==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 10-DEC-09 3L0H . COMPND 2 MOLECULE: GLUTATHIONE S-TRANSFERASE A1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.FANUCCHI,I.A.ACHILONU,R.J.ADAMSON,M.A.FERNANDES,J.P.BURKE, . 440 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21451.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 322 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 4.1 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 . 2 0.5 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 . 1 0.2 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 . 20 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 208 47.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.7 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 0 0 0 2 0 4 1 4 3 0 2 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 1 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 2 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 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 A 0 0 159 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -97.3 28.6 36.7 -13.4 2 3 A E - 0 0 173 3,-0.0 58,-0.3 1,-0.0 3,-0.1 -0.933 360.0-126.9-123.7 128.5 30.5 36.3 -10.1 3 4 A K - 0 0 119 -2,-0.4 26,-0.2 1,-0.1 2,-0.1 -0.254 50.3 -94.2 -50.9 145.0 32.9 33.9 -8.5 4 5 A P - 0 0 9 0, 0.0 26,-3.3 0, 0.0 2,-0.6 -0.418 38.6-140.2 -69.8 146.6 31.6 32.8 -5.2 5 6 A K E -aB 30 58A 46 53,-2.4 53,-2.1 24,-0.2 2,-0.5 -0.920 9.5-154.8-115.2 119.2 33.1 34.8 -2.3 6 7 A L E -aB 31 57A 0 24,-2.2 26,-3.4 -2,-0.6 2,-0.6 -0.809 2.0-161.7 -95.4 118.4 34.1 33.0 1.1 7 8 A H E +aB 32 56A 0 49,-3.0 49,-1.4 -2,-0.5 2,-0.3 -0.885 42.3 106.2-100.1 112.0 34.1 35.0 4.4 8 9 A Y E S-a 33 0A 18 24,-1.0 26,-3.1 -2,-0.6 2,-0.1 -0.954 70.2 -82.3-163.5 172.0 36.2 33.3 7.1 9 10 A F - 0 0 5 -2,-0.3 2,-1.5 24,-0.2 26,-0.1 -0.478 58.9 -90.3 -79.2 162.5 39.5 33.5 9.0 10 11 A N S S+ 0 0 84 24,-0.5 2,-0.3 -2,-0.1 3,-0.1 -0.613 97.0 78.5 -73.6 88.8 42.6 32.0 7.3 11 12 A A S S- 0 0 5 -2,-1.5 4,-0.2 1,-0.2 -2,-0.1 -0.933 90.8 -95.9 176.9 158.2 42.3 28.5 8.8 12 13 A R S >> S+ 0 0 27 193,-0.6 4,-1.5 -2,-0.3 3,-1.0 0.981 72.1 126.2 -54.6 -65.8 40.3 25.3 8.3 13 14 A G T 34 S- 0 0 23 1,-0.2 4,-0.3 2,-0.2 3,-0.2 -0.042 91.8 -34.5 36.9-127.8 37.6 25.8 10.9 14 15 A R T 34 S+ 0 0 96 1,-0.2 -1,-0.2 2,-0.1 4,-0.2 0.421 134.4 67.0-103.1 -4.3 34.1 25.5 9.5 15 16 A M T X> S+ 0 0 0 -3,-1.0 4,-1.5 -4,-0.2 3,-0.6 0.636 79.8 79.2 -84.5 -17.8 35.0 26.9 6.1 16 17 A E H 3X S+ 0 0 3 -4,-1.5 4,-2.4 1,-0.2 3,-0.4 0.915 83.9 57.2 -68.6 -45.0 37.2 24.1 4.9 17 18 A S H 3> S+ 0 0 24 -4,-0.3 4,-1.7 1,-0.3 -1,-0.2 0.820 108.9 49.8 -53.7 -32.5 34.6 21.5 3.9 18 19 A T H <> S+ 0 0 0 -3,-0.6 4,-2.9 -4,-0.2 -1,-0.3 0.863 106.8 54.6 -71.4 -39.9 33.2 24.2 1.5 19 20 A R H X S+ 0 0 0 -4,-1.5 4,-2.1 -3,-0.4 5,-0.2 0.939 112.6 43.5 -57.0 -47.0 36.7 24.9 0.1 20 21 A A H X S+ 0 0 5 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.821 113.7 50.4 -75.3 -31.5 37.1 21.2 -0.7 21 22 A L H X S+ 0 0 0 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.919 112.9 45.5 -70.8 -46.8 33.5 20.8 -2.1 22 23 A L H <>S+ 0 0 0 -4,-2.9 5,-3.1 1,-0.2 -2,-0.2 0.918 114.8 46.7 -65.9 -43.3 33.9 23.8 -4.5 23 24 A A H ><5S+ 0 0 20 -4,-2.1 3,-0.9 -5,-0.2 -1,-0.2 0.836 109.8 54.6 -64.5 -36.4 37.3 22.8 -5.8 24 25 A A H 3<5S+ 0 0 10 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.875 107.8 49.8 -63.8 -34.8 36.2 19.2 -6.3 25 26 A A T 3<5S- 0 0 33 -4,-1.7 -1,-0.2 2,-0.1 -2,-0.2 0.384 120.7-113.7 -79.9 -4.4 33.3 20.5 -8.5 26 27 A G T < 5 + 0 0 52 -3,-0.9 2,-0.5 1,-0.2 -3,-0.2 0.834 65.9 150.9 75.5 32.4 35.9 22.6 -10.4 27 28 A V < - 0 0 20 -5,-3.1 2,-0.3 -6,-0.2 -1,-0.2 -0.880 38.0-143.5-107.1 123.6 34.4 25.8 -9.1 28 29 A E + 0 0 137 -2,-0.5 2,-0.3 -5,-0.0 -5,-0.0 -0.656 25.5 175.4 -84.1 143.9 36.7 28.9 -8.7 29 30 A F - 0 0 28 -2,-0.3 2,-0.2 -26,-0.2 -24,-0.2 -0.938 27.2-124.8-143.6 159.9 36.0 31.3 -5.8 30 31 A E E -a 5 0A 89 -26,-3.3 -24,-2.2 -2,-0.3 2,-0.4 -0.625 23.1-149.4 -98.2 167.2 37.4 34.4 -4.1 31 32 A E E -a 6 0A 43 -2,-0.2 2,-0.6 -26,-0.2 -24,-0.2 -0.997 6.9-160.0-141.7 127.9 38.2 34.5 -0.4 32 33 A K E -a 7 0A 97 -26,-3.4 -24,-1.0 -2,-0.4 2,-0.5 -0.879 20.3-141.8-114.9 110.6 38.1 37.4 2.0 33 34 A F E -a 8 0A 75 -2,-0.6 2,-0.4 -26,-0.2 -24,-0.2 -0.515 4.0-147.7 -79.9 112.9 40.2 36.8 5.0 34 35 A I + 0 0 7 -26,-3.1 -24,-0.5 -2,-0.5 -1,-0.1 -0.643 23.4 171.3 -69.2 123.8 38.8 38.1 8.4 35 36 A K + 0 0 140 -2,-0.4 2,-0.3 -26,-0.1 -1,-0.1 0.603 50.1 22.9-117.8 -5.2 41.7 39.1 10.5 36 37 A S S > S- 0 0 39 1,-0.1 4,-1.8 182,-0.1 5,-0.1 -0.935 76.6-102.2-153.7 166.8 40.5 40.9 13.6 37 38 A A H > S+ 0 0 13 -2,-0.3 4,-2.0 1,-0.2 3,-0.3 0.978 124.3 53.9 -59.3 -49.4 37.5 41.3 16.0 38 39 A E H > S+ 0 0 132 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.756 102.4 56.8 -45.7 -40.4 36.9 44.7 14.1 39 40 A D H > S+ 0 0 41 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.943 109.9 45.0 -61.3 -48.3 36.8 42.9 10.7 40 41 A L H X S+ 0 0 0 -4,-1.8 4,-1.8 -3,-0.3 3,-0.3 0.886 109.7 55.7 -57.6 -43.6 34.0 40.6 12.0 41 42 A D H X S+ 0 0 41 -4,-2.0 4,-3.3 1,-0.2 -1,-0.2 0.797 102.1 57.3 -61.4 -37.9 32.2 43.6 13.5 42 43 A K H X S+ 0 0 119 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.865 107.4 46.9 -54.3 -45.5 32.2 45.4 10.1 43 44 A L H <>S+ 0 0 8 -4,-1.2 5,-2.4 -3,-0.3 6,-0.5 0.820 113.5 49.3 -75.8 -32.3 30.3 42.4 8.5 44 45 A R H ><5S+ 0 0 57 -4,-1.8 3,-1.8 4,-0.2 -2,-0.2 0.968 113.7 44.5 -64.3 -54.0 27.9 42.4 11.4 45 46 A N H 3<5S+ 0 0 141 -4,-3.3 -2,-0.2 1,-0.3 -1,-0.2 0.727 107.8 59.8 -69.5 -19.1 27.2 46.2 11.2 46 47 A D T 3<5S- 0 0 67 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.517 115.2-116.4 -81.6 -4.2 27.0 45.9 7.3 47 48 A G T < 5S+ 0 0 43 -3,-1.8 -3,-0.2 -4,-0.2 -2,-0.1 0.681 77.5 128.6 83.0 22.7 24.0 43.5 7.8 48 49 A Y < + 0 0 79 -5,-2.4 2,-0.5 -6,-0.2 -4,-0.2 0.631 53.4 65.1 -88.6 -16.9 26.0 40.7 6.1 49 50 A L > - 0 0 3 -6,-0.5 3,-1.8 -5,-0.2 -1,-0.1 -0.908 62.1-157.8-119.5 105.8 25.6 37.9 8.7 50 51 A M T 3 S+ 0 0 36 -2,-0.5 -1,-0.2 1,-0.3 14,-0.0 0.894 100.5 20.8 -49.4 -51.4 22.0 36.5 9.4 51 52 A F T 3 S- 0 0 2 2,-0.3 -1,-0.3 303,-0.0 3,-0.1 0.009 115.2-103.9-100.4 20.5 23.1 35.2 13.0 52 53 A Q S < S+ 0 0 61 -3,-1.8 2,-0.3 1,-0.2 -8,-0.1 0.658 89.2 105.5 66.1 16.3 26.1 37.5 13.4 53 54 A Q - 0 0 64 2,-0.1 -2,-0.3 -9,-0.1 -1,-0.2 -0.917 59.9-102.3-125.4 154.2 28.5 34.5 12.6 54 55 A V S S+ 0 0 16 -2,-0.3 2,-0.2 -3,-0.1 -46,-0.1 -0.718 73.7 84.5-101.8 166.6 30.7 33.2 9.9 55 56 A P + 0 0 6 0, 0.0 11,-0.8 0, 0.0 2,-0.4 0.300 61.8 168.0 -53.6 137.0 31.1 31.1 7.5 56 57 A M E -BC 7 65A 0 -49,-1.4 -49,-3.0 9,-0.2 2,-0.4 -0.995 15.9-167.2-131.0 140.4 29.3 33.3 5.1 57 58 A V E -BC 6 64A 0 7,-2.9 7,-2.8 -2,-0.4 2,-0.7 -0.991 14.3-148.3-127.4 123.9 29.3 32.8 1.3 58 59 A E E +BC 5 63A 50 -53,-2.1 -53,-2.4 -2,-0.4 2,-0.3 -0.859 39.1 150.0 -86.4 116.0 28.1 35.2 -1.4 59 60 A I E > - C 0 62A 9 3,-1.4 3,-1.8 -2,-0.7 -56,-0.1 -0.938 60.1 -8.6-154.4 125.7 26.7 33.1 -4.2 60 61 A D T 3 S- 0 0 60 -58,-0.3 3,-0.1 -2,-0.3 -1,-0.0 0.883 129.7 -47.3 56.3 46.9 24.0 33.6 -6.8 61 62 A G T 3 S+ 0 0 87 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.332 116.5 112.9 80.3 -8.4 22.7 36.9 -5.2 62 63 A M E < -C 59 0A 24 -3,-1.8 -3,-1.4 2,-0.0 2,-0.6 -0.605 61.6-146.3 -99.6 155.5 22.6 35.4 -1.7 63 64 A K E -C 58 0A 84 -2,-0.2 2,-0.6 -5,-0.2 -13,-0.2 -0.871 33.3-166.7-111.6 83.6 24.5 35.9 1.6 64 65 A L E -C 57 0A 0 -7,-2.8 -7,-2.9 -2,-0.6 2,-0.3 -0.738 10.0-179.4 -79.5 117.0 24.4 32.3 2.8 65 66 A V E +C 56 0A 4 -2,-0.6 -9,-0.2 -9,-0.2 -11,-0.1 -0.766 46.1 61.2-107.5 160.2 25.3 31.6 6.5 66 67 A Q S >> S- 0 0 23 -11,-0.8 4,-2.4 -2,-0.3 3,-0.9 0.712 76.8-118.9 83.5 114.0 25.4 28.1 8.2 67 68 A T H 3> S+ 0 0 27 1,-0.3 4,-3.4 2,-0.2 5,-0.2 0.880 112.7 49.1 -40.3 -60.0 27.8 25.4 6.8 68 69 A R H 3> S+ 0 0 60 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.764 109.3 51.6 -58.2 -31.5 25.0 23.0 5.9 69 70 A A H <> S+ 0 0 0 -3,-0.9 4,-1.9 2,-0.2 -1,-0.2 0.961 113.9 43.9 -72.1 -49.4 23.0 25.6 4.1 70 71 A I H X S+ 0 0 1 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.974 117.5 45.7 -54.1 -53.2 26.1 26.6 2.0 71 72 A L H X S+ 0 0 11 -4,-3.4 4,-2.5 1,-0.2 5,-0.2 0.894 110.5 51.3 -62.8 -45.8 27.1 22.9 1.3 72 73 A N H X S+ 0 0 10 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.870 112.7 48.2 -59.4 -42.1 23.6 21.7 0.4 73 74 A Y H X S+ 0 0 9 -4,-1.9 4,-2.2 -3,-0.2 -1,-0.2 0.881 113.7 44.3 -59.0 -44.5 23.3 24.6 -2.1 74 75 A I H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.932 113.7 51.6 -72.7 -40.7 26.7 24.0 -3.8 75 76 A A H <>S+ 0 0 0 -4,-2.5 5,-3.3 1,-0.2 6,-0.4 0.873 112.3 45.2 -63.5 -44.3 26.1 20.2 -3.9 76 77 A S H ><5S+ 0 0 27 -4,-1.7 3,-1.4 -5,-0.2 -1,-0.2 0.900 109.5 54.5 -64.1 -50.8 22.8 20.5 -5.5 77 78 A K H 3<5S+ 0 0 74 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.836 114.5 39.9 -53.3 -41.1 23.9 23.1 -8.1 78 79 A Y T 3<5S- 0 0 74 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 -0.108 116.4-105.4-111.7 33.7 26.8 21.0 -9.4 79 80 A N T < 5S+ 0 0 118 -3,-1.4 3,-0.2 1,-0.1 -3,-0.2 0.733 82.8 123.7 58.1 36.0 25.0 17.6 -9.4 80 81 A L < + 0 0 13 -5,-3.3 74,-2.2 -6,-0.2 75,-0.2 0.021 52.4 77.2-112.9 27.3 26.8 16.2 -6.3 81 82 A Y S S- 0 0 6 1,-0.5 3,-0.2 -6,-0.4 -1,-0.2 -0.162 104.0 -95.7-130.3 37.3 23.7 15.4 -4.2 82 83 A G - 0 0 25 -3,-0.2 -1,-0.5 70,-0.2 3,-0.1 -0.151 38.1 -87.2 70.6-173.1 22.4 12.1 -5.9 83 84 A K S S+ 0 0 162 -3,-0.1 2,-0.2 1,-0.1 -1,-0.2 0.487 97.3 11.4-115.3 -7.9 19.8 11.8 -8.6 84 85 A D S > S- 0 0 59 -3,-0.2 4,-2.3 1,-0.1 5,-0.1 -0.923 85.1 -83.3-158.8 179.0 16.6 11.5 -6.4 85 86 A I H > S+ 0 0 50 -2,-0.2 4,-1.4 1,-0.2 211,-0.1 0.893 124.1 49.3 -61.9 -37.6 15.0 11.8 -2.8 86 87 A K H > S+ 0 0 94 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.846 110.8 48.0 -73.2 -37.4 16.1 8.3 -1.9 87 88 A E H > S+ 0 0 35 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.904 109.7 54.6 -67.8 -37.4 19.7 8.8 -3.0 88 89 A R H X S+ 0 0 62 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.829 104.5 55.3 -67.3 -26.6 19.6 12.1 -1.0 89 90 A A H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.984 110.0 43.6 -66.1 -54.5 18.6 10.2 2.1 90 91 A L H X S+ 0 0 57 -4,-1.7 4,-2.0 1,-0.2 5,-0.2 0.912 113.7 51.7 -56.4 -46.7 21.5 7.8 2.0 91 92 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.939 111.7 46.6 -51.2 -50.3 23.9 10.6 1.2 92 93 A D H X S+ 0 0 4 -4,-2.0 4,-1.7 1,-0.2 197,-0.2 0.859 109.6 53.5 -65.9 -36.9 22.6 12.7 4.2 93 94 A M H X S+ 0 0 12 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.951 114.3 43.0 -61.3 -45.0 22.8 9.7 6.6 94 95 A Y H X S+ 0 0 22 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.865 115.1 46.6 -68.4 -41.6 26.5 9.1 5.6 95 96 A I H X S+ 0 0 11 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.682 106.9 56.9 -87.1 -16.2 27.6 12.7 5.7 96 97 A E H X S+ 0 0 11 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.811 107.4 49.8 -75.6 -36.2 25.9 13.5 9.1 97 98 A G H X S+ 0 0 0 -4,-1.4 4,-1.9 -5,-0.2 5,-0.3 0.907 110.9 50.0 -61.5 -42.4 28.0 10.6 10.6 98 99 A I H X S+ 0 0 11 -4,-1.7 4,-3.0 1,-0.2 -2,-0.2 0.895 110.1 50.9 -62.8 -37.4 31.1 12.2 9.0 99 100 A A H X S+ 0 0 29 -4,-1.2 4,-3.7 2,-0.2 -2,-0.2 0.885 106.5 55.4 -67.6 -38.5 30.0 15.6 10.5 100 101 A D H X S+ 0 0 49 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.890 115.7 35.2 -60.3 -49.3 29.7 14.0 13.9 101 102 A L H X S+ 0 0 3 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.852 116.2 58.5 -70.9 -40.8 33.3 12.6 13.9 102 103 A G H X S+ 0 0 26 -4,-3.0 4,-1.8 -5,-0.3 -2,-0.2 0.921 105.4 48.7 -50.5 -53.3 34.3 15.8 12.0 103 104 A E H X S+ 0 0 73 -4,-3.7 4,-2.0 1,-0.2 -1,-0.2 0.893 106.3 56.5 -51.2 -49.7 33.0 17.9 14.9 104 105 A M H < S+ 0 0 61 -4,-1.3 4,-0.4 1,-0.2 -1,-0.2 0.910 110.3 44.9 -50.6 -41.2 34.9 15.8 17.5 105 106 A I H >< S+ 0 0 29 -4,-1.7 3,-0.8 1,-0.2 -2,-0.2 0.911 110.8 53.1 -75.3 -34.9 38.2 16.5 15.7 106 107 A L H 3< S+ 0 0 57 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.854 111.5 43.6 -68.5 -42.5 37.7 20.2 15.2 107 108 A L T >< S+ 0 0 80 -4,-2.0 3,-0.5 1,-0.2 -1,-0.3 0.358 85.4 97.8 -89.6 0.9 36.9 21.0 18.9 108 109 A L G X S+ 0 0 31 -3,-0.8 3,-1.5 -4,-0.4 -1,-0.2 0.923 78.8 54.9 -51.7 -50.0 39.7 18.9 20.2 109 110 A P G 3 S+ 0 0 54 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.771 102.0 56.7 -57.6 -29.3 42.0 21.9 20.6 110 111 A V G < S+ 0 0 60 -3,-0.5 -2,-0.1 -4,-0.2 -3,-0.1 0.181 82.2 118.9 -94.3 17.0 39.6 23.9 22.8 111 112 A C S < S- 0 0 20 -3,-1.5 5,-0.1 1,-0.1 -3,-0.0 -0.419 77.8 -99.1 -71.6 149.1 39.4 21.1 25.4 112 113 A P >> - 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0 0 23 -5,-2.5 -1,-0.2 -6,-0.2 2,-0.2 -0.896 40.8-143.0-103.3 121.4 1.0 11.8 8.3 248 29 B E + 0 0 151 -2,-0.6 2,-0.3 -5,-0.0 -5,-0.0 -0.578 30.2 174.2 -77.1 140.5 -0.0 9.0 10.7 249 30 B F - 0 0 32 -2,-0.2 2,-0.3 -26,-0.2 -24,-0.2 -0.941 27.0-119.2-149.0 157.4 3.0 7.0 12.2 250 31 B E E -d 225 0B 109 -26,-3.1 -24,-3.3 -2,-0.3 2,-0.5 -0.785 17.4-152.3-102.0 153.0 4.0 4.3 14.7 251 32 B E E -d 226 0B 43 -2,-0.3 2,-0.6 -26,-0.2 -24,-0.2 -0.981 4.2-164.4-122.3 128.1 6.4 4.6 17.7 252 33 B K E -d 227 0B 120 -26,-3.2 -24,-1.4 -2,-0.5 2,-0.6 -0.931 22.2-144.8-107.2 114.6 8.5 1.7 19.1 253 34 B F E -d 228 0B 61 -2,-0.6 2,-0.3 -26,-0.2 -24,-0.2 -0.716 3.8-146.0 -90.4 120.2 9.8 2.8 22.6 254 35 B I E +d 229 0B 6 -26,-1.9 -24,-0.6 -2,-0.6 184,-0.1 -0.670 22.1 172.7 -68.9 130.4 13.2 1.7 23.9 255 36 B K + 0 0 118 -2,-0.3 2,-0.2 -26,-0.1 -1,-0.1 0.681 59.1 23.1-108.7 -37.6 12.9 1.2 27.7 256 37 B S S > S- 0 0 42 182,-0.1 4,-1.0 181,-0.1 -1,-0.1 -0.644 79.5-105.7-121.8 179.6 16.3 -0.3 28.7 257 38 B A H > S+ 0 0 21 -2,-0.2 4,-2.0 2,-0.2 5,-0.1 0.703 120.5 61.6 -78.4 -17.6 19.9 -0.4 27.4 258 39 B E H > S+ 0 0 157 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.820 99.0 55.9 -71.0 -35.5 19.1 -4.1 26.4 259 40 B D H > S+ 0 0 68 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.894 109.5 45.2 -64.1 -43.8 16.4 -2.7 24.0 260 41 B L H >X S+ 0 0 0 -4,-1.0 4,-2.2 2,-0.2 3,-0.7 0.960 110.7 53.1 -60.5 -55.3 19.1 -0.5 22.2 261 42 B D H 3X S+ 0 0 53 -4,-2.0 4,-2.5 1,-0.3 -2,-0.2 0.751 103.5 58.0 -51.8 -37.5 21.7 -3.3 22.1 262 43 B K H 3X S+ 0 0 129 -4,-1.6 4,-1.9 2,-0.2 -1,-0.3 0.884 108.1 45.9 -58.1 -45.1 19.0 -5.5 20.4 263 44 B L H <<>S+ 0 0 17 -4,-1.2 5,-2.2 -3,-0.7 6,-0.4 0.930 113.4 49.4 -63.5 -49.0 18.7 -2.9 17.6 264 45 B R H ><5S+ 0 0 52 -4,-2.2 3,-2.4 1,-0.2 5,-0.4 0.980 113.3 46.7 -48.1 -66.0 22.5 -2.6 17.3 265 46 B N H 3<5S+ 0 0 134 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.712 106.0 57.6 -43.1 -46.7 22.9 -6.4 17.1 266 47 B D T 3<5S- 0 0 80 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.359 117.0-114.2 -66.7 -3.0 20.1 -6.8 14.5 267 48 B G T < 5S+ 0 0 48 -3,-2.4 -3,-0.2 -4,-0.2 -2,-0.2 0.595 77.8 129.1 80.4 16.3 22.0 -4.4 12.2 268 49 B Y < + 0 0 74 -5,-2.2 2,-0.5 -6,-0.2 -4,-0.2 0.556 54.2 63.2 -84.1 -12.3 19.4 -1.7 12.4 269 50 B L > - 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0 0 30 70,-0.3 -1,-0.4 -3,-0.2 3,-0.1 -0.147 36.9 -80.1 85.2 179.0 10.3 24.9 -0.9 303 84 B K S S- 0 0 155 1,-0.1 2,-0.2 -3,-0.1 -1,-0.1 0.672 100.3 -9.1 -95.5 -20.2 9.8 25.1 -4.7 304 85 B D S > S- 0 0 68 -3,-0.1 4,-2.5 0, 0.0 5,-0.2 -0.897 85.6 -73.4-163.6-173.6 13.5 25.0 -5.8 305 86 B I H > S+ 0 0 67 -2,-0.2 4,-1.1 2,-0.2 -228,-0.1 0.745 123.8 53.6 -78.1 -19.5 17.2 25.2 -4.6 306 87 B K H > S+ 0 0 104 2,-0.2 4,-1.9 3,-0.1 3,-0.3 0.959 111.7 46.0 -71.8 -52.7 17.2 28.9 -3.8 307 88 B E H > S+ 0 0 34 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.937 110.9 51.9 -46.5 -56.1 14.1 28.4 -1.6 308 89 B R H X S+ 0 0 18 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.846 107.6 57.7 -45.0 -39.7 15.7 25.3 0.0 309 90 B A H X S+ 0 0 2 -4,-1.1 4,-2.3 -3,-0.3 -2,-0.2 0.920 108.8 39.8 -64.3 -53.8 18.7 27.6 0.6 310 91 B L H X S+ 0 0 57 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.897 116.9 52.9 -55.9 -46.0 16.8 30.3 2.6 311 92 B I H X S+ 0 0 0 -4,-3.0 4,-2.1 -5,-0.2 -2,-0.2 0.912 111.1 46.5 -59.7 -41.0 14.9 27.4 4.3 312 93 B D H X S+ 0 0 3 -4,-2.9 4,-1.5 -5,-0.2 -1,-0.2 0.880 108.6 53.2 -70.3 -46.6 18.2 25.8 5.3 313 94 B M H X S+ 0 0 15 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.891 114.1 45.4 -49.9 -45.8 19.9 29.0 6.6 314 95 B Y H X S+ 0 0 20 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.909 113.1 45.9 -67.6 -43.0 16.8 29.5 8.8 315 96 B I H X S+ 0 0 8 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.732 108.0 56.1 -82.1 -16.3 16.4 26.0 10.2 316 97 B E H X S+ 0 0 12 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.866 108.0 48.8 -78.5 -33.6 20.1 25.5 11.0 317 98 B G H X S+ 0 0 0 -4,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.875 112.5 48.9 -67.5 -41.5 20.0 28.7 13.1 318 99 B I H X S+ 0 0 10 -4,-1.8 4,-3.8 2,-0.2 3,-0.2 0.971 111.2 50.5 -58.4 -55.8 16.8 27.3 14.8 319 100 B A H X S+ 0 0 29 -4,-3.0 4,-3.2 1,-0.2 -2,-0.2 0.859 105.7 56.5 -47.6 -41.1 18.7 23.9 15.3 320 101 B D H X S+ 0 0 51 -4,-1.6 4,-1.1 2,-0.2 -1,-0.2 0.924 114.9 36.7 -68.3 -49.2 21.6 25.8 16.9 321 102 B L H X S+ 0 0 1 -4,-1.8 4,-1.8 -3,-0.2 3,-0.5 0.935 113.8 58.8 -60.9 -52.3 19.4 27.4 19.5 322 103 B G H X S+ 0 0 21 -4,-3.8 4,-2.6 1,-0.2 3,-0.4 0.915 104.6 51.4 -34.4 -56.8 17.4 24.1 19.7 323 104 B E H X S+ 0 0 77 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.806 104.3 54.9 -56.4 -41.3 20.6 22.2 20.7 324 105 B M H < S+ 0 0 52 -4,-1.1 4,-0.4 -3,-0.5 -1,-0.2 0.920 114.7 41.8 -58.9 -39.3 21.5 24.7 23.5 325 106 B I H >< S+ 0 0 33 -4,-1.8 3,-1.1 -3,-0.4 -2,-0.2 0.951 111.8 54.8 -73.3 -47.7 17.9 24.0 25.0 326 107 B L H 3< S+ 0 0 55 -4,-2.6 4,-0.2 1,-0.3 -1,-0.2 0.816 114.5 38.5 -50.4 -43.3 18.0 20.2 24.4 327 108 B L T >< S+ 0 0 74 -4,-1.8 3,-0.7 1,-0.2 -1,-0.3 0.478 84.9 100.5 -97.5 -3.6 21.3 19.7 26.3 328 109 B L G X S+ 0 0 22 -3,-1.1 3,-1.0 -4,-0.4 -1,-0.2 0.858 83.9 49.7 -56.5 -30.4 20.7 22.1 29.1 329 110 B P G 3 S+ 0 0 50 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.826 104.6 54.5 -86.7 -20.5 19.8 19.3 31.5 330 111 B V G < S+ 0 0 50 -3,-0.7 -2,-0.2 -4,-0.2 -3,-0.1 0.295 88.7 119.0 -80.0 14.5 22.7 17.0 30.8 331 112 B C S < S- 0 0 20 -3,-1.0 5,-0.1 -4,-0.2 -3,-0.0 -0.526 81.3 -94.5 -83.9 137.0 24.9 20.0 31.7 332 113 B P >> - 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