==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-AUG-11 3TAU . COMPND 2 MOLECULE: GUANYLATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES; . AUTHOR J.S.BRUNZELLE,Z.WAWRZAK,O.ONOPRIYENKO,J.KWOK,W.F.ANDERSON, . 376 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21149.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 279 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 46 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 6.9 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 . 4 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 . 31 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 136 36.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 0 0 0 0 4 4 1 1 1 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 0 6 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 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 2 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 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 2 A T 0 0 114 0, 0.0 2,-0.2 0, 0.0 94,-0.1 0.000 360.0 360.0 360.0 112.0 16.9 31.4 74.3 2 3 A E - 0 0 83 93,-0.1 2,-0.1 92,-0.1 184,-0.0 -0.567 360.0 -95.2 -75.8 145.3 15.5 32.3 70.8 3 4 A R - 0 0 96 -2,-0.2 90,-0.2 182,-0.1 89,-0.1 -0.400 39.0-125.2 -66.3 134.3 11.9 31.1 70.1 4 5 A G - 0 0 2 88,-3.3 2,-0.3 87,-0.2 93,-0.2 -0.240 20.9-123.3 -70.4 164.2 11.5 27.8 68.2 5 6 A L - 0 0 10 90,-0.1 93,-2.5 112,-0.0 2,-0.6 -0.865 8.4-131.4-112.0 145.9 9.5 27.5 65.0 6 7 A L E -a 98 0A 1 -2,-0.3 112,-3.2 110,-0.2 2,-0.5 -0.888 25.0-163.3 -92.3 118.0 6.6 25.2 64.2 7 8 A I E -ab 99 118A 0 91,-3.1 93,-2.9 -2,-0.6 2,-0.6 -0.947 3.7-167.8-108.4 118.0 7.3 23.4 60.9 8 9 A V E -ab 100 119A 0 110,-3.2 112,-3.2 -2,-0.5 2,-0.6 -0.936 2.8-166.2-113.4 117.7 4.3 21.8 59.2 9 10 A L E +ab 101 120A 0 91,-3.2 93,-2.5 -2,-0.6 2,-0.2 -0.894 23.5 149.5-104.0 121.6 4.9 19.5 56.3 10 11 A S E + b 0 121A 0 110,-2.7 112,-3.2 -2,-0.6 93,-0.1 -0.631 2.8 136.1-134.0-168.6 1.8 18.6 54.3 11 12 A G - 0 0 1 91,-0.2 93,-0.4 110,-0.2 112,-0.1 -0.647 58.8 -41.4 140.4 166.4 0.9 17.7 50.7 12 13 A P > - 0 0 29 0, 0.0 3,-1.9 0, 0.0 5,-0.3 -0.139 69.5 -87.6 -64.4 153.8 -1.4 15.1 48.9 13 14 A S T 3 S+ 0 0 123 1,-0.3 90,-0.0 2,-0.1 0, 0.0 -0.346 116.3 25.2 -55.8 132.2 -1.7 11.5 50.0 14 15 A G T 3 S+ 0 0 81 -3,-0.1 -1,-0.3 110,-0.0 -3,-0.0 0.352 86.0 112.8 89.4 -4.1 1.0 9.3 48.4 15 16 A V S < S- 0 0 15 -3,-1.9 -2,-0.1 107,-0.1 108,-0.0 0.709 93.3-104.1 -73.4 -21.2 3.5 12.3 47.8 16 17 A G > + 0 0 20 -4,-0.2 4,-2.6 -5,-0.1 5,-0.2 0.696 68.9 147.7 104.6 27.3 5.9 10.8 50.4 17 18 A K H > S+ 0 0 16 -5,-0.3 4,-2.8 1,-0.2 5,-0.1 0.899 76.2 48.1 -56.0 -47.7 5.4 13.0 53.5 18 19 A G H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.917 113.1 46.7 -60.0 -47.3 6.1 10.0 55.9 19 20 A T H > S+ 0 0 79 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.903 114.6 47.3 -63.0 -43.4 9.3 9.0 54.0 20 21 A V H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.923 111.8 50.4 -66.2 -43.9 10.5 12.7 53.9 21 22 A R H X S+ 0 0 69 -4,-2.8 4,-2.1 -5,-0.2 -2,-0.2 0.925 110.8 49.1 -59.9 -47.2 9.7 13.2 57.6 22 23 A E H X S+ 0 0 108 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.914 113.4 46.9 -56.5 -46.4 11.7 10.0 58.5 23 24 A A H X S+ 0 0 29 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.871 108.7 55.0 -66.3 -37.6 14.7 11.2 56.4 24 25 A V H < S+ 0 0 0 -4,-2.6 6,-0.3 1,-0.2 -1,-0.2 0.926 111.8 44.4 -60.0 -45.6 14.5 14.7 58.0 25 26 A F H < S+ 0 0 33 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.782 111.7 52.9 -71.7 -26.8 14.8 13.1 61.5 26 27 A K H < S+ 0 0 181 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.754 84.3 104.5 -75.8 -29.0 17.6 10.7 60.4 27 28 A D S >< S- 0 0 33 -4,-1.6 3,-1.4 -3,-0.2 -3,-0.0 -0.367 70.5-142.7 -56.6 122.6 19.7 13.7 59.0 28 29 A P T 3 S+ 0 0 129 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.667 95.7 60.2 -65.4 -12.1 22.5 14.4 61.5 29 30 A E T 3 S+ 0 0 139 -5,-0.1 2,-0.2 2,-0.0 -2,-0.1 0.596 86.9 88.2 -90.1 -13.4 22.2 18.2 61.0 30 31 A T < - 0 0 25 -3,-1.4 143,-0.0 -6,-0.3 -5,-0.0 -0.558 48.0-174.3 -89.5 152.5 18.6 18.6 62.1 31 32 A S + 0 0 107 -2,-0.2 66,-0.4 2,-0.1 2,-0.2 -0.168 32.1 143.5-136.3 43.0 17.5 19.2 65.7 32 33 A F - 0 0 20 -8,-0.1 2,-0.4 64,-0.1 66,-0.2 -0.516 42.6-138.7 -81.0 152.9 13.7 19.0 65.5 33 34 A D E -c 98 0A 58 64,-2.4 66,-2.2 -2,-0.2 2,-0.1 -0.907 26.4-118.7-100.6 139.3 11.4 17.6 68.2 34 35 A Y E -c 99 0A 141 -2,-0.4 2,-0.4 64,-0.2 66,-0.2 -0.490 31.9-107.4 -70.9 145.1 8.5 15.5 66.9 35 36 A S - 0 0 24 64,-1.2 2,-0.5 -2,-0.1 66,-0.1 -0.658 32.7-143.5 -76.0 125.0 5.1 16.8 67.8 36 37 A I - 0 0 29 -2,-0.4 2,-0.2 48,-0.1 17,-0.1 -0.824 16.0-138.0 -91.0 128.3 3.6 14.5 70.5 37 38 A S - 0 0 34 15,-0.5 17,-2.1 -2,-0.5 2,-0.3 -0.570 4.7-129.5 -89.2 153.1 -0.2 14.0 70.2 38 39 A X E +fG 54 82B 9 44,-3.2 44,-2.2 15,-0.2 2,-0.3 -0.758 32.2 179.2 -92.5 142.3 -2.8 14.0 72.9 39 40 A T E -fG 55 81B 0 15,-2.4 17,-2.7 -2,-0.3 42,-0.2 -0.985 35.3-149.6-143.8 155.3 -5.2 11.1 73.0 40 41 A T S S+ 0 0 19 40,-1.7 18,-0.2 -2,-0.3 41,-0.1 0.484 72.6 99.9-100.4 -7.0 -8.1 9.8 75.0 41 42 A R S S- 0 0 21 39,-0.5 15,-0.2 1,-0.1 -2,-0.1 -0.389 82.1-104.7 -74.6 158.2 -7.3 6.1 74.3 42 43 A L - 0 0 136 1,-0.1 -1,-0.1 13,-0.1 -2,-0.1 -0.461 44.9 -85.5 -81.6 157.0 -5.4 4.2 77.0 43 44 A P - 0 0 68 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.302 38.9-144.3 -65.4 147.0 -1.7 3.3 76.7 44 45 A R > - 0 0 136 1,-0.2 3,-1.8 4,-0.0 2,-0.1 -0.319 48.2 -52.7 -93.8-177.8 -0.6 0.2 74.8 45 46 A E T 3 S+ 0 0 202 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 -0.396 127.7 7.5 -62.3 126.4 2.4 -2.1 75.6 46 47 A G T 3 S+ 0 0 76 1,-0.2 2,-0.3 -2,-0.1 -1,-0.3 0.433 95.7 134.8 80.4 3.7 5.6 -0.0 75.9 47 48 A E < - 0 0 45 -3,-1.8 2,-0.4 4,-0.0 -1,-0.2 -0.677 35.3-164.4 -89.4 139.5 3.8 3.4 75.7 48 49 A Q >>> - 0 0 122 -2,-0.3 4,-2.3 -3,-0.1 3,-1.5 -0.971 23.6-114.4-123.9 137.5 4.7 6.2 78.1 49 50 A D B 345S+i 53 0C 88 -2,-0.4 5,-0.2 1,-0.2 0, 0.0 -0.455 104.4 20.0 -67.9 138.0 2.8 9.4 78.8 50 51 A G T 345S+ 0 0 33 3,-2.4 -1,-0.2 -2,-0.1 4,-0.2 0.371 126.7 56.4 83.1 -4.4 4.7 12.5 77.7 51 52 A V T <45S+ 0 0 86 -3,-1.5 -2,-0.2 2,-0.6 -1,-0.1 0.671 121.7 12.9-118.3 -64.4 6.9 10.4 75.3 52 53 A D T <5S- 0 0 72 -4,-2.3 -15,-0.5 1,-0.3 2,-0.3 0.871 135.7 -16.8 -84.5 -43.5 4.6 8.5 72.9 53 54 A Y B < -i 49 0C 56 -5,-1.0 -3,-2.4 -17,-0.1 2,-0.8 -0.938 61.4-109.1-151.8 165.0 1.3 10.4 73.7 54 55 A Y E -f 38 0B 19 -17,-2.1 -15,-2.4 -2,-0.3 2,-0.6 -0.950 42.0-150.2 -98.5 101.8 -0.2 12.8 76.2 55 56 A F E +f 39 0B 31 -2,-0.8 2,-0.3 -17,-0.2 -15,-0.2 -0.724 30.9 156.5 -80.7 115.8 -2.7 10.3 77.7 56 57 A R - 0 0 64 -17,-2.7 2,-0.1 -2,-0.6 -2,-0.0 -0.898 41.2 -99.8-135.0 166.4 -5.8 12.3 78.9 57 58 A S > - 0 0 62 -2,-0.3 4,-2.2 1,-0.1 5,-0.1 -0.390 35.8-109.8 -79.5 165.9 -9.5 11.8 79.7 58 59 A R H > S+ 0 0 97 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.889 119.5 56.3 -58.3 -42.7 -12.3 12.8 77.2 59 60 A E H > S+ 0 0 143 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.912 109.1 44.6 -58.2 -46.3 -13.3 15.6 79.7 60 61 A V H > S+ 0 0 72 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.914 114.9 49.2 -65.6 -44.0 -9.8 17.1 79.6 61 62 A F H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.920 112.3 46.4 -61.9 -47.9 -9.6 16.8 75.8 62 63 A E H X S+ 0 0 78 -4,-3.0 4,-2.7 2,-0.2 -1,-0.2 0.858 111.0 53.2 -64.5 -35.5 -13.1 18.4 75.2 63 64 A Q H X S+ 0 0 85 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.888 108.2 50.4 -66.0 -38.2 -12.2 21.2 77.7 64 65 A A H <>S+ 0 0 17 -4,-2.1 5,-2.9 2,-0.2 6,-0.4 0.914 111.7 48.2 -65.1 -40.5 -9.0 21.8 75.6 65 66 A I H ><5S+ 0 0 42 -4,-2.1 3,-1.7 1,-0.2 5,-0.3 0.958 112.9 47.7 -60.7 -54.5 -11.1 21.9 72.4 66 67 A K H 3<5S+ 0 0 167 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.821 110.9 51.7 -56.4 -38.5 -13.7 24.4 74.0 67 68 A D T 3<5S- 0 0 82 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.357 115.9-111.7 -84.8 6.3 -10.8 26.6 75.4 68 69 A G T < 5S+ 0 0 55 -3,-1.7 -3,-0.2 -4,-0.2 -2,-0.1 0.816 81.7 126.6 67.6 31.9 -9.1 27.0 71.9 69 70 A K < + 0 0 94 -5,-2.9 16,-3.2 -6,-0.2 2,-0.5 0.188 45.7 88.4-104.0 11.1 -6.1 24.9 73.1 70 71 A X E -H 84 0B 18 -6,-0.4 3,-0.1 -5,-0.3 -2,-0.0 -0.959 53.4-168.7-116.6 116.3 -6.2 22.3 70.3 71 72 A L E S- 0 0 7 12,-2.5 42,-0.3 -2,-0.5 2,-0.3 0.908 79.9 -12.8 -67.3 -43.3 -4.3 23.1 67.1 72 73 A E E S+H 83 0B 26 11,-0.8 11,-2.0 41,-0.1 2,-0.3 -0.969 73.0 169.5-152.0 153.2 -6.0 20.2 65.3 73 74 A Y E +H 82 0B 90 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.985 9.3 179.2-161.8 162.5 -8.1 17.2 66.4 74 75 A A E -H 81 0B 51 7,-2.2 7,-2.3 -2,-0.3 2,-0.5 -0.964 29.7-121.2-159.9 157.9 -10.3 14.4 65.3 75 76 A E E -H 80 0B 91 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.962 26.5-172.6-108.9 115.6 -12.2 11.5 66.8 76 77 A Y E > S-H 79 0B 171 3,-3.2 3,-0.5 -2,-0.5 -2,-0.0 -0.931 74.4 -25.1-116.2 96.5 -11.0 8.1 65.3 77 78 A V T 3 S- 0 0 125 -2,-0.5 -1,-0.1 1,-0.2 3,-0.1 0.851 127.5 -46.4 67.9 44.3 -13.3 5.2 66.5 78 79 A G T 3 S+ 0 0 38 1,-0.2 2,-0.5 -37,-0.0 -1,-0.2 0.431 120.6 108.5 80.3 -1.2 -14.6 7.1 69.8 79 80 A N E < - H 0 76B 47 -3,-0.5 -3,-3.2 -40,-0.0 2,-0.3 -0.932 64.3-137.1-110.7 130.0 -11.0 8.1 70.6 80 81 A Y E - H 0 75B 22 -2,-0.5 -40,-1.7 -5,-0.2 -39,-0.5 -0.638 20.5-178.2 -84.8 145.1 -9.8 11.7 70.3 81 82 A Y E +GH 39 74B 58 -7,-2.3 -7,-2.2 -2,-0.3 2,-0.3 -0.985 18.4 142.4-138.8 132.0 -6.4 12.4 68.8 82 83 A G E -GH 38 73B 0 -44,-2.2 -44,-3.2 -2,-0.3 -9,-0.2 -0.992 52.1-104.0-166.7 168.9 -5.0 15.9 68.5 83 84 A T E - H 0 72B 0 -11,-2.0 -12,-2.5 -2,-0.3 -11,-0.8 -0.895 41.9-140.8-101.6 108.6 -2.1 18.4 68.6 84 85 A P E > - H 0 70B 5 0, 0.0 4,-1.6 0, 0.0 -14,-0.3 -0.596 4.9-147.4 -79.4 132.8 -2.3 20.3 72.0 85 86 A L H > S+ 0 0 46 -16,-3.2 4,-3.2 -2,-0.3 5,-0.2 0.901 93.9 59.3 -59.0 -46.8 -1.5 24.1 71.9 86 87 A E H > S+ 0 0 127 -17,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.866 109.5 40.3 -53.0 -49.0 -0.0 24.1 75.5 87 88 A Y H > S+ 0 0 51 2,-0.2 4,-1.7 -3,-0.2 -1,-0.2 0.836 116.2 50.1 -74.5 -33.4 2.8 21.5 74.8 88 89 A V H X S+ 0 0 6 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.972 113.0 47.4 -66.3 -49.9 3.6 22.9 71.4 89 90 A E H X S+ 0 0 68 -4,-3.2 4,-2.9 1,-0.2 5,-0.2 0.880 108.6 54.6 -55.5 -45.1 3.9 26.5 72.9 90 91 A E H X S+ 0 0 126 -4,-2.0 4,-1.3 -5,-0.2 -1,-0.2 0.923 112.0 43.8 -56.3 -48.0 6.1 25.3 75.9 91 92 A K H <>S+ 0 0 49 -4,-1.7 5,-2.5 2,-0.2 -2,-0.2 0.873 114.7 48.7 -66.5 -39.7 8.6 23.7 73.4 92 93 A L H ><5S+ 0 0 0 -4,-2.4 -88,-3.3 1,-0.2 3,-1.8 0.932 110.9 49.9 -67.3 -43.6 8.6 26.7 71.1 93 94 A A H 3<5S+ 0 0 56 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.773 107.0 56.5 -63.5 -27.2 9.1 29.2 74.0 94 95 A A T 3<5S- 0 0 64 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.383 124.9-105.1 -86.2 4.4 12.0 27.0 75.2 95 96 A G T < 5S+ 0 0 28 -3,-1.8 2,-0.4 1,-0.3 -3,-0.2 0.613 74.5 137.2 84.5 16.5 13.7 27.4 71.8 96 97 A V < - 0 0 42 -5,-2.5 2,-0.3 -92,-0.1 -1,-0.3 -0.822 49.9-133.7 -97.7 132.5 13.0 24.0 70.2 97 98 A D - 0 0 21 -2,-0.4 -64,-2.4 -66,-0.4 2,-0.4 -0.625 20.4-149.6 -78.8 137.6 11.8 23.7 66.6 98 99 A I E -ac 6 33A 3 -93,-2.5 -91,-3.1 -2,-0.3 2,-0.5 -0.929 4.6-156.9-111.0 133.5 8.9 21.3 66.2 99 100 A F E -ac 7 34A 4 -66,-2.2 -64,-1.2 -2,-0.4 2,-0.4 -0.959 13.3-179.0-112.6 124.7 8.4 19.3 63.0 100 101 A L E -a 8 0A 17 -93,-2.9 -91,-3.2 -2,-0.5 2,-0.5 -0.991 12.5-162.9-128.7 125.8 4.9 18.1 62.3 101 102 A E E +a 9 0A 52 -2,-0.4 2,-0.3 -93,-0.2 -91,-0.2 -0.919 27.0 161.6-104.0 126.5 3.8 16.0 59.3 102 103 A I - 0 0 7 -93,-2.5 -91,-0.2 -2,-0.5 -2,-0.0 -0.983 41.4 -96.1-150.7 154.7 0.1 16.0 58.6 103 104 A E > - 0 0 133 -2,-0.3 4,-2.3 -93,-0.1 3,-0.2 -0.242 47.4-104.3 -62.8 158.4 -2.7 15.3 56.0 104 105 A V H > S+ 0 0 35 -93,-0.4 4,-1.5 1,-0.2 -1,-0.1 0.852 121.3 50.6 -59.7 -37.2 -4.0 18.3 54.0 105 106 A Q H > S+ 0 0 125 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.876 112.4 47.0 -70.5 -33.6 -7.3 18.5 56.0 106 107 A G H > S+ 0 0 9 1,-0.2 4,-1.9 2,-0.2 3,-0.3 0.880 107.4 58.0 -69.1 -39.3 -5.3 18.4 59.3 107 108 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.851 101.2 54.8 -61.3 -37.7 -2.9 21.1 58.0 108 109 A X H X S+ 0 0 68 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.868 106.9 51.1 -67.4 -32.0 -5.7 23.6 57.3 109 110 A Q H X S+ 0 0 74 -4,-1.0 4,-2.2 -3,-0.3 -2,-0.2 0.949 113.3 45.4 -65.9 -47.2 -6.9 23.2 61.0 110 111 A V H X S+ 0 0 0 -4,-1.9 4,-3.2 1,-0.2 -2,-0.2 0.883 111.2 53.8 -62.2 -42.0 -3.2 23.9 62.2 111 112 A R H < S+ 0 0 60 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.904 110.8 45.4 -60.9 -43.8 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11.3-145.9 -95.3 111.1 3.6 21.9 50.7 122 123 A L E - d 0 160A 0 -112,-3.2 39,-0.2 -2,-0.7 -105,-0.1 -0.679 23.9-151.6 -79.6 119.3 5.3 18.7 49.5 123 124 A T E - d 0 161A 0 37,-3.3 39,-2.5 -2,-0.6 -112,-0.0 -0.777 13.3-117.1-102.8 134.7 4.6 18.5 45.8 124 125 A P > - 0 0 14 0, 0.0 3,-1.2 0, 0.0 4,-0.4 -0.384 22.6-131.6 -62.0 140.4 4.3 15.5 43.4 125 126 A P T 3> S+ 0 0 59 0, 0.0 4,-0.6 0, 0.0 3,-0.4 0.730 103.2 68.2 -67.4 -16.6 7.0 15.6 40.7 126 127 A D T 34 S+ 0 0 100 1,-0.2 -3,-0.0 2,-0.2 0, 0.0 0.681 80.5 77.8 -72.5 -21.1 4.3 15.0 38.0 127 128 A L T X4 S+ 0 0 0 -3,-1.2 3,-1.0 1,-0.2 4,-0.2 0.911 99.6 39.5 -57.4 -45.6 2.8 18.5 38.6 128 129 A S T 34 S+ 0 0 53 -3,-0.4 3,-0.3 -4,-0.4 -1,-0.2 0.761 115.9 53.3 -74.2 -25.9 5.6 20.2 36.5 129 130 A E T 3< S+ 0 0 119 -4,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.141 77.2 108.6 -95.1 20.4 5.5 17.3 33.9 130 131 A L S < S+ 0 0 23 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.1 0.928 77.4 47.4 -62.6 -50.6 1.7 17.7 33.4 131 132 A K S S+ 0 0 94 -3,-0.3 2,-2.3 1,-0.2 -1,-0.2 0.839 97.1 73.9 -62.1 -34.7 1.9 19.2 29.8 132 133 A N 0 0 137 1,-0.2 -1,-0.2 -4,-0.2 -3,-0.0 -0.379 360.0 360.0 -78.1 59.6 4.4 16.5 28.8 133 134 A R 0 0 213 -2,-2.3 -1,-0.2 -3,-0.1 -2,-0.1 0.300 360.0 360.0-147.2 360.0 1.5 13.9 28.7 134 ! 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 0.0 135 142 A S 0 0 133 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 132.8 -9.7 14.5 26.2 136 143 A X > - 0 0 127 1,-0.1 4,-2.3 4,-0.0 5,-0.1 -0.323 360.0-121.8 -65.4 153.5 -9.8 11.3 28.4 137 144 A E H > S+ 0 0 155 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.832 117.5 53.5 -68.3 -27.1 -11.7 11.5 31.7 138 145 A V H > S+ 0 0 60 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.891 109.0 46.9 -71.2 -42.0 -8.3 10.6 33.4 139 146 A V H > S+ 0 0 52 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.905 113.6 49.4 -65.9 -43.2 -6.4 13.5 31.6 140 147 A E H X S+ 0 0 113 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.848 112.9 47.4 -60.7 -39.8 -9.3 15.8 32.7 141 148 A E H X S+ 0 0 127 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.884 110.6 51.3 -69.3 -43.2 -9.0 14.5 36.3 142 149 A R H X S+ 0 0 116 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.885 112.4 46.3 -62.5 -41.0 -5.1 14.9 36.2 143 150 A X H X S+ 0 0 81 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.859 113.1 49.7 -68.0 -39.3 -5.5 18.6 35.1 144 151 A E H X S+ 0 0 102 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.894 110.6 50.0 -65.8 -41.6 -8.3 19.2 37.7 145 152 A T H X S+ 0 0 69 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.939 110.8 50.4 -60.8 -47.7 -6.0 17.6 40.5 146 153 A A H X S+ 0 0 1 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.912 109.7 49.5 -56.8 -48.2 -3.1 19.9 39.3 147 154 A K H X S+ 0 0 120 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.898 112.9 47.1 -61.0 -42.7 -5.3 23.1 39.4 148 155 A K H X S+ 0 0 123 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.825 110.2 52.2 -70.5 -35.2 -6.6 22.2 43.0 149 156 A E H X S+ 0 0 23 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.910 111.4 47.4 -64.6 -41.9 -3.0 21.5 44.2 150 157 A I H < S+ 0 0 4 -4,-2.1 4,-0.5 2,-0.2 -2,-0.2 0.887 113.6 48.2 -66.4 -40.0 -1.9 24.9 42.9 151 158 A E H >< S+ 0 0 147 -4,-2.0 3,-1.3 1,-0.2 4,-0.3 0.932 111.9 49.1 -64.3 -47.4 -5.0 26.6 44.6 152 159 A X H >< S+ 0 0 49 -4,-2.7 3,-2.0 1,-0.3 -2,-0.2 0.898 101.1 66.6 -60.3 -27.7 -4.3 24.8 47.9 153 160 A X G >< S+ 0 0 0 -4,-1.8 3,-1.7 1,-0.3 -1,-0.3 0.634 82.8 73.4 -71.5 -23.2 -0.6 25.9 47.7 154 161 A A G < S+ 0 0 72 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.693 91.9 57.5 -66.1 -20.5 -1.6 29.6 48.1 155 162 A S G < S+ 0 0 51 -3,-2.0 -1,-0.3 -4,-0.3 2,-0.2 0.465 99.4 78.7 -84.6 -7.2 -2.3 28.8 51.8 156 163 A Y S < S- 0 0 4 -3,-1.7 211,-0.2 -4,-0.2 -36,-0.2 -0.617 71.4-142.0-105.6 164.2 1.3 27.6 52.3 157 164 A D S S+ 0 0 65 -38,-2.0 210,-1.7 1,-0.3 2,-0.3 0.842 84.5 14.4 -88.5 -40.6 4.6 29.4 52.7 158 165 A Y E -dE 120 366A 3 -39,-2.0 -37,-3.0 208,-0.3 2,-0.4 -0.942 58.8-151.2-136.7 152.5 6.8 27.1 50.6 159 166 A A E -d 121 0A 4 206,-2.0 2,-0.4 -2,-0.3 -37,-0.2 -0.999 15.1-172.6-126.4 126.8 6.3 24.3 48.1 160 167 A V E -d 122 0A 0 -39,-2.3 -37,-3.3 -2,-0.4 2,-0.3 -0.993 19.2-133.6-123.4 128.1 9.0 21.5 47.8 161 168 A V E -d 123 0A 38 -2,-0.4 2,-1.3 -39,-0.2 3,-0.4 -0.637 7.9-142.5 -80.5 133.2 9.0 18.9 45.0 162 169 A N + 0 0 22 -39,-2.5 3,-0.2 -2,-0.3 -1,-0.1 -0.590 54.0 135.6 -93.4 71.7 9.6 15.3 46.2 163 170 A D S S+ 0 0 85 -2,-1.3 2,-0.4 1,-0.4 -1,-0.2 0.916 84.3 5.0 -77.3 -50.2 11.7 14.4 43.1 164 171 A V S >> S- 0 0 79 -3,-0.4 4,-2.0 1,-0.1 3,-0.6 -0.994 74.2-132.8-135.0 132.0 14.3 12.6 45.3 165 172 A V H 3> S+ 0 0 45 -2,-0.4 4,-2.3 1,-0.2 3,-0.3 0.931 108.7 54.2 -53.6 -47.1 13.8 12.2 49.1 166 173 A A H 3> S+ 0 0 68 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.805 108.7 49.7 -54.4 -39.3 17.4 13.5 49.8 167 174 A N H <> S+ 0 0 66 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.873 109.4 49.7 -70.0 -42.1 16.7 16.7 47.7 168 175 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 -3,-0.3 -2,-0.2 0.897 111.0 51.2 -63.4 -39.6 13.4 17.4 49.5 169 176 A V H X S+ 0 0 7 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.929 109.5 50.0 -61.2 -45.6 15.3 17.0 52.9 170 177 A Q H X S+ 0 0 121 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.894 112.7 46.4 -63.4 -40.4 18.0 19.4 51.8 171 178 A K H X S+ 0 0 48 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.883 111.5 51.4 -68.7 -39.3 15.4 22.1 50.7 172 179 A I H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.930 110.4 48.5 -64.5 -44.1 13.5 21.7 54.0 173 180 A K H X S+ 0 0 26 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.889 111.8 51.2 -61.0 -40.8 16.7 22.2 56.0 174 181 A G H X S+ 0 0 15 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.882 108.8 50.6 -61.4 -42.9 17.4 25.2 53.9 175 182 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.947 112.5 45.4 -60.6 -50.6 13.9 26.6 54.5 176 183 A V H X S+ 0 0 9 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.901 114.6 48.0 -64.1 -43.1 14.2 26.2 58.3 177 184 A E H X S+ 0 0 72 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.920 111.8 50.3 -62.7 -43.8 17.7 27.7 58.4 178 185 A T H >< S+ 0 0 0 -4,-2.5 3,-1.1 1,-0.2 4,-0.5 0.908 106.5 54.6 -61.3 -45.2 16.6 30.7 56.3 179 186 A E H >< S+ 0 0 6 -4,-2.4 3,-1.0 1,-0.3 -1,-0.2 0.878 106.8 52.1 -58.1 -35.7 13.6 31.4 58.5 180 187 A H H 3< S+ 0 0 31 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.697 104.4 58.0 -73.8 -16.4 16.0 31.6 61.5 181 188 A L T << S+ 0 0 12 -3,-1.1 162,-2.3 -4,-0.8 -1,-0.2 0.485 74.4 122.4 -91.4 -2.5 18.2 34.1 59.6 182 189 A K B X> S-J 342 0D 49 -3,-1.0 4,-2.2 -4,-0.5 3,-0.8 -0.360 71.1-125.2 -59.8 134.6 15.3 36.7 59.1 183 190 A T H 3> S+ 0 0 1 158,-1.6 4,-3.4 1,-0.2 5,-0.3 0.817 107.3 62.9 -58.4 -33.2 16.4 40.0 60.7 184 191 A E H 3> S+ 0 0 138 157,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.923 112.4 37.4 -56.7 -42.0 13.3 40.2 63.0 185 192 A R H <> S+ 0 0 82 -3,-0.8 4,-1.7 -6,-0.2 -2,-0.2 0.889 117.8 49.8 -75.1 -42.4 14.5 37.0 64.7 186 193 A V H X S+ 0 0 2 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.910 110.3 50.4 -64.5 -45.5 18.3 37.8 64.5 187 194 A I H X S+ 0 0 23 -4,-3.4 4,-2.7 1,-0.2 5,-0.2 0.895 106.6 56.0 -59.1 -42.9 17.7 41.3 66.0 188 195 A H H X S+ 0 0 119 -4,-1.3 4,-2.1 -5,-0.3 -1,-0.2 0.917 108.2 48.0 -56.4 -45.6 15.7 39.8 68.9 189 196 A R H X S+ 0 0 88 -4,-1.7 4,-1.3 1,-0.2 -2,-0.2 0.919 114.2 45.7 -59.0 -50.2 18.7 37.5 69.7 190 197 A Y H X S+ 0 0 8 -4,-2.1 4,-1.1 1,-0.2 -2,-0.2 0.848 113.2 49.2 -64.6 -38.5 21.2 40.5 69.7 191 198 A K H < S+ 0 0 119 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.868 108.7 52.1 -69.8 -39.0 18.9 42.8 71.7 192 199 A K H < S+ 0 0 127 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.782 105.6 56.9 -65.9 -29.3 18.3 40.1 74.4 193 200 A X H < 0 0 92 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.862 360.0 360.0 -67.2 -38.0 22.1 39.7 74.7 194 201 A L < 0 0 109 -4,-1.1 -3,-0.1 -3,-0.1 0, 0.0 0.314 360.0 360.0 -89.4 360.0 22.3 43.5 75.4 195 !* 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 0.0 196 4 B R 0 0 164 0, 0.0 90,-0.2 0, 0.0 89,-0.1 0.000 360.0 360.0 360.0 136.0 12.0 36.0 36.6 197 5 B G - 0 0 6 88,-3.3 2,-0.3 87,-0.2 93,-0.2 -0.208 360.0-116.0 -68.6 160.5 15.4 36.1 38.3 198 6 B L - 0 0 14 90,-0.1 93,-2.5 112,-0.0 2,-0.6 -0.820 13.6-132.9-100.7 142.5 15.9 37.3 41.9 199 7 B L E -k 291 0D 5 -2,-0.3 112,-3.2 110,-0.2 2,-0.5 -0.870 24.3-168.2 -95.7 115.9 17.9 40.4 42.9 200 8 B I E -kl 292 311D 0 91,-3.3 93,-3.4 -2,-0.6 2,-0.6 -0.941 0.8-167.7-107.8 119.2 20.3 39.4 45.8 201 9 B V E -kl 293 312D 0 110,-3.2 112,-3.2 -2,-0.5 2,-0.6 -0.945 2.6-166.0-114.3 116.0 21.9 42.3 47.6 202 10 B L E +kl 294 313D 0 91,-3.4 93,-2.4 -2,-0.6 2,-0.2 -0.901 25.1 148.0-102.5 120.9 24.8 41.6 50.0 203 11 B S E + l 0 314D 0 110,-2.7 112,-3.1 -2,-0.6 93,-0.1 -0.633 4.7 137.0-135.2-168.6 25.7 44.5 52.2 204 12 B G - 0 0 0 110,-0.2 93,-0.4 91,-0.2 112,-0.1 -0.682 58.4 -41.2 139.9 168.2 27.1 45.1 55.7 205 13 B P S > S- 0 0 16 0, 0.0 3,-1.9 0, 0.0 5,-0.3 -0.145 70.2 -85.5 -65.8 157.1 29.7 47.3 57.4 206 14 B S T 3 S+ 0 0 122 1,-0.3 90,-0.0 2,-0.1 0, 0.0 -0.356 116.6 22.2 -58.0 131.2 33.1 48.1 55.8 207 15 B G T 3 S+ 0 0 81 -3,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.416 85.8 116.0 86.1 2.2 35.7 45.4 56.8 208 16 B V S < S- 0 0 13 -3,-1.9 -2,-0.1 107,-0.1 138,-0.1 0.715 92.0-102.9 -74.0 -21.7 33.0 42.7 57.5 209 17 B G S > S+ 0 0 16 -4,-0.2 4,-2.7 -5,-0.1 5,-0.2 0.694 70.2 147.0 106.1 27.3 34.3 40.6 54.6 210 18 B K H > S+ 0 0 22 -5,-0.3 4,-2.8 2,-0.2 5,-0.1 0.903 78.0 47.2 -56.4 -47.7 31.7 41.3 51.9 211 19 B G H > S+ 0 0 19 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.919 113.0 48.2 -59.0 -49.7 34.3 41.0 49.1 212 20 B T H > S+ 0 0 80 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.892 115.2 45.1 -57.8 -47.1 35.8 37.7 50.6 213 21 B V H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.911 112.3 51.2 -67.5 -43.6 32.3 36.2 50.9 214 22 B R H X S+ 0 0 50 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.921 110.1 49.9 -60.0 -45.9 31.2 37.3 47.4 215 23 B E H X S+ 0 0 112 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.912 112.8 46.7 -57.5 -45.6 34.4 35.7 45.9 216 24 B A H X S+ 0 0 31 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.860 108.4 55.7 -66.0 -37.1 33.7 32.4 47.8 217 25 B V H < S+ 0 0 0 -4,-2.4 6,-0.3 1,-0.2 -1,-0.2 0.921 111.4 44.3 -59.9 -44.9 30.0 32.5 46.7 218 26 B F H < S+ 0 0 66 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.771 110.4 54.3 -75.5 -23.3 31.3 32.7 43.0 219 27 B K H < S+ 0 0 182 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.765 84.6 103.8 -76.4 -28.1 33.9 29.9 43.5 220 28 B D S >< S- 0 0 35 -4,-1.6 3,-1.4 -3,-0.2 -3,-0.0 -0.359 71.4-141.9 -56.8 123.1 31.2 27.5 44.9 221 29 B P T 3 S+ 0 0 131 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.613 96.8 58.0 -66.2 -12.7 30.4 25.0 42.1 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-0.915 29.9-157.4-103.6 109.7 16.6 40.2 48.8 312 120 B F E -l 201 0D 3 -2,-0.7 30,-2.0 -112,-0.2 29,-1.8 -0.801 8.8-171.1 -98.0 115.7 18.7 42.2 51.2 313 121 B I E -ln 202 342D 0 -112,-3.2 -110,-2.7 -2,-0.6 2,-0.7 -0.941 11.2-152.0-113.1 122.0 21.3 40.3 53.2 314 122 B F E -ln 203 343D 0 28,-3.1 30,-2.2 -2,-0.5 2,-0.6 -0.850 10.2-146.8 -95.3 110.0 23.2 42.0 56.0 315 123 B L E - n 0 344D 0 -112,-3.1 30,-0.2 -2,-0.7 -105,-0.1 -0.682 23.4-151.3 -79.2 118.4 26.6 40.4 56.5 316 124 B T E - n 0 345D 0 28,-3.1 30,-2.6 -2,-0.6 -112,-0.0 -0.777 13.4-114.2-101.3 134.7 27.3 40.7 60.2 317 125 B P > - 0 0 24 0, 0.0 3,-1.1 0, 0.0 4,-0.4 -0.349 21.2-133.2 -61.9 141.3 30.6 41.0 62.1 318 126 B P G >> S+ 0 0 48 0, 0.0 4,-0.7 0, 0.0 3,-0.7 0.799 102.4 67.5 -66.3 -24.5 31.4 38.0 64.3 319 127 B D G 34 S+ 0 0 123 1,-0.2 11,-0.0 2,-0.2 28,-0.0 0.674 81.0 78.1 -68.5 -18.4 32.3 40.3 67.2 320 128 B L G <4 S+ 0 0 12 -3,-1.1 -1,-0.2 1,-0.2 14,-0.0 0.906 99.1 40.2 -58.2 -45.4 28.7 41.5 67.6 321 129 B S T <4 0 0 62 -3,-0.7 -1,-0.2 -4,-0.4 -2,-0.2 0.752 360.0 360.0 -74.0 -26.1 27.6 38.3 69.5 322 130 B E < 0 0 185 -4,-0.7 -1,-0.2 0, 0.0 -2,-0.2 0.163 360.0 360.0 -96.0 360.0 30.9 38.4 71.4 323 ! 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 0.0 324 147 B E > 0 0 213 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -42.1 32.5 53.0 74.0 325 148 B E H > + 0 0 169 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.889 360.0 51.2 -68.5 -43.8 33.1 53.1 70.2 326 149 B R H > S+ 0 0 227 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.873 112.3 46.5 -62.1 -41.4 32.7 49.3 69.9 327 150 B X H > S+ 0 0 129 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.871 113.0 49.5 -68.1 -40.1 29.4 49.4 71.8 328 151 B E H X S+ 0 0 115 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.896 111.1 49.6 -65.2 -42.4 28.2 52.4 69.7 329 152 B T H X S+ 0 0 62 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.935 110.7 50.8 -60.9 -48.6 29.1 50.5 66.4 330 153 B A H X S+ 0 0 14 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.908 109.8 49.4 -55.4 -48.8 27.2 47.4 67.7 331 154 B K H X S+ 0 0 147 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.903 113.3 46.0 -60.6 -44.3 24.1 49.5 68.5 332 155 B K H X S+ 0 0 127 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.827 110.7 53.0 -69.7 -32.2 24.1 51.2 65.0 333 156 B E H X S+ 0 0 22 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.905 110.4 47.7 -70.3 -37.2 24.7 47.8 63.2 334 157 B I H X S+ 0 0 5 -4,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.891 113.0 48.6 -68.1 -42.0 21.7 46.3 65.0 335 158 B E H >< S+ 0 0 136 -4,-2.1 3,-1.0 1,-0.2 4,-0.2 0.927 112.7 48.2 -63.1 -47.2 19.6 49.5 64.1 336 159 B X H >< S+ 0 0 66 -4,-2.5 3,-2.1 1,-0.2 -2,-0.2 0.868 100.6 66.4 -55.6 -47.4 20.8 49.2 60.4 337 160 B X H >< S+ 0 0 0 -4,-2.0 3,-1.9 1,-0.3 -1,-0.2 0.728 84.3 73.4 -49.5 -29.9 20.0 45.5 60.3 338 161 B A T << S+ 0 0 59 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.730 90.8 57.8 -63.2 -22.3 16.2 46.3 60.6 339 162 B S T < S+ 0 0 46 -3,-2.1 -1,-0.3 -4,-0.2 2,-0.2 0.395 97.9 79.9 -86.1 -1.5 16.2 47.5 57.0 340 163 B Y S < S- 0 0 8 -3,-1.9 -157,-0.2 -4,-0.1 -27,-0.2 -0.700 72.6-139.9-108.0 158.8 17.4 44.1 55.7 341 164 B D S S+ 0 0 65 -29,-1.8 -158,-1.6 -2,-0.2 2,-0.3 0.848 86.5 15.4 -82.1 -40.3 15.5 40.8 55.1 342 165 B Y E -Jn 182 313D 2 -30,-2.0 -28,-3.1 -160,-0.3 2,-0.4 -0.946 61.0-151.5-135.5 152.7 18.3 38.5 56.5 343 166 B A E - n 0 314D 3 -162,-2.3 2,-0.4 -2,-0.3 -28,-0.2 -1.000 14.1-172.7-128.0 126.9 21.4 38.8 58.6 344 167 B V E - n 0 315D 0 -30,-2.2 -28,-3.1 -2,-0.4 2,-0.3 -0.991 19.6-132.9-123.2 126.7 24.3 36.3 58.2 345 168 B V E - n 0 316D 37 -2,-0.4 2,-1.4 -30,-0.2 3,-0.4 -0.617 8.3-140.5 -79.8 133.9 27.3 36.3 60.5 346 169 B N + 0 0 26 -30,-2.6 3,-0.2 -2,-0.3 -1,-0.1 -0.590 57.7 132.7 -89.4 68.6 30.8 36.1 58.8 347 170 B D S S+ 0 0 85 -2,-1.4 2,-0.4 1,-0.4 -1,-0.2 0.925 83.9 4.1 -77.6 -53.4 32.1 33.6 61.5 348 171 B V S >> S- 0 0 76 -3,-0.4 4,-1.9 1,-0.1 3,-0.8 -0.994 75.6-133.7-136.0 125.0 33.6 31.2 58.9 349 172 B V H 3> S+ 0 0 44 -2,-0.4 4,-2.3 1,-0.3 3,-0.2 0.909 106.9 53.8 -51.8 -48.9 33.5 32.3 55.2 350 173 B A H 3> S+ 0 0 55 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.813 108.1 51.0 -54.9 -37.0 32.2 28.7 54.1 351 174 B N H <> S+ 0 0 56 -3,-0.8 4,-2.0 2,-0.2 -1,-0.2 0.912 109.5 48.8 -69.1 -42.9 29.4 29.0 56.7 352 175 B A H X S+ 0 0 0 -4,-1.9 4,-2.3 -3,-0.2 -2,-0.2 0.880 110.4 53.3 -62.1 -40.7 28.2 32.4 55.4 353 176 B V H X S+ 0 0 6 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.923 109.1 46.9 -60.6 -50.1 28.3 31.1 51.8 354 177 B Q H X S+ 0 0 119 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.890 112.8 49.8 -63.8 -36.9 26.1 28.1 52.6 355 178 B K H X S+ 0 0 52 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.914 111.5 49.1 -67.1 -40.1 23.6 30.3 54.5 356 179 B I H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.931 112.1 47.7 -64.3 -46.0 23.5 32.7 51.5 357 180 B K H X S+ 0 0 39 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.886 112.4 51.0 -60.1 -40.9 22.9 29.8 49.0 358 181 B G H X S+ 0 0 15 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.869 108.1 51.9 -62.1 -40.7 20.2 28.5 51.3 359 182 B I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.945 111.2 46.7 -62.0 -49.3 18.5 32.0 51.5 360 183 B V H X S+ 0 0 6 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.909 114.4 46.9 -62.7 -43.9 18.4 32.3 47.6 361 184 B E H X S+ 0 0 70 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.923 112.2 50.4 -64.6 -42.8 17.0 28.7 47.2 362 185 B T H >< S+ 0 0 0 -4,-2.5 3,-0.9 1,-0.2 4,-0.5 0.910 107.6 52.9 -61.8 -44.1 14.4 29.3 50.0 363 186 B E H >< S+ 0 0 9 -4,-2.6 3,-1.0 1,-0.3 -1,-0.2 0.870 106.9 53.7 -59.7 -35.4 13.2 32.6 48.3 364 187 B H H 3< S+ 0 0 76 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.735 105.1 55.6 -67.6 -24.4 12.8 30.6 45.0 365 188 B L T << S+ 0 0 12 -4,-1.0 -206,-2.0 -3,-0.9 -1,-0.2 0.457 74.9 124.1 -92.1 -1.3 10.5 28.0 46.9 366 189 B K B X> -E 158 0A 60 -3,-1.0 4,-2.3 -4,-0.5 3,-0.7 -0.370 69.4-127.0 -59.2 133.7 8.0 30.7 48.2 367 190 B T H 3> S+ 0 0 13 -210,-1.7 4,-3.2 1,-0.2 5,-0.3 0.815 106.7 63.3 -59.1 -31.4 4.5 29.6 47.0 368 191 B E H 3> S+ 0 0 102 -211,-0.3 4,-1.4 1,-0.2 -1,-0.2 0.928 112.5 36.8 -58.1 -41.8 3.8 33.0 45.4 369 192 B R H <> S+ 0 0 83 -3,-0.7 4,-1.7 -6,-0.2 -2,-0.2 0.898 118.0 50.0 -75.8 -41.9 6.8 32.3 43.0 370 193 B V H X S+ 0 0 7 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.918 110.4 50.1 -64.5 -45.5 6.1 28.6 42.7 371 194 B I H X S+ 0 0 23 -4,-3.2 4,-2.6 1,-0.2 5,-0.2 0.894 107.1 55.5 -58.8 -43.6 2.4 29.2 41.9 372 195 B H H X S+ 0 0 134 -4,-1.4 4,-1.7 -5,-0.3 -1,-0.2 0.915 109.3 46.9 -56.3 -45.3 3.4 31.7 39.2 373 196 B R H X S+ 0 0 139 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.920 114.4 46.3 -61.0 -49.8 5.6 29.1 37.5 374 197 B Y H X S+ 0 0 10 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.828 109.8 53.6 -64.9 -36.1 2.9 26.4 37.6 375 198 B K H X S+ 0 0 127 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.879 105.9 52.6 -68.1 -38.3 0.1 28.7 36.3 376 199 B K H < S+ 0 0 83 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.916 110.7 48.8 -61.3 -42.1 2.1 29.7 33.3 377 200 B X H < S+ 0 0 41 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.882 107.6 54.9 -63.3 -40.1 2.5 26.0 32.6 378 201 B L H < 0 0 28 -4,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.890 360.0 360.0 -61.9 -40.2 -1.2 25.4 33.0 379 202 B E < 0 0 185 -4,-2.1 -1,-0.1 -5,-0.1 -4,-0.0 -0.740 360.0 360.0 140.0 360.0 -1.9 28.1 30.4