==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-MAY-06 2DPS . COMPND 2 MOLECULE: LEUCYL/PHENYLALANYL-TRNA--PROTEIN TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.SUTO,Y.SHIMIZU,K.TOMITA . 459 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21378.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 310 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 96 20.9 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 . 5 1.1 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 . 21 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 112 24.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.4 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 1 0 2 4 0 2 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 3 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 0 PARALLEL BRIDGES PER LADDER . 1 2 8 2 0 0 0 4 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 2 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 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 0 122 0, 0.0 2,-0.2 0, 0.0 25,-0.2 0.000 360.0 360.0 360.0-157.8 21.3 77.0 10.1 2 4 A V - 0 0 60 23,-0.2 25,-1.2 10,-0.0 2,-0.4 -0.839 360.0-132.6-167.3 124.8 17.8 75.5 10.4 3 5 A Q B -a 27 0A 136 -2,-0.2 25,-0.2 23,-0.2 2,-0.1 -0.646 26.2-136.1 -82.5 132.1 16.0 73.6 13.1 4 6 A L - 0 0 16 23,-2.8 25,-0.5 -2,-0.4 2,-0.4 -0.292 16.5-130.3 -79.5 169.5 14.1 70.5 12.0 5 7 A S - 0 0 67 3,-0.3 5,-0.1 5,-0.2 25,-0.1 -0.946 17.7-127.9-127.9 147.8 10.6 69.6 13.1 6 8 A R S S+ 0 0 188 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.778 103.6 76.6 -56.3 -25.6 9.0 66.4 14.5 7 9 A H S S+ 0 0 140 2,-0.0 -1,-0.2 -3,-0.0 2,-0.1 0.960 101.0 5.3 -49.3 -88.0 6.6 67.1 11.7 8 10 A S - 0 0 49 2,-0.1 -3,-0.3 1,-0.0 27,-0.0 -0.412 60.6-122.4-102.4 177.1 8.3 66.0 8.5 9 11 A I + 0 0 64 -2,-0.1 2,-0.2 -5,-0.1 -3,-0.1 -0.003 63.8 140.4-102.9 23.6 11.5 64.3 7.4 10 12 A A - 0 0 63 -5,-0.1 -5,-0.2 1,-0.0 -2,-0.1 -0.467 33.0-164.6 -75.3 141.4 12.5 67.2 5.2 11 13 A F - 0 0 17 -2,-0.2 2,-0.1 27,-0.1 -2,-0.1 -0.963 19.4-118.3-127.0 142.9 16.1 68.4 5.0 12 14 A P - 0 0 39 0, 0.0 -10,-0.0 0, 0.0 5,-0.0 -0.412 51.7 -75.7 -76.1 153.9 17.5 71.7 3.7 13 15 A S > - 0 0 68 1,-0.1 3,-2.2 -2,-0.1 29,-0.0 -0.258 37.0-133.9 -53.2 128.1 19.9 71.6 0.8 14 16 A P G > S+ 0 0 8 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.808 100.3 72.5 -51.1 -35.7 23.4 70.4 1.9 15 17 A E G 3 S+ 0 0 90 1,-0.3 -2,-0.1 186,-0.0 8,-0.0 0.641 86.7 63.1 -60.4 -15.9 24.9 73.3 -0.0 16 18 A G G < S+ 0 0 60 -3,-2.2 -1,-0.3 7,-0.1 -3,-0.1 0.146 79.9 125.2 -94.8 20.3 23.7 75.7 2.6 17 19 A A < - 0 0 16 -3,-1.8 8,-0.2 41,-0.2 7,-0.1 -0.314 68.7 -93.4 -75.8 161.8 25.9 74.1 5.2 18 20 A L > - 0 0 66 6,-2.6 5,-2.8 3,-0.2 -1,-0.1 -0.321 17.9-144.9 -73.2 158.4 28.4 76.0 7.3 19 21 A R T 5S+ 0 0 221 1,-0.3 3,-0.3 3,-0.2 -1,-0.1 0.778 86.2 54.4 -90.0 -33.7 32.0 76.3 6.3 20 22 A E T 5S+ 0 0 161 1,-0.5 -1,-0.3 2,-0.1 2,-0.1 -0.873 110.5 32.7-151.1 112.0 33.2 76.2 9.9 21 23 A P T > 5S- 0 0 57 0, 0.0 3,-1.8 0, 0.0 -1,-0.5 0.337 119.1-120.1 -60.1 129.7 32.4 74.0 11.6 22 24 A N T 3 5S+ 0 0 56 -3,-0.3 -3,-0.2 1,-0.2 -2,-0.1 -0.271 85.0 1.7 -55.9 110.8 32.6 72.3 8.2 23 25 A G T 3 - 0 0 37 1,-0.1 4,-2.8 4,-0.1 5,-0.2 -0.283 60.0-110.7 -64.2 149.8 13.7 57.7 13.5 33 35 A P H > S+ 0 0 33 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.907 118.2 49.1 -47.6 -49.6 14.3 55.2 10.8 34 36 A A H > S+ 0 0 57 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.916 112.4 45.7 -60.3 -46.9 12.6 57.4 8.2 35 37 A R H > S+ 0 0 2 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.889 114.9 49.0 -65.6 -37.7 14.4 60.5 9.2 36 38 A L H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.951 109.4 50.6 -65.3 -51.2 17.8 58.7 9.2 37 39 A L H X S+ 0 0 26 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.912 110.7 50.1 -52.7 -46.4 17.2 57.0 5.8 38 40 A M H X S+ 0 0 46 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.856 104.9 59.1 -61.9 -35.8 16.4 60.4 4.3 39 41 A A H <>S+ 0 0 0 -4,-1.6 5,-3.6 1,-0.2 3,-0.2 0.945 111.0 39.7 -58.9 -49.4 19.5 61.9 5.8 40 42 A Y H ><5S+ 0 0 1 -4,-1.9 3,-2.2 3,-0.2 -2,-0.2 0.914 108.8 60.4 -67.6 -43.4 21.7 59.4 4.0 41 43 A Q H 3<5S+ 0 0 61 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.826 113.1 40.0 -52.2 -33.7 19.7 59.6 0.7 42 44 A R T 3<5S- 0 0 84 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.203 122.7-100.4-104.4 15.5 20.5 63.3 0.7 43 45 A G T < 5S+ 0 0 0 -3,-2.2 2,-0.3 1,-0.2 -3,-0.2 0.767 81.5 121.5 75.6 27.8 24.1 63.2 1.8 44 46 A I < - 0 0 0 -5,-3.6 -1,-0.2 -6,-0.2 14,-0.2 -0.873 35.0-176.5-122.2 152.9 23.7 64.1 5.4 45 47 A F E -C 57 0A 9 12,-1.7 12,-2.9 -2,-0.3 2,-0.2 -0.992 25.4-112.4-146.5 153.3 24.5 62.3 8.7 46 48 A P E +C 56 0A 1 0, 0.0 2,-0.2 0, 0.0 10,-0.2 -0.574 36.9 159.9 -86.7 151.5 24.1 62.9 12.4 47 49 A W + 0 0 116 8,-2.4 2,-0.3 -2,-0.2 -2,-0.1 -0.773 9.6 135.7-169.6 123.0 26.9 63.6 14.8 48 50 A F - 0 0 16 -2,-0.2 3,-0.1 6,-0.1 6,-0.1 -0.944 48.7-105.8-169.9 147.0 26.9 65.2 18.2 49 51 A S > - 0 0 48 -2,-0.3 3,-1.5 1,-0.1 59,-0.1 -0.395 53.9 -87.5 -75.1 153.9 28.4 64.7 21.6 50 52 A P T 3 S+ 0 0 81 0, 0.0 -1,-0.1 0, 0.0 59,-0.1 -0.417 116.8 35.9 -62.5 138.9 26.1 63.4 24.3 51 53 A G T 3 S+ 0 0 84 1,-0.5 -2,-0.0 -3,-0.1 0, 0.0 -0.170 99.6 91.8 110.4 -39.1 24.3 66.4 26.0 52 54 A D S < S- 0 0 88 -3,-1.5 -1,-0.5 1,-0.1 2,-0.1 -0.314 84.2 -98.6 -82.8 169.3 23.9 68.4 22.8 53 55 A P - 0 0 68 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 -0.432 57.6 -71.9 -82.6 164.9 20.9 68.4 20.5 54 56 A I - 0 0 27 -2,-0.1 -26,-1.9 -25,-0.1 2,-0.4 -0.362 53.7-164.4 -59.2 131.0 21.0 66.3 17.3 55 57 A L E -B 27 0A 32 -28,-0.2 -8,-2.4 -3,-0.1 2,-0.3 -0.972 2.7-154.5-122.3 133.7 23.3 67.9 14.7 56 58 A W E -BC 26 46A 0 -30,-2.9 -31,-2.6 -2,-0.4 -30,-1.0 -0.837 12.8-164.8-111.7 146.8 23.3 67.0 11.0 57 59 A W E +BC 24 45A 33 -12,-2.9 -12,-1.7 -2,-0.3 -33,-0.2 -0.907 30.9 169.7-135.1 160.8 26.2 67.3 8.6 58 60 A S - 0 0 0 -35,-1.1 -35,-0.2 -2,-0.3 -41,-0.2 -0.511 33.0-161.1-162.6 75.6 27.3 67.4 5.0 59 61 A P - 0 0 8 0, 0.0 -36,-0.1 0, 0.0 -40,-0.1 -0.120 15.6-113.5 -64.7 160.5 30.9 68.6 4.9 60 62 A D S S+ 0 0 64 -41,-0.1 2,-0.2 1,-0.1 -37,-0.1 -0.944 102.6 30.1-142.6 113.2 32.8 70.0 1.9 61 63 A P S S- 0 0 48 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.558 91.2-146.9 -74.9 176.7 35.0 68.3 0.9 62 64 A R E -D 199 0B 1 137,-2.6 137,-2.0 -2,-0.2 2,-0.3 -0.906 12.7-125.6-111.0 134.3 33.7 64.8 1.8 63 65 A A E +DE 198 185B 2 122,-3.1 121,-2.2 -2,-0.4 122,-0.8 -0.626 42.7 164.9 -78.7 135.6 36.2 62.0 2.8 64 66 A V E -DE 197 183B 0 133,-3.5 133,-3.0 -2,-0.3 2,-0.4 -0.924 29.2-140.0-146.7 168.4 35.6 59.0 0.6 65 67 A L E - E 0 182B 4 117,-2.8 117,-1.7 -2,-0.3 131,-0.1 -0.908 8.6-146.5-142.4 114.6 37.3 55.7 -0.4 66 68 A W > - 0 0 76 -2,-0.4 3,-2.9 129,-0.4 4,-0.2 -0.690 22.9-139.3 -77.3 111.9 37.5 54.1 -3.8 67 69 A P G > S+ 0 0 8 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.785 100.6 53.1 -39.2 -43.4 37.4 50.3 -2.9 68 70 A E G 3 S+ 0 0 163 1,-0.2 -2,-0.1 112,-0.2 112,-0.0 0.671 103.0 58.5 -72.5 -16.6 40.0 49.5 -5.5 69 71 A S G < S+ 0 0 72 -3,-2.9 -1,-0.2 2,-0.1 2,-0.2 0.307 70.2 136.2 -95.8 8.9 42.4 52.2 -4.2 70 72 A L < - 0 0 25 -3,-1.2 2,-0.4 -4,-0.2 125,-0.2 -0.392 52.9-135.2 -58.1 121.5 42.6 50.6 -0.7 71 73 A H - 0 0 115 123,-2.8 2,-0.5 -2,-0.2 -1,-0.1 -0.706 23.6-175.3 -86.5 130.9 46.3 50.8 0.2 72 74 A I - 0 0 43 -2,-0.4 5,-0.1 123,-0.0 122,-0.1 -0.944 18.9-136.5-128.8 108.8 47.7 47.6 1.8 73 75 A S > - 0 0 43 -2,-0.5 4,-1.6 1,-0.1 5,-0.1 -0.022 24.5-111.9 -55.6 165.1 51.3 47.7 3.0 74 76 A R H > S+ 0 0 183 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.818 118.4 56.0 -70.3 -32.6 53.6 44.7 2.3 75 77 A S H > S+ 0 0 66 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.858 106.9 50.2 -68.0 -35.1 53.7 43.8 5.9 76 78 A M H > S+ 0 0 4 2,-0.2 4,-3.6 1,-0.2 5,-0.3 0.891 106.8 53.0 -69.9 -40.9 49.9 43.6 6.0 77 79 A K H X S+ 0 0 122 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.903 109.5 50.4 -59.7 -40.5 49.7 41.3 2.9 78 80 A R H X S+ 0 0 144 -4,-1.7 4,-0.8 2,-0.2 -1,-0.2 0.921 113.7 45.9 -61.5 -45.0 52.2 39.1 4.8 79 81 A F H >< S+ 0 0 58 -4,-1.9 3,-1.0 1,-0.2 -2,-0.2 0.936 112.0 49.0 -64.1 -50.2 49.9 39.2 7.8 80 82 A H H >< S+ 0 0 27 -4,-3.6 3,-0.9 1,-0.3 -1,-0.2 0.769 104.1 59.6 -64.6 -27.8 46.6 38.6 5.9 81 83 A K H 3< S+ 0 0 164 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.784 120.5 28.5 -70.9 -24.9 48.1 35.6 4.0 82 84 A R T << S+ 0 0 162 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.2 -0.027 95.9 170.3-120.9 24.5 48.7 34.0 7.4 83 85 A S < - 0 0 11 -3,-0.9 -3,-0.1 1,-0.1 -4,-0.0 0.006 32.7-160.7 -46.6 137.5 45.8 35.7 9.1 84 86 A P + 0 0 43 0, 0.0 50,-0.4 0, 0.0 2,-0.3 0.249 68.9 89.2 -99.3 6.6 44.7 34.7 12.6 85 87 A Y - 0 0 4 48,-0.2 2,-0.4 -5,-0.1 48,-0.2 -0.741 60.8-153.2-110.7 154.5 41.3 36.4 12.1 86 88 A R E -F 132 0B 49 46,-2.1 46,-3.2 -2,-0.3 2,-0.4 -0.939 15.6-149.2-120.0 145.3 38.0 35.4 10.6 87 89 A V E +FG 131 227B 0 140,-2.8 139,-2.3 -2,-0.4 140,-1.9 -0.961 17.3 175.3-120.4 137.5 35.7 37.9 9.0 88 90 A T E -FG 130 225B 6 42,-2.1 42,-3.0 -2,-0.4 2,-0.4 -0.862 23.6-130.3-132.8 168.1 31.9 37.9 9.0 89 91 A M E S-FG 129 224B 0 135,-2.4 135,-1.3 -2,-0.3 40,-0.2 -0.977 82.7 -11.5-123.0 131.4 29.0 40.1 7.8 90 92 A N S S+ 0 0 6 38,-3.1 -1,-0.1 -2,-0.4 39,-0.1 0.814 89.6 123.5 48.4 43.6 26.0 40.9 10.0 91 93 A Y S S+ 0 0 20 37,-0.1 3,-0.1 1,-0.1 -1,-0.1 0.821 88.3 6.9 -93.4 -42.9 26.8 38.4 12.7 92 94 A A > + 0 0 0 1,-0.1 4,-2.2 -4,-0.1 3,-0.4 -0.395 65.9 161.0-141.9 62.7 26.9 40.8 15.6 93 95 A F H > S+ 0 0 2 263,-0.3 4,-2.3 1,-0.2 5,-0.3 0.910 80.1 54.1 -47.2 -50.7 25.8 44.3 14.6 94 96 A G H > S+ 0 0 13 1,-0.2 4,-1.9 261,-0.2 -1,-0.2 0.868 108.6 46.4 -54.1 -45.0 25.2 45.3 18.2 95 97 A Q H > S+ 0 0 66 -3,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.891 110.4 53.9 -68.0 -38.2 28.6 44.3 19.4 96 98 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.958 111.5 42.9 -61.2 -51.4 30.4 46.1 16.6 97 99 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.897 115.6 50.4 -62.5 -38.5 28.7 49.4 17.2 98 100 A E H X S+ 0 0 103 -4,-1.9 4,-2.7 -5,-0.3 -1,-0.2 0.889 109.2 52.5 -64.0 -39.4 29.2 48.9 20.9 99 101 A G H < S+ 0 0 12 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.878 112.0 44.4 -63.5 -39.0 32.8 48.2 20.1 100 102 A C H >< S+ 0 0 3 -4,-2.3 3,-0.6 1,-0.2 -2,-0.2 0.820 114.0 52.2 -73.6 -31.4 33.0 51.5 18.2 101 103 A A H 3< S+ 0 0 16 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.874 106.5 50.6 -72.9 -38.6 31.2 53.2 21.0 102 104 A S T 3< S+ 0 0 85 -4,-2.7 3,-0.4 -5,-0.1 -1,-0.2 0.409 87.1 111.6 -82.1 4.6 33.5 52.1 23.8 103 105 A D < + 0 0 70 -3,-0.6 -3,-0.0 1,-0.2 53,-0.0 -0.555 67.3 34.9 -79.9 143.3 36.6 53.2 21.8 104 106 A R 0 0 162 -2,-0.2 -1,-0.2 3,-0.0 -4,-0.0 0.869 360.0 360.0 82.5 42.1 38.5 56.2 23.2 105 107 A E 0 0 221 -3,-0.4 -2,-0.2 2,-0.0 -3,-0.0 0.964 360.0 360.0 79.3 360.0 38.0 55.5 27.0 106 ! 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 0.0 107 110 A T 0 0 49 0, 0.0 -6,-0.0 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 155.3 32.5 58.6 21.8 108 111 A W + 0 0 24 -59,-0.1 2,-1.5 1,-0.1 5,-0.2 0.625 360.0 114.5 -59.4 -16.2 29.3 60.4 20.7 109 112 A I - 0 0 13 -9,-0.1 2,-0.2 -8,-0.1 -1,-0.1 -0.411 50.3-179.9 -62.9 91.4 27.7 56.9 20.2 110 113 A T > - 0 0 55 -2,-1.5 4,-2.9 1,-0.1 3,-0.2 -0.524 44.9-100.1 -92.7 161.8 25.0 57.2 22.8 111 114 A R H > S+ 0 0 182 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.890 126.5 53.4 -46.5 -44.7 22.5 54.6 23.7 112 115 A G H > S+ 0 0 34 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.939 109.2 47.3 -56.7 -49.5 19.9 56.5 21.7 113 116 A V H > S+ 0 0 0 -3,-0.2 4,-2.5 -5,-0.2 5,-0.3 0.920 111.5 52.2 -58.2 -44.4 22.3 56.5 18.7 114 117 A V H X S+ 0 0 15 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.929 110.8 45.7 -58.6 -48.4 22.9 52.8 19.2 115 118 A E H X S+ 0 0 76 -4,-2.9 4,-2.3 -5,-0.2 -1,-0.2 0.924 111.4 54.7 -61.1 -43.8 19.2 52.0 19.2 116 119 A A H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.897 113.8 38.4 -57.7 -46.1 18.6 54.2 16.2 117 120 A Y H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.802 111.4 60.6 -77.1 -24.9 21.2 52.4 14.1 118 121 A H H X S+ 0 0 54 -4,-2.1 4,-2.9 -5,-0.3 -2,-0.2 0.883 103.2 51.5 -66.3 -37.4 20.1 49.1 15.5 119 122 A R H X S+ 0 0 90 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.933 108.6 50.7 -62.8 -46.5 16.7 49.8 14.1 120 123 A L H <>S+ 0 0 0 -4,-1.4 5,-3.4 2,-0.2 6,-1.4 0.843 111.6 48.1 -60.3 -35.0 18.2 50.4 10.7 121 124 A H H ><5S+ 0 0 35 -4,-1.9 3,-1.6 4,-0.3 -2,-0.2 0.951 111.2 50.0 -68.8 -47.9 20.1 47.2 11.0 122 125 A E H 3<5S+ 0 0 76 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.845 110.9 50.2 -57.1 -36.4 16.9 45.4 12.0 123 126 A L T 3<5S- 0 0 46 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.518 122.4-107.0 -82.2 -5.5 15.1 46.9 9.0 124 127 A G T < 5S+ 0 0 22 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.729 95.3 95.4 89.5 23.1 17.9 45.8 6.7 125 128 A H S S- H 0 136B 86 3,-3.1 3,-2.1 -2,-0.4 2,-0.4 -0.851 77.0 -67.4-105.7 88.4 40.2 36.1 16.8 134 137 A E T 3 S- 0 0 34 -2,-1.0 106,-0.1 -50,-0.4 -48,-0.1 -0.467 122.2 -4.0 62.6-116.2 38.6 32.7 17.3 135 138 A D T 3 S+ 0 0 45 -2,-0.4 2,-0.4 103,-0.3 131,-0.4 0.580 120.5 88.0 -83.0 -9.9 35.7 33.2 19.8 136 139 A E E < S-H 133 0B 104 -3,-2.1 -3,-3.1 130,-0.1 2,-0.8 -0.779 73.8-132.9-101.8 133.4 36.5 36.9 20.4 137 140 A L E +H 132 0B 24 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.676 33.2 169.9 -75.6 112.6 35.2 39.9 18.5 138 141 A V E - 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