==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-DEC-01 1GQT . COMPND 2 MOLECULE: RIBOKINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.E.ANDERSSON,S.L.MOWBRAY . 1223 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48725.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 964 78.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 167 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 108 8.8 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 . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 113 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 137 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 359 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 1.7 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 3 8 1 0 5 1 1 2 7 8 4 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 12 5 11 4 0 4 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 . 0 0 0 0 8 4 4 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 . 4 0 0 4 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 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 4 A A 0 0 104 0, 0.0 263,-0.2 0, 0.0 262,-0.1 0.000 360.0 360.0 360.0 179.1 15.9 14.6 56.6 2 5 A G - 0 0 21 261,-1.3 52,-0.7 258,-0.1 2,-0.4 0.018 360.0-107.8 -58.8 168.9 13.2 12.0 57.3 3 6 A S E -a 54 0A 54 128,-0.2 131,-2.0 50,-0.1 130,-1.8 -0.803 28.1-157.1-112.4 132.3 10.6 12.4 60.0 4 7 A L E -ab 55 134A 1 50,-3.0 52,-2.7 -2,-0.4 2,-0.5 -0.963 7.9-167.2-116.6 129.7 10.5 10.3 63.2 5 8 A V E -ab 56 135A 2 129,-2.6 131,-2.7 -2,-0.4 2,-0.4 -0.973 8.5-168.5-110.4 122.3 7.6 9.5 65.5 6 9 A V E -ab 57 136A 0 50,-2.7 52,-3.3 -2,-0.5 2,-0.4 -0.855 2.3-171.7-103.6 144.9 8.5 8.0 68.9 7 10 A L E +ab 58 137A 0 129,-2.0 131,-0.7 -2,-0.4 2,-0.3 -0.983 34.3 92.1-140.8 122.4 5.7 6.5 71.0 8 11 A G - 0 0 0 50,-1.9 52,-0.4 -2,-0.4 2,-0.1 -0.972 62.1 -40.1 174.2-169.1 6.3 5.5 74.6 9 12 A S - 0 0 1 -2,-0.3 33,-2.5 50,-0.1 2,-0.4 -0.383 27.4-151.9 -90.5 162.4 6.3 6.3 78.3 10 13 A I + 0 0 1 50,-0.4 83,-0.5 31,-0.2 2,-0.3 -0.995 24.1 171.0-127.7 125.9 7.2 9.2 80.4 11 14 A N E -Ij 38 93B 4 27,-1.7 27,-3.0 -2,-0.4 2,-0.6 -0.928 36.2-129.8-125.9 158.8 8.4 8.7 84.0 12 15 A A E -Ij 37 94B 4 81,-1.6 83,-2.7 -2,-0.3 2,-0.5 -0.958 37.2-144.0 -96.7 121.7 9.9 10.7 86.9 13 16 A D E -Ij 36 95B 8 23,-4.0 23,-2.3 -2,-0.6 2,-0.6 -0.762 14.7-164.7 -91.6 126.8 12.9 8.6 88.0 14 17 A H E -Ij 35 96B 20 81,-2.7 83,-2.9 -2,-0.5 2,-0.5 -0.956 17.6-168.7-107.7 116.6 13.9 8.4 91.6 15 18 A I E -Ij 34 97B 1 19,-3.4 19,-2.0 -2,-0.6 2,-0.6 -0.900 13.0-177.2-118.2 121.1 17.4 7.0 91.8 16 19 A L E -Ij 33 98B 1 81,-2.7 83,-2.2 -2,-0.5 2,-0.4 -0.937 14.4-150.6-117.9 117.0 19.3 5.7 94.8 17 20 A N E +Ij 32 99B 26 15,-2.7 14,-2.4 -2,-0.6 15,-0.8 -0.727 28.6 162.7 -81.7 128.1 22.9 4.5 94.6 18 21 A L - 0 0 4 81,-2.8 12,-0.1 -2,-0.4 3,-0.1 -0.849 46.5-117.4-136.7 175.0 23.8 1.9 97.2 19 22 A Q S S+ 0 0 159 10,-0.4 82,-2.6 1,-0.3 2,-0.3 0.964 97.0 6.0 -75.7 -59.9 26.5 -0.7 97.8 20 23 A S S S- 0 0 83 80,-0.2 -1,-0.3 81,-0.1 3,-0.1 -0.942 84.2-103.4-124.5 145.1 24.2 -3.8 97.7 21 24 A F - 0 0 38 -2,-0.3 395,-0.0 -3,-0.1 84,-0.0 -0.425 48.3-105.0 -56.4 136.0 20.6 -4.2 96.8 22 25 A P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.376 33.0-136.4 -58.6 145.6 18.5 -4.7 99.9 23 26 A T > - 0 0 77 1,-0.2 3,-2.8 392,-0.1 392,-0.2 -0.719 48.4 -58.7-102.2 165.0 17.4 -8.4 100.4 24 27 A P T 3 S+ 0 0 73 0, 0.0 390,-0.2 0, 0.0 -1,-0.2 -0.026 128.7 9.8 -52.5 133.3 13.8 -9.1 101.5 25 28 A G T 3 S+ 0 0 52 388,-2.5 389,-0.2 1,-0.3 2,-0.1 0.373 106.9 122.7 77.9 -3.8 13.0 -7.5 104.8 26 29 A E < - 0 0 80 -3,-2.8 389,-1.7 387,-0.2 2,-0.4 -0.426 48.6-153.8 -94.0 165.0 16.2 -5.5 104.7 27 30 A T E -m 415 0C 27 387,-0.2 2,-0.3 -2,-0.1 389,-0.2 -0.986 13.3-176.9-136.0 125.9 17.0 -1.7 104.7 28 31 A V E -m 416 0C 29 387,-2.1 389,-2.4 -2,-0.4 2,-0.4 -0.903 20.6-133.6-122.1 153.3 20.0 -0.2 103.2 29 32 A T E -m 417 0C 83 -2,-0.3 -10,-0.4 387,-0.2 389,-0.2 -0.896 23.8-144.0-104.6 134.3 21.2 3.4 103.2 30 33 A G - 0 0 15 387,-3.0 389,-0.4 -2,-0.4 -12,-0.3 -0.323 10.3-142.1 -94.1 175.4 22.4 4.9 99.8 31 34 A N S S+ 0 0 93 -14,-2.4 2,-0.3 1,-0.4 -13,-0.1 0.457 83.3 23.9-118.3 -9.9 25.2 7.4 99.0 32 35 A H E -I 17 0B 109 -15,-0.8 -15,-2.7 2,-0.0 -1,-0.4 -0.946 61.5-169.9-155.2 144.8 23.6 9.5 96.3 33 36 A Y E +I 16 0B 55 -2,-0.3 2,-0.3 -17,-0.2 -17,-0.2 -0.990 8.5 179.6-138.1 137.2 20.0 10.2 95.4 34 37 A Q E -I 15 0B 51 -19,-2.0 -19,-3.4 -2,-0.3 2,-0.5 -0.999 18.9-155.1-145.2 143.3 18.6 11.9 92.3 35 38 A V E +I 14 0B 75 -2,-0.3 2,-0.3 -21,-0.2 -21,-0.2 -0.974 35.6 145.8-114.7 119.2 15.3 12.8 90.8 36 39 A A E -I 13 0B 15 -23,-2.3 -23,-4.0 -2,-0.5 2,-0.3 -0.969 52.2 -82.8-150.3 167.6 15.1 13.2 87.1 37 40 A F E +I 12 0B 43 -2,-0.3 252,-1.7 -25,-0.2 -25,-0.2 -0.552 58.4 148.5 -74.8 130.6 13.0 12.7 84.0 38 41 A G E +I 11 0B 0 -27,-3.0 -27,-1.7 -2,-0.3 4,-0.2 -0.506 9.7 132.0-138.7-149.0 13.1 9.1 82.7 39 42 A G > - 0 0 5 -29,-0.3 4,-3.3 -2,-0.2 5,-0.3 0.372 60.5-108.9 92.5 124.8 10.8 6.7 80.9 40 43 A K H > S+ 0 0 38 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.882 116.7 47.3 -54.7 -46.1 12.0 4.7 77.9 41 44 A G H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.956 115.4 44.4 -63.4 -48.8 9.9 6.6 75.3 42 45 A A H > S+ 0 0 0 -33,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.896 113.0 51.4 -63.7 -37.7 10.9 10.0 76.6 43 46 A N H X S+ 0 0 5 -4,-3.3 4,-2.5 -34,-0.3 -1,-0.2 0.927 113.6 45.1 -64.4 -42.9 14.6 9.0 76.9 44 47 A Q H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.3 -2,-0.2 0.841 111.8 51.5 -67.8 -33.0 14.5 7.7 73.4 45 48 A A H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.911 111.6 48.3 -71.0 -37.9 12.7 10.8 72.1 46 49 A V H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.4 0.908 108.6 52.3 -70.9 -41.8 15.3 13.0 73.8 47 50 A A H X S+ 0 0 1 -4,-2.5 4,-1.3 -5,-0.2 -1,-0.2 0.911 114.3 44.6 -57.6 -42.7 18.2 11.1 72.4 48 51 A A H X>S+ 0 0 0 -4,-2.0 5,-2.4 2,-0.2 4,-0.7 0.960 116.0 46.2 -62.5 -52.3 16.6 11.5 68.9 49 52 A G H ><5S+ 0 0 1 -4,-3.0 3,-1.5 1,-0.2 -2,-0.2 0.941 114.8 44.3 -57.9 -51.0 15.8 15.2 69.5 50 53 A R H 3<5S+ 0 0 22 -4,-3.0 245,-2.2 1,-0.3 -1,-0.2 0.809 109.2 59.4 -69.5 -25.5 19.2 16.2 70.9 51 54 A S H 3<5S- 0 0 1 -4,-1.3 -1,-0.3 -5,-0.4 -2,-0.2 0.609 125.9-100.1 -75.3 -16.8 20.9 14.1 68.2 52 55 A G T <<5 + 0 0 33 -3,-1.5 -3,-0.2 -4,-0.7 -2,-0.1 0.598 69.7 147.5 106.9 16.8 19.2 16.3 65.6 53 56 A A < - 0 0 8 -5,-2.4 2,-1.3 -6,-0.1 -1,-0.2 -0.421 55.5-119.1 -76.8 152.5 16.2 14.3 64.4 54 57 A N E +a 3 0A 80 -52,-0.7 -50,-3.0 -2,-0.1 2,-0.4 -0.766 57.1 169.4 -83.1 94.4 12.8 15.7 63.2 55 58 A I E -ac 4 79A 8 -2,-1.3 25,-2.5 23,-0.6 2,-0.3 -0.922 31.5-169.2-123.9 137.1 10.9 13.9 65.9 56 59 A A E -ac 5 80A 8 -52,-2.7 -50,-2.7 -2,-0.4 2,-0.5 -0.927 19.3-141.7-114.5 149.3 7.4 14.0 67.3 57 60 A F E -a 6 0A 0 23,-2.1 2,-0.6 -2,-0.3 -50,-0.2 -0.907 7.3-161.1-120.0 113.9 6.5 12.1 70.5 58 61 A I E +a 7 0A 5 -52,-3.3 -50,-1.9 -2,-0.5 2,-0.3 -0.859 43.8 115.7 -93.3 121.6 3.2 10.3 71.2 59 62 A A E -q 84 0D 1 24,-1.1 26,-3.2 -2,-0.6 2,-0.4 -0.966 52.0-116.9-169.8 177.1 2.8 9.8 75.0 60 63 A C E -q 85 0D 2 -52,-0.4 -50,-0.4 -2,-0.3 2,-0.3 -0.991 17.2-173.6-134.5 131.2 0.7 10.7 78.0 61 64 A T E -q 86 0D 0 24,-2.6 26,-2.6 -2,-0.4 31,-0.1 -0.804 30.7-109.8-108.7 167.3 1.4 12.6 81.2 62 65 A G E -q 87 0D 0 -2,-0.3 29,-0.2 24,-0.2 26,-0.2 -0.256 34.6-102.5 -77.8 178.9 -0.9 12.9 84.2 63 66 A D S S+ 0 0 83 27,-1.9 28,-0.1 24,-0.7 2,-0.1 0.046 85.7 106.7 -94.9 28.5 -2.6 16.2 85.1 64 67 A D S > S- 0 0 49 26,-0.2 4,-1.1 1,-0.1 27,-0.0 -0.307 85.4 -96.8-103.3-176.8 -0.2 16.9 87.9 65 68 A S H > S+ 0 0 100 2,-0.2 4,-2.3 1,-0.2 3,-0.5 0.935 120.7 53.9 -70.2 -46.2 2.7 19.4 88.4 66 69 A I H > S+ 0 0 60 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.931 106.2 54.1 -53.4 -41.3 5.4 16.9 87.5 67 70 A G H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.854 107.6 52.3 -63.0 -30.6 3.6 16.3 84.2 68 71 A E H X S+ 0 0 83 -4,-1.1 4,-1.8 -3,-0.5 -1,-0.2 0.939 108.9 47.5 -67.6 -46.9 3.7 19.9 83.6 69 72 A S H X S+ 0 0 59 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.922 109.8 52.4 -61.9 -46.7 7.4 20.3 84.2 70 73 A V H X S+ 0 0 1 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.932 106.7 53.9 -61.5 -42.3 8.3 17.3 81.9 71 74 A R H X S+ 0 0 47 -4,-1.8 4,-1.6 -5,-0.3 -1,-0.2 0.943 109.0 48.0 -57.8 -41.2 6.3 18.7 79.1 72 75 A Q H X S+ 0 0 106 -4,-1.8 4,-0.9 1,-0.2 -1,-0.2 0.877 113.3 48.4 -67.0 -36.5 8.2 22.0 79.3 73 76 A Q H >X S+ 0 0 67 -4,-2.1 3,-1.0 1,-0.2 4,-0.5 0.941 106.4 55.7 -68.0 -44.4 11.5 20.2 79.4 74 77 A L H ><>S+ 0 0 0 -4,-3.1 3,-1.4 1,-0.3 5,-0.7 0.855 101.5 58.7 -57.6 -34.0 10.6 18.0 76.4 75 78 A A H ><5S+ 0 0 52 -4,-1.6 3,-0.8 1,-0.3 4,-0.4 0.845 103.1 52.5 -69.4 -27.6 9.9 21.0 74.3 76 79 A T H <<5S+ 0 0 91 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.518 94.4 72.8 -84.1 -1.6 13.4 22.3 74.8 77 80 A D T <<5S- 0 0 1 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.1 0.140 119.8 -98.3 -97.7 21.4 14.9 19.0 73.7 78 81 A N T < 5S+ 0 0 89 -3,-0.8 -23,-0.6 1,-0.2 2,-0.4 0.876 82.6 133.8 69.2 38.0 14.1 19.6 70.0 79 82 A I E < -c 55 0A 10 -5,-0.7 2,-0.8 -4,-0.4 -1,-0.2 -0.973 59.2-131.1-124.7 137.2 10.9 17.4 70.2 80 83 A D E -c 56 0A 63 -25,-2.5 -23,-2.1 -2,-0.4 -5,-0.1 -0.778 25.0-178.7 -86.9 109.4 7.4 18.2 68.9 81 84 A I > + 0 0 45 -2,-0.8 3,-1.9 1,-0.2 -1,-0.1 0.161 46.5 114.2-100.9 14.0 5.2 17.4 71.9 82 85 A T T 3 S+ 0 0 105 1,-0.3 -1,-0.2 -24,-0.0 -24,-0.1 0.788 79.1 48.4 -48.1 -40.1 1.9 18.2 70.1 83 86 A P T 3 S+ 0 0 2 0, 0.0 -24,-1.1 0, 0.0 2,-0.8 0.247 81.8 112.5 -89.9 13.9 0.8 14.6 70.4 84 87 A V E < -q 59 0D 15 -3,-1.9 -24,-0.2 -26,-0.2 2,-0.2 -0.786 59.7-153.3 -85.6 109.0 1.7 14.4 74.1 85 88 A S E -q 60 0D 39 -26,-3.2 -24,-2.6 -2,-0.8 2,-0.5 -0.504 9.8-137.3 -86.1 158.3 -1.7 14.0 75.8 86 89 A V E -q 61 0D 69 -26,-0.2 2,-0.8 -2,-0.2 -24,-0.2 -0.950 15.5-149.0-114.2 119.1 -2.8 15.1 79.3 87 90 A I E > -q 62 0D 39 -26,-2.6 3,-1.4 -2,-0.5 -24,-0.7 -0.776 15.8-132.0 -97.9 113.1 -4.9 12.5 81.1 88 91 A K T 3 S+ 0 0 187 -2,-0.8 3,-0.1 1,-0.2 -24,-0.0 -0.307 87.6 11.1 -58.5 139.0 -7.4 14.1 83.6 89 92 A G T 3 S+ 0 0 73 1,-0.2 2,-0.3 -26,-0.1 -1,-0.2 0.655 106.5 109.1 71.7 15.9 -7.4 12.6 87.0 90 93 A E < - 0 0 65 -3,-1.4 -27,-1.9 -29,-0.1 2,-0.2 -0.873 62.4-127.5-125.7 153.5 -4.3 10.5 86.4 91 94 A S - 0 0 45 -2,-0.3 22,-2.6 -29,-0.2 2,-0.3 -0.680 29.9-103.1 -99.4 156.6 -0.7 10.8 87.8 92 95 A T - 0 0 2 -2,-0.2 20,-0.2 20,-0.2 -80,-0.1 -0.576 51.1 -91.3 -73.0 140.0 2.5 10.9 85.7 93 96 A G E -j 11 0B 1 -83,-0.5 -81,-1.6 18,-0.4 2,-0.3 -0.036 42.2-157.8 -47.3 150.1 4.4 7.7 85.7 94 97 A V E -jK 12 110B 15 16,-2.1 16,-3.1 -83,-0.3 2,-0.4 -0.982 6.9-161.0-132.8 141.6 7.1 7.1 88.3 95 98 A A E -jK 13 109B 2 -83,-2.7 -81,-2.7 -2,-0.3 2,-0.5 -0.994 4.6-157.9-121.7 137.9 10.1 4.8 88.4 96 99 A L E -jK 14 108B 2 12,-3.5 12,-3.0 -2,-0.4 2,-0.4 -0.982 20.6-173.1-115.2 121.8 11.9 3.8 91.6 97 100 A I E -jK 15 107B 5 -83,-2.9 -81,-2.7 -2,-0.5 2,-0.4 -0.957 17.6-168.0-126.0 126.7 15.5 2.7 90.8 98 101 A F E -jK 16 106B 3 8,-1.9 8,-1.8 -2,-0.4 2,-0.4 -0.965 9.2-166.6-108.0 133.9 18.2 1.2 92.9 99 102 A V E -jK 17 105B 10 -83,-2.2 -81,-2.8 -2,-0.4 6,-0.3 -0.986 11.2-148.6-121.9 124.7 21.8 1.0 91.5 100 103 A N > - 0 0 20 4,-3.0 3,-1.0 -2,-0.4 -80,-0.2 -0.135 34.9 -87.4 -88.6-179.2 24.4 -1.1 93.2 101 104 A G T 3 S+ 0 0 58 -82,-2.6 -81,-0.1 1,-0.3 -82,-0.1 0.746 127.7 49.0 -61.9 -24.3 28.2 -0.9 93.5 102 105 A E T 3 S- 0 0 150 -83,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.688 120.4-105.6 -82.3 -23.5 28.7 -2.7 90.2 103 106 A G S < S+ 0 0 24 -3,-1.0 144,-0.3 1,-0.4 2,-0.1 0.420 74.2 137.9 106.1 -4.0 26.3 -0.5 88.3 104 107 A E - 0 0 92 -5,-0.1 -4,-3.0 143,-0.0 -1,-0.4 -0.488 34.5-164.0 -68.5 148.3 23.5 -3.0 88.1 105 108 A N E -K 99 0B 26 -6,-0.3 228,-1.5 -2,-0.1 2,-0.3 -0.938 17.5-154.7-130.1 153.3 20.0 -1.6 88.7 106 109 A V E -K 98 0B 9 -8,-1.8 -8,-1.9 -2,-0.3 2,-0.4 -0.930 19.8-154.1-118.7 155.0 16.6 -2.9 89.5 107 110 A I E -Kl 97 335B 26 227,-1.7 229,-2.5 -2,-0.3 2,-0.4 -0.987 13.6-168.9-137.8 124.1 13.6 -0.8 88.5 108 111 A G E -Kl 96 336B 0 -12,-3.0 -12,-3.5 -2,-0.4 2,-0.4 -0.934 18.4-159.2-107.4 133.0 10.0 -0.6 89.9 109 112 A I E -Kl 95 337B 11 227,-2.8 229,-2.9 -2,-0.4 2,-0.6 -0.919 20.7-158.4-122.5 133.7 7.5 1.4 87.9 110 113 A H E -K 94 0B 31 -16,-3.1 -16,-2.1 -2,-0.4 4,-0.1 -0.953 17.8-157.0-100.9 116.6 4.2 3.0 88.6 111 114 A A > + 0 0 28 -2,-0.6 3,-1.8 227,-0.4 -18,-0.4 0.894 30.1 156.7 -63.8 -44.9 2.5 3.2 85.2 112 115 A G G > S- 0 0 7 1,-0.3 3,-1.4 2,-0.2 -20,-0.2 -0.247 74.6 -2.1 48.4-128.2 0.1 6.1 86.0 113 116 A A G > S+ 0 0 0 -22,-2.6 3,-2.0 1,-0.3 -1,-0.3 0.668 120.0 78.1 -67.3 -17.9 -0.9 7.9 82.8 114 117 A N G X S+ 0 0 6 -3,-1.8 3,-1.4 1,-0.3 -1,-0.3 0.845 88.4 59.0 -60.0 -32.7 1.3 5.7 80.6 115 118 A A G < S+ 0 0 67 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.606 94.7 67.0 -69.0 -10.6 -1.4 3.0 80.9 116 119 A A G < + 0 0 31 -3,-2.0 2,-1.2 -4,-0.2 -1,-0.3 0.318 66.6 108.3 -95.3 8.6 -3.8 5.5 79.3 117 120 A L < + 0 0 1 -3,-1.4 28,-0.2 -57,-0.1 -57,-0.1 -0.740 59.3 178.5 -86.3 98.5 -2.1 5.5 76.0 118 121 A S > - 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0 0 38 -6,-0.4 -1,-0.2 7,-0.1 -2,-0.2 -0.813 60.5-133.1 -97.4 118.9 21.6 -16.8 117.4 503 198 B R - 0 0 162 -2,-0.6 2,-0.6 -6,-0.1 10,-0.1 -0.380 19.4-148.2 -59.6 131.7 19.0 -17.7 114.8 504 199 B V + 0 0 2 -11,-0.3 3,-0.1 1,-0.1 -7,-0.1 -0.892 41.6 139.5-113.1 108.0 15.5 -17.3 116.2 505 200 B E S S+ 0 0 88 -2,-0.6 2,-0.3 1,-0.3 -1,-0.1 0.567 71.6 9.2-115.1 -16.0 12.8 -19.7 114.9 506 201 B N S > S- 0 0 66 1,-0.0 4,-2.1 0, 0.0 -1,-0.3 -0.939 88.9 -83.4-158.5 171.9 10.9 -20.5 118.1 507 202 B D H > S+ 0 0 67 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.829 123.0 57.3 -58.4 -29.9 10.5 -19.5 121.7 508 203 B E H > S+ 0 0 136 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.945 108.0 45.3 -67.0 -52.0 13.4 -21.7 122.7 509 204 B D H > S+ 0 0 32 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.848 110.3 57.2 -48.5 -40.2 15.8 -19.9 120.4 510 205 B A H X S+ 0 0 0 -4,-2.1 4,-3.4 1,-0.2 5,-0.2 0.963 101.8 54.7 -66.2 -43.0 14.3 -16.7 121.6 511 206 B A H X S+ 0 0 43 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.872 110.6 45.9 -53.7 -39.9 15.3 -17.6 125.2 512 207 B K H X S+ 0 0 120 -4,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.921 112.8 48.9 -70.9 -43.6 18.9 -18.1 124.1 513 208 B A H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.937 112.1 49.7 -64.8 -43.8 19.0 -14.9 122.1 514 209 B A H X S+ 0 0 0 -4,-3.4 4,-3.3 -5,-0.2 3,-0.3 0.944 104.8 58.4 -59.0 -46.9 17.5 -12.9 125.0 515 210 B Q H X S+ 0 0 123 -4,-2.3 4,-2.9 1,-0.3 5,-0.3 0.905 104.4 50.1 -50.7 -47.5 20.0 -14.4 127.5 516 211 B V H X S+ 0 0 42 -4,-1.9 4,-1.3 1,-0.2 -1,-0.3 0.898 113.2 47.1 -58.0 -40.7 22.9 -13.0 125.5 517 212 B L H <>S+ 0 0 0 -4,-1.5 5,-1.8 -3,-0.3 -2,-0.2 0.906 111.7 50.5 -69.4 -41.1 21.2 -9.6 125.4 518 213 B H H ><5S+ 0 0 21 -4,-3.3 3,-1.8 1,-0.2 -2,-0.2 0.907 108.6 51.1 -61.3 -43.1 20.5 -9.8 129.2 519 214 B E H 3<5S+ 0 0 157 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.778 101.1 63.3 -67.4 -25.3 24.1 -10.7 129.9 520 215 B K T 3<5S- 0 0 65 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.561 132.8 -91.0 -73.8 -5.3 25.1 -7.7 127.9 521 216 B G T < 5S+ 0 0 40 -3,-1.8 2,-0.8 1,-0.2 -3,-0.2 0.399 84.4 132.3 116.9 0.5 23.3 -5.6 130.5 522 217 B I < - 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