==== 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 03-DEC-04 1Y5V . COMPND 2 MOLECULE: QUEUINE TRNA-RIBOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ZYMOMONAS MOBILIS; . AUTHOR B.STENGL,E.A.MEYER,A.HEINE,R.BRENK,F.DIEDERICH,G.KLEBE . 360 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14435.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 8.1 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 . 6 1.7 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 . 19 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 127 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.5 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 1 0 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 . 2 2 1 0 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 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 11 A R 0 0 162 0, 0.0 22,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 159.3 8.9 -10.3 25.8 2 12 A P - 0 0 55 0, 0.0 3,-0.2 0, 0.0 173,-0.0 -0.363 360.0-105.3 -74.5 168.1 10.3 -8.4 28.8 3 13 A R S S- 0 0 67 1,-0.3 20,-0.5 19,-0.2 2,-0.3 0.915 102.3 -9.4 -54.5 -45.2 9.6 -4.7 29.5 4 14 A F + 0 0 27 18,-0.2 2,-0.3 19,-0.1 -1,-0.3 -0.894 65.8 162.1-161.6 123.7 13.1 -4.0 28.4 5 15 A S E -A 21 0A 45 16,-1.8 16,-2.9 -2,-0.3 2,-0.5 -0.861 14.3-165.4-143.5 119.9 16.1 -6.0 27.5 6 16 A F E -A 20 0A 29 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.896 12.3-178.6-105.7 123.3 19.2 -4.8 25.5 7 17 A S E -A 19 0A 61 12,-2.8 12,-2.1 -2,-0.5 2,-0.6 -0.984 19.1-146.2-125.3 133.1 21.5 -7.5 24.3 8 18 A I E +A 18 0A 45 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.843 16.9 177.2 -96.7 117.0 24.7 -6.9 22.3 9 19 A A E + 0 0 83 8,-2.3 2,-0.3 -2,-0.6 9,-0.2 0.761 64.7 3.4 -91.4 -28.7 25.4 -9.7 19.9 10 20 A A E -A 17 0A 22 7,-1.8 7,-2.6 2,-0.0 2,-0.3 -0.982 57.9-163.1-161.2 154.2 28.6 -8.4 18.2 11 21 A R E -A 16 0A 111 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.944 10.2-177.0-140.6 153.4 31.1 -5.6 18.4 12 22 A E E > S-A 15 0A 50 3,-2.1 3,-2.0 -2,-0.3 2,-0.2 -0.840 73.1 -45.3-153.0 110.9 33.8 -4.1 16.3 13 23 A G T 3 S- 0 0 75 1,-0.3 -1,-0.1 -2,-0.3 241,-0.1 -0.506 124.7 -23.3 62.1-131.3 35.8 -1.3 17.8 14 24 A K T 3 S+ 0 0 90 239,-0.5 -1,-0.3 -2,-0.2 2,-0.2 0.565 118.5 102.6 -83.8 -12.0 33.2 1.0 19.5 15 25 A A E < -A 12 0A 1 -3,-2.0 -3,-2.1 238,-0.2 2,-0.3 -0.446 49.7-176.7 -79.1 146.8 30.4 -0.2 17.2 16 26 A R E -A 11 0A 3 240,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.966 13.9-162.9-139.9 149.1 27.9 -2.7 18.5 17 27 A T E +A 10 0A 7 -7,-2.6 -8,-2.3 -2,-0.3 -7,-1.8 -0.992 35.6 108.8-136.5 147.5 24.9 -4.6 17.0 18 28 A G E -AB 8 29A 7 11,-2.1 11,-3.1 -2,-0.3 2,-0.3 -0.865 53.1 -75.7 179.8-155.7 22.2 -6.3 19.0 19 29 A T E -AB 7 28A 46 -12,-2.1 -12,-2.8 -2,-0.3 2,-0.5 -0.980 11.9-150.9-144.0 143.9 18.6 -6.1 20.0 20 30 A I E -AB 6 27A 0 7,-2.5 7,-3.0 -2,-0.3 2,-0.5 -0.990 21.9-157.5-110.3 122.2 16.3 -4.3 22.3 21 31 A E E +AB 5 26A 63 -16,-2.9 -16,-1.8 -2,-0.5 2,-0.3 -0.885 20.6 163.0-102.8 131.4 13.3 -6.5 23.4 22 32 A M E > - B 0 25A 0 3,-1.9 3,-1.6 -2,-0.5 -19,-0.2 -0.889 52.1 -96.0-137.6 168.6 10.2 -4.8 24.6 23 33 A K T 3 S+ 0 0 92 -20,-0.5 -20,-0.1 152,-0.4 3,-0.1 0.889 122.7 45.9 -57.7 -38.3 6.6 -5.9 25.1 24 34 A R T 3 S- 0 0 103 1,-0.2 -1,-0.3 -21,-0.2 2,-0.3 0.444 126.0 -61.5 -89.8 5.8 5.4 -4.6 21.7 25 35 A G E < -B 22 0A 1 -3,-1.6 -3,-1.9 62,-0.2 2,-0.4 -0.866 58.0 -59.9 147.2-179.3 8.4 -6.1 19.8 26 36 A V E -B 21 0A 50 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.815 32.2-154.1-105.4 140.6 12.1 -6.3 19.0 27 37 A I E -B 20 0A 0 -7,-3.0 -7,-2.5 -2,-0.4 2,-0.4 -0.961 12.1-144.3-117.0 116.8 14.3 -3.5 17.9 28 38 A R E -B 19 0A 78 -2,-0.5 -9,-0.2 -9,-0.2 27,-0.1 -0.654 32.9-106.9 -83.8 132.4 17.4 -4.4 15.9 29 39 A T E S+B 18 0A 0 -11,-3.1 -11,-2.1 -2,-0.4 2,-0.2 -0.906 99.9 46.4-120.0 147.6 20.3 -2.2 16.6 30 40 A P S S- 0 0 0 0, 0.0 2,-0.3 0, 0.0 228,-0.2 0.476 92.7-169.7 -63.4 140.4 21.8 0.0 15.3 31 41 A A E -c 258 0B 3 226,-2.4 228,-1.6 -2,-0.2 2,-0.5 -0.875 26.6-154.4-114.2 139.4 18.3 1.3 14.6 32 42 A F E -c 259 0B 2 -2,-0.3 24,-0.3 226,-0.2 23,-0.3 -0.984 17.3-157.9-113.8 127.9 16.9 4.1 12.5 33 43 A M E -c 260 0B 0 226,-2.8 228,-0.5 -2,-0.5 24,-0.2 -0.892 11.2-136.3-110.2 105.5 13.5 5.4 13.8 34 44 A P - 0 0 1 0, 0.0 24,-2.7 0, 0.0 2,-0.4 -0.375 25.0-122.4 -59.3 147.5 11.2 7.2 11.3 35 45 A V E -d 58 0B 21 226,-0.4 7,-0.6 22,-0.2 2,-0.5 -0.753 20.0-167.0-100.5 133.5 9.6 10.3 12.6 36 46 A G E -dE 59 41B 2 22,-2.6 24,-0.5 -2,-0.4 5,-0.2 -0.928 2.2-174.6-106.6 133.0 5.9 11.1 12.9 37 47 A T S S+ 0 0 26 3,-1.3 26,-0.2 -2,-0.5 -1,-0.1 0.846 83.9 18.5-103.1 -22.9 5.2 14.7 13.6 38 48 A A S S- 0 0 51 2,-0.7 -1,-0.2 25,-0.1 3,-0.1 -0.387 130.8 -67.4-133.6 53.8 1.4 14.5 14.0 39 49 A A S S+ 0 0 15 -3,-0.2 2,-0.3 1,-0.1 20,-0.1 0.857 116.6 83.3 65.5 34.1 0.7 10.8 14.7 40 50 A T S S- 0 0 61 5,-0.0 -3,-1.3 6,-0.0 -2,-0.7 -0.901 79.7-126.2-159.7 141.9 1.7 9.9 11.2 41 51 A V B > -EF 36 44B 4 3,-0.5 3,-2.1 -2,-0.3 -5,-0.2 -0.853 63.7 -94.1 -84.0 119.4 5.1 9.2 9.4 42 52 A K T 3 S- 0 0 71 -2,-0.6 -1,-0.1 -7,-0.6 3,-0.1 -0.080 96.7 -7.1 -61.0 130.7 4.5 11.7 6.6 43 53 A A T 3 S+ 0 0 40 1,-0.1 2,-0.4 284,-0.1 -1,-0.3 0.532 112.0 101.9 73.9 12.0 2.9 10.3 3.5 44 54 A L B < -F 41 0B 15 -3,-2.1 -3,-0.5 283,-0.1 -1,-0.1 -0.984 65.9-133.7-130.0 135.2 3.1 6.6 4.6 45 55 A K >> - 0 0 136 -2,-0.4 4,-2.0 1,-0.1 3,-0.7 -0.492 36.0-114.4 -66.2 149.4 0.7 4.1 6.0 46 56 A P H 3> S+ 0 0 34 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.841 117.1 60.8 -59.1 -32.9 2.2 2.3 9.0 47 57 A E H 3> S+ 0 0 136 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.848 106.3 48.1 -62.5 -30.6 2.1 -1.0 7.0 48 58 A T H <> S+ 0 0 30 -3,-0.7 4,-1.6 2,-0.2 -1,-0.2 0.921 107.9 53.3 -73.0 -41.9 4.4 0.8 4.5 49 59 A V H <>S+ 0 0 2 -4,-2.0 5,-1.4 1,-0.2 3,-0.4 0.947 112.6 45.7 -57.3 -44.3 6.7 2.0 7.3 50 60 A R H ><5S+ 0 0 82 -4,-2.7 3,-2.2 1,-0.2 -1,-0.2 0.922 106.3 58.6 -64.0 -42.2 7.0 -1.5 8.6 51 61 A A H 3<5S+ 0 0 80 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.785 98.4 59.7 -62.3 -26.8 7.6 -2.9 5.1 52 62 A T T 3<5S- 0 0 16 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.622 127.2 -99.6 -72.1 -14.4 10.6 -0.7 4.7 53 63 A G T < 5 + 0 0 18 -3,-2.2 -3,-0.2 -4,-0.3 -2,-0.1 0.320 67.5 153.8 110.0 2.1 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 -0.391 21.7-175.8 -61.6 136.8 11.4 -0.0 10.6 55 65 A D S S+ 0 0 8 -23,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.552 72.1 15.7-103.8 -17.4 11.1 -1.7 14.0 56 66 A I - 0 0 1 -24,-0.3 2,-0.3 31,-0.1 -1,-0.3 -0.977 65.4-154.8-154.0 150.4 10.2 1.5 16.0 57 67 A I E - g 0 89B 3 31,-1.3 33,-2.2 -2,-0.3 2,-0.5 -0.875 21.5-116.6-127.1 163.8 8.9 5.0 15.1 58 68 A L E -dg 35 90B 12 -24,-2.7 -22,-2.6 -2,-0.3 2,-0.5 -0.899 19.0-147.4-107.9 130.6 9.2 8.3 16.9 59 69 A G E -dg 36 91B 7 31,-2.9 2,-1.4 -2,-0.5 33,-1.2 -0.824 16.4-132.0 -94.0 130.0 6.1 10.0 18.1 60 70 A N >> - 0 0 30 -24,-0.5 4,-1.8 -2,-0.5 3,-0.5 -0.641 24.8-175.4 -90.8 87.7 6.3 13.8 18.1 61 71 A T H 3> S+ 0 0 2 -2,-1.4 4,-3.1 1,-0.2 5,-0.3 0.842 75.2 58.3 -44.5 -58.5 5.0 14.8 21.5 62 72 A Y H 3> S+ 0 0 42 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.898 112.1 42.2 -44.0 -48.7 5.1 18.6 21.2 63 73 A H H <> S+ 0 0 81 -3,-0.5 4,-3.5 1,-0.2 -1,-0.3 0.909 114.5 52.4 -71.4 -32.2 2.7 18.4 18.2 64 74 A L H <>S+ 0 0 0 -4,-1.8 5,-3.1 1,-0.2 -2,-0.2 0.909 102.7 54.1 -76.2 -34.5 0.6 15.8 19.9 65 75 A M H <5S+ 0 0 12 -4,-3.1 5,-0.4 4,-0.2 -1,-0.2 0.835 120.4 36.4 -66.5 -23.3 -0.1 17.6 23.2 66 76 A L H <5S+ 0 0 78 -4,-1.0 -2,-0.2 -5,-0.3 -1,-0.2 0.885 120.0 50.7 -86.5 -48.4 -1.3 20.5 21.0 67 77 A R T <5S- 0 0 200 -4,-3.5 -1,-0.3 -5,-0.2 -2,-0.1 -0.964 134.4 -8.7-141.6 115.2 -3.0 18.4 18.3 68 78 A P T 5S- 0 0 34 0, 0.0 -1,-0.2 0, 0.0 -3,-0.2 -0.995 105.2-119.0 -87.9 -1.1 -4.9 16.3 18.9 69 79 A G >< - 0 0 14 -5,-3.1 4,-2.2 -6,-0.2 -4,-0.2 0.060 12.2-110.3 106.0 142.0 -4.1 16.5 22.7 70 80 A A H > S+ 0 0 1 -5,-0.4 4,-2.3 2,-0.2 5,-0.1 0.912 117.1 48.6 -71.1 -46.3 -2.7 13.9 25.1 71 81 A E H > S+ 0 0 100 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.861 111.5 52.5 -61.9 -38.1 -5.9 13.3 27.0 72 82 A R H > S+ 0 0 161 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.938 108.6 47.8 -67.4 -46.2 -7.8 13.0 23.8 73 83 A I H <>S+ 0 0 0 -4,-2.2 5,-3.0 1,-0.2 4,-0.5 0.944 111.4 52.6 -60.2 -39.7 -5.4 10.3 22.4 74 84 A A H ><5S+ 0 0 37 -4,-2.3 3,-1.5 1,-0.2 -1,-0.2 0.937 107.1 51.2 -60.3 -45.8 -5.7 8.4 25.7 75 85 A K H 3<5S+ 0 0 179 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.835 108.4 53.9 -59.4 -33.1 -9.5 8.5 25.6 76 86 A L T 3<5S- 0 0 82 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.482 132.1 -89.2 -86.3 -0.1 -9.2 7.1 22.1 77 87 A G T < 5S- 0 0 54 -3,-1.5 4,-0.4 -4,-0.5 -3,-0.2 0.506 72.0 -71.7 111.1 5.8 -7.1 4.2 23.2 78 88 A G >< - 0 0 9 -5,-3.0 4,-2.2 -6,-0.2 50,-0.2 -0.131 59.4 -68.4 98.8 164.8 -3.6 5.5 22.9 79 89 A L H > S+ 0 0 1 48,-2.7 4,-2.6 1,-0.2 5,-0.3 0.880 124.2 59.0 -65.7 -33.9 -1.3 6.4 20.1 80 90 A H H >>S+ 0 0 16 47,-0.4 5,-1.8 1,-0.2 4,-1.3 0.954 114.1 36.4 -61.9 -47.6 -0.7 2.8 18.9 81 91 A S H 45S+ 0 0 89 -4,-0.4 -1,-0.2 3,-0.2 -2,-0.2 0.891 115.3 56.9 -67.6 -43.6 -4.4 2.2 18.2 82 92 A F H <5S+ 0 0 91 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.949 120.5 25.7 -57.2 -52.0 -5.0 5.7 17.0 83 93 A M H <5S- 0 0 30 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.550 108.2-116.1 -94.9 -6.9 -2.4 5.7 14.2 84 94 A G T <5 + 0 0 53 -4,-1.3 2,-0.5 -5,-0.3 -3,-0.2 0.871 69.9 130.5 75.8 36.7 -2.4 1.9 13.6 85 95 A W < - 0 0 9 -5,-1.8 -1,-0.2 -6,-0.3 -2,-0.2 -0.973 29.6-179.8-120.1 113.0 1.1 1.1 14.6 86 96 A D + 0 0 122 -2,-0.5 3,-0.1 -3,-0.1 -1,-0.1 0.414 54.9 82.3 -99.5 5.8 1.3 -1.8 17.0 87 97 A R S S- 0 0 69 1,-0.2 -62,-0.2 -7,-0.1 -31,-0.1 -0.290 95.4 -51.3 -98.4 180.0 5.2 -1.9 17.5 88 98 A P - 0 0 0 0, 0.0 -31,-1.3 0, 0.0 2,-0.4 -0.221 49.4-162.5 -58.0 150.8 7.3 0.2 19.9 89 99 A I E -g 57 0B 1 -33,-0.2 41,-2.2 39,-0.2 42,-2.0 -0.999 4.9-156.2-130.1 126.2 7.0 4.0 19.8 90 100 A L E -gh 58 131B 1 -33,-2.2 -31,-2.9 -2,-0.4 2,-0.4 -0.866 13.2-159.9 -97.5 134.5 9.7 6.3 21.3 91 101 A T E -gh 59 132B 0 40,-2.5 42,-1.1 -2,-0.5 -31,-0.1 -0.948 12.7-131.8-114.6 135.9 8.4 9.8 22.3 92 102 A D - 0 0 42 -33,-1.2 -31,-0.2 -2,-0.4 43,-0.1 -0.398 24.5-119.8 -76.5 164.9 10.5 12.9 22.8 93 103 A S - 0 0 0 41,-0.3 -1,-0.1 -32,-0.1 30,-0.1 0.606 36.5-116.2 -91.4 -10.5 9.9 14.8 26.0 94 104 A G S > S+ 0 0 2 1,-0.0 4,-1.5 21,-0.0 2,-1.2 0.182 82.5 120.2 98.2 -12.7 8.9 18.1 24.3 95 105 A G T 4 S+ 0 0 9 1,-0.2 43,-0.7 39,-0.2 -1,-0.0 -0.275 79.1 33.1 -81.3 44.5 11.9 19.8 25.8 96 106 A Y T 4 S+ 0 0 112 -2,-1.2 -1,-0.2 41,-0.1 41,-0.0 0.242 111.3 55.6-154.9 -55.3 13.4 20.8 22.5 97 107 A Q T 4 S+ 0 0 39 1,-0.2 -2,-0.2 0, 0.0 -37,-0.0 0.663 105.4 55.9 -67.2 -24.7 10.5 21.5 20.1 98 108 A V < 0 0 20 -4,-1.5 -1,-0.2 12,-0.0 -3,-0.1 0.959 360.0 360.0 -69.6 -50.7 9.0 24.0 22.5 99 109 A M 0 0 115 -5,-0.2 11,-0.0 11,-0.0 -5,-0.0 -0.321 360.0 360.0 -76.7 360.0 12.3 26.1 22.6 100 ! 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 0.0 101 115 A T 0 0 86 0, 0.0 2,-0.6 0, 0.0 9,-0.3 0.000 360.0 360.0 360.0 119.3 8.1 30.7 26.3 102 116 A K E -M 109 0C 145 7,-3.1 7,-2.4 2,-0.0 2,-0.4 -0.977 360.0-159.4-112.1 114.3 8.7 31.4 30.0 103 117 A Q E +M 108 0C 90 -2,-0.6 2,-0.3 5,-0.2 5,-0.2 -0.780 21.9 151.8 -96.8 134.5 11.4 29.1 31.3 104 118 A S E > -M 107 0C 45 3,-2.5 3,-0.5 -2,-0.4 -2,-0.0 -0.864 61.0 -91.9-146.9 177.4 11.8 28.3 35.1 105 119 A E T 3 S+ 0 0 62 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 0.704 125.3 58.4 -65.6 -21.8 13.2 25.6 37.3 106 120 A E T 3 S- 0 0 121 1,-0.2 2,-0.3 10,-0.1 -1,-0.2 0.817 121.6 -96.5 -74.7 -32.7 9.6 24.2 37.3 107 121 A G E < -M 104 0C 5 -3,-0.5 -3,-2.5 9,-0.2 2,-0.4 -0.996 52.3 -45.2 150.6-145.6 9.6 23.9 33.5 108 122 A V E -MN 103 115C 9 7,-3.6 7,-3.2 -2,-0.3 2,-0.3 -0.988 29.0-164.2-133.2 140.0 8.3 25.9 30.5 109 123 A T E +MN 102 114C 66 -7,-2.4 -7,-3.1 -2,-0.4 2,-0.3 -0.885 28.5 170.4-107.9 142.8 5.2 27.8 29.6 110 124 A F 0 0 15 3,-2.3 -11,-0.0 -2,-0.3 -12,-0.0 -0.971 360.0 360.0-158.0 169.3 4.7 28.7 26.0 111 125 A K 0 0 124 -2,-0.3 -2,-0.0 -13,-0.1 0, 0.0 -0.733 360.0 360.0 -84.0 360.0 2.6 30.0 23.2 112 ! 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 0.0 113 133 A H 0 0 124 0, 0.0 -3,-2.3 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 159.7 0.6 26.0 27.8 114 134 A M E -N 109 0C 55 -5,-0.3 2,-0.4 2,-0.0 -5,-0.3 -0.965 360.0-175.0-133.2 146.2 3.0 24.3 30.3 115 135 A L E +N 108 0C 2 -7,-3.2 -7,-3.6 -2,-0.4 3,-0.0 -0.983 12.9 162.3-134.8 127.0 5.5 21.6 30.3 116 136 A S > - 0 0 26 -2,-0.4 4,-2.9 -9,-0.3 5,-0.3 -0.830 55.6 -97.0-128.6 167.6 7.4 20.3 33.4 117 137 A P H > S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.913 126.6 48.9 -47.9 -43.1 9.3 17.0 33.9 118 138 A E H > S+ 0 0 70 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.905 113.7 42.8 -67.0 -41.9 6.2 15.6 35.6 119 139 A R H > S+ 0 0 61 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.892 112.1 54.6 -75.8 -38.6 3.7 16.7 32.9 120 140 A S H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.947 110.4 45.7 -60.7 -47.7 6.0 15.5 30.1 121 141 A I H X S+ 0 0 0 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.897 113.9 50.8 -62.7 -39.0 6.3 12.1 31.6 122 142 A E H X S+ 0 0 70 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.934 108.9 49.6 -65.8 -44.9 2.5 12.1 32.1 123 143 A I H X S+ 0 0 0 -4,-3.2 4,-2.7 2,-0.2 -1,-0.2 0.942 109.0 51.8 -58.2 -44.5 1.8 13.1 28.5 124 144 A Q H X>S+ 0 0 0 -4,-2.4 5,-2.4 1,-0.2 4,-0.8 0.899 110.5 51.1 -62.7 -34.8 4.1 10.3 27.2 125 145 A H H ><5S+ 0 0 65 -4,-2.0 3,-1.1 -5,-0.2 -2,-0.2 0.949 108.3 49.7 -61.5 -45.8 2.1 8.0 29.5 126 146 A L H 3<5S+ 0 0 31 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.876 109.3 53.0 -62.7 -38.0 -1.2 9.2 28.0 127 147 A L H 3<5S- 0 0 0 -4,-2.7 -48,-2.7 -5,-0.2 -47,-0.4 0.730 113.4-122.2 -69.2 -19.2 0.1 8.7 24.6 128 148 A G T <<5 - 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0 0 3 -2,-1.2 4,-0.1 1,-0.1 9,-0.1 -0.188 20.9-115.6 -57.6 128.4 21.3 23.7 25.2 140 160 A P - 0 0 71 0, 0.0 -1,-0.1 0, 0.0 73,-0.0 -0.212 40.5 -92.3 -61.8 154.2 21.6 26.2 22.3 141 161 A Y S S+ 0 0 89 72,-0.4 2,-0.1 1,-0.1 3,-0.0 -0.986 105.1 32.1-122.9 135.4 24.8 26.2 20.1 142 162 A P S S+ 0 0 105 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.523 84.3 177.2 -76.7 163.1 27.1 27.8 20.5 143 163 A A - 0 0 13 -2,-0.1 43,-0.2 -4,-0.1 -2,-0.1 -0.989 29.1-122.7-131.2 140.4 27.0 28.0 24.2 144 164 A T > - 0 0 84 -2,-0.4 4,-3.0 1,-0.1 5,-0.3 -0.429 34.1-110.6 -71.4 156.8 29.4 29.5 26.7 145 165 A P H > S+ 0 0 79 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.907 117.6 51.0 -54.7 -41.4 30.8 27.1 29.3 146 166 A S H > S+ 0 0 85 2,-0.2 4,-2.7 1,-0.2 5,-0.1 0.947 114.6 42.6 -61.9 -44.3 28.8 28.8 32.1 147 167 A R H > S+ 0 0 112 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.875 113.6 51.7 -69.8 -43.6 25.5 28.6 30.2 148 168 A A H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 5,-0.2 0.909 112.9 46.9 -62.5 -41.6 26.2 25.1 29.1 149 169 A A H X S+ 0 0 16 -4,-2.6 4,-2.8 -5,-0.3 -2,-0.2 0.946 111.1 49.1 -66.6 -44.0 26.9 24.1 32.6 150 170 A S H X S+ 0 0 63 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.921 114.9 46.1 -56.6 -43.3 23.8 25.8 34.1 151 171 A S H X S+ 0 0 1 -4,-2.3 4,-2.6 2,-0.2 -14,-0.2 0.914 112.5 49.3 -67.9 -44.5 21.6 24.2 31.5 152 172 A M H X S+ 0 0 5 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.951 110.2 51.4 -59.5 -47.8 23.2 20.8 31.9 153 173 A E H X S+ 0 0 85 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.909 110.9 48.0 -57.4 -43.5 22.8 21.0 35.7 154 174 A R H X S+ 0 0 60 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.905 109.6 53.7 -65.0 -39.7 19.1 21.9 35.3 155 175 A S H X S+ 0 0 2 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.891 107.4 50.4 -61.9 -39.1 18.7 19.0 32.9 156 176 A M H X S+ 0 0 20 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.910 109.7 49.7 -68.3 -39.3 20.1 16.6 35.4 157 177 A R H X S+ 0 0 109 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.929 113.2 47.9 -59.8 -41.3 17.8 17.9 38.1 158 178 A W H X S+ 0 0 6 -4,-2.8 4,-2.2 1,-0.2 -23,-0.4 0.814 105.3 59.4 -67.6 -29.3 15.0 17.4 35.6 159 179 A A H X S+ 0 0 3 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.890 106.2 47.3 -66.8 -39.5 16.3 13.9 34.8 160 180 A K H X S+ 0 0 95 -4,-1.8 4,-2.5 1,-0.2 5,-0.2 0.923 111.8 50.2 -68.2 -41.4 15.8 12.9 38.5 161 181 A R H X S+ 0 0 46 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.884 110.7 50.6 -62.4 -34.2 12.3 14.4 38.5 162 182 A S H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.930 109.5 49.8 -64.4 -51.7 11.6 12.4 35.3 163 183 A R H X S+ 0 0 31 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.911 113.9 45.6 -49.0 -49.5 12.9 9.2 36.8 164 184 A D H X S+ 0 0 69 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.916 111.5 50.1 -74.8 -37.6 10.8 9.7 39.9 165 185 A A H < S+ 0 0 16 -4,-2.3 4,-0.3 -5,-0.2 -1,-0.2 0.931 113.9 47.5 -57.4 -47.6 7.6 10.7 38.0 166 186 A F H >< S+ 0 0 1 -4,-2.6 3,-1.4 1,-0.2 7,-0.5 0.949 112.7 46.9 -57.8 -49.3 7.9 7.6 35.8 167 187 A D H 3< S+ 0 0 78 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.797 104.3 63.3 -68.2 -23.9 8.6 5.2 38.7 168 188 A S T 3< S+ 0 0 106 -4,-1.5 2,-0.5 -3,-0.2 -1,-0.3 0.338 92.2 70.5 -81.0 -2.0 5.6 6.7 40.6 169 189 A R S <> S- 0 0 63 -3,-1.4 4,-2.8 -4,-0.3 3,-0.4 -0.931 71.5-163.0-118.8 98.0 3.2 5.5 37.9 170 190 A K H > S+ 0 0 60 -2,-0.5 4,-1.8 1,-0.3 5,-0.2 0.800 84.4 51.4 -62.7 -38.2 3.0 1.8 38.2 171 191 A E H > S+ 0 0 56 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.909 115.4 43.5 -65.7 -38.1 1.6 1.0 34.8 172 192 A Q H >> S+ 0 0 7 -3,-0.4 4,-2.6 1,-0.2 3,-0.6 0.963 112.0 51.5 -72.5 -46.6 4.2 3.1 33.1 173 193 A A H 3< S+ 0 0 24 -4,-2.8 -1,-0.2 -7,-0.5 -2,-0.2 0.820 113.5 46.4 -59.4 -28.7 7.1 1.8 35.1 174 194 A E H 3< S+ 0 0 123 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.722 124.4 26.5 -88.1 -19.7 6.1 -1.8 34.4 175 195 A N H << S+ 0 0 71 -4,-1.2 -152,-0.4 -3,-0.6 2,-0.2 0.631 113.4 55.2-119.4 -19.8 5.5 -1.6 30.7 176 196 A A < - 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