==== 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 LIGASE 10-MAR-04 1VCM . COMPND 2 MOLECULE: CTP SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR M.GOTO,RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI . 531 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21132.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 368 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 61 11.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 5.8 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 33 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 154 29.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.6 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 1 1 1 0 2 3 0 2 1 5 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 1 3 2 0 1 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 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 0 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 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 10 A R 0 0 221 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 148.4 34.4 3.8 53.6 2 11 A P - 0 0 69 0, 0.0 2,-0.2 0, 0.0 164,-0.0 -0.332 360.0-118.0 -67.1 141.5 30.9 2.9 54.6 3 12 A R - 0 0 50 -2,-0.1 2,-0.3 135,-0.0 135,-0.2 -0.593 29.6-137.7 -78.0 142.0 28.0 5.1 53.6 4 13 A K E -a 138 0A 15 133,-3.7 135,-2.9 -2,-0.2 2,-0.5 -0.803 11.1-155.7-104.9 143.4 26.1 6.7 56.5 5 14 A Y E -ab 139 171A 3 165,-2.9 167,-2.3 -2,-0.3 2,-0.6 -0.969 7.5-172.2-121.8 128.8 22.4 7.0 56.9 6 15 A V E -ab 140 172A 0 133,-2.5 135,-2.6 -2,-0.5 2,-0.3 -0.962 13.6-163.4-118.4 110.7 20.6 9.6 59.1 7 16 A F E -ab 141 173A 2 165,-2.9 167,-2.9 -2,-0.6 2,-0.5 -0.755 1.2-160.7 -96.6 142.2 16.8 9.0 59.2 8 17 A I E +ab 142 174A 0 133,-2.7 135,-3.0 -2,-0.3 2,-0.3 -0.975 11.6 175.4-128.6 122.5 14.4 11.6 60.4 9 18 A T E - b 0 175A 5 165,-2.6 167,-3.1 -2,-0.5 2,-0.3 -0.781 17.0-140.2-118.6 163.9 10.8 11.0 61.6 10 19 A G E - b 0 176A 6 133,-0.3 137,-2.7 -2,-0.3 2,-0.3 -0.934 17.8-173.6-126.1 150.0 8.1 13.2 63.1 11 20 A G + 0 0 0 165,-2.9 2,-2.3 -2,-0.3 167,-0.4 -0.889 53.4 22.0-140.4 170.2 5.7 12.7 65.9 12 21 A V S S- 0 0 50 135,-0.4 2,-0.3 -2,-0.3 165,-0.1 -0.426 122.3 -4.5 75.2 -64.7 2.7 14.1 67.8 13 22 A V S S- 0 0 59 -2,-2.3 -2,-0.1 132,-0.1 3,-0.1 -0.938 71.8-114.9-147.8 169.0 1.6 16.4 64.9 14 23 A S S S+ 0 0 85 -2,-0.3 132,-0.1 1,-0.2 130,-0.0 -0.290 85.8 63.7 -94.0-172.8 2.8 17.4 61.4 15 24 A S + 0 0 116 -2,-0.1 -1,-0.2 1,-0.1 0, 0.0 0.921 58.8 129.0 63.2 44.7 3.9 20.9 60.5 16 25 A L S S- 0 0 13 -3,-0.1 -1,-0.1 160,-0.1 197,-0.1 0.293 85.6 -99.4-109.6 6.4 6.9 21.0 62.9 17 26 A G > + 0 0 39 3,-0.1 4,-1.8 195,-0.1 3,-0.3 0.793 68.3 154.1 80.4 30.7 9.3 22.1 60.3 18 27 A K H > S+ 0 0 28 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.800 70.3 57.2 -61.2 -29.7 10.8 18.7 59.6 19 28 A G H > S+ 0 0 8 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.895 108.3 44.3 -69.1 -39.9 11.7 19.7 56.1 20 29 A I H > S+ 0 0 18 -3,-0.3 4,-2.9 2,-0.2 -2,-0.2 0.787 111.4 56.1 -74.0 -27.0 13.8 22.6 57.3 21 30 A L H X S+ 0 0 5 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.942 109.4 44.8 -67.6 -47.3 15.3 20.3 60.0 22 31 A T H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.940 116.6 46.6 -60.0 -48.1 16.4 17.8 57.3 23 32 A S H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.904 111.4 51.4 -60.6 -45.1 17.7 20.7 55.2 24 33 A S H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.859 111.2 46.8 -64.1 -36.0 19.5 22.3 58.2 25 34 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.878 110.5 53.9 -73.0 -36.0 21.2 19.0 59.1 26 35 A G H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.914 109.1 48.3 -62.3 -40.5 22.2 18.5 55.5 27 36 A A H X S+ 0 0 3 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.910 108.5 53.6 -65.9 -42.7 23.8 22.0 55.4 28 37 A L H < S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.889 111.1 46.9 -58.5 -39.9 25.7 21.2 58.7 29 38 A L H ><>S+ 0 0 1 -4,-2.1 5,-1.4 1,-0.2 3,-1.0 0.868 112.1 48.9 -71.7 -36.9 27.1 18.1 57.1 30 39 A R H ><5S+ 0 0 97 -4,-2.0 3,-2.7 1,-0.3 -2,-0.2 0.882 101.6 62.8 -69.1 -38.5 28.1 19.9 53.9 31 40 A A T 3<5S+ 0 0 23 -4,-2.9 242,-1.9 1,-0.3 -1,-0.3 0.517 100.9 57.3 -64.1 -0.8 29.8 22.6 55.9 32 41 A R T < 5S- 0 0 18 -3,-1.0 -1,-0.3 240,-0.2 -2,-0.2 0.322 122.1-105.9-110.3 3.3 32.0 19.8 57.0 33 42 A G T < 5S+ 0 0 71 -3,-2.7 -3,-0.2 1,-0.3 -2,-0.1 0.451 71.8 139.9 89.1 0.1 33.1 18.8 53.5 34 43 A Y < - 0 0 28 -5,-1.4 2,-0.7 1,-0.1 -1,-0.3 -0.372 58.4-118.6 -76.6 155.2 31.0 15.6 53.2 35 44 A R + 0 0 52 -2,-0.1 102,-2.7 100,-0.0 103,-1.6 -0.876 50.2 176.0 -93.4 117.2 29.3 14.6 50.0 36 45 A V E -c 138 0A 5 -2,-0.7 2,-0.3 100,-0.2 103,-0.2 -0.743 22.5-179.9-123.3 167.4 25.6 14.5 51.0 37 46 A T E -c 139 0A 0 101,-1.2 103,-2.6 -2,-0.2 2,-0.4 -0.966 15.1-142.3-158.8 158.8 22.1 14.0 49.7 38 47 A A E -c 140 0A 2 -2,-0.3 2,-0.4 101,-0.2 103,-0.2 -0.984 4.9-159.5-132.1 142.8 18.6 14.1 51.0 39 48 A I E -c 141 0A 0 101,-2.2 103,-2.9 -2,-0.4 2,-0.6 -0.984 8.3-151.8-123.8 126.2 15.6 11.9 50.2 40 49 A K E -cd 142 89A 11 48,-3.2 50,-1.8 -2,-0.4 2,-0.5 -0.871 8.0-156.5-100.2 116.8 12.0 13.1 51.0 41 50 A I E -cd 143 90A 0 101,-3.0 103,-1.5 -2,-0.6 50,-0.2 -0.820 7.6-170.8 -92.9 126.3 9.6 10.2 51.6 42 51 A D E - d 0 91A 12 48,-3.4 50,-0.9 -2,-0.5 101,-0.1 -0.935 12.6-155.7-119.4 106.0 6.0 11.2 50.9 43 52 A P + 0 0 6 0, 0.0 48,-0.1 0, 0.0 -1,-0.1 0.472 57.4 115.6 -58.9 -3.6 3.6 8.5 52.1 44 53 A Y S S- 0 0 46 1,-0.1 48,-1.7 48,-0.1 49,-1.1 -0.226 73.8-123.7 -69.9 161.7 0.9 9.7 49.7 45 54 A V S S+ 0 0 111 47,-0.2 -1,-0.1 46,-0.1 46,-0.1 0.701 75.9 111.5 -78.2 -19.5 -0.3 7.5 46.9 46 55 A N - 0 0 55 1,-0.2 47,-0.5 47,-0.1 48,-0.4 -0.296 67.2-140.6 -55.3 135.3 0.4 10.1 44.1 47 56 A V S S- 0 0 62 46,-0.2 2,-0.3 1,-0.2 44,-0.2 0.858 79.8 -23.2 -67.5 -35.1 3.3 8.8 42.0 48 57 A D S > S- 0 0 36 21,-0.1 3,-0.7 42,-0.1 -1,-0.2 -0.926 77.4 -87.6-161.5 174.4 4.7 12.3 41.9 49 58 A A G > S+ 0 0 2 19,-1.6 3,-1.0 -2,-0.3 20,-0.2 0.249 94.3 107.3 -77.8 16.0 3.4 15.8 42.2 50 59 A G G 3 S+ 0 0 24 18,-0.4 -1,-0.2 1,-0.2 19,-0.1 0.872 76.9 42.8 -63.0 -42.3 2.6 15.8 38.5 51 60 A T G < S+ 0 0 130 -3,-0.7 -1,-0.2 2,-0.1 2,-0.2 0.330 99.2 97.9 -89.2 10.3 -1.2 15.6 38.7 52 61 A M S < S- 0 0 76 -3,-1.0 8,-0.1 1,-0.1 4,-0.0 -0.607 92.3 -83.7 -97.9 157.7 -1.4 18.1 41.6 53 62 A R - 0 0 45 -2,-0.2 4,-0.2 1,-0.2 -1,-0.1 -0.437 38.5-142.9 -60.5 115.6 -2.2 21.9 41.4 54 63 A P S S- 0 0 40 0, 0.0 6,-1.6 0, 0.0 -1,-0.2 0.661 88.0 -1.8 -54.7 -23.8 1.2 23.5 40.6 55 64 A Y S > S+ 0 0 21 4,-0.2 3,-1.9 250,-0.1 -2,-0.1 0.573 113.0 80.5-132.7 -54.5 0.6 26.5 42.8 56 65 A E T 3 S+ 0 0 149 1,-0.3 2,-0.6 248,-0.1 248,-0.1 0.776 106.3 23.8 -24.2 -79.6 -2.8 26.5 44.5 57 66 A H T 3 S- 0 0 95 1,-0.3 -1,-0.3 -4,-0.2 2,-0.1 -0.244 139.1 -40.8 -93.3 47.4 -2.3 24.1 47.4 58 67 A G S < S- 0 0 12 -3,-1.9 -1,-0.3 -2,-0.6 246,-0.3 -0.026 79.3 -71.0 108.5 145.5 1.4 24.6 47.7 59 68 A E - 0 0 12 244,-1.8 2,-0.6 -3,-0.1 12,-0.4 -0.396 34.9-141.0 -72.5 145.1 4.2 24.9 45.1 60 69 A V - 0 0 8 -6,-1.6 10,-0.2 244,-0.2 11,-0.1 -0.938 22.0-142.8-107.1 113.6 5.4 21.9 43.1 61 70 A F E -G 69 0B 0 8,-1.0 8,-2.0 -2,-0.6 2,-0.4 -0.308 7.2-146.8 -73.3 159.3 9.2 22.0 42.7 62 71 A V E -G 68 0B 0 6,-0.2 6,-0.2 9,-0.1 2,-0.1 -0.989 8.6-146.3-132.9 123.6 10.9 20.9 39.5 63 72 A T > - 0 0 0 4,-2.0 3,-3.1 -2,-0.4 4,-0.2 -0.442 33.8 -99.6 -87.0 162.3 14.3 19.3 39.4 64 73 A A T 3 S+ 0 0 23 20,-0.5 368,-2.7 1,-0.3 21,-0.1 0.775 123.3 57.1 -48.6 -30.2 16.9 19.6 36.7 65 74 A D T 3 S- 0 0 84 19,-0.4 -1,-0.3 366,-0.2 20,-0.1 0.334 123.6-102.2 -87.7 8.2 15.8 16.3 35.3 66 75 A G < + 0 0 13 -3,-3.1 2,-0.3 1,-0.3 -2,-0.2 0.627 69.2 151.7 84.3 14.7 12.2 17.6 34.8 67 76 A A - 0 0 0 -4,-0.2 -4,-2.0 363,-0.1 2,-0.8 -0.586 40.9-141.8 -82.5 141.1 10.7 15.8 37.8 68 77 A E E +G 62 0B 29 -2,-0.3 -19,-1.6 -6,-0.2 -18,-0.4 -0.910 39.8 163.3-103.0 107.3 7.7 17.4 39.5 69 78 A T E -G 61 0B 3 -8,-2.0 -8,-1.0 -2,-0.8 -21,-0.1 -0.585 42.2 -72.2-120.2-179.6 8.2 16.8 43.2 70 79 A D > - 0 0 35 -10,-0.2 3,-1.2 -2,-0.2 4,-0.4 -0.330 50.7-109.7 -68.7 156.2 7.1 17.9 46.6 71 80 A L T >> S+ 0 0 30 -12,-0.4 4,-1.1 1,-0.2 3,-0.9 0.679 108.9 76.5 -64.9 -19.1 8.3 21.4 47.7 72 81 A D H 3> S+ 0 0 20 1,-0.3 4,-2.6 2,-0.2 3,-0.4 0.862 83.6 66.7 -60.3 -34.1 10.7 20.0 50.3 73 82 A I H <> S+ 0 0 0 -3,-1.2 4,-2.7 1,-0.3 -1,-0.3 0.875 98.5 53.0 -54.0 -37.0 13.1 19.1 47.5 74 83 A G H <> S+ 0 0 0 -3,-0.9 4,-2.1 -4,-0.4 -1,-0.3 0.875 106.5 51.7 -66.8 -36.0 13.5 22.8 46.9 75 84 A H H X S+ 0 0 16 -4,-1.1 4,-2.3 -3,-0.4 5,-0.2 0.918 110.8 49.5 -64.9 -41.7 14.4 23.2 50.6 76 85 A Y H X S+ 0 0 0 -4,-2.6 4,-3.1 2,-0.2 5,-0.4 0.943 109.8 48.8 -62.5 -50.1 17.0 20.5 50.2 77 86 A E H X>S+ 0 0 0 -4,-2.7 4,-1.3 1,-0.2 5,-1.2 0.912 113.4 47.6 -57.9 -44.1 18.6 22.0 47.0 78 87 A R H <5S+ 0 0 4 -4,-2.1 439,-0.3 3,-0.2 -1,-0.2 0.915 118.9 38.0 -65.1 -44.2 18.9 25.4 48.6 79 88 A F H <5S+ 0 0 7 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.839 125.6 37.2 -77.9 -33.9 20.4 24.3 51.9 80 89 A L H <5S- 0 0 1 -4,-3.1 -2,-0.2 -5,-0.2 -1,-0.2 0.561 101.9-134.8 -91.2 -10.3 22.6 21.5 50.5 81 90 A D T <5 + 0 0 49 -4,-1.3 2,-0.3 -5,-0.4 -3,-0.2 0.981 61.9 112.4 54.2 62.9 23.4 23.7 47.4 82 91 A M S - 0 0 27 -2,-0.2 3,-1.9 -22,-0.1 4,-0.1 -0.671 37.0 -85.9-126.9-177.1 16.6 14.2 40.9 86 95 A R G > S+ 0 0 100 1,-0.3 3,-1.4 -2,-0.2 -18,-0.0 0.709 119.7 71.0 -65.5 -18.4 13.2 12.5 40.9 87 96 A G G 3 S+ 0 0 21 1,-0.3 -1,-0.3 43,-0.1 43,-0.2 0.652 86.9 67.6 -71.5 -13.2 14.8 9.7 42.9 88 97 A N G < S+ 0 0 0 -3,-1.9 -48,-3.2 1,-0.2 2,-0.5 0.436 92.1 62.5 -87.2 -0.2 15.0 12.0 45.8 89 98 A N E < S-d 40 0A 3 -3,-1.4 2,-0.4 -50,-0.2 -48,-0.2 -0.901 70.9-176.3-126.4 100.2 11.2 12.1 46.2 90 99 A L E +d 41 0A 2 -50,-1.8 -48,-3.4 -2,-0.5 2,-0.3 -0.833 4.9 179.7-100.4 133.2 9.9 8.7 47.1 91 100 A T E > -d 42 0A 0 -2,-0.4 4,-1.9 -50,-0.2 5,-0.2 -0.810 41.4-111.8-129.1 169.1 6.2 8.0 47.4 92 101 A T H > S+ 0 0 20 -48,-1.7 4,-3.0 -50,-0.9 5,-0.3 0.906 116.2 54.9 -66.0 -42.6 3.8 5.1 48.2 93 102 A G H > S+ 0 0 7 -49,-1.1 4,-2.5 -47,-0.5 5,-0.3 0.899 108.3 48.3 -57.9 -43.9 2.4 5.2 44.6 94 103 A Q H > S+ 0 0 23 -48,-0.4 4,-2.7 2,-0.2 5,-0.2 0.964 115.3 44.0 -59.6 -55.2 5.9 4.8 43.1 95 104 A V H X S+ 0 0 0 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.892 119.0 41.0 -59.7 -46.4 6.8 1.9 45.5 96 105 A Y H X S+ 0 0 72 -4,-3.0 4,-3.0 2,-0.2 5,-0.2 0.932 116.2 48.4 -72.2 -44.5 3.5 -0.0 45.1 97 106 A L H X S+ 0 0 77 -4,-2.5 4,-2.7 -5,-0.3 5,-0.2 0.956 113.0 49.4 -57.9 -49.9 3.1 0.5 41.4 98 107 A S H X S+ 0 0 23 -4,-2.7 4,-1.1 -5,-0.3 -1,-0.2 0.837 115.2 43.6 -59.3 -34.9 6.7 -0.5 40.8 99 108 A V H X S+ 0 0 5 -4,-1.5 4,-1.5 -5,-0.2 -1,-0.2 0.865 113.2 50.6 -79.6 -37.5 6.2 -3.7 42.9 100 109 A I H X S+ 0 0 89 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.881 108.2 53.0 -66.6 -39.7 2.8 -4.6 41.5 101 110 A Q H X S+ 0 0 90 -4,-2.7 4,-1.6 -5,-0.2 6,-0.2 0.897 106.8 54.5 -63.4 -38.3 4.2 -4.2 37.9 102 111 A K H <>S+ 0 0 48 -4,-1.1 5,-2.4 -5,-0.2 6,-0.4 0.874 109.8 44.1 -65.0 -39.1 7.0 -6.6 38.8 103 112 A E H ><5S+ 0 0 63 -4,-1.5 3,-1.2 3,-0.2 -1,-0.2 0.805 109.2 55.3 -80.1 -25.7 4.7 -9.4 40.0 104 113 A R H 3<5S+ 0 0 187 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.865 107.2 52.0 -69.7 -32.9 2.2 -9.1 37.2 105 114 A R T 3<5S- 0 0 144 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.334 120.2-118.0 -81.0 7.6 5.2 -9.6 34.9 106 115 A G T X 5S+ 0 0 45 -3,-1.2 3,-1.5 1,-0.1 -3,-0.2 0.593 71.7 138.6 67.4 12.8 5.9 -12.7 37.0 107 116 A E T 3 < + 0 0 111 -5,-2.4 -4,-0.2 1,-0.3 -1,-0.1 0.594 60.6 67.6 -66.1 -11.9 9.3 -11.3 38.1 108 117 A Y T > S- 0 0 40 -6,-0.4 3,-1.9 -5,-0.1 -1,-0.3 0.205 108.6-122.7 -93.2 17.7 8.7 -12.5 41.7 109 118 A L T < - 0 0 72 -3,-1.5 -2,-0.1 1,-0.3 -6,-0.1 0.786 64.3 -55.9 47.3 41.1 9.0 -16.1 40.4 110 119 A S T 3 S+ 0 0 127 1,-0.2 -1,-0.3 -4,-0.2 2,-0.1 0.483 98.3 135.2 77.9 3.9 5.6 -17.2 41.6 111 120 A Q < - 0 0 107 -3,-1.9 2,-0.5 1,-0.1 -1,-0.2 -0.381 66.6-100.6 -78.1 164.0 6.0 -16.3 45.3 112 121 A T - 0 0 106 -2,-0.1 2,-0.5 1,-0.0 -1,-0.1 -0.762 41.8-136.2 -84.5 128.8 3.2 -14.6 47.2 113 122 A V + 0 0 41 -2,-0.5 2,-0.3 4,-0.1 3,-0.0 -0.766 27.7 178.3 -95.4 131.2 4.2 -10.9 47.3 114 123 A Q >> - 0 0 114 -2,-0.5 5,-1.5 1,-0.1 4,-0.7 -0.872 46.3-107.9-131.4 161.1 3.8 -8.9 50.5 115 124 A V T 4>S+ 0 0 60 -2,-0.3 5,-2.3 1,-0.2 4,-0.4 0.918 104.4 71.3 -49.1 -46.3 4.4 -5.5 52.1 116 125 A I T 45S- 0 0 86 3,-0.2 -1,-0.2 1,-0.2 42,-0.0 -0.982 115.4 -1.6-116.7 127.3 7.2 -7.2 54.0 117 126 A P T >5S+ 0 0 55 0, 0.0 4,-3.0 0, 0.0 5,-0.2 -1.000 135.2 46.8 -91.6 -11.8 9.7 -8.0 52.5 118 127 A H H X5S+ 0 0 16 -4,-0.7 4,-2.1 2,-0.2 -3,-0.2 0.906 116.9 37.9 -61.6 -50.1 8.8 -7.0 49.0 119 128 A I H >S+ 0 0 0 -4,-1.7 5,-2.0 -5,-0.2 -1,-0.2 0.832 110.8 53.8 -64.7 -30.9 22.4 7.6 47.1 132 141 A E H ><5S+ 0 0 106 -4,-2.2 3,-2.4 3,-0.2 -2,-0.2 0.984 108.5 44.5 -66.7 -60.3 24.7 5.5 44.8 133 142 A E H 3<5S+ 0 0 102 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.820 115.7 48.4 -58.6 -29.2 24.3 7.6 41.7 134 143 A Q T 3<5S- 0 0 42 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.278 105.0-135.1 -94.3 14.7 24.8 10.8 43.6 135 144 A K T < 5 + 0 0 149 -3,-2.4 2,-0.3 1,-0.2 -3,-0.2 0.822 37.9 174.6 33.4 59.7 27.8 9.3 45.4 136 145 A A < - 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