==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-AUG-09 3IK9 . COMPND 2 MOLECULE: GLUTATHIONE S-TRANSFERASE A1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.M.BALOGH,I.LE TRONG,W.M.ATKINS,R.E.STENKAMP . 1751 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 79691.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1277 72.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 72 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 . 8 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 . 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 . 71 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 196 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 838 47.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 40 2.3 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 1 7 3 13 7 18 7 0 3 1 8 4 0 0 0 0 0 8 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 8 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 . 0 0 8 8 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 8 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 75 0, 0.0 2,-0.1 0, 0.0 58,-0.0 0.000 360.0 360.0 360.0-167.8 -1.5 -13.8 57.8 2 3 A E - 0 0 150 1,-0.1 58,-0.3 3,-0.0 3,-0.0 -0.356 360.0 -86.6 -87.0 170.5 -4.8 -15.6 58.2 3 4 A K - 0 0 102 -2,-0.1 26,-0.2 1,-0.1 2,-0.2 -0.575 56.6 -94.8 -64.4 143.3 -7.2 -17.1 55.6 4 5 A P - 0 0 4 0, 0.0 26,-2.4 0, 0.0 2,-0.5 -0.467 42.7-146.3 -58.2 130.1 -9.7 -14.4 54.3 5 6 A K E -aB 30 58A 48 53,-2.6 53,-2.4 24,-0.2 2,-0.6 -0.914 5.9-151.3-110.3 121.1 -12.9 -14.8 56.3 6 7 A L E -aB 31 57A 0 24,-2.7 26,-2.2 -2,-0.5 2,-0.7 -0.741 3.8-161.8 -94.9 116.3 -16.3 -14.1 54.7 7 8 A H E +aB 32 56A 5 49,-3.2 49,-1.4 -2,-0.6 2,-0.3 -0.851 42.9 107.6 -97.2 115.3 -19.3 -12.8 56.7 8 9 A Y E S-a 33 0A 11 24,-1.0 26,-3.1 -2,-0.7 5,-0.0 -0.966 71.2 -71.6-165.9 170.8 -22.6 -13.4 54.9 9 10 A F - 0 0 9 -2,-0.3 2,-1.7 24,-0.2 26,-0.1 -0.336 60.3 -96.6 -63.3 160.0 -25.7 -15.4 54.8 10 11 A N S S+ 0 0 78 24,-0.4 2,-0.3 23,-0.0 -1,-0.1 -0.687 98.4 62.4 -80.2 86.0 -25.3 -19.0 53.8 11 12 A G S S- 0 0 5 -2,-1.7 4,-0.1 1,-0.2 193,-0.1 -0.963 91.0 -83.4 173.3-177.2 -26.3 -18.3 50.2 12 13 A R S >> S+ 0 0 20 193,-0.5 3,-1.7 -2,-0.3 4,-1.2 0.993 71.2 110.6 -74.9 -79.4 -25.3 -16.4 47.0 13 14 A G G >4 S- 0 0 14 1,-0.2 3,-0.5 2,-0.2 4,-0.4 0.027 97.1 -15.7 27.1-123.1 -26.5 -12.8 47.0 14 15 A R G 34 S+ 0 0 84 1,-0.2 -1,-0.2 2,-0.1 4,-0.2 0.480 134.9 57.0 -87.8 -3.6 -23.8 -10.2 47.2 15 16 A M G X> S+ 0 0 0 -3,-1.7 4,-1.3 -4,-0.1 3,-0.7 0.674 84.7 81.1 -96.1 -16.9 -21.1 -12.5 48.5 16 17 A E H S+ 0 0 22 -4,-0.4 4,-1.8 1,-0.3 -1,-0.3 0.838 109.2 48.9 -58.3 -35.1 -19.0 -13.0 43.1 18 19 A T H <> S+ 0 0 0 -3,-0.7 4,-2.7 2,-0.2 5,-0.3 0.800 106.2 54.6 -70.4 -36.6 -16.2 -12.9 45.8 19 20 A R H X S+ 0 0 0 -4,-1.3 4,-3.0 -3,-0.5 5,-0.3 0.982 111.9 46.5 -63.1 -50.4 -16.4 -16.6 46.5 20 21 A W H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.862 113.5 47.4 -49.7 -49.1 -15.9 -17.2 42.7 21 22 A L H X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.889 114.0 45.4 -69.9 -44.2 -13.0 -14.7 42.5 22 23 A L H <>S+ 0 0 0 -4,-2.7 5,-2.4 2,-0.2 3,-0.3 0.963 117.9 43.8 -61.8 -49.0 -11.1 -16.0 45.5 23 24 A A H ><5S+ 0 0 16 -4,-3.0 3,-1.4 -5,-0.3 -2,-0.2 0.905 112.5 54.2 -62.3 -35.6 -11.7 -19.7 44.3 24 25 A A H 3<5S+ 0 0 5 -4,-2.6 -1,-0.2 -5,-0.3 169,-0.2 0.815 109.3 47.7 -67.3 -30.6 -10.7 -18.5 40.8 25 26 A A T 3<5S- 0 0 29 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.364 119.5-113.2 -87.3 -0.6 -7.5 -17.1 42.2 26 27 A G T < 5 + 0 0 52 -3,-1.4 2,-0.5 -4,-0.3 -3,-0.2 0.846 64.2 150.4 73.2 38.2 -6.8 -20.3 44.1 27 28 A V < - 0 0 16 -5,-2.4 2,-0.3 -6,-0.1 -1,-0.2 -0.899 41.5-139.9-110.9 119.2 -7.3 -18.8 47.6 28 29 A E + 0 0 155 -2,-0.5 2,-0.3 -5,-0.0 -5,-0.0 -0.635 32.4 174.3 -72.7 135.5 -8.6 -20.9 50.5 29 30 A F - 0 0 27 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.907 23.8-134.5-137.2 168.1 -11.0 -18.9 52.6 30 31 A E E -a 5 0A 57 -26,-2.4 -24,-2.7 -2,-0.3 2,-0.4 -0.857 14.1-144.4-120.9 157.6 -13.3 -19.5 55.6 31 32 A E E -a 6 0A 45 -2,-0.3 2,-0.6 -26,-0.2 -24,-0.2 -0.972 7.6-162.3-125.3 136.4 -16.8 -18.4 56.1 32 33 A K E -a 7 0A 125 -26,-2.2 -24,-1.0 -2,-0.4 2,-0.3 -0.961 30.4-138.0-111.6 109.5 -18.6 -17.3 59.2 33 34 A F E -a 8 0A 66 -2,-0.6 2,-0.8 -26,-0.2 -24,-0.2 -0.511 5.0-140.1 -81.7 133.3 -22.3 -17.6 58.4 34 35 A I + 0 0 5 -26,-3.1 -24,-0.4 -2,-0.3 -1,-0.1 -0.787 31.4 166.5 -85.1 107.8 -24.9 -15.0 59.5 35 36 A K + 0 0 127 -2,-0.8 2,-0.3 -26,-0.1 -1,-0.2 0.547 56.6 14.4-103.8 -15.1 -27.8 -17.2 60.5 36 37 A S S > S- 0 0 8 1,-0.1 4,-1.8 182,-0.0 3,-0.3 -0.954 81.5 -95.9-150.8 167.9 -30.1 -14.7 62.4 37 38 A A H > S+ 0 0 23 180,-0.6 4,-3.2 686,-0.4 5,-0.2 0.827 122.6 60.4 -52.1 -34.4 -30.7 -11.0 63.0 38 39 A E H > S+ 0 0 37 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.876 100.2 51.0 -69.9 -37.6 -28.7 -11.5 66.2 39 40 A D H > S+ 0 0 26 -3,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.949 113.8 46.5 -61.5 -44.2 -25.6 -12.6 64.2 40 41 A L H X S+ 0 0 2 -4,-1.8 4,-2.9 1,-0.2 3,-0.3 0.973 112.6 48.8 -61.8 -51.2 -26.0 -9.4 62.1 41 42 A D H X S+ 0 0 37 -4,-3.2 4,-2.8 1,-0.2 -1,-0.2 0.789 107.1 54.8 -64.8 -27.9 -26.5 -7.2 65.1 42 43 A K H X S+ 0 0 69 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.890 111.8 45.5 -66.4 -43.9 -23.5 -8.5 67.0 43 44 A L H <>S+ 0 0 20 -4,-1.8 5,-2.2 -3,-0.3 6,-0.6 0.934 114.9 47.6 -61.3 -49.4 -21.3 -7.7 64.0 44 45 A R H ><5S+ 0 0 26 -4,-2.9 3,-1.8 1,-0.2 5,-0.3 0.988 117.3 42.3 -53.4 -54.8 -23.0 -4.2 63.7 45 46 A N H 3<5S+ 0 0 76 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.700 107.1 58.7 -75.7 -21.4 -22.6 -3.6 67.4 46 47 A D T 3<5S- 0 0 72 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.473 116.0-115.7 -77.7 -4.5 -19.0 -4.9 67.6 47 48 A G T < 5S+ 0 0 41 -3,-1.8 -3,-0.2 -4,-0.5 -2,-0.2 0.743 78.9 127.9 78.9 26.2 -18.1 -2.3 65.0 48 49 A Y < + 0 0 78 -5,-2.2 2,-0.6 1,-0.2 -4,-0.2 0.693 61.9 63.5 -82.0 -21.0 -17.2 -4.8 62.3 49 50 A L > - 0 0 2 -6,-0.6 3,-2.2 -5,-0.3 -1,-0.2 -0.840 64.0-163.0-118.4 96.7 -19.5 -3.2 59.7 50 51 A M T 3 S+ 0 0 41 -2,-0.6 -1,-0.2 1,-0.3 14,-0.0 0.826 96.3 24.5 -48.4 -42.4 -18.7 0.4 58.6 51 52 A F T 3 S- 0 0 1 2,-0.3 -1,-0.3 303,-0.1 3,-0.1 0.184 115.2-105.5-110.7 18.2 -22.2 1.0 57.1 52 53 A Q S < S+ 0 0 26 -3,-2.2 2,-0.3 1,-0.2 -2,-0.1 0.670 86.4 106.5 68.1 24.1 -24.0 -1.7 59.1 53 54 A Q - 0 0 67 2,-0.1 -2,-0.3 -9,-0.1 -1,-0.2 -0.876 57.9-105.0-131.6 158.8 -24.2 -4.0 56.1 54 55 A V S S+ 0 0 21 -2,-0.3 2,-0.2 -3,-0.1 -46,-0.1 -0.816 72.7 85.3-115.4 161.2 -22.7 -7.2 54.8 55 56 A P + 0 0 4 0, 0.0 11,-0.8 0, 0.0 2,-0.3 0.345 59.9 166.6 -59.0 150.7 -20.8 -8.6 52.8 56 57 A M E -BC 7 65A 0 -49,-1.4 -49,-3.2 -2,-0.2 2,-0.4 -0.979 15.8-169.4-138.7 140.4 -17.8 -8.1 55.0 57 58 A V E -BC 6 64A 0 7,-2.1 7,-2.5 -2,-0.3 2,-0.6 -0.996 15.1-147.9-130.6 122.6 -14.5 -9.9 54.5 58 59 A E E +BC 5 63A 48 -53,-2.4 -53,-2.6 -2,-0.4 2,-0.3 -0.839 38.0 155.4 -86.2 121.5 -11.7 -9.9 57.0 59 60 A I E > - C 0 62A 6 3,-1.9 3,-1.7 -2,-0.6 -2,-0.1 -0.961 60.2 -7.5-155.6 125.9 -8.6 -10.0 54.8 60 61 A D T 3 S- 0 0 29 -2,-0.3 3,-0.1 -58,-0.3 -1,-0.0 0.882 126.8 -53.6 48.3 50.5 -5.1 -8.9 55.6 61 62 A G T 3 S+ 0 0 84 1,-0.2 2,-0.3 -59,-0.0 -1,-0.3 0.517 114.9 108.3 72.3 5.3 -6.0 -7.2 58.9 62 63 A M E < -C 59 0A 25 -3,-1.7 -3,-1.9 -5,-0.0 2,-0.7 -0.873 64.9-138.4-111.4 149.6 -8.8 -5.0 57.4 63 64 A K E -C 58 0A 90 -2,-0.3 2,-0.5 -5,-0.2 -13,-0.2 -0.894 31.9-165.5-103.1 100.2 -12.5 -5.4 57.8 64 65 A L E +C 57 0A 1 -7,-2.5 -7,-2.1 -2,-0.7 2,-0.2 -0.784 12.8 175.6-100.0 122.1 -13.8 -4.7 54.3 65 66 A V E +C 56 0A 3 -2,-0.5 -9,-0.2 -9,-0.2 4,-0.1 -0.674 44.7 64.6-113.6 173.9 -17.4 -3.9 53.5 66 67 A Q S >> S- 0 0 22 -11,-0.8 4,-2.5 -2,-0.2 3,-0.7 0.778 75.6-120.5 69.6 116.2 -18.9 -3.0 50.1 67 68 A T H 3> S+ 0 0 27 1,-0.3 4,-3.3 2,-0.2 5,-0.2 0.852 110.0 51.8 -50.8 -48.0 -18.8 -5.7 47.4 68 69 A R H 3> S+ 0 0 51 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.846 110.2 46.7 -63.0 -37.6 -16.8 -3.6 45.0 69 70 A A H <> S+ 0 0 0 -3,-0.7 4,-2.4 2,-0.2 5,-0.2 0.921 113.6 50.2 -70.6 -40.6 -14.1 -2.7 47.5 70 71 A I H X S+ 0 0 1 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.985 117.1 40.3 -56.3 -58.6 -13.9 -6.3 48.5 71 72 A L H X S+ 0 0 11 -4,-3.3 4,-3.5 1,-0.2 5,-0.2 0.828 112.4 53.7 -59.3 -44.0 -13.6 -7.4 44.9 72 73 A N H X S+ 0 0 15 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.913 111.2 47.2 -61.1 -43.7 -11.3 -4.6 43.7 73 74 A Y H X S+ 0 0 10 -4,-2.4 4,-3.0 -5,-0.2 -2,-0.2 0.953 115.4 44.5 -59.9 -48.2 -8.8 -5.4 46.5 74 75 A I H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 6,-0.3 0.976 113.8 50.7 -64.6 -52.7 -8.9 -9.2 45.7 75 76 A A H <>S+ 0 0 0 -4,-3.5 5,-2.9 1,-0.2 6,-0.7 0.886 115.5 42.1 -46.5 -48.9 -8.6 -8.5 41.9 76 77 A S H ><5S+ 0 0 36 -4,-2.3 3,-1.1 -5,-0.2 -1,-0.2 0.901 111.3 54.7 -73.7 -39.7 -5.7 -6.3 42.4 77 78 A K H 3<5S+ 0 0 43 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.905 116.8 36.7 -58.0 -42.6 -3.9 -8.5 45.0 78 79 A Y T 3<5S- 0 0 19 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.096 115.4-110.2-104.7 23.3 -4.0 -11.6 42.8 79 80 A N T < 5S+ 0 0 68 -3,-1.1 3,-0.2 -5,-0.1 -3,-0.2 0.780 81.9 123.7 56.8 36.4 -3.3 -9.7 39.5 80 81 A L < + 0 0 15 -5,-2.9 74,-2.8 -6,-0.3 75,-0.2 0.105 54.6 80.3-105.5 16.7 -6.8 -10.3 38.0 81 82 A Y S S- 0 0 18 -6,-0.7 -1,-0.2 1,-0.4 3,-0.1 -0.175 103.6-103.3-113.4 37.0 -7.3 -6.5 37.5 82 83 A G - 0 0 30 -3,-0.2 -1,-0.4 70,-0.2 3,-0.1 0.012 30.5 -92.1 66.2-178.1 -5.3 -6.1 34.3 83 84 A K S S+ 0 0 150 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.493 94.7 25.6-113.3 -12.0 -1.8 -4.7 33.9 84 85 A D S > S- 0 0 60 -3,-0.1 4,-2.2 1,-0.1 3,-0.4 -0.974 83.4 -95.7-152.0 169.2 -2.4 -1.0 33.2 85 86 A I H > S+ 0 0 46 -2,-0.3 4,-1.2 1,-0.2 212,-0.1 0.789 120.6 50.7 -57.8 -33.6 -4.8 1.9 33.6 86 87 A K H > S+ 0 0 91 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.845 108.0 51.8 -76.0 -33.9 -6.4 1.4 30.2 87 88 A E H > S+ 0 0 27 -3,-0.4 4,-3.2 1,-0.2 -2,-0.2 0.916 109.0 51.7 -65.7 -38.5 -7.0 -2.4 30.8 88 89 A R H X S+ 0 0 75 -4,-2.2 4,-3.4 2,-0.2 5,-0.3 0.850 106.4 54.3 -65.4 -32.8 -8.7 -1.4 34.1 89 90 A A H X S+ 0 0 2 -4,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.955 112.7 42.5 -63.5 -48.7 -10.9 1.0 32.2 90 91 A L H X S+ 0 0 65 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.936 116.9 48.1 -59.7 -46.7 -12.0 -1.8 29.9 91 92 A I H X S+ 0 0 0 -4,-3.2 4,-3.1 1,-0.2 5,-0.3 0.929 113.1 47.0 -63.8 -44.2 -12.4 -4.2 32.8 92 93 A D H X S+ 0 0 5 -4,-3.4 4,-1.9 1,-0.2 5,-0.2 0.896 110.8 51.6 -66.1 -41.2 -14.4 -1.7 34.9 93 94 A M H X S+ 0 0 14 -4,-2.4 4,-1.4 -5,-0.3 -1,-0.2 0.922 115.2 43.7 -61.0 -41.7 -16.6 -0.9 32.1 94 95 A Y H X S+ 0 0 19 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.955 114.3 45.8 -67.7 -53.2 -17.3 -4.6 31.5 95 96 A I H X S+ 0 0 9 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.780 110.1 56.1 -70.4 -20.9 -17.7 -5.7 35.1 96 97 A E H X S+ 0 0 8 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.866 106.8 49.3 -76.0 -37.4 -20.1 -2.7 35.8 97 98 A G H X S+ 0 0 0 -4,-1.4 4,-1.9 -5,-0.2 -2,-0.2 0.922 114.0 47.1 -59.2 -41.8 -22.3 -3.8 32.9 98 99 A I H X S+ 0 0 10 -4,-2.2 4,-4.1 1,-0.2 5,-0.2 0.948 110.7 51.1 -66.6 -45.7 -22.2 -7.3 34.5 99 100 A A H X S+ 0 0 31 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.850 106.9 54.7 -63.6 -35.0 -22.9 -6.0 38.0 100 101 A D H X S+ 0 0 48 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.971 115.6 38.0 -57.8 -54.3 -25.9 -4.0 36.6 101 102 A L H >X S+ 0 0 1 -4,-1.9 4,-1.5 1,-0.2 3,-1.4 0.977 116.9 52.3 -58.1 -52.7 -27.4 -7.2 35.1 102 103 A G H 3X S+ 0 0 16 -4,-4.1 4,-2.0 1,-0.3 -1,-0.2 0.785 102.1 60.3 -58.1 -33.4 -26.3 -9.3 38.1 103 104 A E H 3X S+ 0 0 68 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.3 0.831 102.4 52.2 -59.1 -38.3 -28.0 -6.8 40.4 104 105 A M H X S+ 0 0 83 -4,-1.8 3,-2.9 1,-0.2 4,-0.8 0.773 90.6 88.9 -82.0 -23.2 -33.1 -8.7 43.6 108 109 A L G >< S+ 0 0 9 -4,-1.7 3,-0.7 1,-0.3 -1,-0.2 0.792 83.9 53.9 -45.5 -44.0 -35.4 -11.0 41.6 109 110 A P G 34 S+ 0 0 32 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.494 108.0 52.9 -75.1 1.7 -36.3 -13.3 44.6 110 111 A F G <4 S+ 0 0 40 -3,-2.9 -2,-0.2 2,-0.1 -3,-0.1 0.599 83.0 95.6-109.4 -16.4 -37.3 -10.3 46.7 111 112 A C S << S- 0 0 22 -4,-0.8 5,-0.1 -3,-0.7 0, 0.0 -0.339 94.1 -77.9 -71.9 160.2 -39.8 -8.5 44.5 112 113 A P >> - 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0 0 2 -6,-0.5 3,-2.4 -5,-0.2 -1,-0.2 -0.838 64.0-163.6-107.1 100.8 -22.5 3.5 24.2 270 51 B M T 3 S+ 0 0 38 -2,-0.7 -1,-0.1 1,-0.3 -136,-0.1 0.751 94.9 25.7 -54.2 -33.6 -21.5 -0.2 25.1 271 52 B F T 3 S- 0 0 1 2,-0.3 -1,-0.3 -137,-0.1 3,-0.1 0.108 115.5-106.5-115.3 19.6 -24.7 -0.8 27.1 272 53 B Q S < S+ 0 0 64 -3,-2.4 2,-0.3 1,-0.2 -2,-0.1 0.660 87.8 110.2 62.8 20.7 -26.8 1.8 25.2 273 54 B Q - 0 0 62 2,-0.1 -2,-0.3 -9,-0.1 -1,-0.2 -0.845 56.3-115.3-123.1 158.9 -26.5 4.1 28.3 274 55 B V + 0 0 16 -2,-0.3 2,-0.2 -3,-0.1 -46,-0.1 -0.824 68.8 95.5-116.5 163.7 -24.9 7.3 29.4 275 56 B P + 0 0 5 0, 0.0 11,-0.6 0, 0.0 2,-0.4 0.259 59.2 171.3 -57.6 145.9 -22.8 8.9 31.2 276 57 B M E -EF 227 285B 0 -49,-1.3 -49,-3.4 -2,-0.2 2,-0.5 -0.982 15.6-170.4-136.9 137.1 -20.2 8.7 28.5 277 58 B V E -EF 226 284B 0 7,-2.0 7,-2.3 -2,-0.4 2,-0.6 -0.998 14.3-148.4-127.3 122.9 -16.9 10.5 28.7 278 59 B E E +EF 225 283B 43 -53,-2.8 -53,-2.8 -2,-0.5 2,-0.3 -0.854 38.1 153.4 -87.5 125.9 -14.6 10.6 25.7 279 60 B I E > - F 0 282B 6 3,-2.1 3,-1.9 -2,-0.6 -56,-0.1 -0.934 56.5 -6.1-162.4 131.2 -11.1 10.8 27.2 280 61 B D T 3 S- 0 0 41 -2,-0.3 3,-0.1 1,-0.3 -57,-0.0 0.827 126.7 -53.6 47.7 44.4 -7.6 9.7 26.1 281 62 B G T 3 S+ 0 0 80 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.208 118.1 102.5 85.9 -16.6 -9.0 8.1 22.9 282 63 B M E < -F 279 0B 31 -3,-1.9 -3,-2.1 2,-0.0 2,-0.5 -0.546 65.8-138.3 -97.0 163.2 -11.5 5.9 24.7 283 64 B K E -F 278 0B 69 -5,-0.2 2,-0.4 -2,-0.2 -13,-0.2 -0.882 28.6-163.6-119.9 96.7 -15.2 6.2 25.1 284 65 B L E +F 277 0B 1 -7,-2.3 -7,-2.0 -2,-0.5 2,-0.2 -0.695 11.4 178.4 -92.2 125.7 -15.8 5.2 28.7 285 66 B V E +F 276 0B 4 -2,-0.4 -9,-0.2 -9,-0.2 4,-0.1 -0.704 46.9 65.8-115.3 171.3 -19.3 4.3 30.0 286 67 B Q S >> S- 0 0 18 -11,-0.6 4,-2.4 -2,-0.2 3,-0.8 0.795 77.1-121.2 73.1 111.4 -20.3 3.2 33.5 287 68 B T H 3> S+ 0 0 22 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.882 110.9 49.4 -43.3 -53.8 -19.9 5.9 36.1 288 69 B R H 3> S+ 0 0 39 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.808 108.9 52.3 -66.5 -29.6 -17.4 3.9 38.2 289 70 B A H <> S+ 0 0 0 -3,-0.8 4,-1.8 -197,-0.2 -1,-0.2 0.927 111.8 47.3 -67.3 -43.1 -15.3 3.0 35.2 290 71 B I H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.963 114.6 45.6 -58.1 -52.0 -15.0 6.7 34.3 291 72 B L H X S+ 0 0 9 -4,-2.6 4,-3.3 1,-0.2 -2,-0.2 0.831 110.4 52.0 -66.1 -42.3 -14.2 7.8 37.9 292 73 B N H X S+ 0 0 15 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.849 111.1 49.5 -59.6 -41.6 -11.6 5.1 38.6 293 74 B Y H X S+ 0 0 10 -4,-1.8 4,-2.6 -5,-0.2 -2,-0.2 0.935 116.2 40.3 -64.4 -46.7 -9.8 6.1 35.4 294 75 B I H X S+ 0 0 1 -4,-2.2 4,-2.7 2,-0.2 6,-0.3 0.950 116.1 52.6 -64.7 -48.0 -9.8 9.8 36.2 295 76 B A H <>S+ 0 0 0 -4,-3.3 5,-2.8 1,-0.2 6,-0.6 0.888 115.1 39.9 -53.7 -48.1 -9.0 8.9 39.9 296 77 B S H ><5S+ 0 0 28 -4,-2.4 3,-1.4 4,-0.2 -1,-0.2 0.902 113.0 55.0 -73.4 -40.3 -6.1 6.8 38.9 297 78 B K H 3<5S+ 0 0 74 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.934 114.3 39.2 -59.5 -44.4 -4.8 9.1 36.1 298 79 B Y T 3<5S- 0 0 74 -4,-2.7 -1,-0.3 -5,-0.1 -2,-0.2 0.057 114.9-109.5-101.4 26.6 -4.6 12.2 38.4 299 80 B N T < 5S+ 0 0 137 -3,-1.4 3,-0.3 1,-0.1 -3,-0.2 0.779 82.0 125.4 54.6 33.1 -3.3 10.4 41.5 300 81 B L < + 0 0 14 -5,-2.8 74,-2.7 -6,-0.3 75,-0.3 0.190 51.5 81.3-100.8 17.7 -6.5 10.8 43.4 301 82 B Y S S- 0 0 14 -6,-0.6 -1,-0.2 1,-0.4 72,-0.1 -0.020 102.1-102.5-113.3 29.1 -6.8 7.0 44.1 302 83 B G - 0 0 21 -3,-0.3 -1,-0.4 70,-0.2 3,-0.1 -0.087 35.0 -89.1 72.5-179.3 -4.4 6.7 47.1 303 84 B K S S+ 0 0 147 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.702 95.6 19.6-105.0 -23.9 -0.8 5.4 46.9 304 85 B D S > S- 0 0 58 -3,-0.1 4,-2.4 1,-0.0 3,-0.4 -0.874 84.9 -90.6-143.4 176.6 -1.2 1.6 47.5 305 86 B I H > S+ 0 0 37 -2,-0.3 4,-1.5 1,-0.3 5,-0.1 0.828 120.9 51.4 -60.1 -40.2 -3.7 -1.3 47.4 306 87 B K H > S+ 0 0 96 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.846 109.5 50.3 -68.0 -35.5 -4.7 -0.9 51.0 307 88 B E H > S+ 0 0 24 -3,-0.4 4,-3.1 1,-0.2 3,-0.2 0.952 108.4 53.5 -66.3 -45.3 -5.4 2.8 50.6 308 89 B R H X S+ 0 0 78 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.824 105.7 54.5 -52.6 -38.1 -7.5 1.9 47.5 309 90 B A H X S+ 0 0 1 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.896 110.7 43.4 -68.6 -41.6 -9.5 -0.5 49.6 310 91 B L H X S+ 0 0 58 -4,-1.7 4,-3.1 -3,-0.2 -2,-0.2 0.938 114.5 51.1 -65.8 -44.9 -10.4 2.2 52.2 311 92 B I H X S+ 0 0 0 -4,-3.1 4,-3.3 1,-0.2 5,-0.2 0.942 114.0 44.5 -57.1 -47.7 -11.1 4.7 49.5 312 93 B D H X S+ 0 0 3 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.895 112.6 49.7 -65.9 -44.3 -13.4 2.2 47.7 313 94 B M H X S+ 0 0 12 -4,-2.5 4,-1.6 -5,-0.2 3,-0.3 0.995 115.7 45.4 -56.5 -54.0 -15.2 1.1 50.9 314 95 B Y H X S+ 0 0 19 -4,-3.1 4,-1.4 1,-0.2 3,-0.5 0.932 115.5 44.3 -54.8 -54.4 -15.7 4.8 51.7 315 96 B I H X S+ 0 0 8 -4,-3.3 4,-3.0 1,-0.2 -1,-0.2 0.770 106.9 58.8 -71.7 -21.6 -16.9 5.9 48.3 316 97 B E H X S+ 0 0 11 -4,-2.2 4,-2.0 -3,-0.3 -1,-0.2 0.844 104.3 52.3 -73.1 -32.0 -19.2 2.9 47.7 317 98 B G H X S+ 0 0 0 -4,-1.6 4,-1.6 -3,-0.5 -2,-0.2 0.900 112.6 45.4 -61.4 -40.6 -21.1 4.0 50.9 318 99 B I H X S+ 0 0 15 -4,-1.4 4,-3.1 1,-0.2 -2,-0.2 0.917 110.2 54.8 -69.3 -43.0 -21.3 7.4 49.3 319 100 B A H X S+ 0 0 28 -4,-3.0 4,-2.5 2,-0.2 -2,-0.2 0.838 104.6 54.0 -56.4 -40.0 -22.4 5.8 46.0 320 101 B D H X S+ 0 0 47 -4,-2.0 4,-1.0 2,-0.2 -1,-0.2 0.927 113.8 40.2 -62.9 -48.6 -25.3 3.9 47.7 321 102 B L H >X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 3,-0.7 0.936 114.4 54.9 -61.5 -46.2 -26.7 7.1 49.2 322 103 B G H 3X S+ 0 0 19 -4,-3.1 4,-3.3 1,-0.3 -2,-0.2 0.868 102.5 56.7 -58.7 -41.5 -26.0 9.0 45.9 323 104 B E H 3X S+ 0 0 67 -4,-2.5 4,-2.0 2,-0.2 -1,-0.3 0.850 106.7 49.2 -54.2 -41.5 -27.9 6.4 44.0 324 105 B M H < S+ 0 0 85 -4,-2.0 3,-2.0 1,-0.2 -1,-0.2 0.721 91.6 90.1 -79.9 -22.9 -33.3 8.4 41.5 328 109 B L G >< S+ 0 0 27 -4,-1.4 3,-1.0 1,-0.3 -1,-0.2 0.785 82.9 54.3 -52.1 -37.3 -35.4 10.4 43.9 329 110 B P G 3 S+ 0 0 26 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.743 103.4 57.6 -69.3 -21.7 -36.7 12.9 41.2 330 111 B F G < S+ 0 0 57 -3,-2.0 -2,-0.2 -4,-0.2 -3,-0.1 -0.104 84.9 109.3-100.6 35.1 -38.0 10.0 39.0 331 112 B C S < S- 0 0 14 -3,-1.0 5,-0.0 2,-0.0 -3,-0.0 -0.708 78.2-108.9 -95.1 154.4 -40.3 8.6 41.8 332 113 B P >> - 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