==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-AUG-11 3TKA . COMPND 2 MOLECULE: RIBOSOMAL RNA SMALL SUBUNIT METHYLTRANSFERASE H; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Z.Q.GAO,Y.WEI,H.ZHANG,Y.H.DONG . 284 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13685.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 201 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 6.0 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 . 0 0.0 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 . 13 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.8 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 1 2 4 0 0 0 1 2 1 1 1 0 0 0 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 8 A T 0 0 151 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 155.8 45.9 5.8 1.6 2 9 A T > - 0 0 46 1,-0.1 5,-2.4 259,-0.1 4,-0.3 -0.855 360.0-137.8-119.0 154.0 44.6 7.7 4.6 3 10 A V T >S+ 0 0 15 -2,-0.3 5,-1.4 3,-0.2 -1,-0.1 0.947 106.0 55.0 -62.4 -49.9 43.0 6.9 7.9 4 11 A L T 5S+ 0 0 32 3,-0.2 -1,-0.2 1,-0.1 225,-0.1 0.834 127.9 9.4 -60.4 -39.7 40.6 9.8 7.4 5 12 A L T >5S+ 0 0 62 3,-0.1 4,-1.8 2,-0.0 5,-0.2 0.854 132.8 35.2-106.3 -59.8 39.2 8.7 4.1 6 13 A D H >5S+ 0 0 49 -4,-0.3 4,-2.0 2,-0.2 -3,-0.2 0.889 121.9 42.9 -65.6 -43.1 40.3 5.3 2.9 7 14 A E H >< S+ 0 0 2 -4,-1.8 3,-1.1 1,-0.2 5,-0.4 0.880 110.3 55.9 -68.0 -41.0 35.2 3.9 4.3 10 17 A N H >< S+ 0 0 94 -4,-2.0 3,-2.3 1,-0.2 -1,-0.2 0.888 98.2 65.7 -51.5 -41.6 36.9 0.4 4.6 11 18 A G H 3< S+ 0 0 2 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.749 90.6 62.8 -57.0 -27.8 35.4 0.3 8.1 12 19 A L T << S- 0 0 0 -3,-1.1 213,-0.3 -4,-0.5 -1,-0.3 0.626 93.4-144.9 -73.2 -14.3 31.9 0.2 6.7 13 20 A N < - 0 0 99 -3,-2.3 -3,-0.1 -4,-0.3 2,-0.1 0.939 26.0-147.9 45.8 58.6 32.6 -3.1 4.9 14 21 A I - 0 0 29 -5,-0.4 -1,-0.2 -4,-0.1 76,-0.0 -0.326 19.8-166.9 -65.6 127.3 30.4 -2.1 2.0 15 22 A R > - 0 0 103 -3,-0.2 3,-1.7 -2,-0.1 24,-0.1 -0.887 31.9-117.9-104.0 150.9 28.4 -4.7 0.1 16 23 A P T 3 S+ 0 0 76 0, 0.0 23,-2.5 0, 0.0 26,-0.4 0.746 112.7 38.7 -59.9 -29.9 26.9 -3.5 -3.3 17 24 A D T 3 S+ 0 0 83 21,-0.2 21,-0.1 24,-0.1 -3,-0.0 0.191 94.7 116.5-107.1 12.9 23.3 -4.0 -2.2 18 25 A G < - 0 0 0 -3,-1.7 25,-2.0 24,-0.1 2,-0.5 -0.202 63.4-122.7 -78.4 171.5 23.7 -2.8 1.4 19 26 A I E -a 43 0A 33 68,-0.2 70,-3.0 23,-0.2 71,-1.0 -0.969 33.9-177.3-122.6 118.0 22.1 0.2 3.1 20 27 A Y E -ab 44 90A 3 23,-2.8 25,-2.8 -2,-0.5 2,-0.5 -0.793 19.6-145.9-121.6 151.3 24.4 2.8 4.6 21 28 A I E -ab 45 91A 1 69,-2.8 71,-3.2 -2,-0.3 2,-0.7 -0.979 3.4-167.3-115.9 126.6 24.2 6.0 6.5 22 29 A D E -ab 46 92A 0 23,-2.1 25,-2.5 -2,-0.5 3,-0.4 -0.945 11.8-175.9-101.6 104.7 26.6 9.0 6.1 23 30 A G S S+ 0 0 1 69,-2.8 70,-0.2 -2,-0.7 -1,-0.1 0.492 75.7 43.8 -82.2 -3.0 25.6 10.9 9.2 24 31 A T + 0 0 0 68,-0.4 -1,-0.2 1,-0.1 24,-0.2 -0.547 65.3 172.7-142.8 65.0 27.9 13.9 8.5 25 32 A F > + 0 0 0 22,-2.7 3,-2.7 -3,-0.4 2,-0.5 0.845 15.1 158.5 -48.8 -48.0 27.6 14.6 4.7 26 33 A G T 3 S- 0 0 0 261,-0.3 30,-0.2 1,-0.3 -1,-0.2 -0.425 79.9 -16.9 61.5-109.3 29.7 17.8 4.8 27 34 A R T 3 S- 0 0 55 -2,-0.5 -1,-0.3 -3,-0.2 -2,-0.1 0.228 99.8-102.2-112.5 11.1 30.8 18.3 1.2 28 35 A G S <> S+ 0 0 0 -3,-2.7 4,-3.3 -4,-0.2 5,-0.3 0.546 78.7 133.0 87.5 10.1 30.1 14.7 0.2 29 36 A G H > S+ 0 0 13 -4,-0.3 4,-2.4 2,-0.2 5,-0.2 0.979 82.2 33.0 -55.7 -62.1 33.6 13.3 0.2 30 37 A H H > S+ 0 0 4 257,-1.2 4,-2.6 -5,-0.2 5,-0.2 0.922 118.5 56.0 -58.9 -43.6 32.7 10.1 2.1 31 38 A S H > S+ 0 0 0 -6,-0.3 4,-2.8 1,-0.2 -2,-0.2 0.911 109.7 44.4 -58.8 -45.9 29.2 10.0 0.5 32 39 A R H X S+ 0 0 143 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.926 113.1 52.5 -63.4 -44.6 30.6 10.0 -3.1 33 40 A L H < S+ 0 0 48 -4,-2.4 4,-0.3 -5,-0.3 -2,-0.2 0.887 112.4 44.7 -56.7 -41.9 33.2 7.5 -2.0 34 41 A I H >X S+ 0 0 0 -4,-2.6 3,-1.8 1,-0.2 4,-0.6 0.935 110.6 53.6 -69.5 -48.6 30.5 5.2 -0.6 35 42 A L H >< S+ 0 0 14 -4,-2.8 3,-1.5 1,-0.3 -2,-0.2 0.878 100.8 60.6 -53.4 -41.5 28.2 5.6 -3.6 36 43 A S T 3< S+ 0 0 90 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.666 107.1 47.2 -63.4 -15.1 31.1 4.6 -6.0 37 44 A Q T <4 S+ 0 0 89 -3,-1.8 -1,-0.3 -4,-0.3 2,-0.2 0.463 95.6 94.2-104.3 -4.6 31.1 1.2 -4.2 38 45 A L << - 0 0 15 -3,-1.5 -21,-0.2 -4,-0.6 2,-0.1 -0.611 63.7-143.5 -89.1 148.1 27.4 0.7 -4.3 39 46 A G > - 0 0 24 -23,-2.5 3,-1.4 -2,-0.2 -1,-0.1 -0.286 44.4 -79.5 -93.4-172.2 25.5 -1.3 -6.9 40 47 A E T 3 S+ 0 0 144 1,-0.3 -23,-0.1 -2,-0.1 -2,-0.0 0.690 132.2 49.9 -68.3 -17.5 22.1 -0.5 -8.3 41 48 A E T 3 S+ 0 0 131 -25,-0.2 -1,-0.3 2,-0.0 -24,-0.1 0.481 90.9 106.0 -96.9 -4.9 20.4 -2.1 -5.3 42 49 A G < - 0 0 3 -3,-1.4 2,-0.4 -26,-0.4 -23,-0.2 -0.305 53.7-158.0 -72.2 157.8 22.5 -0.1 -2.8 43 50 A R E -a 19 0A 83 -25,-2.0 -23,-2.8 2,-0.0 2,-0.5 -0.995 8.6-164.9-142.5 134.7 21.2 2.8 -0.9 44 51 A L E -ac 20 65A 0 20,-2.1 22,-2.0 -2,-0.4 2,-0.5 -0.978 2.6-170.0-119.4 122.9 22.9 5.8 0.8 45 52 A L E -ac 21 66A 2 -25,-2.8 -23,-2.1 -2,-0.5 2,-0.3 -0.957 13.8-165.7-111.0 121.5 21.0 7.9 3.4 46 53 A A E -ac 22 67A 0 20,-3.0 22,-2.7 -2,-0.5 2,-0.3 -0.805 5.9-166.3-110.5 149.5 22.9 11.1 4.3 47 54 A I E + c 0 68A 2 -25,-2.5 -22,-2.7 -2,-0.3 2,-0.3 -0.971 14.5 157.2-130.5 146.6 22.4 13.5 7.2 48 55 A D E - c 0 69A 2 20,-2.0 22,-0.8 -2,-0.3 -24,-0.1 -0.868 30.9-152.8-163.3 141.3 23.7 17.0 8.0 49 56 A R S S+ 0 0 45 -2,-0.3 20,-0.1 20,-0.2 3,-0.1 0.570 76.0 92.3 -87.6 -9.4 22.3 19.8 10.3 50 57 A D >> - 0 0 0 1,-0.1 4,-1.9 20,-0.1 3,-0.7 -0.780 67.2-150.4 -92.3 116.7 24.0 22.5 8.1 51 58 A P H 3> S+ 0 0 43 0, 0.0 4,-2.2 0, 0.0 -1,-0.1 0.822 98.0 57.6 -50.1 -39.2 21.9 23.9 5.3 52 59 A Q H 3> S+ 0 0 71 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.892 105.3 50.6 -64.7 -36.1 25.0 24.6 3.2 53 60 A A H <> S+ 0 0 0 -3,-0.7 4,-2.8 2,-0.2 -1,-0.2 0.931 109.2 50.9 -63.5 -43.0 25.8 20.9 3.4 54 61 A I H X S+ 0 0 28 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.885 105.5 57.5 -58.2 -39.8 22.2 20.2 2.3 55 62 A A H < S+ 0 0 49 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.874 110.0 43.7 -61.9 -40.4 22.7 22.6 -0.6 56 63 A V H >< S+ 0 0 46 -4,-1.9 3,-1.5 -30,-0.2 4,-0.5 0.951 113.5 49.9 -65.7 -49.6 25.7 20.5 -1.8 57 64 A A H >< S+ 0 0 2 -4,-2.8 3,-1.2 1,-0.3 -2,-0.2 0.807 100.2 67.4 -57.5 -31.3 23.9 17.2 -1.2 58 65 A K T 3< S+ 0 0 156 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.732 93.3 58.0 -61.6 -28.9 20.9 18.5 -3.2 59 66 A T T < S+ 0 0 107 -3,-1.5 2,-0.4 -4,-0.5 -1,-0.3 0.678 78.3 106.7 -82.3 -18.8 22.9 18.6 -6.4 60 67 A I < - 0 0 44 -3,-1.2 2,-0.9 -4,-0.5 5,-0.0 -0.483 58.2-158.9 -65.0 119.7 23.7 14.9 -6.2 61 68 A D + 0 0 162 -2,-0.4 -1,-0.1 3,-0.0 -2,-0.1 -0.768 43.8 119.7-107.5 84.3 21.6 13.3 -8.9 62 69 A D > - 0 0 37 -2,-0.9 3,-1.4 3,-0.2 -2,-0.0 -0.944 54.4-148.3-150.9 121.0 21.3 9.6 -7.9 63 70 A P T 3 S+ 0 0 135 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.735 101.1 59.8 -65.3 -19.6 18.1 7.8 -7.1 64 71 A R T 3 S+ 0 0 60 -21,-0.1 -20,-2.1 -3,-0.1 2,-0.4 0.679 97.5 75.7 -78.7 -16.7 20.0 5.7 -4.6 65 72 A F E < +c 44 0A 19 -3,-1.4 2,-0.3 -22,-0.2 -3,-0.2 -0.774 53.7 169.3-103.3 136.5 21.0 8.7 -2.5 66 73 A S E -c 45 0A 35 -22,-2.0 -20,-3.0 -2,-0.4 2,-0.4 -0.981 17.6-146.0-138.9 158.1 18.9 10.9 -0.2 67 74 A I E -c 46 0A 44 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.964 4.2-160.7-125.0 140.3 19.6 13.6 2.3 68 75 A I E -c 47 0A 15 -22,-2.7 -20,-2.0 -2,-0.4 2,-0.8 -0.973 12.2-144.6-117.2 132.6 18.1 14.6 5.7 69 76 A H E +c 48 0A 70 -2,-0.4 -20,-0.2 -22,-0.2 -22,-0.1 -0.834 60.3 75.4 -96.8 110.1 18.4 18.0 7.3 70 77 A G S S- 0 0 8 -22,-0.8 -22,-0.2 -2,-0.8 -20,-0.1 -0.945 86.4 -56.2 169.9 173.5 18.6 17.6 11.1 71 78 A P > - 0 0 42 0, 0.0 3,-1.4 0, 0.0 -23,-0.1 -0.439 43.1-127.0 -70.0 145.7 20.9 16.5 14.0 72 79 A F G > S+ 0 0 13 1,-0.2 3,-2.0 2,-0.1 4,-0.2 0.712 103.0 79.7 -72.3 -11.2 22.3 13.0 13.7 73 80 A S G 3 S+ 0 0 21 1,-0.3 3,-0.5 2,-0.1 -1,-0.2 0.777 86.8 58.6 -56.9 -26.8 20.9 12.4 17.3 74 81 A A G X> S+ 0 0 23 -3,-1.4 4,-2.3 1,-0.2 3,-0.5 0.240 72.3 117.6 -87.7 13.7 17.5 11.9 15.6 75 82 A L H <> S+ 0 0 1 -3,-2.0 4,-2.3 1,-0.2 5,-0.2 0.873 70.2 53.1 -46.9 -48.9 19.1 9.0 13.6 76 83 A G H 3> S+ 0 0 16 -3,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.888 109.5 48.2 -57.3 -43.0 16.8 6.4 15.1 77 84 A E H <> S+ 0 0 131 -3,-0.5 4,-2.9 2,-0.2 -1,-0.2 0.928 108.6 53.4 -64.7 -44.7 13.7 8.4 14.1 78 85 A Y H X S+ 0 0 20 -4,-2.3 4,-1.2 1,-0.3 -2,-0.2 0.959 110.8 47.2 -55.9 -51.2 14.9 9.0 10.6 79 86 A V H <>S+ 0 0 1 -4,-2.3 5,-3.1 1,-0.2 6,-0.4 0.797 112.2 49.7 -58.4 -34.9 15.4 5.2 10.1 80 87 A A H ><5S+ 0 0 38 -4,-1.6 3,-1.8 -5,-0.2 -1,-0.2 0.891 102.6 60.8 -73.4 -35.8 12.0 4.5 11.6 81 88 A E H 3<5S+ 0 0 129 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.837 112.3 40.7 -57.2 -30.8 10.4 7.0 9.3 82 89 A R T 3<5S- 0 0 73 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.298 111.8-117.3-103.0 7.9 11.7 4.8 6.5 83 90 A D T < 5S+ 0 0 141 -3,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.906 76.0 128.9 57.7 42.7 10.9 1.4 8.0 84 91 A L > < + 0 0 12 -5,-3.1 3,-2.9 -6,-0.1 4,-0.2 0.287 21.3 141.5-111.5 9.0 14.7 0.6 8.0 85 92 A I T 3 S+ 0 0 107 -6,-0.4 134,-0.2 1,-0.3 135,-0.1 -0.331 81.1 7.4 -55.9 119.9 14.9 -0.4 11.6 86 93 A G T 3 S+ 0 0 32 133,-1.1 -1,-0.3 132,-0.2 134,-0.2 0.549 112.3 91.3 83.8 7.8 17.3 -3.4 11.7 87 94 A K < + 0 0 132 -3,-2.9 2,-0.5 132,-0.5 -68,-0.2 0.203 50.2 112.7-121.1 15.7 18.2 -2.9 8.0 88 95 A I E - d 0 220A 0 131,-1.5 133,-3.0 -4,-0.2 -68,-0.2 -0.812 41.2-172.0 -94.5 124.8 21.2 -0.6 8.2 89 96 A D E + 0 0 18 -70,-3.0 136,-2.1 -2,-0.5 2,-0.3 0.566 69.2 0.8 -92.4 -12.1 24.5 -2.2 7.1 90 97 A G E -bd 20 225A 0 -71,-1.0 -69,-2.8 134,-0.3 2,-0.4 -0.879 51.0-158.7-174.9 143.5 26.7 0.7 8.1 91 98 A I E -bd 21 226A 2 134,-2.5 136,-2.4 -2,-0.3 2,-0.5 -0.998 13.6-165.8-125.2 126.3 26.8 4.1 9.7 92 99 A L E -bd 22 227A 0 -71,-3.2 -69,-2.8 -2,-0.4 2,-0.5 -0.955 4.3-174.8-111.9 131.7 29.7 6.5 9.2 93 100 A L E - d 0 228A 4 134,-2.1 136,-3.1 -2,-0.5 2,-0.7 -0.985 9.3-172.7-124.8 121.6 30.2 9.6 11.3 94 101 A D E - d 0 229A 22 -2,-0.5 136,-0.1 134,-0.2 134,-0.1 -0.866 32.6-144.9-111.9 93.8 32.9 12.0 10.5 95 102 A L + 0 0 3 134,-2.4 2,-0.3 -2,-0.7 -71,-0.0 -0.196 44.1 21.0 -77.8 148.8 32.7 14.3 13.5 96 103 A G S S- 0 0 5 109,-0.1 2,-0.1 134,-0.1 -2,-0.1 -0.707 92.4 -16.1 108.5-157.9 33.2 18.0 14.0 97 104 A V - 0 0 7 -2,-0.3 2,-0.2 1,-0.1 24,-0.0 -0.405 56.8-122.1 -86.9 158.8 33.1 21.1 11.8 98 105 A S > - 0 0 3 -2,-0.1 4,-1.7 1,-0.1 5,-0.1 -0.626 27.3-112.9 -89.4 159.7 33.3 21.2 8.0 99 106 A S H > S+ 0 0 66 -2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.931 117.8 54.5 -59.1 -46.3 36.0 23.2 6.2 100 107 A P H > S+ 0 0 35 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.918 104.6 53.9 -54.0 -42.6 33.5 25.7 4.9 101 108 A Q H 4 S+ 0 0 1 1,-0.2 8,-0.5 2,-0.2 -2,-0.2 0.889 116.1 41.0 -56.4 -39.2 32.2 26.3 8.5 102 109 A L H < S+ 0 0 50 -4,-1.7 -1,-0.2 -3,-0.2 -3,-0.1 0.882 117.8 44.2 -72.6 -40.3 35.8 27.1 9.4 103 110 A D H < S+ 0 0 118 -4,-2.8 2,-1.0 -5,-0.1 -2,-0.2 0.693 95.1 79.5 -86.6 -23.9 36.9 29.1 6.4 104 111 A D >< - 0 0 65 -4,-2.2 3,-2.1 -5,-0.3 4,-0.4 -0.779 64.1-162.3 -90.6 99.8 33.8 31.3 6.0 105 112 A A G > S+ 0 0 6 -2,-1.0 3,-1.4 1,-0.3 5,-0.2 0.756 85.8 67.3 -50.8 -29.1 34.3 34.0 8.6 106 113 A E G 3 S+ 0 0 114 1,-0.3 -1,-0.3 9,-0.2 9,-0.1 0.751 87.3 64.9 -68.3 -25.2 30.6 34.9 8.3 107 114 A R G < S- 0 0 20 -3,-2.1 12,-1.3 -7,-0.2 13,-0.3 0.670 106.4-133.5 -69.6 -14.5 29.7 31.5 9.9 108 115 A G < + 0 0 0 -3,-1.4 10,-0.3 -4,-0.4 -3,-0.1 0.825 69.5 120.9 68.0 36.7 31.4 32.9 13.0 109 116 A F + 0 0 13 -8,-0.5 2,-0.3 -5,-0.4 -7,-0.1 0.615 56.9 82.1 -94.7 -15.6 33.6 30.0 14.0 110 117 A S - 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0 0 14 -6,-1.7 3,-1.4 1,-0.2 -1,-0.2 -0.748 32.1-159.2 -85.4 116.3 40.6 25.8 29.8 152 159 A R T 3 S+ 0 0 141 -2,-0.6 3,-0.5 1,-0.3 -1,-0.2 0.869 92.5 53.8 -63.4 -36.0 42.5 26.3 33.2 153 160 A F T 3> S+ 0 0 59 1,-0.2 4,-2.7 2,-0.1 5,-0.3 0.102 70.3 126.0 -89.8 24.5 41.4 29.9 33.3 154 161 A A H <> S+ 0 0 5 -3,-1.4 4,-2.6 1,-0.2 -1,-0.2 0.833 70.3 51.5 -49.7 -41.0 37.7 29.2 32.9 155 162 A K H > S+ 0 0 174 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.962 114.2 39.4 -70.3 -49.7 36.7 31.1 35.9 156 163 A R H > S+ 0 0 134 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.878 116.8 51.7 -67.4 -36.7 38.5 34.4 35.2 157 164 A I H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.953 111.0 47.4 -63.9 -48.6 37.6 34.1 31.5 158 165 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.3 -2,-0.2 0.909 112.3 51.3 -56.4 -44.2 33.9 33.6 32.4 159 166 A R H X S+ 0 0 85 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.961 110.9 46.6 -56.9 -53.3 34.1 36.5 34.8 160 167 A A H X S+ 0 0 21 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.874 112.6 51.5 -59.0 -37.8 35.6 38.8 32.1 161 168 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.932 109.9 48.0 -65.3 -46.7 33.0 37.7 29.6 162 169 A V H X S+ 0 0 13 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.910 113.3 48.3 -60.7 -43.9 30.1 38.4 32.0 163 170 A E H X S+ 0 0 92 -4,-2.6 4,-2.1 2,-0.2 3,-0.4 0.960 111.1 50.3 -62.2 -50.6 31.5 41.8 32.8 164 171 A R H X S+ 0 0 52 -4,-2.7 4,-4.2 1,-0.2 -2,-0.2 0.920 112.3 46.6 -51.6 -49.0 32.0 42.7 29.1 165 172 A N H < S+ 0 0 10 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.757 107.8 56.8 -73.8 -20.5 28.5 41.7 28.3 166 173 A R H < S+ 0 0 158 -4,-1.6 -1,-0.2 -3,-0.4 -2,-0.2 0.880 122.8 26.3 -70.6 -37.3 27.1 43.6 31.2 167 174 A E H < S+ 0 0 171 -4,-2.1 -2,-0.2 -3,-0.2 -3,-0.2 0.884 140.4 8.5 -92.6 -44.3 28.8 46.7 29.8 168 175 A Q S < S- 0 0 120 -4,-4.2 -1,-0.2 -5,-0.2 -2,-0.2 -0.654 81.7-128.4-148.6 84.6 29.1 46.3 26.1 169 176 A P - 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