==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-AUG-97 5GSS . COMPND 2 MOLECULE: GLUTATHIONE S-TRANSFERASE P1-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.OAKLEY,M.PARKER . 416 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17496.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 318 76.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 4.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 2 0.5 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 . 18 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 196 47.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.9 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 2 2 2 0 2 2 0 2 2 0 0 0 2 0 0 0 0 0 0 0 2 0 0 2 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 P 0 0 125 0, 0.0 56,-2.1 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-144.2 31.0 3.0 37.8 2 3 A Y E +aB 27 56A 23 24,-0.6 26,-2.3 54,-0.2 2,-0.3 -0.826 360.0 179.9-109.3 147.9 27.9 2.9 35.5 3 4 A T E -aB 28 55A 21 52,-1.8 52,-2.6 -2,-0.3 2,-0.5 -0.987 10.2-160.9-145.4 126.9 24.2 2.8 36.4 4 5 A V E -aB 29 54A 1 24,-2.8 26,-2.9 -2,-0.3 2,-0.6 -0.971 5.3-160.6-113.9 123.2 21.3 2.7 34.0 5 6 A V E +aB 30 53A 13 48,-3.2 48,-1.9 -2,-0.5 2,-0.3 -0.940 35.8 131.5-103.3 115.9 17.9 3.8 35.4 6 7 A Y E -a 31 0A 21 24,-1.9 26,-2.7 -2,-0.6 -2,-0.0 -0.950 58.3 -87.4-157.0 169.8 15.1 2.5 33.2 7 8 A F - 0 0 50 -2,-0.3 2,-2.7 24,-0.2 26,-0.2 -0.396 60.6 -88.9 -77.4 161.4 11.8 0.7 33.1 8 9 A P S S+ 0 0 57 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.363 97.0 95.0 -73.4 64.4 11.9 -3.2 33.0 9 10 A V S S- 0 0 13 -2,-2.7 193,-0.2 1,-0.2 194,-0.1 -0.924 76.3-127.6-144.4 163.5 12.0 -3.3 29.2 10 11 A R S >> S+ 0 0 35 191,-2.6 3,-2.4 -2,-0.3 4,-1.1 0.950 70.7 118.6 -76.5 -57.1 14.7 -3.6 26.6 11 12 A G G >4 S- 0 0 12 191,-2.5 3,-0.9 190,-0.3 4,-0.4 0.088 87.5 -4.9 33.2-127.7 13.4 -0.6 24.6 12 13 A R G 34 S+ 0 0 60 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.420 134.4 57.2 -75.5 2.1 15.9 2.3 24.4 13 14 A C G <> S+ 0 0 0 -3,-2.4 4,-2.4 2,-0.1 -1,-0.2 0.573 79.0 89.5-107.4 -10.3 18.5 0.7 26.7 14 15 A A H S+ 0 0 4 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.939 113.8 47.2 -62.5 -50.4 21.8 -1.2 22.5 16 17 A L H > S+ 0 0 1 -4,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.859 113.2 51.0 -62.0 -33.2 23.8 0.5 25.3 17 18 A R H X S+ 0 0 13 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.925 109.5 48.9 -69.0 -44.1 23.4 -2.7 27.4 18 19 A M H X S+ 0 0 0 -4,-2.4 4,-3.0 -5,-0.2 5,-0.2 0.917 112.6 50.4 -59.4 -42.0 24.7 -4.8 24.5 19 20 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.957 111.5 46.0 -59.6 -55.3 27.6 -2.3 24.2 20 21 A L H <>S+ 0 0 0 -4,-2.6 5,-3.0 2,-0.2 -2,-0.2 0.926 116.6 45.2 -54.8 -49.1 28.4 -2.5 27.9 21 22 A A H ><5S+ 0 0 14 -4,-2.9 3,-1.9 1,-0.2 -2,-0.2 0.940 113.6 47.7 -62.0 -50.1 28.3 -6.3 28.0 22 23 A D H 3<5S+ 0 0 14 -4,-3.0 -1,-0.2 1,-0.3 165,-0.2 0.823 111.4 52.3 -62.1 -31.3 30.2 -6.8 24.8 23 24 A Q T 3<5S- 0 0 53 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.278 116.0-115.9 -88.0 9.1 32.9 -4.4 26.0 24 25 A G T < 5 + 0 0 45 -3,-1.9 -3,-0.2 1,-0.2 2,-0.2 0.745 62.3 153.1 63.5 27.0 33.2 -6.3 29.3 25 26 A Q < - 0 0 66 -5,-3.0 2,-0.4 -6,-0.2 -1,-0.2 -0.554 39.6-134.1 -89.2 152.9 31.9 -3.4 31.3 26 27 A S + 0 0 96 -2,-0.2 -24,-0.6 -23,-0.0 2,-0.3 -0.854 31.1 168.5-104.4 139.7 30.2 -3.7 34.7 27 28 A W E -a 2 0A 46 -2,-0.4 2,-0.4 -26,-0.1 -24,-0.2 -0.987 30.5-125.1-150.6 157.0 27.0 -1.7 35.4 28 29 A K E -a 3 0A 103 -26,-2.3 -24,-2.8 -2,-0.3 2,-0.6 -0.847 19.3-144.1-103.3 137.1 24.2 -1.4 37.9 29 30 A E E -a 4 0A 47 -2,-0.4 2,-0.8 -26,-0.2 -24,-0.2 -0.920 9.0-166.8-104.7 118.6 20.5 -1.6 36.8 30 31 A E E -a 5 0A 92 -26,-2.9 -24,-1.9 -2,-0.6 2,-0.4 -0.923 17.9-150.7-104.7 102.4 18.1 0.6 38.7 31 32 A V E -a 6 0A 90 -2,-0.8 2,-0.6 -26,-0.2 -24,-0.2 -0.632 5.9-157.3 -79.7 129.4 14.7 -0.7 37.7 32 33 A V - 0 0 9 -26,-2.7 2,-0.2 -2,-0.4 -2,-0.0 -0.931 8.6-151.3-110.3 117.8 11.8 1.7 37.7 33 34 A T > - 0 0 43 -2,-0.6 4,-2.8 -26,-0.2 5,-0.2 -0.532 27.4-113.6 -84.1 158.9 8.3 0.3 38.0 34 35 A V H > S+ 0 0 84 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.846 118.7 56.1 -59.4 -33.5 5.3 2.0 36.5 35 36 A E H > S+ 0 0 133 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.959 109.5 43.9 -62.5 -53.6 4.1 2.5 40.1 36 37 A T H >> S+ 0 0 66 1,-0.2 4,-0.7 2,-0.2 3,-0.5 0.912 114.7 50.5 -58.6 -43.6 7.2 4.4 41.0 37 38 A W H >< S+ 0 0 41 -4,-2.8 3,-1.4 1,-0.2 6,-0.4 0.943 107.9 52.2 -61.1 -48.3 7.2 6.3 37.8 38 39 A Q H 3< S+ 0 0 151 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.714 91.5 75.6 -63.9 -18.2 3.5 7.4 38.3 39 40 A E H << S- 0 0 132 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.896 96.0-142.9 -59.6 -39.6 4.4 8.7 41.7 40 41 A G S S+ 0 0 65 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.906 87.6 46.6 -59.3 -47.6 9.0 12.6 41.8 42 43 A L H >> S+ 0 0 33 -6,-0.4 4,-0.8 2,-0.2 3,-0.7 0.974 113.3 49.1 -59.7 -54.6 11.6 10.7 39.7 43 44 A K H >4 S+ 0 0 86 -6,-0.4 3,-1.5 1,-0.3 6,-0.3 0.910 108.1 55.2 -50.4 -47.4 10.1 11.9 36.5 44 45 A A H 3< S+ 0 0 84 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.855 106.5 50.4 -55.0 -40.6 10.2 15.5 37.8 45 46 A S H << S+ 0 0 74 -4,-1.6 2,-0.4 -3,-0.7 -1,-0.3 0.570 89.2 99.2 -75.8 -12.5 13.9 15.2 38.5 46 47 A C S X< S- 0 0 6 -3,-1.5 3,-2.0 -4,-0.8 5,-0.1 -0.664 80.6-127.6 -79.2 131.1 14.6 13.9 35.0 47 48 A L T 3 S+ 0 0 26 -2,-0.4 -1,-0.1 1,-0.3 292,-0.1 0.844 107.9 19.5 -44.0 -50.1 15.9 16.6 32.6 48 49 A Y T 3 S- 0 0 42 2,-0.3 -1,-0.3 288,-0.1 3,-0.1 0.031 115.2-104.6-111.7 24.1 13.3 15.9 29.9 49 50 A G S < S+ 0 0 12 -3,-2.0 2,-0.3 -6,-0.3 -2,-0.1 0.743 88.7 96.6 61.1 26.8 10.9 14.0 32.2 50 51 A Q - 0 0 115 2,-0.1 -2,-0.3 -7,-0.1 -1,-0.2 -0.914 62.1 -88.5-143.4 168.4 12.0 10.7 30.7 51 52 A L S S+ 0 0 18 -2,-0.3 2,-0.2 -3,-0.1 -45,-0.1 -0.839 74.5 74.0-115.4 164.3 14.2 7.6 31.1 52 53 A P - 0 0 4 0, 0.0 11,-0.8 0, 0.0 2,-0.4 0.331 56.2-177.7 -65.8 155.9 16.8 6.2 30.6 53 54 A K E -BC 5 62A 39 -48,-1.9 -48,-3.2 -2,-0.2 2,-0.4 -0.953 9.2-162.5-120.5 137.2 18.8 8.1 33.1 54 55 A F E -BC 4 61A 0 7,-2.7 7,-3.1 -2,-0.4 2,-0.4 -0.979 8.9-161.3-129.6 142.0 22.5 7.1 33.1 55 56 A Q E +BC 3 60A 58 -52,-2.6 -52,-1.8 -2,-0.4 2,-0.5 -0.987 11.7 177.4-127.4 127.5 25.2 7.7 35.7 56 57 A D E > S-BC 2 59A 45 3,-2.6 3,-2.1 -2,-0.4 -54,-0.2 -0.890 76.9 -54.5-123.0 94.7 29.0 7.4 35.0 57 58 A G T 3 S- 0 0 51 -56,-2.1 -1,-0.1 -2,-0.5 -54,-0.1 -0.521 121.4 -23.0 66.2-134.1 30.5 8.4 38.4 58 59 A D T 3 S+ 0 0 149 -2,-0.2 2,-0.7 -3,-0.1 -1,-0.3 0.313 114.6 107.4 -91.7 10.2 28.9 11.7 39.2 59 60 A L E < -C 56 0A 13 -3,-2.1 -3,-2.6 2,-0.0 2,-0.5 -0.808 55.1-163.2 -89.4 115.8 28.2 12.5 35.5 60 61 A T E -C 55 0A 50 -2,-0.7 2,-0.3 -5,-0.2 -5,-0.2 -0.908 10.1-175.8-104.0 126.0 24.4 12.1 35.0 61 62 A L E -C 54 0A 0 -7,-3.1 -7,-2.7 -2,-0.5 2,-0.3 -0.826 12.7-168.9-121.0 156.4 23.2 11.8 31.5 62 63 A Y E +C 53 0A 24 -2,-0.3 -9,-0.2 -9,-0.2 -11,-0.1 -0.886 52.9 64.3-134.0 163.0 19.8 11.6 29.8 63 64 A Q S >> S- 0 0 26 -11,-0.8 4,-2.1 -2,-0.3 3,-0.9 0.770 71.3-124.7 83.8 110.7 18.9 10.6 26.2 64 65 A S H 3> S+ 0 0 6 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.856 111.1 49.9 -51.6 -42.6 19.7 7.1 25.0 65 66 A N H 3> S+ 0 0 10 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.787 107.5 54.9 -69.9 -26.7 21.9 8.4 22.0 66 67 A T H <> S+ 0 0 0 -3,-0.9 4,-2.7 2,-0.2 -2,-0.2 0.936 109.2 47.5 -69.7 -43.3 23.8 10.6 24.4 67 68 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.917 112.6 49.8 -62.0 -43.2 24.6 7.6 26.5 68 69 A L H X S+ 0 0 4 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.927 113.5 44.7 -61.3 -47.7 25.6 5.7 23.4 69 70 A R H X S+ 0 0 2 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.857 112.0 53.5 -66.1 -36.1 27.9 8.4 22.1 70 71 A H H X S+ 0 0 5 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.939 112.5 42.4 -63.0 -51.2 29.4 8.9 25.6 71 72 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 6,-0.2 0.878 115.1 52.3 -62.8 -39.3 30.3 5.2 25.9 72 73 A G H X>S+ 0 0 0 -4,-2.3 5,-2.9 -5,-0.2 4,-0.6 0.926 112.4 44.6 -63.1 -43.2 31.5 5.3 22.3 73 74 A R H <5S+ 0 0 50 -4,-2.8 3,-0.5 3,-0.2 -2,-0.2 0.947 120.7 38.9 -67.3 -45.8 33.7 8.3 23.0 74 75 A T H <5S+ 0 0 40 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.731 121.0 43.5 -78.8 -24.7 35.1 7.0 26.3 75 76 A L H <5S- 0 0 41 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.358 112.8-111.3-101.5 4.0 35.4 3.3 25.2 76 77 A G T <5S+ 0 0 45 -4,-0.6 -3,-0.2 -3,-0.5 3,-0.1 0.879 78.4 126.9 69.8 39.8 36.9 4.0 21.7 77 78 A L < + 0 0 7 -5,-2.9 72,-2.5 -6,-0.2 73,-0.3 -0.361 44.7 90.0-121.8 51.0 33.9 2.9 19.7 78 79 A Y S S- 0 0 22 1,-0.5 -1,-0.1 -6,-0.3 70,-0.1 -0.157 98.3 -79.4-139.6 39.3 33.5 6.1 17.7 79 80 A G - 0 0 17 68,-0.3 -1,-0.5 -3,-0.1 3,-0.1 -0.044 41.2 -93.2 84.1 167.8 35.6 5.5 14.5 80 81 A K S S+ 0 0 131 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.632 101.2 1.7 -93.6 -19.2 39.3 5.8 14.0 81 82 A D S > S- 0 0 68 -3,-0.1 4,-2.4 1,-0.0 5,-0.2 -0.905 89.5 -79.5-152.7-177.0 39.2 9.4 12.8 82 83 A Q H > S+ 0 0 98 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.835 123.3 54.1 -62.0 -38.8 36.8 12.4 12.2 83 84 A Q H > S+ 0 0 97 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.933 112.6 43.5 -63.1 -44.3 35.6 11.1 8.8 84 85 A E H > S+ 0 0 18 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.877 109.9 56.6 -68.1 -37.6 34.6 7.7 10.4 85 86 A A H X S+ 0 0 6 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.906 108.4 48.0 -59.7 -41.4 33.1 9.5 13.5 86 87 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.921 112.4 47.9 -64.9 -44.1 30.8 11.4 11.1 87 88 A L H X S+ 0 0 42 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.869 109.4 53.6 -64.2 -38.0 29.8 8.2 9.2 88 89 A V H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.920 110.1 48.1 -62.4 -41.6 29.1 6.6 12.6 89 90 A D H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 5,-0.3 0.924 108.4 54.0 -63.6 -44.6 26.9 9.5 13.4 90 91 A M H X S+ 0 0 10 -4,-2.6 4,-1.4 2,-0.2 -1,-0.2 0.881 111.1 46.2 -58.3 -39.1 25.1 9.2 10.0 91 92 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.960 113.2 48.3 -68.5 -50.6 24.4 5.6 10.7 92 93 A N H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.869 109.4 52.1 -57.9 -41.7 23.1 6.2 14.2 93 94 A D H X S+ 0 0 12 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.877 110.5 49.7 -63.4 -36.9 20.9 9.1 13.1 94 95 A G H X S+ 0 0 4 -4,-1.4 4,-2.1 -5,-0.3 -2,-0.2 0.920 110.7 49.0 -66.4 -43.2 19.4 6.7 10.5 95 96 A V H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.942 111.2 50.7 -60.3 -47.8 18.9 4.0 13.1 96 97 A E H X S+ 0 0 25 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.904 107.1 54.1 -56.4 -45.2 17.2 6.6 15.4 97 98 A D H X S+ 0 0 53 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.923 113.7 40.8 -56.3 -47.9 14.9 7.7 12.6 98 99 A L H X S+ 0 0 4 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.861 111.1 57.7 -70.7 -35.0 13.7 4.2 12.0 99 100 A R H X S+ 0 0 12 -4,-2.8 4,-3.1 1,-0.2 5,-0.2 0.925 104.7 52.2 -60.7 -41.4 13.5 3.5 15.7 100 101 A C H X S+ 0 0 52 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.893 110.1 47.5 -62.0 -39.7 11.1 6.5 16.1 101 102 A K H X S+ 0 0 99 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.917 112.6 49.9 -66.4 -42.3 8.9 5.0 13.4 102 103 A Y H X S+ 0 0 2 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.945 112.1 46.8 -58.6 -52.2 9.0 1.6 15.1 103 104 A I H X S+ 0 0 44 -4,-3.1 4,-2.8 1,-0.2 5,-0.4 0.902 110.5 53.8 -58.1 -41.8 8.1 3.1 18.5 104 105 A S H X>S+ 0 0 56 -4,-2.4 4,-2.9 -5,-0.2 5,-0.7 0.927 111.5 45.2 -59.8 -47.0 5.3 5.1 16.8 105 106 A L H X5S+ 0 0 5 -4,-2.5 4,-1.8 3,-0.2 -2,-0.2 0.986 113.7 48.8 -58.6 -59.4 3.9 1.9 15.4 106 107 A I H <5S+ 0 0 0 -4,-2.8 4,-0.3 1,-0.2 -2,-0.2 0.863 127.6 23.6 -48.2 -49.0 4.2 -0.1 18.6 107 108 A Y H <5S+ 0 0 113 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.701 129.5 39.5 -95.4 -21.7 2.6 2.6 20.8 108 109 A T H <5S- 0 0 103 -4,-2.9 -3,-0.2 -5,-0.4 -2,-0.2 0.791 132.0 -11.9-100.9 -38.5 0.5 4.6 18.3 109 110 A N X< + 0 0 72 -4,-1.8 4,-1.7 -5,-0.7 -3,-0.2 -0.196 64.5 152.5-166.9 69.1 -1.1 2.2 15.9 110 111 A Y H > S+ 0 0 36 -4,-0.3 4,-1.9 3,-0.2 5,-0.2 0.973 78.9 44.9 -63.2 -57.6 0.2 -1.3 15.8 111 112 A E H 4 S+ 0 0 127 1,-0.2 4,-0.4 2,-0.2 3,-0.2 0.941 122.6 32.0 -54.6 -60.2 -3.0 -3.0 14.6 112 113 A A H 4 S+ 0 0 86 1,-0.2 4,-0.4 2,-0.1 -1,-0.2 0.851 127.1 39.9 -71.6 -34.5 -4.0 -0.6 11.8 113 114 A G H X S+ 0 0 11 -4,-1.7 4,-2.4 -8,-0.2 5,-0.2 0.550 87.1 89.9 -96.1 -4.4 -0.5 0.4 10.8 114 115 A K H X S+ 0 0 47 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.922 88.0 49.5 -58.7 -48.3 1.5 -2.9 11.0 115 116 A D H > S+ 0 0 111 -4,-0.4 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0.934 111.7 52.1 -65.6 -44.2 17.6 -5.2 13.2 159 160 A L H X S+ 0 0 34 -4,-3.0 4,-1.2 1,-0.2 -2,-0.2 0.923 111.4 45.8 -59.2 -46.9 16.9 -7.7 16.0 160 161 A I H X S+ 0 0 4 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.829 111.1 52.8 -68.1 -30.7 13.6 -6.1 17.0 161 162 A H H X S+ 0 0 0 -4,-1.7 4,-3.3 -5,-0.3 -1,-0.2 0.822 102.1 59.2 -74.3 -26.3 12.5 -5.8 13.4 162 163 A E H < S+ 0 0 72 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.856 108.6 45.8 -65.5 -36.7 13.2 -9.5 13.0 163 164 A V H < S+ 0 0 59 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.911 116.0 45.6 -71.0 -42.4 10.6 -10.1 15.8 164 165 A L H < S+ 0 0 5 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.896 132.9 16.4 -67.5 -43.0 8.2 -7.6 14.2 165 166 A A S >< S- 0 0 12 -4,-3.3 3,-2.6 -5,-0.1 -1,-0.3 -0.701 83.9-145.9-135.4 81.9 8.6 -9.0 10.7 166 167 A P T 3 S+ 0 0 109 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.161 86.7 17.8 -48.0 131.3 10.2 -12.5 10.7 167 168 A G T > S+ 0 0 27 -5,-0.1 3,-2.6 1,-0.1 4,-0.4 0.344 79.9 130.1 86.2 -5.0 12.4 -12.8 7.6 168 169 A C T < S+ 0 0 23 -3,-2.6 3,-0.3 1,-0.3 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-1,-0.1 -3,-0.1 -102,-0.1 0.249 360.0 360.0-169.2 360.0 6.4 -6.5 19.3 209 !* 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 0.0 210 2 B P 0 0 126 0, 0.0 56,-2.1 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-142.9 35.1 23.4 0.7 211 3 B Y E +dE 236 265B 23 24,-0.7 26,-2.3 54,-0.2 2,-0.3 -0.822 360.0 179.4-110.6 147.9 31.5 23.0 2.0 212 4 B T E -dE 237 264B 21 52,-1.8 52,-2.6 -2,-0.3 2,-0.5 -0.986 10.1-161.5-145.5 127.4 28.3 22.5 0.1 213 5 B V E -dE 238 263B 1 24,-2.7 26,-2.9 -2,-0.3 2,-0.6 -0.969 5.3-160.7-114.7 123.2 24.8 22.1 1.5 214 6 B V E +dE 239 262B 13 48,-3.1 48,-1.9 -2,-0.5 2,-0.3 -0.943 35.8 131.0-103.1 117.4 22.1 20.6 -0.8 215 7 B Y E -d 240 0B 22 24,-1.8 26,-2.6 -2,-0.6 -2,-0.0 -0.959 58.4 -86.1-158.7 169.7 18.6 21.4 0.5 216 8 B F - 0 0 49 -2,-0.3 2,-2.7 24,-0.2 26,-0.2 -0.380 60.4 -89.3 -77.2 160.9 15.2 22.8 -0.5 217 9 B P S S+ 0 0 59 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.364 97.0 95.1 -73.5 64.7 14.8 26.5 -0.4 218 10 B V S S- 0 0 13 -2,-2.7 193,-0.2 1,-0.2 194,-0.1 -0.921 76.2-128.0-143.8 163.8 13.7 26.6 3.2 219 11 B R S >> S+ 0 0 33 191,-2.6 3,-2.5 -2,-0.3 4,-1.0 0.949 70.5 118.6 -76.8 -58.1 15.5 27.2 6.5 220 12 B G G >4 S- 0 0 14 191,-2.5 3,-0.9 190,-0.3 4,-0.4 0.073 87.5 -4.7 34.6-127.6 14.1 24.0 8.1 221 13 B R G 34 S+ 0 0 60 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.400 134.3 57.2 -76.3 3.6 16.8 21.5 9.1 222 14 B C G <> S+ 0 0 0 -3,-2.5 4,-2.4 2,-0.1 -1,-0.2 0.563 79.1 89.4-108.9 -10.5 19.6 23.6 7.7 223 15 B A H S+ 0 0 4 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.936 113.9 46.8 -62.1 -50.9 21.3 25.8 12.6 225 17 B L H > S+ 0 0 0 -4,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.866 113.2 51.4 -61.9 -33.6 24.2 24.4 10.5 226 18 B R H X S+ 0 0 12 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.933 109.4 48.6 -67.7 -45.6 24.0 27.6 8.4 227 19 B M H X S+ 0 0 0 -4,-2.5 4,-3.0 -5,-0.2 5,-0.2 0.915 112.7 50.7 -58.4 -42.5 24.1 29.8 11.4 228 20 B L H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.954 111.4 45.9 -59.1 -55.7 27.1 27.8 12.7 229 21 B L H <>S+ 0 0 0 -4,-2.7 5,-3.0 2,-0.2 -2,-0.2 0.925 116.6 45.3 -54.8 -49.4 29.0 28.1 9.4 230 22 B A H ><5S+ 0 0 15 -4,-2.9 3,-2.0 1,-0.2 -2,-0.2 0.946 113.6 47.7 -61.2 -51.0 28.3 31.9 9.1 231 23 B D H 3<5S+ 0 0 15 -4,-3.0 -1,-0.2 1,-0.3 165,-0.2 0.824 111.3 52.4 -61.8 -30.9 29.1 32.6 12.8 232 24 B Q T 3<5S- 0 0 52 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.258 116.0-115.7 -88.2 9.4 32.3 30.6 12.4 233 25 B G T < 5 + 0 0 45 -3,-2.0 -3,-0.2 1,-0.2 2,-0.2 0.746 62.7 152.5 63.4 27.6 33.3 32.6 9.3 234 26 B Q < - 0 0 66 -5,-3.0 2,-0.4 -6,-0.2 -1,-0.2 -0.557 39.9-134.2 -90.0 153.4 33.1 29.6 7.0 235 27 B S + 0 0 96 -2,-0.2 -24,-0.7 -23,-0.0 2,-0.3 -0.863 30.8 168.8-105.4 140.8 32.4 29.7 3.3 236 28 B W E -d 211 0B 46 -2,-0.4 2,-0.4 -26,-0.1 -24,-0.2 -0.986 30.4-124.8-151.3 156.2 29.9 27.3 1.8 237 29 B K E -d 212 0B 105 -26,-2.3 -24,-2.7 -2,-0.3 2,-0.6 -0.848 19.3-144.3-102.6 136.7 28.0 26.7 -1.4 238 30 B E E -d 213 0B 46 -2,-0.4 2,-0.8 -26,-0.2 -24,-0.2 -0.921 9.0-166.9-104.1 118.3 24.2 26.4 -1.4 239 31 B E E -d 214 0B 92 -26,-2.9 -24,-1.8 -2,-0.6 2,-0.4 -0.918 17.8-150.9-105.3 101.2 22.8 23.9 -3.9 240 32 B V E -d 215 0B 89 -2,-0.8 2,-0.6 -26,-0.2 -24,-0.2 -0.630 5.9-157.3 -78.7 128.7 19.1 24.7 -4.0 241 33 B V - 0 0 9 -26,-2.6 2,-0.2 -2,-0.4 -2,-0.0 -0.932 8.7-150.9-110.1 118.0 16.7 21.8 -4.8 242 34 B T > - 0 0 42 -2,-0.6 4,-2.8 -26,-0.2 5,-0.2 -0.517 27.2-113.8 -83.7 158.3 13.3 22.7 -6.2 243 35 B V H > S+ 0 0 83 1,-0.2 4,-3.0 2,-0.2 5,-0.1 0.849 118.8 56.0 -58.8 -33.5 10.3 20.6 -5.6 244 36 B E H > S+ 0 0 136 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.960 109.6 44.0 -62.5 -53.4 10.2 19.9 -9.4 245 37 B T H >> S+ 0 0 67 1,-0.2 4,-0.7 2,-0.2 3,-0.6 0.912 114.7 50.4 -58.7 -43.8 13.8 18.6 -9.3 246 38 B W H >< S+ 0 0 41 -4,-2.8 3,-1.4 1,-0.2 6,-0.4 0.949 107.8 52.3 -60.6 -49.1 13.0 16.6 -6.2 247 39 B Q H 3< S+ 0 0 149 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.697 91.3 75.9 -63.1 -18.1 9.9 15.1 -7.7 248 40 B E H << S- 0 0 131 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.908 96.0-142.5 -59.7 -40.2 11.9 14.0 -10.7 249 41 B G S S+ 0 0 63 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.911 87.4 46.7 -58.9 -48.7 16.9 10.7 -9.4 251 43 B L H >> S+ 0 0 31 -6,-0.4 3,-0.8 2,-0.2 4,-0.8 0.976 113.3 49.1 -58.3 -56.0 18.4 13.0 -6.7 252 44 B K H >4 S+ 0 0 87 -6,-0.4 3,-1.5 1,-0.3 6,-0.3 0.902 108.1 55.5 -49.1 -47.5 16.2 11.5 -3.9 253 45 B A H 3< S+ 0 0 84 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.848 106.4 50.3 -55.4 -39.8 17.2 8.0 -5.1 254 46 B S H << S+ 0 0 71 -4,-1.6 2,-0.4 -3,-0.8 -1,-0.3 0.557 89.3 99.2 -77.1 -11.9 20.9 8.8 -4.7 255 47 B C S X< S- 0 0 5 -3,-1.5 3,-2.1 -4,-0.8 5,-0.1 -0.681 80.5-127.6 -79.0 130.7 20.4 10.1 -1.2 256 48 B L T 3 S+ 0 0 28 -2,-0.4 -1,-0.1 1,-0.3 -126,-0.1 0.840 108.1 19.4 -42.7 -51.4 21.3 7.6 1.5 257 49 B Y T 3 S- 0 0 41 2,-0.3 -1,-0.3 -130,-0.1 3,-0.1 0.013 115.0-105.1-111.4 24.9 18.0 7.8 3.3 258 50 B G S < S+ 0 0 15 -3,-2.1 2,-0.3 -6,-0.3 -2,-0.1 0.745 88.7 96.5 59.4 27.1 16.1 9.4 0.4 259 51 B Q - 0 0 115 2,-0.1 -2,-0.3 -7,-0.1 -1,-0.2 -0.917 62.1 -89.2-143.1 167.9 16.2 12.8 2.0 260 52 B L S S+ 0 0 18 -2,-0.3 2,-0.2 -3,-0.1 -45,-0.1 -0.825 74.5 74.9-115.7 163.0 17.9 16.2 2.3 261 53 B P - 0 0 4 0, 0.0 11,-0.8 0, 0.0 2,-0.4 0.339 56.5-177.5 -68.7 157.0 20.0 17.9 3.5 262 54 B K E -EF 214 271B 38 -48,-1.9 -48,-3.1 -2,-0.2 2,-0.4 -0.951 9.2-161.9-120.9 138.0 23.0 16.4 1.8 263 55 B F E -EF 213 270B 0 7,-2.8 7,-3.2 -2,-0.4 2,-0.4 -0.982 9.1-161.3-130.4 141.9 26.3 17.9 2.8 264 56 B Q E +EF 212 269B 60 -52,-2.6 -52,-1.8 -2,-0.4 2,-0.5 -0.981 11.9 176.4-127.1 127.9 29.7 17.8 1.2 265 57 B D E > S-EF 211 268B 45 3,-2.6 3,-2.2 -2,-0.4 -54,-0.2 -0.886 76.6 -54.6-124.7 95.5 33.0 18.6 2.9 266 58 B G T 3 S- 0 0 49 -56,-2.1 -1,-0.1 -2,-0.5 -54,-0.0 -0.521 121.0 -23.3 65.8-134.4 35.6 17.9 0.2 267 59 B D T 3 S+ 0 0 149 -2,-0.2 2,-0.7 -3,-0.1 -1,-0.3 0.310 114.8 107.2 -92.0 10.6 34.9 14.4 -1.0 268 60 B L E < -F 265 0B 15 -3,-2.2 -3,-2.6 2,-0.0 2,-0.5 -0.807 55.3-163.2 -88.6 116.7 33.1 13.5 2.3 269 61 B T E -F 264 0B 51 -2,-0.7 2,-0.3 -5,-0.2 -5,-0.2 -0.913 10.1-175.4-105.1 127.3 29.4 13.3 1.6 270 62 B L E -F 263 0B 0 -7,-3.2 -7,-2.8 -2,-0.5 2,-0.3 -0.840 13.0-169.2-121.7 156.9 27.1 13.4 4.7 271 63 B Y E +F 262 0B 24 -2,-0.3 -9,-0.2 -9,-0.2 -11,-0.1 -0.893 52.9 64.4-134.8 161.9 23.4 13.0 5.2 272 64 B Q S >> S- 0 0 25 -11,-0.8 4,-2.2 -2,-0.3 3,-0.9 0.754 71.1-125.0 85.0 110.2 21.4 13.8 8.5 273 65 B S H 3> S+ 0 0 8 1,-0.3 4,-2.4 2,-0.2 5,-0.1 0.871 111.2 49.6 -50.5 -44.2 21.3 17.3 9.8 274 66 B N H 3> S+ 0 0 10 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.780 107.6 54.9 -68.7 -27.3 22.6 16.3 13.2 275 67 B T H <> S+ 0 0 0 -3,-0.9 4,-2.7 2,-0.2 -1,-0.2 0.932 109.4 47.4 -69.3 -42.7 25.5 14.4 11.6 276 68 B I H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.930 112.5 50.1 -62.9 -44.1 26.4 17.6 9.7 277 69 B L H X S+ 0 0 4 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.925 113.5 44.5 -60.2 -47.4 26.1 19.6 13.0 278 70 B R H X S+ 0 0 2 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.862 111.7 53.9 -66.2 -36.3 28.3 17.1 14.9 279 71 B H H X S+ 0 0 6 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.943 112.2 42.4 -62.7 -50.6 30.8 17.0 12.0 280 72 B L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 6,-0.3 0.886 115.3 52.1 -63.2 -38.8 31.3 20.7 11.9 281 73 B G H X>S+ 0 0 0 -4,-2.3 5,-2.8 -5,-0.3 4,-0.6 0.922 112.3 44.7 -64.1 -42.2 31.3 20.8 15.7 282 74 B R H <5S+ 0 0 48 -4,-2.9 3,-0.4 3,-0.2 -2,-0.2 0.945 120.9 38.4 -67.7 -46.2 34.0 18.1 15.8 283 75 B T H <5S+ 0 0 41 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.744 121.2 43.8 -78.4 -25.4 36.2 19.7 13.0 284 76 B L H <5S- 0 0 42 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.362 112.5-111.6-100.6 3.1 35.6 23.3 14.1 285 77 B G T <5S+ 0 0 45 -4,-0.6 -3,-0.2 -3,-0.4 3,-0.2 0.874 78.3 126.8 69.9 40.0 36.1 22.7 17.8 286 78 B L < + 0 0 7 -5,-2.8 72,-2.5 -6,-0.3 73,-0.3 -0.369 45.0 90.3-121.7 50.9 32.5 23.4 18.9 287 79 B Y S S- 0 0 23 1,-0.5 -1,-0.1 -6,-0.3 70,-0.1 -0.144 98.1 -79.3-138.9 38.2 31.9 20.2 20.8 288 80 B G - 0 0 17 68,-0.3 -1,-0.5 -3,-0.2 3,-0.1 -0.070 40.7 -93.8 85.8 167.4 32.9 20.9 24.4 289 81 B K S S+ 0 0 131 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.602 101.3 2.4 -94.6 -18.6 36.4 21.2 26.0 290 82 B D S > S- 0 0 69 -3,-0.1 4,-2.4 1,-0.0 5,-0.2 -0.919 89.1 -80.8-153.2-178.2 36.4 17.6 27.2 291 83 B Q H > S+ 0 0 97 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.843 123.1 54.7 -62.0 -37.9 34.4 14.3 27.1 292 84 B Q H > S+ 0 0 97 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.939 112.7 42.9 -63.2 -44.5 32.1 15.4 29.9 293 85 B E H > S+ 0 0 17 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.874 109.9 57.1 -68.4 -37.1 31.1 18.5 28.0 294 86 B A H X S+ 0 0 6 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.908 108.2 48.0 -59.4 -42.0 30.8 16.6 24.8 295 87 B A H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.923 112.2 48.2 -64.1 -44.4 28.3 14.3 26.4 296 88 B L H X S+ 0 0 44 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.877 109.1 53.7 -64.7 -38.2 26.3 17.3 27.8 297 89 B V H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.918 109.9 48.4 -62.1 -40.2 26.4 18.9 24.4 298 90 B D H X S+ 0 0 0 -4,-2.0 4,-3.0 1,-0.2 5,-0.3 0.930 108.1 53.9 -64.7 -44.5 24.9 15.7 23.0 299 91 B M H X S+ 0 0 9 -4,-2.6 4,-1.4 2,-0.2 -1,-0.2 0.864 111.1 46.2 -58.5 -38.7 22.3 15.7 25.7 300 92 B V H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.960 113.3 48.4 -68.9 -50.7 21.2 19.2 24.8 301 93 B N H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.874 109.6 51.7 -57.8 -42.5 21.2 18.4 21.0 302 94 B D H X S+ 0 0 11 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.877 110.7 49.7 -62.5 -37.4 19.1 15.3 21.5 303 95 B G H X S+ 0 0 3 -4,-1.4 4,-2.0 -5,-0.3 -2,-0.2 0.921 110.8 48.8 -66.2 -43.2 16.7 17.3 23.5 304 96 B V H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.941 111.1 50.9 -60.7 -46.5 16.5 20.0 20.8 305 97 B E H X S+ 0 0 22 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.903 107.0 54.2 -58.1 -44.0 16.0 17.2 18.2 306 98 B D H X S+ 0 0 54 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.924 113.6 40.7 -56.9 -48.1 13.2 15.7 20.2 307 99 B L H X S+ 0 0 3 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.862 111.1 57.7 -70.9 -34.6 11.3 19.0 20.3 308 100 B R H X S+ 0 0 10 -4,-2.8 4,-3.1 1,-0.2 5,-0.2 0.931 104.8 52.3 -61.2 -41.8 12.2 19.8 16.7 309 101 B C H X S+ 0 0 54 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.892 110.1 47.5 -61.5 -39.4 10.5 16.5 15.7 310 102 B K H X S+ 0 0 100 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.924 112.6 50.0 -66.4 -42.5 7.3 17.5 17.6 311 103 B Y H X S+ 0 0 3 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.947 112.1 46.7 -58.6 -51.8 7.4 21.0 16.0 312 104 B I H X S+ 0 0 45 -4,-3.1 4,-2.8 1,-0.2 5,-0.4 0.903 110.6 53.5 -58.6 -42.0 7.8 19.4 12.5 313 105 B S H X>S+ 0 0 57 -4,-2.4 4,-2.8 -5,-0.2 5,-0.7 0.922 111.7 45.4 -59.9 -46.0 5.0 17.0 13.3 314 106 B L H X5S+ 0 0 5 -4,-2.5 4,-1.8 3,-0.2 -2,-0.2 0.990 113.8 48.6 -59.3 -59.7 2.7 20.0 14.2 315 107 B I H <5S+ 0 0 0 -4,-2.9 4,-0.3 1,-0.2 -2,-0.2 0.857 127.7 23.7 -48.0 -49.0 3.7 22.1 11.2 316 108 B Y H <5S+ 0 0 111 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.712 129.3 39.5 -95.6 -21.8 3.2 19.2 8.6 317 109 B T H <5S- 0 0 103 -4,-2.8 -3,-0.2 -5,-0.4 -2,-0.2 0.803 131.8 -11.6-100.4 -39.1 0.7 16.9 10.4 318 110 B N X< + 0 0 71 -4,-1.8 4,-1.8 -5,-0.7 -3,-0.2 -0.190 64.4 152.4-165.9 68.7 -1.9 19.0 12.2 319 111 B Y H > S+ 0 0 36 -4,-0.3 4,-1.9 3,-0.2 5,-0.2 0.974 79.0 44.6 -62.8 -57.8 -1.1 22.7 12.6 320 112 B E H 4 S+ 0 0 127 1,-0.2 4,-0.4 2,-0.2 3,-0.2 0.938 122.7 32.2 -54.7 -60.1 -4.7 23.8 12.8 321 113 B A H 4 S+ 0 0 86 1,-0.2 4,-0.4 2,-0.1 -1,-0.2 0.847 127.2 39.4 -71.4 -34.5 -6.1 21.3 15.2 322 114 B G H X S+ 0 0 11 -4,-1.8 4,-2.5 -8,-0.2 5,-0.2 0.544 87.2 90.2 -97.0 -3.7 -3.0 20.7 17.3 323 115 B K H X S+ 0 0 45 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.925 88.0 49.4 -58.7 -48.2 -1.5 24.2 17.6 324 116 B D H > S+ 0 0 112 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.939 114.0 45.0 -57.7 -50.3 -3.3 25.2 20.8 325 117 B D H > S+ 0 0 107 -4,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.896 112.4 52.5 -60.4 -42.2 -2.4 22.0 22.6 326 118 B Y H X S+ 0 0 32 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.935 110.1 48.2 -59.2 -47.2 1.2 22.3 21.4 327 119 B V H < S+ 0 0 51 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.869 108.8 51.9 -64.4 -38.3 1.5 25.8 22.7 328 120 B K H < S+ 0 0 151 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.867 113.3 47.2 -65.1 -34.3 0.1 24.9 26.1 329 121 B A H >X S+ 0 0 51 -4,-1.8 4,-1.2 -5,-0.2 3,-0.6 0.723 90.9 86.8 -77.8 -23.5 2.7 22.1 26.3 330 122 B L H >X S+ 0 0 4 -4,-1.5 4,-2.2 1,-0.2 3,-0.7 0.835 79.2 58.6 -45.5 -52.9 5.5 24.4 25.1 331 123 B P H 3> S+ 0 0 62 0, 0.0 4,-2.5 0, 0.0 3,-0.3 0.928 107.4 47.9 -47.6 -49.1 6.5 25.8 28.6 332 124 B G H <4 S+ 0 0 46 -3,-0.6 -2,-0.2 -4,-0.3 -3,-0.1 0.789 112.1 50.4 -62.7 -29.8 7.2 22.3 29.8 333 125 B Q H << S+ 0 0 64 -4,-1.2 4,-0.3 -3,-0.7 -1,-0.2 0.772 114.4 43.6 -78.2 -29.7 9.3 21.5 26.7 334 126 B L H >X S+ 0 0 0 -4,-2.2 4,-1.4 -3,-0.3 3,-1.1 0.808 94.2 79.5 -85.3 -32.2 11.4 24.7 27.1 335 127 B K H 3X S+ 0 0 126 -4,-2.5 4,-2.8 -5,-0.3 5,-0.2 0.813 84.6 61.3 -43.8 -44.5 12.0 24.4 30.8 336 128 B P H 3> S+ 0 0 12 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.910 105.5 46.9 -54.7 -41.6 14.8 21.9 30.5 337 129 B F H <> S+ 0 0 2 -3,-1.1 4,-2.3 -4,-0.3 -2,-0.2 0.886 110.8 51.4 -69.1 -35.7 16.9 24.3 28.4 338 130 B E H X S+ 0 0 26 -4,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.935 111.5 49.1 -63.9 -44.0 16.3 27.1 30.9 339 131 B T H X S+ 0 0 59 -4,-2.8 4,-1.4 2,-0.2 -2,-0.2 0.907 108.6 51.6 -61.6 -45.2 17.4 24.7 33.7 340 132 B L H < S+ 0 0 17 -4,-2.5 3,-0.5 1,-0.2 4,-0.3 0.937 111.5 48.4 -58.0 -44.7 20.5 23.7 31.8 341 133 B L H >< S+ 0 0 0 -4,-2.3 3,-2.0 1,-0.2 6,-1.1 0.938 107.3 55.2 -60.8 -46.3 21.4 27.4 31.4 342 134 B S H 3X S+ 0 0 62 -4,-2.7 4,-0.6 1,-0.3 -1,-0.2 0.781 107.8 50.6 -60.0 -26.1 20.7 28.0 35.1 343 135 B Q T 3< S+ 0 0 148 -4,-1.4 2,-0.6 -3,-0.5 -1,-0.3 0.460 100.4 70.9 -91.7 -0.4 23.2 25.3 36.0 344 136 B N T X4>S- 0 0 24 -3,-2.0 3,-1.9 -4,-0.3 5,-0.6 -0.825 129.6 -47.1-121.7 92.1 25.9 26.7 33.7 345 137 B Q G >45S- 0 0 107 -2,-0.6 3,-2.1 1,-0.3 -2,-0.1 0.883 106.2 -63.0 53.3 41.8 27.4 30.0 35.0 346 138 B G G 3<5S- 0 0 44 -4,-0.6 -1,-0.3 1,-0.3 -4,-0.2 0.711 89.7 -68.9 58.2 21.7 23.9 31.3 35.7 347 139 B G G < 5S+ 0 0 1 -3,-1.9 -1,-0.3 -6,-1.1 -2,-0.2 0.650 105.2 125.5 72.8 17.3 23.2 31.2 32.0 348 140 B K T < 5S+ 0 0 162 -3,-2.1 -3,-0.1 -4,-0.3 -2,-0.1 0.614 75.7 23.6 -82.1 -15.1 25.6 34.0 31.3 349 141 B T S S- 0 0 11 3,-0.3 3,-0.6 -8,-0.0 -1,-0.3 -0.990 122.8 -29.1-139.3 125.7 27.3 23.9 27.9 353 145 B G T 3 S- 0 0 9 -2,-0.4 -3,-1.0 1,-0.2 -4,-0.1 -0.189 90.4 -64.3 68.0-161.5 30.6 25.1 29.2 354 146 B D T 3 S+ 0 0 101 -5,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.134 110.7 71.6-113.5 16.8 32.1 28.5 28.4 355 147 B Q S < S- 0 0 62 -3,-0.6 -3,-0.3 -69,-0.0 -67,-0.1 -0.964 89.2-100.8-130.2 147.1 32.7 28.0 24.6 356 148 B I - 0 0 12 -2,-0.3 -68,-0.3 -6,-0.1 2,-0.3 -0.352 41.0-169.0 -66.2 146.9 30.0 27.9 21.9 357 149 B S >> - 0 0 1 -70,-0.1 3,-1.1 -4,-0.1 4,-1.0 -0.867 39.4-102.1-132.2 168.5 29.0 24.4 20.6 358 150 B F H 3> S+ 0 0 0 -72,-2.5 4,-1.9 -2,-0.3 5,-0.2 0.829 120.5 63.5 -61.2 -29.0 27.0 23.1 17.8 359 151 B A H 3> S+ 0 0 0 -73,-0.3 4,-3.0 1,-0.2 -1,-0.3 0.826 95.1 60.4 -64.5 -31.0 24.2 22.5 20.2 360 152 B D H <> S+ 0 0 0 -3,-1.1 4,-3.0 2,-0.2 -1,-0.2 0.930 106.6 44.5 -61.8 -47.2 24.0 26.3 20.8 361 153 B Y H X S+ 0 0 0 -4,-1.0 4,-2.4 2,-0.2 -2,-0.2 0.903 115.2 48.8 -65.1 -39.6 23.2 27.0 17.2 362 154 B N H X S+ 0 0 4 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.923 114.6 44.4 -66.3 -43.9 20.7 24.1 17.1 363 155 B L H X S+ 0 0 0 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.917 111.4 54.5 -66.6 -41.4 19.0 25.3 20.3 364 156 B L H X S+ 0 0 0 -4,-3.0 4,-3.0 -5,-0.2 -2,-0.2 0.944 109.3 47.3 -58.8 -47.6 19.0 29.0 19.1 365 157 B D H X S+ 0 0 2 -4,-2.4 4,-2.9 1,-0.2 5,-0.3 0.938 110.3 52.3 -59.5 -46.5 17.2 28.0 15.9 366 158 B L H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.911 113.0 45.3 -54.3 -45.8 14.7 26.0 17.9 367 159 B L H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.937 111.7 52.0 -66.3 -44.3 14.0 29.0 20.1 368 160 B L H X S+ 0 0 34 -4,-3.0 4,-1.3 1,-0.2 3,-0.3 0.931 111.4 45.7 -58.9 -47.7 13.8 31.4 17.2 369 161 B I H X S+ 0 0 4 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.833 111.2 52.8 -68.0 -30.3 11.3 29.3 15.3 370 162 B H H X S+ 0 0 0 -4,-1.7 4,-3.3 -5,-0.3 -1,-0.2 0.814 102.1 59.3 -74.1 -25.8 9.2 28.8 18.4 371 163 B E H < S+ 0 0 72 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.876 108.5 45.7 -66.1 -38.0 9.1 32.6 19.0 372 164 B V H < S+ 0 0 57 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.912 116.1 45.6 -69.5 -42.6 7.5 32.8 15.5 373 165 B L H < S+ 0 0 5 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.895 132.9 16.3 -67.3 -43.2 5.1 30.0 16.4 374 166 B A S >< S- 0 0 10 -4,-3.3 3,-2.5 -5,-0.1 -1,-0.3 -0.712 83.8-146.2-135.5 81.7 4.2 31.3 19.8 375 167 B P T 3 S+ 0 0 112 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.184 86.6 18.2 -48.5 131.6 5.2 35.0 20.2 376 168 B G T > S+ 0 0 29 -5,-0.1 3,-2.5 1,-0.1 4,-0.4 0.335 80.1 130.0 85.8 -4.0 6.3 35.6 23.8 377 169 B C T < S+ 0 0 24 -3,-2.5 3,-0.3 1,-0.3 -6,-0.1 0.719 74.1 53.5 -56.1 -20.8 6.9 31.9 24.7 378 170 B L T > S+ 0 0 0 -4,-0.2 3,-1.9 1,-0.2 7,-0.4 0.527 81.7 90.5 -92.2 -6.2 10.3 32.9 26.0 379 171 B D T < S+ 0 0 127 -3,-2.5 -1,-0.2 1,-0.3 -2,-0.1 0.845 84.7 53.6 -57.8 -37.9 9.0 35.6 28.4 380 172 B A T 3 S+ 0 0 80 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.500 104.1 66.2 -74.8 -3.3 8.6 33.1 31.2 381 173 B F <> + 0 0 13 -3,-1.9 4,-2.7 1,-0.1 5,-0.2 -0.743 56.9 176.7-125.9 87.7 12.3 32.2 30.7 382 174 B P H > S+ 0 0 88 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.845 83.7 49.0 -56.1 -40.6 14.7 35.0 31.5 383 175 B L H > S+ 0 0 42 2,-0.2 4,-2.8 1,-0.2 5,-0.1 0.954 113.9 44.3 -67.5 -47.2 17.8 32.9 30.8 384 176 B L H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.890 114.8 50.2 -63.5 -41.5 16.6 31.6 27.5 385 177 B S H X S+ 0 0 41 -4,-2.7 4,-2.6 -7,-0.4 5,-0.2 0.960 114.4 43.0 -60.7 -52.2 15.4 35.1 26.4 386 178 B A H X S+ 0 0 51 -4,-2.4 4,-3.0 -5,-0.2 -2,-0.2 0.913 113.4 54.2 -59.0 -43.7 18.8 36.7 27.4 387 179 B Y H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.914 109.1 47.2 -56.8 -48.2 20.6 33.7 25.7 388 180 B V H X S+ 0 0 15 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.954 114.1 46.7 -61.1 -50.2 18.7 34.3 22.5 389 181 B G H X S+ 0 0 45 -4,-2.6 4,-0.8 1,-0.2 -2,-0.2 0.905 114.3 49.2 -58.5 -42.1 19.4 38.0 22.5 390 182 B R H >< S+ 0 0 79 -4,-3.0 3,-0.6 -5,-0.2 4,-0.4 0.945 114.6 40.7 -63.4 -54.9 23.0 37.4 23.3 391 183 B L H >< S+ 0 0 2 -4,-2.7 3,-1.3 1,-0.2 -1,-0.2 0.876 112.2 56.0 -64.1 -37.9 23.8 34.8 20.6 392 184 B S H 3< S+ 0 0 25 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.744 102.8 59.0 -65.3 -22.4 21.8 36.7 18.0 393 185 B A T << S+ 0 0 57 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.573 71.8 118.2 -83.4 -13.1 24.0 39.7 18.8 394 186 B R S <> S- 0 0 70 -3,-1.3 4,-3.3 -4,-0.4 3,-0.3 -0.438 75.2-121.5 -57.1 121.3 27.2 37.9 17.9 395 187 B P H > S+ 0 0 111 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.774 105.2 38.2 -30.9 -66.3 28.5 40.0 14.9 396 188 B K H > S+ 0 0 121 -165,-0.2 4,-2.7 2,-0.2 5,-0.1 0.924 120.1 47.6 -60.9 -43.5 28.7 37.4 12.1 397 189 B L H > S+ 0 0 0 -3,-0.3 4,-3.4 2,-0.2 5,-0.3 0.950 110.7 51.8 -61.2 -50.6 25.5 35.7 13.3 398 190 B K H X S+ 0 0 132 -4,-3.3 4,-1.3 1,-0.2 -1,-0.2 0.915 111.6 47.4 -51.7 -48.1 23.7 39.0 13.5 399 191 B A H X S+ 0 0 62 -4,-2.5 4,-0.8 -5,-0.3 3,-0.4 0.945 113.4 48.1 -61.3 -46.6 24.7 39.9 10.0 400 192 B F H >< S+ 0 0 14 -4,-2.7 3,-1.2 1,-0.2 6,-0.4 0.926 109.4 51.8 -60.3 -47.1 23.7 36.4 8.7 401 193 B L H 3< S+ 0 0 28 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.762 112.2 47.6 -62.9 -24.2 20.3 36.5 10.4 402 194 B A H 3< S+ 0 0 77 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.567 92.9 104.0 -92.4 -8.8 19.6 39.9 8.8 403 195 B S S XX S- 0 0 25 -3,-1.2 4,-2.9 -4,-0.8 3,-1.6 -0.390 80.2-122.5 -76.6 151.1 20.7 38.8 5.3 404 196 B P H 3> S+ 0 0 91 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.817 110.3 71.0 -57.8 -32.7 18.2 38.0 2.5 405 197 B E H 34 S+ 0 0 99 2,-0.2 -4,-0.1 1,-0.1 -5,-0.1 0.794 116.3 20.3 -51.9 -37.5 19.9 34.6 2.4 406 198 B Y H X4 S+ 0 0 22 -3,-1.6 3,-1.9 -6,-0.4 -1,-0.1 0.838 125.3 51.8 -99.0 -56.0 18.2 33.9 5.7 407 199 B V H 3< S+ 0 0 71 -4,-2.9 -2,-0.2 -7,-0.3 -6,-0.1 0.801 108.6 49.9 -54.4 -39.1 15.3 36.4 5.9 408 200 B N T 3< S+ 0 0 125 -4,-2.4 -1,-0.3 -5,-0.3 -3,-0.1 0.323 92.7 90.7 -88.4 10.7 13.8 35.6 2.5 409 201 B L S < S- 0 0 42 -3,-1.9 -191,-0.2 -5,-0.1 2,-0.1 -0.858 81.0-119.9-104.7 134.6 13.7 31.9 3.0 410 202 B P - 0 0 62 0, 0.0 -191,-2.6 0, 0.0 -190,-0.3 -0.457 14.5-129.8 -71.5 151.0 10.6 30.4 4.6 411 203 B I S S+ 0 0 6 -193,-0.2 -191,-2.5 -192,-0.2 2,-0.2 0.943 90.0 20.3 -64.3 -45.4 11.0 28.5 7.9 412 204 B N S > S- 0 0 7 4,-0.4 3,-0.6 -193,-0.1 -193,-0.1 -0.737 76.5-119.0-122.6 167.8 9.1 25.5 6.6 413 205 B G T 3 S+ 0 0 53 -2,-0.2 -1,-0.0 1,-0.2 -2,-0.0 0.681 106.6 54.4 -81.0 -18.9 8.1 24.0 3.2 414 206 B N T 3 S- 0 0 58 2,-0.2 -1,-0.2 0, 0.0 3,-0.1 0.321 111.8-109.5 -98.3 8.3 4.4 24.2 3.6 415 207 B G S < S+ 0 0 66 -3,-0.6 2,-0.3 1,-0.3 -2,-0.1 0.569 79.2 122.9 79.0 6.5 4.1 27.9 4.4 416 208 B K 0 0 65 1,-0.1 -4,-0.4 -101,-0.0 -1,-0.3 -0.695 360.0 360.0-101.6 156.2 3.2 27.4 8.0 417 209 B Q 0 0 100 -2,-0.3 -1,-0.1 -3,-0.1 -102,-0.1 0.253 360.0 360.0-170.0 360.0 5.1 28.7 11.0