==== 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-MAR-00 1ENU . COMPND 2 MOLECULE: TRNA-GUANINE TRANSGLYCOSYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ZYMOMONAS MOBILIS; . AUTHOR U.GRADLER,H.D.GERBER,D.M.GOODENOUGH-LASHUA,G.A.GARCIA,R.FICN . 372 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15216.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 258 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 9.1 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 . 5 1.3 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 . 24 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 130 34.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.2 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 4 1 1 1 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 . 0 3 4 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 PARALLEL BRIDGES PER LADDER . 3 1 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 2 0 0 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 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 0 169 0, 0.0 22,-0.1 0, 0.0 25,-0.0 0.000 360.0 360.0 360.0 162.0 8.5 -10.1 25.8 2 12 A P - 0 0 52 0, 0.0 3,-0.2 0, 0.0 183,-0.0 -0.230 360.0-106.3 -76.9 172.4 9.9 -8.2 28.7 3 13 A R S S- 0 0 67 1,-0.3 20,-0.5 19,-0.2 2,-0.3 0.943 101.6 -12.5 -61.9 -45.4 9.2 -4.5 29.5 4 14 A F + 0 0 24 18,-0.2 -1,-0.3 19,-0.1 2,-0.3 -0.931 64.9 164.0-162.6 131.7 12.8 -3.8 28.3 5 15 A S E -A 21 0A 48 16,-1.2 16,-2.7 -2,-0.3 2,-0.5 -0.839 12.3-168.2-154.0 110.8 15.9 -5.8 27.5 6 16 A F E +A 20 0A 26 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.880 12.4 178.1-101.6 126.2 18.9 -4.6 25.5 7 17 A S E -A 19 0A 57 12,-2.4 12,-2.2 -2,-0.5 2,-0.6 -0.997 22.1-142.4-132.8 130.8 21.4 -7.2 24.4 8 18 A I E +A 18 0A 47 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.838 18.3 177.7 -93.8 117.6 24.5 -6.7 22.4 9 19 A A E + 0 0 86 8,-2.0 2,-0.3 -2,-0.6 9,-0.2 0.819 65.5 12.1 -86.9 -36.6 25.1 -9.5 19.9 10 20 A A E -A 17 0A 21 7,-2.1 7,-2.2 2,-0.0 2,-0.3 -0.975 59.3-165.9-145.1 157.3 28.2 -8.1 18.2 11 21 A R E +A 16 0A 120 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.979 11.6 176.1-141.9 155.8 30.9 -5.5 18.5 12 22 A E E > S-A 15 0A 49 3,-1.9 3,-1.6 -2,-0.3 2,-0.2 -0.774 72.6 -44.2-160.3 105.1 33.6 -3.8 16.4 13 23 A G T 3 S- 0 0 78 1,-0.3 -1,-0.2 -2,-0.2 251,-0.1 -0.507 124.0 -24.3 67.4-133.7 35.5 -0.9 18.0 14 24 A K T 3 S+ 0 0 90 249,-0.6 -1,-0.3 -2,-0.2 250,-0.1 0.650 117.6 105.4 -83.2 -15.2 33.0 1.3 19.7 15 25 A A E < -A 12 0A 1 -3,-1.6 -3,-1.9 248,-0.3 2,-0.3 -0.337 49.7-172.6 -69.8 143.0 30.2 0.1 17.4 16 26 A R E -A 11 0A 3 250,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.963 11.5-166.2-134.9 151.7 27.6 -2.3 18.7 17 27 A T E +A 10 0A 7 -7,-2.2 -7,-2.1 -2,-0.3 -8,-2.0 -0.997 35.9 101.6-137.8 136.2 24.8 -4.3 17.1 18 28 A G E -AB 8 29A 6 11,-1.9 11,-2.5 -2,-0.4 2,-0.3 -0.874 55.6 -76.0-174.2-146.2 21.9 -6.1 18.9 19 29 A T E -AB 7 28A 41 -12,-2.2 -12,-2.4 -2,-0.3 2,-0.5 -0.992 12.1-148.0-146.9 151.3 18.3 -5.8 19.9 20 30 A I E -AB 6 27A 0 7,-2.4 7,-2.6 -2,-0.3 2,-0.5 -0.989 22.8-154.1-117.6 119.1 16.0 -4.1 22.4 21 31 A E E +AB 5 26A 75 -16,-2.7 -16,-1.2 -2,-0.5 2,-0.3 -0.864 22.1 164.7 -98.9 128.9 13.1 -6.3 23.3 22 32 A M E > - B 0 25A 1 3,-2.1 3,-1.4 -2,-0.5 -19,-0.2 -0.885 51.6 -99.1-134.1 165.6 9.9 -4.6 24.4 23 33 A K T 3 S+ 0 0 83 -20,-0.5 -20,-0.1 162,-0.3 3,-0.1 0.900 122.7 45.2 -54.3 -40.4 6.3 -5.7 24.9 24 34 A R T 3 S- 0 0 102 1,-0.2 2,-0.3 -21,-0.2 -1,-0.3 0.481 125.4 -56.8 -84.8 -4.2 5.3 -4.3 21.5 25 35 A G E < -B 22 0A 0 -3,-1.4 -3,-2.1 62,-0.2 2,-0.4 -0.896 56.3 -64.5 155.4 178.0 8.2 -5.6 19.6 26 36 A V E -B 21 0A 44 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.843 33.2-156.2-104.8 135.9 11.9 -6.1 18.9 27 37 A I E -B 20 0A 0 -7,-2.6 -7,-2.4 -2,-0.4 2,-0.4 -0.958 10.1-146.0-113.8 118.4 14.1 -3.2 17.8 28 38 A R E -B 19 0A 75 -2,-0.5 -9,-0.2 -9,-0.2 27,-0.2 -0.722 32.6-109.8 -84.8 130.5 17.2 -4.1 15.9 29 39 A T E S+B 18 0A 0 -11,-2.5 -11,-1.9 -2,-0.4 2,-0.1 -0.893 99.3 48.9-118.7 148.3 20.2 -1.7 16.7 30 40 A P S S- 0 0 0 0, 0.0 2,-0.3 0, 0.0 238,-0.2 0.417 92.9-176.7 -62.0 136.8 21.7 0.4 15.4 31 41 A A E -c 268 0B 3 236,-2.9 238,-2.1 -2,-0.1 2,-0.5 -0.870 27.5-152.3-117.4 147.2 18.2 1.6 14.6 32 42 A F E -c 269 0B 2 -2,-0.3 24,-0.3 236,-0.2 23,-0.3 -0.977 15.1-152.8-114.6 128.3 16.8 4.6 12.7 33 43 A M E -c 270 0B 0 236,-2.9 238,-0.8 -2,-0.5 24,-0.2 -0.893 10.1-138.5-106.5 114.9 13.4 5.8 13.8 34 44 A P - 0 0 0 0, 0.0 24,-2.8 0, 0.0 2,-0.5 -0.404 30.0-113.4 -65.4 150.2 11.1 7.5 11.2 35 45 A V E -d 58 0B 3 236,-0.5 2,-0.7 22,-0.2 7,-0.6 -0.778 22.3-163.9 -97.1 125.5 9.4 10.6 12.7 36 46 A G E +dE 59 41B 2 22,-3.5 24,-2.2 -2,-0.5 3,-0.3 -0.932 14.6 178.1-102.5 109.6 5.7 10.8 13.2 37 47 A T S S+ 0 0 47 3,-1.8 2,-0.6 -2,-0.7 27,-0.3 0.981 74.3 15.9 -80.2 -68.9 4.9 14.4 13.6 38 48 A A S S- 0 0 50 2,-0.5 -1,-0.2 25,-0.1 3,-0.1 -0.480 134.7 -64.3-105.1 61.8 1.1 14.9 14.0 39 49 A A S S+ 0 0 14 -2,-0.6 2,-0.3 -3,-0.3 -1,-0.1 0.784 121.1 87.6 63.4 30.6 0.4 11.3 14.8 40 50 A T S S- 0 0 67 5,-0.0 -3,-1.8 6,-0.0 2,-0.8 -0.970 77.3-129.2-159.9 138.4 1.6 10.4 11.2 41 51 A V B > -EF 36 44B 4 3,-0.5 3,-2.1 -2,-0.3 -5,-0.2 -0.858 62.9 -90.2 -87.6 110.1 4.8 9.6 9.4 42 52 A K T 3 S- 0 0 85 -2,-0.8 235,-0.1 -7,-0.6 -1,-0.1 0.086 97.2 -15.3 -30.9 113.2 4.5 12.2 6.6 43 53 A A T 3 S+ 0 0 37 1,-0.1 2,-0.4 294,-0.1 -1,-0.3 0.660 112.0 105.8 62.4 25.1 2.8 10.7 3.5 44 54 A L B < -F 41 0B 16 -3,-2.1 -3,-0.5 293,-0.1 -1,-0.1 -0.997 65.3-133.1-137.8 133.1 3.0 7.1 4.6 45 55 A K >> - 0 0 135 -2,-0.4 4,-1.8 1,-0.1 3,-0.9 -0.499 37.2-111.6 -72.4 150.8 0.5 4.6 6.0 46 56 A P H 3> S+ 0 0 31 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.847 118.8 58.4 -54.4 -34.7 2.0 2.8 9.1 47 57 A E H 3> S+ 0 0 137 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.842 105.7 49.6 -65.0 -32.6 2.1 -0.5 7.0 48 58 A T H <> S+ 0 0 30 -3,-0.9 4,-1.4 2,-0.2 -1,-0.2 0.881 108.4 52.6 -72.5 -38.3 4.3 1.2 4.5 49 59 A V H <>S+ 0 0 1 -4,-1.8 5,-1.3 1,-0.2 4,-0.4 0.922 112.6 45.1 -62.0 -44.1 6.6 2.5 7.3 50 60 A R H ><5S+ 0 0 81 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.892 106.5 60.4 -66.7 -38.8 6.9 -1.1 8.6 51 61 A A H 3<5S+ 0 0 78 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.800 97.2 60.0 -60.0 -30.0 7.5 -2.4 5.0 52 62 A T T 3<5S- 0 0 18 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.663 127.5 -97.4 -72.1 -19.3 10.6 -0.2 4.7 53 63 A G T < 5S+ 0 0 17 -3,-1.6 -3,-0.2 -4,-0.4 -2,-0.1 0.332 70.3 151.7 120.2 -5.2 12.1 -2.0 7.7 54 64 A A < - 0 0 0 -5,-1.3 -1,-0.3 1,-0.1 3,-0.1 -0.349 23.0-177.0 -63.6 132.0 11.3 0.3 10.6 55 65 A D S S+ 0 0 7 -23,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.591 73.2 13.8 -99.2 -19.1 10.9 -1.5 14.0 56 66 A I - 0 0 0 -24,-0.3 2,-0.3 31,-0.1 -1,-0.3 -0.984 64.3-153.3-156.0 151.3 10.0 1.7 15.9 57 67 A I E - g 0 89B 1 31,-1.3 33,-2.4 -2,-0.3 2,-0.4 -0.881 20.5-120.4-126.6 159.8 9.0 5.3 15.1 58 68 A L E -dg 35 90B 2 -24,-2.8 -22,-3.5 -2,-0.3 2,-0.5 -0.866 21.0-152.7-101.6 134.0 9.4 8.6 17.0 59 69 A G E -dg 36 91B 5 31,-2.7 33,-1.4 -2,-0.4 2,-0.4 -0.940 14.6-131.2-110.2 122.9 6.2 10.5 18.0 60 70 A N > - 0 0 9 -24,-2.2 4,-1.0 -2,-0.5 -21,-0.2 -0.605 16.6-167.1 -72.9 123.4 6.5 14.3 18.5 61 71 A T H > S+ 0 0 0 -2,-0.4 4,-2.8 2,-0.2 5,-0.2 0.861 79.8 60.7 -78.5 -39.4 4.9 15.2 21.8 62 72 A Y H > S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 5,-0.2 0.935 107.9 43.2 -54.6 -52.4 4.7 19.0 21.2 63 73 A H H > S+ 0 0 35 1,-0.2 4,-2.1 2,-0.2 3,-0.2 0.904 115.4 50.2 -62.8 -40.9 2.5 18.7 18.2 64 74 A L H <>S+ 0 0 0 -4,-1.0 5,-2.4 -27,-0.3 -2,-0.2 0.877 105.3 53.9 -68.3 -39.1 0.3 16.1 19.8 65 75 A M H <5S+ 0 0 9 -4,-2.8 5,-0.3 4,-0.2 -1,-0.2 0.795 119.2 37.1 -67.1 -26.0 -0.4 17.9 23.1 66 76 A L H <5S+ 0 0 28 -4,-1.2 -2,-0.2 -5,-0.2 -3,-0.1 0.947 117.9 41.7 -86.1 -69.3 -1.6 20.9 21.0 67 77 A R T <5S- 0 0 169 -4,-2.1 -3,-0.2 1,-0.2 -2,-0.1 0.940 136.6 -0.7 -51.0 -83.6 -3.5 19.5 18.0 68 78 A P T 5S- 0 0 27 0, 0.0 4,-0.2 0, 0.0 -1,-0.2 0.874 105.5-121.2 -83.7 -24.2 -5.7 16.6 19.1 69 79 A G >< - 0 0 16 -5,-2.4 4,-1.9 -6,-0.2 -4,-0.2 0.110 8.6-108.1 100.2 141.1 -4.6 16.8 22.8 70 80 A A H > S+ 0 0 1 -5,-0.3 4,-2.1 2,-0.2 5,-0.1 0.916 119.8 50.3 -67.8 -42.4 -2.9 14.1 25.0 71 81 A E H > S+ 0 0 86 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.875 110.4 50.4 -62.5 -39.8 -6.1 13.5 27.0 72 82 A R H > S+ 0 0 159 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.916 109.1 50.1 -65.0 -45.4 -8.1 13.1 23.8 73 83 A I H <>S+ 0 0 0 -4,-1.9 5,-3.1 1,-0.2 4,-0.4 0.901 110.1 52.0 -61.0 -37.9 -5.7 10.6 22.3 74 84 A A H ><5S+ 0 0 37 -4,-2.1 3,-1.3 1,-0.2 -1,-0.2 0.922 108.6 49.9 -63.9 -43.3 -5.9 8.7 25.6 75 85 A K H 3<5S+ 0 0 170 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.835 107.8 54.9 -63.9 -33.0 -9.7 8.6 25.4 76 86 A L T 3<5S- 0 0 91 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.498 132.8 -88.2 -79.4 -5.6 -9.5 7.4 21.9 77 87 A G T < 5S- 0 0 53 -3,-1.3 4,-0.4 -4,-0.4 -3,-0.2 0.437 72.7 -69.6 114.5 0.6 -7.4 4.4 22.9 78 88 A G >< - 0 0 10 -5,-3.1 4,-2.6 -6,-0.2 60,-0.2 -0.193 59.0 -71.1 102.3 164.6 -3.8 5.8 22.8 79 89 A L H > S+ 0 0 2 58,-2.5 4,-3.0 2,-0.2 5,-0.4 0.859 126.2 55.3 -63.3 -40.6 -1.4 6.8 20.0 80 90 A H H >>S+ 0 0 7 57,-0.5 4,-1.7 2,-0.2 5,-1.4 0.945 115.2 38.7 -57.7 -51.5 -0.8 3.3 18.7 81 91 A S H 45S+ 0 0 85 -4,-0.4 -2,-0.2 3,-0.2 -1,-0.2 0.925 115.6 55.1 -64.2 -45.8 -4.5 2.6 18.2 82 92 A F H <5S+ 0 0 92 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.922 120.6 26.6 -55.2 -53.7 -5.1 6.2 17.0 83 93 A M H <5S- 0 0 30 -4,-3.0 -1,-0.2 2,-0.2 -2,-0.2 0.614 107.8-114.6 -90.0 -12.9 -2.5 6.1 14.1 84 94 A G T <5S+ 0 0 51 -4,-1.7 2,-0.6 -5,-0.4 -3,-0.2 0.796 71.4 129.5 86.2 26.0 -2.5 2.4 13.4 85 95 A W < + 0 0 8 -5,-1.4 -1,-0.2 -6,-0.3 -2,-0.2 -0.970 29.5 179.4-114.5 112.7 1.1 1.6 14.5 86 96 A D + 0 0 117 -2,-0.6 -1,-0.1 -3,-0.1 3,-0.1 0.405 55.0 84.3 -94.7 3.2 1.2 -1.4 16.9 87 97 A R S S- 0 0 66 1,-0.2 -62,-0.2 -7,-0.1 -31,-0.1 -0.298 94.7 -53.2 -95.5 179.2 5.0 -1.5 17.3 88 98 A P - 0 0 0 0, 0.0 -31,-1.3 0, 0.0 2,-0.4 -0.148 49.1-163.7 -54.5 149.9 7.2 0.5 19.7 89 99 A I E -g 57 0B 0 -33,-0.2 51,-2.1 49,-0.1 52,-2.0 -0.990 7.0-157.8-138.0 122.2 7.0 4.3 19.8 90 100 A L E -gh 58 141B 0 -33,-2.4 -31,-2.7 -2,-0.4 2,-0.4 -0.908 15.7-160.4 -98.9 128.4 9.6 6.5 21.3 91 101 A T E -gh 59 142B 0 50,-2.4 52,-1.1 -2,-0.5 -31,-0.2 -0.921 10.7-134.1-111.8 136.6 8.1 9.9 22.2 92 102 A D - 0 0 23 -33,-1.4 51,-0.1 -2,-0.4 53,-0.1 -0.297 28.1-110.2 -76.0 172.8 10.2 13.0 22.8 93 103 A S - 0 0 5 51,-0.3 40,-0.1 49,-0.1 52,-0.1 0.695 38.6-125.0 -80.0 -19.2 9.5 15.2 25.8 94 104 A G S > S+ 0 0 2 31,-0.0 4,-1.0 -33,-0.0 -1,-0.1 0.135 85.1 104.5 96.4 -18.9 8.1 18.1 23.8 95 105 A G H > S+ 0 0 6 1,-0.2 4,-1.9 2,-0.2 3,-0.4 0.891 74.6 54.1 -62.1 -44.2 10.4 20.7 25.3 96 106 A Y H > S+ 0 0 123 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.894 112.1 43.5 -58.6 -45.1 12.8 21.0 22.3 97 107 A Q H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 5,-0.5 0.641 107.2 62.0 -76.6 -15.9 9.9 21.8 19.9 98 108 A V H X S+ 0 0 0 -4,-1.0 4,-1.7 -3,-0.4 -2,-0.2 0.928 108.4 42.2 -72.0 -45.1 8.4 24.2 22.5 99 109 A M H < S+ 0 0 86 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.833 122.2 40.9 -69.7 -31.8 11.6 26.3 22.3 100 110 A S H < S+ 0 0 75 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.862 131.0 18.3 -85.5 -38.8 11.8 26.0 18.6 101 111 A L H < S+ 0 0 60 -4,-2.4 -3,-0.2 -5,-0.1 -2,-0.2 0.649 101.5 86.4-111.1 -20.8 8.1 26.4 17.5 102 112 A S < - 0 0 18 -4,-1.7 3,-0.3 -5,-0.5 2,-0.2 -0.377 68.1-118.5 -85.0 166.0 6.1 27.9 20.3 103 113 A S E S+N 115 0C 56 12,-2.9 12,-2.8 1,-0.2 -1,-0.1 -0.671 79.0 1.2-102.4 155.0 5.5 31.6 21.1 104 114 A L E S- 0 0 148 -2,-0.2 2,-0.2 10,-0.2 -1,-0.2 0.812 75.6-167.7 36.1 57.4 6.4 33.7 24.2 105 115 A T E - 0 0 45 -3,-0.3 2,-0.5 9,-0.1 9,-0.2 -0.528 6.9-163.4 -73.6 134.6 8.1 30.9 26.2 106 116 A K E -N 113 0C 156 7,-3.0 7,-2.8 -2,-0.2 2,-0.3 -0.989 10.0-156.4-121.2 118.6 8.7 31.6 29.8 107 117 A Q E +N 112 0C 91 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.714 21.8 150.6-100.4 151.4 11.2 29.4 31.6 108 118 A S - 0 0 50 3,-2.0 3,-0.2 -2,-0.3 -2,-0.0 -0.933 59.9 -88.8-160.1 176.6 11.6 28.5 35.2 109 119 A E S S+ 0 0 69 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 0.762 124.8 56.5 -68.3 -23.7 12.8 25.8 37.6 110 120 A E S S- 0 0 108 1,-0.2 2,-0.3 16,-0.1 -1,-0.2 0.846 121.9 -91.8 -75.8 -34.4 9.3 24.4 37.5 111 121 A G - 0 0 0 -3,-0.2 -3,-2.0 15,-0.2 2,-0.4 -0.981 54.1 -43.7 159.0-147.6 9.2 24.0 33.7 112 122 A V E -NO 107 125C 5 13,-3.1 13,-1.6 -2,-0.3 2,-0.4 -0.983 34.6-162.3-128.3 129.5 8.2 26.0 30.6 113 123 A T E +NO 106 124C 25 -7,-2.8 -7,-3.0 -2,-0.4 2,-0.3 -0.872 28.0 158.7-103.3 140.6 5.1 28.1 30.0 114 124 A F E - 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0 0 107 -5,-2.5 4,-1.0 -6,-0.2 3,-0.9 -0.473 43.2-134.4 -75.0 138.8 1.6 16.1 -6.7 330 340 A I H >> S+ 0 0 127 1,-0.3 4,-2.1 2,-0.2 3,-0.7 0.885 104.9 61.1 -56.8 -42.2 0.9 14.3 -3.4 331 341 A L H 3> S+ 0 0 55 1,-0.3 4,-2.8 2,-0.2 -1,-0.3 0.824 97.2 60.4 -57.3 -31.0 2.1 11.0 -4.9 332 342 A G H <> S+ 0 0 0 -3,-0.9 4,-2.3 -8,-0.3 -54,-0.3 0.909 107.2 44.8 -62.6 -39.8 5.5 12.6 -5.5 333 343 A A H S+ 0 0 0 -4,-2.0 5,-3.1 -5,-0.2 6,-0.6 0.856 111.8 48.2 -65.9 -33.3 28.8 -5.4 8.8 355 365 A I H ><5S+ 0 0 2 -4,-2.0 3,-1.9 4,-0.2 -344,-0.2 0.955 110.5 51.0 -69.7 -47.3 29.2 -5.1 12.6 356 366 A S H 3<5S+ 0 0 67 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.741 115.4 44.3 -57.9 -28.5 28.0 -8.7 13.1 357 367 A E T 3<5S- 0 0 120 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.246 112.7-116.8-102.6 9.9 30.5 -9.8 10.5 358 368 A G T < 5S+ 0 0 53 -3,-1.9 -3,-0.2 1,-0.1 -2,-0.1 0.834 90.1 100.3 58.4 37.0 33.4 -7.7 11.8 359 369 A R >< + 0 0 108 -5,-3.1 4,-1.7 -6,-0.1 -4,-0.2 -0.031 36.1 115.2-139.3 29.9 33.8 -5.6 8.6 360 370 A F H > S+ 0 0 5 -6,-0.6 4,-2.9 2,-0.2 5,-0.2 0.910 75.5 55.2 -67.6 -44.3 32.0 -2.4 9.7 361 371 A S H > S+ 0 0 69 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.894 110.5 46.7 -57.4 -39.8 35.1 -0.2 9.5 362 372 A Q H > S+ 0 0 89 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.879 111.4 52.0 -69.0 -38.5 35.6 -1.4 5.9 363 373 A F H X S+ 0 0 26 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.903 108.7 49.9 -63.9 -42.8 31.9 -0.7 5.2 364 374 A A H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.905 112.7 48.1 -62.1 -41.2 32.2 2.9 6.6 365 375 A Q H X S+ 0 0 120 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.946 115.2 43.1 -64.7 -49.9 35.2 3.4 4.4 366 376 A D H X S+ 0 0 84 -4,-2.7 4,-1.7 1,-0.2 5,-0.2 0.828 111.6 56.2 -65.6 -35.2 33.5 2.0 1.2 367 377 A F H X S+ 0 0 8 -4,-2.6 4,-2.9 -5,-0.2 -1,-0.2 0.931 111.1 42.7 -62.7 -46.9 30.3 3.9 2.0 368 378 A R H X S+ 0 0 64 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.860 108.0 58.2 -68.2 -39.9 32.1 7.2 2.1 369 379 A A H < S+ 0 0 77 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.946 118.4 33.2 -56.0 -46.6 34.3 6.6 -0.9 370 380 A R H < S+ 0 0 95 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.919 117.6 51.6 -76.8 -46.1 31.1 6.1 -3.0 371 381 A Y H < 0 0 19 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.842 360.0 360.0 -61.8 -34.2 28.8 8.6 -1.2 372 382 A F < 0 0 146 -4,-2.5 0, 0.0 -5,-0.2 0, 0.0 -0.206 360.0 360.0-111.4 360.0 31.3 11.4 -1.5