.7 268 281 A C - 0 0 14 -235,-0.7 -233,-0.4 -2,-0.3 4,-0.3 -0.924 40.0-143.0-164.1 144.2 15.7 12.2 12.1 269 282 A V S >>S+ 0 0 52 -2,-0.3 4,-2.8 1,-0.2 5,-0.5 0.541 79.7 98.7 -81.9 -7.3 13.2 14.0 9.9 270 283 A L H >>S+ 0 0 26 1,-0.2 4,-2.0 2,-0.2 5,-0.6 0.909 80.3 46.7 -50.3 -53.2 15.7 14.1 7.0 271 284 A P H >5S+ 0 0 0 0, 0.0 4,-0.7 0, 0.0 -1,-0.2 0.906 121.9 36.6 -62.5 -38.8 14.4 11.1 5.0 272 285 A T H >5S+ 0 0 6 -3,-0.3 4,-2.2 -4,-0.3 -2,-0.2 0.958 123.5 38.5 -76.5 -55.4 10.7 12.2 5.2 273 286 A R H X5S+ 0 0 126 -4,-2.8 4,-1.3 1,-0.2 -3,-0.2 0.954 119.8 45.1 -67.4 -46.4 11.0 15.9 5.0 274 287 A S H < - 0 0 3 -2,-0.3 3,-1.7 86,-0.1 20,-0.1 -0.956 49.0-108.8-138.9 163.2 21.2 6.8 -3.1 283 296 A W T 3 S+ 0 0 24 -2,-0.3 19,-0.1 1,-0.3 -1,-0.0 0.726 121.3 55.2 -70.0 -18.9 24.4 4.9 -2.4 284 297 A D T 3 S- 0 0 113 1,-0.4 -1,-0.3 85,-0.1 84,-0.1 0.152 128.8 -83.9 -88.8 18.3 26.2 7.3 -4.7 285 298 A G < - 0 0 3 -3,-1.7 -1,-0.4 85,-0.1 84,-0.1 -0.284 64.6 -44.1 102.8 170.6 25.0 10.3 -2.6 286 299 A P - 0 0 61 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.350 51.4-162.7 -72.0 152.6 21.8 12.3 -2.5 287 300 A I E -M 280 0D 18 -7,-2.5 -7,-2.7 -2,-0.1 2,-0.8 -0.959 19.8-130.9-130.2 151.4 20.1 13.5 -5.7 288 301 A N E > -M 279 0D 72 -2,-0.3 3,-2.1 -9,-0.2 -9,-0.2 -0.873 16.7-161.2-105.4 107.5 17.5 16.2 -6.3 289 302 A I T 3 S+ 0 0 0 -11,-2.9 -1,-0.1 -2,-0.8 5,-0.1 0.680 83.2 69.6 -65.2 -18.6 14.9 14.6 -8.4 290 303 A R T 3 S+ 0 0 107 -12,-0.3 -1,-0.3 -13,-0.2 5,-0.1 0.710 73.5 113.8 -71.3 -17.9 13.4 17.9 -9.5 291 304 A N S X S- 0 0 75 -3,-2.1 3,-2.2 -13,-0.2 4,-0.2 -0.290 77.6-123.4 -60.4 138.7 16.6 18.6 -11.6 292 305 A A G > S+ 0 0 61 1,-0.3 3,-1.9 2,-0.2 4,-0.3 0.720 104.1 75.5 -53.4 -26.0 15.9 18.7 -15.3 293 306 A R G 3 S+ 0 0 158 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.696 94.1 52.3 -65.8 -17.9 18.5 15.9 -15.9 294 307 A F G X S+ 0 0 5 -3,-2.2 3,-1.3 -6,-0.2 -1,-0.3 0.451 77.3 100.3 -93.8 -0.9 16.1 13.4 -14.5 295 308 A S T < S+ 0 0 59 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.753 100.0 20.9 -62.7 -24.8 13.1 14.3 -16.8 296 309 A E T 3 S+ 0 0 171 -3,-0.3 2,-0.7 -4,-0.3 -1,-0.3 0.059 90.8 127.3-127.8 22.8 13.8 11.4 -19.2 297 310 A D < - 0 0 23 -3,-1.3 19,-2.4 1,-0.2 20,-0.3 -0.712 36.1-172.1 -87.6 113.5 15.8 9.1 -16.9 298 311 A L + 0 0 144 -2,-0.7 -1,-0.2 17,-0.2 -4,-0.0 0.523 51.7 105.1 -87.3 -4.2 14.2 5.6 -16.9 299 312 A K S S- 0 0 117 15,-0.1 16,-2.9 1,-0.1 17,-0.2 -0.357 78.6-105.1 -69.3 155.3 16.4 4.3 -14.1 300 313 A P - 0 0 41 0, 0.0 14,-0.1 0, 0.0 10,-0.1 -0.287 41.1 -94.3 -71.7 164.6 15.0 3.8 -10.6 301 314 A L S S+ 0 0 0 12,-0.4 2,-0.4 1,-0.2 -21,-0.1 0.885 113.8 19.0 -48.8 -43.3 16.0 6.4 -7.9 302 315 A D S S- 0 0 2 3,-0.1 -1,-0.2 -20,-0.1 -20,-0.0 -0.998 73.4-138.9-135.5 138.4 18.8 4.0 -6.7 303 316 A S S S+ 0 0 89 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.1 0.638 100.9 30.6 -70.0 -21.8 20.3 1.2 -8.7 304 317 A E S S+ 0 0 117 -4,-0.0 -1,-0.2 0, 0.0 -22,-0.0 0.689 86.2 124.2-110.4 -25.6 20.6 -1.3 -5.9 305 318 A C - 0 0 13 1,-0.1 -3,-0.1 -5,-0.0 35,-0.1 -0.080 46.8-155.9 -52.0 137.2 17.7 -0.4 -3.7 306 319 A H + 0 0 164 33,-0.1 -1,-0.1 4,-0.0 5,-0.1 0.363 50.8 124.7 -91.6 2.9 15.2 -3.2 -2.9 307 320 A C S > S- 0 0 11 1,-0.1 4,-1.3 29,-0.1 5,-0.2 -0.144 72.9-116.2 -73.0 157.7 12.3 -0.9 -2.2 308 321 A A H > S+ 0 0 54 1,-0.2 4,-1.1 2,-0.2 5,-0.2 0.852 114.1 58.5 -60.8 -29.4 8.9 -1.2 -3.9 309 322 A V H >> S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 3,-0.6 0.952 107.0 45.2 -66.6 -46.7 9.4 2.3 -5.4 310 323 A C H 34 S+ 0 0 15 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.707 110.1 56.6 -72.9 -18.5 12.6 1.4 -7.1 311 324 A Q H 3< S+ 0 0 91 -4,-1.3 -1,-0.2 1,-0.1 -2,-0.2 0.757 122.4 22.3 -76.5 -23.7 11.1 -1.9 -8.4 312 325 A K H << S+ 0 0 65 -4,-1.1 2,-0.3 -3,-0.6 -2,-0.2 0.776 111.3 51.5-121.2 -27.7 8.2 -0.1 -10.1 313 326 A W < - 0 0 100 -4,-2.7 -12,-0.4 -5,-0.2 2,-0.2 -0.879 62.4-129.2-127.7 150.4 8.8 3.6 -11.0 314 327 A S > - 0 0 22 -2,-0.3 4,-2.2 -14,-0.1 5,-0.2 -0.496 26.4-115.7 -88.4 159.9 11.4 5.6 -12.8 315 328 A R H > S+ 0 0 34 -16,-2.9 4,-2.9 1,-0.2 5,-0.2 0.895 117.0 59.3 -53.7 -40.1 13.3 8.8 -11.9 316 329 A A H > S+ 0 0 17 -19,-2.4 4,-2.0 -17,-0.2 -1,-0.2 0.888 106.6 44.7 -61.1 -42.3 11.4 10.4 -14.8 317 330 A Y H > S+ 0 0 83 -20,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.939 114.5 47.0 -67.7 -45.4 8.0 9.7 -13.4 318 331 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.914 109.9 55.7 -65.6 -37.7 8.9 10.8 -9.8 319 332 A H H X S+ 0 0 18 -4,-2.9 4,-2.7 -25,-0.2 -1,-0.2 0.931 109.2 46.7 -52.4 -51.2 10.5 13.9 -11.3 320 333 A H H X S+ 0 0 104 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.950 111.9 50.2 -57.2 -48.6 7.2 14.7 -13.0 321 334 A L H <>S+ 0 0 7 -4,-2.7 5,-2.7 1,-0.2 4,-0.4 0.919 113.5 43.9 -62.8 -43.5 5.2 14.0 -9.8 322 335 A I H ><5S+ 0 0 11 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.936 112.9 52.2 -69.8 -42.1 7.4 16.2 -7.6 323 336 A R H 3<5S+ 0 0 125 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.855 112.7 46.2 -59.9 -35.9 7.5 19.0 -10.2 324 337 A A T 3<5S- 0 0 60 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.451 111.9-121.7 -82.1 -6.1 3.7 18.9 -10.4 325 338 A G T < 5 + 0 0 66 -3,-1.4 2,-0.3 -4,-0.4 -3,-0.2 0.773 51.6 167.3 63.7 32.9 3.3 18.8 -6.6 326 339 A E >>< - 0 0 109 -5,-2.7 4,-1.1 -6,-0.2 3,-0.9 -0.548 42.0-132.4 -80.2 139.7 1.4 15.5 -6.7 327 340 A I H 3> S+ 0 0 125 1,-0.3 4,-2.5 -2,-0.3 3,-0.4 0.874 105.9 62.9 -58.2 -38.2 0.9 13.7 -3.4 328 341 A L H 3> S+ 0 0 51 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.853 97.2 59.5 -61.7 -27.7 2.0 10.5 -4.9 329 342 A G H <> S+ 0 0 0 -3,-0.9 4,-2.4 -8,-0.3 -1,-0.3 0.935 107.0 44.9 -61.1 -46.8 5.4 12.1 -5.5 330 343 A A H X S+ 0 0 21 -4,-1.1 4,-2.4 -3,-0.4 5,-0.2 0.901 113.5 51.6 -61.9 -44.6 5.7 12.7 -1.7 331 344 A M H X S+ 0 0 73 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.919 113.4 42.6 -57.6 -49.5 4.6 9.2 -1.0 332 345 A L H X S+ 0 0 6 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.917 115.3 48.2 -69.1 -44.6 7.1 7.5 -3.4 333 346 A M H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.908 113.7 47.9 -61.2 -41.9 10.0 9.7 -2.4 334 347 A T H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.899 110.5 50.5 -69.1 -41.8 9.3 9.2 1.3 335 348 A E H X S+ 0 0 37 -4,-2.2 4,-2.5 -5,-0.2 5,-0.2 0.948 113.0 46.9 -60.7 -45.8 8.9 5.4 1.0 336 349 A H H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.909 112.9 48.3 -61.1 -46.9 12.3 5.2 -0.9 337 350 A N H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.905 113.2 46.6 -67.0 -40.3 14.1 7.4 1.6 338 351 A I H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.883 113.7 49.2 -67.7 -36.0 12.9 5.5 4.6 339 352 A A H X S+ 0 0 5 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.903 109.2 52.9 -66.3 -40.1 13.7 2.2 2.9 340 353 A F H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.932 109.7 48.0 -57.4 -49.5 17.2 3.5 2.1 341 354 A Y H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.908 112.2 49.1 -59.5 -43.8 17.7 4.4 5.7 342 355 A Q H X S+ 0 0 9 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.887 110.5 51.0 -64.4 -37.3 16.5 1.0 6.9 343 356 A Q H X S+ 0 0 29 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.888 108.5 52.2 -65.5 -37.5 18.8 -0.7 4.3 344 357 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.933 110.1 48.3 -62.2 -48.2 21.7 1.4 5.6 345 358 A M H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.904 110.9 51.0 -63.3 -35.2 20.9 0.2 9.2 346 359 A Q H X S+ 0 0 61 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.907 110.0 49.3 -64.0 -43.1 20.7 -3.5 8.0 347 360 A K H X S+ 0 0 81 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.873 112.0 49.3 -67.2 -35.3 24.1 -3.2 6.2 348 361 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 5,-0.2 0.964 112.8 47.0 -63.4 -49.1 25.5 -1.7 9.4 349 362 A R H X S+ 0 0 11 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.925 114.9 45.6 -59.1 -48.4 24.1 -4.5 11.6 350 363 A D H X S+ 0 0 65 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.901 111.8 51.5 -63.7 -41.5 25.2 -7.2 9.2 351 364 A S H <>S+ 0 0 0 -4,-2.4 5,-2.8 -5,-0.2 6,-0.7 0.882 111.5 46.4 -68.9 -33.3 28.7 -5.8 8.9 352 365 A I H ><5S+ 0 0 2 -4,-2.4 3,-1.4 4,-0.2 -1,-0.2 0.939 110.4 53.8 -71.2 -41.1 29.2 -5.5 12.6 353 366 A S H 3<5S+ 0 0 67 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.823 114.4 42.9 -58.0 -30.8 27.9 -9.1 13.1 354 367 A E T 3<5S- 0 0 123 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.327 113.6-116.1 -99.8 3.5 30.5 -10.2 10.5 355 368 A G T < 5S+ 0 0 49 -3,-1.4 -3,-0.2 -4,-0.3 -4,-0.1 0.779 89.5 103.1 70.6 26.8 33.3 -8.1 11.9 356 369 A R >< + 0 0 108 -5,-2.8 4,-2.2 -6,-0.2 -4,-0.2 0.032 33.9 115.5-132.9 28.5 33.7 -6.0 8.7 357 370 A F H > S+ 0 0 2 -6,-0.7 4,-2.9 2,-0.2 5,-0.2 0.888 74.0 55.6 -66.3 -38.6 32.0 -2.8 9.7 358 371 A S H > S+ 0 0 69 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.948 111.4 45.7 -64.1 -42.0 35.2 -0.7 9.5 359 372 A Q H > S+ 0 0 97 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.902 111.9 51.9 -61.5 -41.5 35.6 -1.8 5.9 360 373 A F H X S+ 0 0 26 -4,-2.2 4,-3.3 2,-0.2 5,-0.2 0.932 108.2 51.1 -58.4 -46.4 31.9 -1.2 5.3 361 374 A A H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.922 113.1 45.3 -60.1 -42.4 32.2 2.4 6.6 362 375 A Q H X S+ 0 0 120 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.940 115.1 46.6 -67.1 -44.3 35.1 3.1 4.4 363 376 A D H X S+ 0 0 89 -4,-2.8 4,-2.0 1,-0.2 5,-0.3 0.915 112.3 52.2 -59.9 -45.8 33.5 1.6 1.3 364 377 A F H X S+ 0 0 8 -4,-3.3 4,-2.9 -5,-0.3 5,-0.2 0.944 112.5 43.8 -55.3 -53.9 30.3 3.4 2.0 365 378 A R H X S+ 0 0 72 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.902 108.9 55.0 -64.0 -41.9 32.0 6.8 2.3 366 379 A A H < S+ 0 0 70 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.915 117.8 37.4 -59.9 -38.8 34.2 6.4 -0.8 367 380 A R H >< S+ 0 0 41 -4,-2.0 3,-1.6 -5,-0.2 -2,-0.2 0.942 114.7 50.9 -78.6 -46.2 31.2 5.7 -2.9 368 381 A Y H 3< S+ 0 0 14 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.859 119.6 38.0 -58.4 -38.1 28.7 8.1 -1.3 369 382 A F T 3< 0 0 120 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.131 360.0 360.0-100.5 20.9 31.1 11.0 -1.6 370 383 A A < 0 0 120 -3,-1.6 -1,-0.2 -5,-0.0 -2,-0.1 0.840 360.0 360.0 -72.3 360.0 32.6 10.0 -5.0