==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 20-NOV-12 4I1D . COMPND 2 MOLECULE: ABC TRANSPORTER SUBSTRATE-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BRADYRHIZOBIUM JAPONICUM; . AUTHOR Y.FAN,K.TAN,J.MACK,S.ZERBS,F.COLLART,A.JOACHIMIAK,MIDWEST CE . 1288 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 51133.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 919 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 86 6.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 134 10.4 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 82 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 155 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 393 30.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 34 2.6 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 13 7 4 0 8 11 9 8 0 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 12 1 3 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 PARALLEL BRIDGES PER LADDER . 6 6 0 0 8 0 0 0 0 0 4 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 0 0 0 0 0 0 0 4 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 42 A N 0 0 157 0, 0.0 30,-0.1 0, 0.0 29,-0.1 0.000 360.0 360.0 360.0 119.9 4.2 87.9 -8.0 2 43 A A + 0 0 46 28,-0.3 30,-2.4 29,-0.0 2,-0.3 -0.252 360.0 175.7 -74.6 156.1 2.0 87.0 -5.0 3 44 A Q E -a 32 0A 44 28,-0.2 2,-0.3 856,-0.1 30,-0.2 -0.940 18.3-165.7-151.2 165.4 2.1 88.8 -1.6 4 45 A I E -a 33 0A 0 28,-1.7 30,-2.8 -2,-0.3 2,-0.5 -0.940 25.6-121.7-145.0 166.6 0.6 89.2 1.9 5 46 A T E -a 34 0A 22 -2,-0.3 53,-2.2 28,-0.2 52,-1.9 -0.980 26.3-163.0-113.8 121.0 0.8 91.7 4.6 6 47 A F E -ab 35 58A 0 28,-3.1 30,-2.1 -2,-0.5 2,-0.5 -0.884 4.4-160.8-105.1 131.4 2.2 90.3 7.9 7 48 A V E +ab 36 59A 1 51,-2.7 53,-3.0 -2,-0.4 30,-0.2 -0.949 22.4 143.0-122.1 127.6 1.6 92.3 11.1 8 49 A S E -a 37 0A 2 28,-1.7 30,-2.0 -2,-0.5 53,-0.1 -0.562 60.5 -76.8-138.4-155.4 3.5 92.0 14.4 9 50 A Q - 0 0 76 1,-0.2 28,-0.1 28,-0.2 673,-0.1 0.359 59.6-142.3-101.7 5.5 4.8 94.2 17.3 10 51 A G > + 0 0 6 26,-0.3 4,-1.8 1,-0.1 3,-0.4 -0.152 55.8 79.3 73.4-166.9 7.9 95.7 15.7 11 52 A G H > S- 0 0 8 1,-0.2 4,-2.0 2,-0.2 670,-0.3 -0.141 108.7 -24.8 67.8-156.3 11.2 96.4 17.3 12 53 A A H > S+ 0 0 46 668,-0.8 4,-2.2 1,-0.2 -1,-0.2 0.887 137.8 58.0 -60.2 -39.1 13.9 93.8 18.1 13 54 A Y H > S+ 0 0 25 -3,-0.4 4,-1.8 1,-0.2 -2,-0.2 0.938 109.1 41.1 -56.4 -53.2 11.2 91.1 18.1 14 55 A Q H X S+ 0 0 7 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.835 112.6 55.6 -69.3 -30.8 9.9 91.8 14.5 15 56 A A H X S+ 0 0 20 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.903 108.2 49.2 -65.7 -37.3 13.5 92.2 13.2 16 57 A A H X S+ 0 0 7 -4,-2.2 4,-2.5 1,-0.2 5,-0.3 0.878 108.7 52.5 -68.3 -38.4 14.3 88.8 14.6 17 58 A Q H X>S+ 0 0 0 -4,-1.8 4,-2.9 1,-0.2 5,-2.3 0.846 106.8 55.0 -61.6 -37.3 11.3 87.3 12.9 18 59 A T H <>S+ 0 0 13 -4,-1.7 5,-2.3 3,-0.2 -2,-0.2 0.943 112.3 40.3 -65.0 -48.8 12.4 88.8 9.7 19 60 A V H <5S+ 0 0 65 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.942 126.8 33.5 -64.7 -48.1 15.8 87.2 9.7 20 61 A A H <5S+ 0 0 3 -4,-2.5 -2,-0.2 -5,-0.2 239,-0.2 0.825 137.4 3.1 -78.6 -36.5 14.6 83.8 11.1 21 62 A I T X5S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.3 -3,-0.2 0.798 119.0 50.5-124.4 -54.3 11.2 83.5 9.5 22 63 A L H > S+ 0 0 39 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.920 115.9 48.2 -63.6 -39.3 13.5 82.6 4.4 25 66 A S H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.3 0.911 111.3 49.1 -63.5 -45.1 9.7 81.9 4.0 26 67 A A H X>S+ 0 0 16 -4,-3.1 5,-1.9 -5,-0.2 4,-1.6 0.877 113.8 47.8 -61.8 -37.5 9.3 84.6 1.3 27 68 A K H <5S+ 0 0 182 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.947 113.2 46.6 -68.3 -48.4 12.3 83.1 -0.5 28 69 A K H <5S+ 0 0 149 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.911 121.0 37.9 -58.5 -44.8 11.0 79.5 -0.2 29 70 A L H <5S- 0 0 56 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.702 104.3-127.7 -84.2 -20.0 7.5 80.4 -1.4 30 71 A G T <5 + 0 0 44 -4,-1.6 -28,-0.3 -5,-0.3 2,-0.3 0.927 65.7 124.0 70.4 45.3 8.6 83.0 -3.9 31 72 A I < - 0 0 20 -5,-1.9 2,-0.5 -6,-0.2 -1,-0.3 -0.826 63.7-113.5-127.9 168.4 6.4 85.7 -2.5 32 73 A T E -a 3 0A 62 -30,-2.4 -28,-1.7 -2,-0.3 2,-0.8 -0.920 23.0-156.3-102.7 124.5 6.7 89.3 -1.2 33 74 A I E -a 4 0A 24 -2,-0.5 2,-0.4 -30,-0.2 -28,-0.2 -0.868 6.9-160.7-101.3 104.3 5.9 89.7 2.5 34 75 A N E -a 5 0A 65 -30,-2.8 -28,-3.1 -2,-0.8 2,-0.3 -0.694 15.8-146.0 -80.4 135.0 4.9 93.3 3.3 35 76 A Q E +a 6 0A 22 -2,-0.4 622,-0.6 -30,-0.2 2,-0.3 -0.750 22.6 171.7-105.9 150.6 5.2 94.1 6.9 36 77 A D E -a 7 0A 9 -30,-2.1 -28,-1.7 -2,-0.3 2,-0.3 -0.916 14.3-150.5-142.5 170.3 3.3 96.3 9.3 37 78 A S E +a 8 0A 24 -2,-0.3 -28,-0.2 -30,-0.2 620,-0.1 -0.995 18.3 161.3-144.2 147.3 3.4 96.8 13.1 38 79 A I - 0 0 39 -30,-2.0 3,-0.3 -2,-0.3 -28,-0.1 -0.929 36.9-133.5-163.1 141.3 1.1 97.8 15.9 39 80 A P S S+ 0 0 103 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.968 102.4 16.9 -59.3 -55.1 1.1 97.4 19.7 40 81 A D - 0 0 76 1,-0.1 4,-0.4 21,-0.1 21,-0.1 -0.957 67.1-175.2-125.7 113.9 -2.5 96.1 19.8 41 82 A A > + 0 0 7 -2,-0.5 4,-2.5 -3,-0.3 3,-0.2 0.653 62.3 84.2 -81.8 -16.8 -4.0 94.9 16.6 42 83 A W H > S+ 0 0 22 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.893 83.9 51.0 -70.7 -42.2 -7.5 94.1 17.7 43 84 A P H > S+ 0 0 80 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.923 116.9 45.7 -55.7 -37.7 -9.3 97.4 17.4 44 85 A A H > S+ 0 0 24 -4,-0.4 4,-3.4 -3,-0.2 5,-0.2 0.890 108.8 54.0 -71.8 -41.0 -7.9 97.7 13.9 45 86 A I H X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 5,-0.4 0.922 108.1 51.6 -58.2 -42.9 -8.8 94.1 13.0 46 87 A K H X S+ 0 0 107 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.939 114.4 42.1 -59.1 -47.1 -12.4 94.8 14.1 47 88 A T H X S+ 0 0 73 -4,-1.8 4,-1.0 -5,-0.2 -2,-0.2 0.938 117.1 47.5 -67.4 -45.3 -12.6 97.8 11.8 48 89 A Q H ><>S+ 0 0 4 -4,-3.4 3,-0.7 1,-0.2 5,-0.5 0.945 117.0 40.8 -61.1 -52.3 -10.8 96.2 8.9 49 90 A V H ><5S+ 0 0 12 -4,-3.1 3,-1.5 1,-0.2 -1,-0.2 0.892 109.5 60.0 -67.1 -38.1 -12.8 93.0 9.0 50 91 A G H 3<5S+ 0 0 11 -4,-2.4 -1,-0.2 -5,-0.4 -2,-0.2 0.763 101.7 55.5 -59.5 -24.9 -16.0 94.9 9.6 51 92 A S T <<5S- 0 0 38 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.644 104.1-130.8 -82.4 -16.5 -15.4 96.7 6.3 52 93 A G T < 5S+ 0 0 51 -3,-1.5 -3,-0.1 -4,-0.5 -2,-0.1 0.245 91.0 80.4 80.5 -13.7 -15.2 93.5 4.3 53 94 A K < - 0 0 110 -5,-0.5 -4,-0.1 783,-0.1 185,-0.1 -0.633 64.0-177.2-126.4 75.5 -12.0 94.8 2.8 54 95 A P - 0 0 3 0, 0.0 -9,-0.1 0, 0.0 -5,-0.0 -0.409 21.0-156.2 -66.3 143.1 -9.1 94.3 5.2 55 96 A I S S+ 0 0 9 -2,-0.1 2,-0.3 183,-0.1 -50,-0.1 0.692 76.5 72.4 -89.1 -22.8 -5.6 95.5 4.3 56 97 A W + 0 0 2 1,-0.1 -50,-0.1 -52,-0.1 3,-0.1 -0.676 52.4 179.2 -92.2 147.0 -3.9 93.0 6.6 57 98 A D + 0 0 0 -52,-1.9 178,-2.4 1,-0.3 2,-0.5 0.793 68.3 27.4-104.3 -58.3 -3.6 89.3 5.9 58 99 A V E -bC 6 234A 0 -53,-2.2 -51,-2.7 176,-0.2 2,-0.4 -0.928 64.1-168.0-118.8 130.6 -1.7 87.6 8.7 59 100 A V E -bC 7 233A 1 174,-2.4 174,-1.7 -2,-0.5 2,-0.6 -0.960 12.8-152.1-121.1 133.2 -1.5 88.9 12.3 60 101 A D E + C 0 232A 3 -53,-3.0 172,-0.2 -2,-0.4 -19,-0.1 -0.926 39.4 147.9-100.7 116.2 0.9 87.8 15.1 61 102 A T E - C 0 231A 5 170,-2.4 170,-2.9 -2,-0.6 5,-0.1 -0.975 55.2 -67.4-149.6 155.6 -0.9 88.3 18.4 62 103 A P E >> - C 0 230A 23 0, 0.0 3,-1.7 0, 0.0 4,-0.8 -0.219 53.4-120.3 -47.3 134.2 -1.2 87.0 22.0 63 104 A T H >> S+ 0 0 14 166,-2.0 4,-1.4 1,-0.3 3,-0.6 0.771 106.7 63.7 -56.3 -33.9 -3.0 83.7 21.7 64 105 A G H 3> S+ 0 0 4 165,-0.3 4,-2.1 1,-0.3 -1,-0.3 0.821 98.4 55.5 -62.7 -32.0 -6.0 84.6 23.8 65 106 A Y H <> S+ 0 0 58 -3,-1.7 4,-3.2 1,-0.2 -1,-0.3 0.789 101.6 58.3 -71.3 -28.8 -7.0 87.3 21.3 66 107 A C H S+ 0 0 2 -4,-3.2 5,-2.6 1,-0.2 6,-0.6 0.884 110.7 51.1 -56.0 -45.8 -11.4 87.0 17.6 70 111 A G H ><5S+ 0 0 5 -4,-2.7 3,-1.1 1,-0.2 -1,-0.2 0.886 108.9 52.4 -61.7 -38.7 -12.2 83.5 16.2 71 112 A E H 3<5S+ 0 0 46 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.803 108.6 51.0 -66.3 -28.7 -15.3 83.3 18.3 72 113 A Q T 3<5S- 0 0 46 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.319 117.2-109.6 -94.9 9.5 -16.5 86.7 17.0 73 114 A G T < 5S+ 0 0 22 -3,-1.1 -3,-0.2 -4,-0.2 -2,-0.1 0.743 85.0 120.4 72.0 25.6 -16.0 85.8 13.3 74 115 A L < + 0 0 6 -5,-2.6 162,-2.2 -6,-0.1 2,-0.3 0.663 67.5 41.2 -97.7 -19.1 -13.0 88.1 12.9 75 116 A I B S-K 235 0B 2 -6,-0.6 160,-0.2 160,-0.3 -2,-0.1 -0.927 92.0 -91.0-130.3 158.7 -10.4 85.5 11.8 76 117 A E - 0 0 41 158,-2.8 2,-0.6 -2,-0.3 158,-0.3 -0.329 29.0-121.3 -71.6 140.0 -10.5 82.5 9.5 77 118 A K - 0 0 147 -2,-0.1 2,-0.3 156,-0.1 20,-0.2 -0.715 43.6-125.8 -69.6 121.2 -11.3 79.0 10.6 78 119 A L - 0 0 19 18,-2.9 2,-0.9 -2,-0.6 20,-0.1 -0.588 10.7-145.1 -82.6 133.1 -8.1 77.3 9.6 79 120 A D > - 0 0 83 -2,-0.3 3,-1.7 1,-0.1 4,-0.1 -0.818 13.5-169.2 -90.8 100.5 -8.1 74.2 7.3 80 121 A F G > S+ 0 0 36 -2,-0.9 3,-0.5 1,-0.3 7,-0.3 0.510 76.2 77.7 -74.6 -3.2 -5.1 72.2 8.7 81 122 A S G 3 S+ 0 0 97 1,-0.2 -1,-0.3 2,-0.1 -2,-0.0 0.613 99.6 46.3 -75.5 -10.8 -5.1 69.8 5.8 82 123 A K G < S+ 0 0 134 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.397 107.3 59.3-106.9 -1.3 -3.4 72.7 3.9 83 124 A I X> + 0 0 1 -3,-0.5 4,-2.4 -4,-0.1 3,-1.4 -0.541 60.7 171.4-127.9 65.9 -0.9 73.4 6.7 84 125 A P H 3> S+ 0 0 75 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.834 77.8 54.0 -46.4 -46.8 1.0 70.2 7.2 85 126 A N H 34 S+ 0 0 36 1,-0.2 4,-0.4 2,-0.2 164,-0.1 0.853 112.7 43.5 -59.6 -35.6 3.5 71.7 9.6 86 127 A A H X4 S+ 0 0 0 -3,-1.4 3,-1.0 1,-0.2 -1,-0.2 0.879 110.2 55.2 -78.2 -38.2 0.8 73.0 11.8 87 128 A A H 3< S+ 0 0 43 -4,-2.4 -2,-0.2 -7,-0.3 -1,-0.2 0.835 103.2 57.4 -60.7 -32.9 -1.2 69.7 11.7 88 129 A A T 3< S+ 0 0 60 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.657 90.0 92.5 -75.5 -15.7 1.9 67.9 12.9 89 130 A X S < S- 0 0 3 -3,-1.0 5,-0.1 -4,-0.4 181,-0.1 -0.453 93.7 -90.1 -74.7 150.8 2.1 70.1 16.0 90 131 A P > - 0 0 64 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.272 36.1-115.7 -59.2 151.0 0.3 68.8 19.2 91 132 A E G > S+ 0 0 150 1,-0.3 3,-1.2 2,-0.2 -2,-0.1 0.750 113.2 65.5 -64.3 -25.0 -3.3 69.9 19.5 92 133 A A G 3 S+ 0 0 100 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.594 96.6 58.8 -72.2 -8.5 -2.5 72.0 22.6 93 134 A Y G < S+ 0 0 73 -3,-2.1 7,-2.8 -7,-0.1 2,-0.3 0.370 108.5 42.3-101.9 2.1 -0.3 74.2 20.4 94 135 A R B < -D 99 0A 57 -3,-1.2 5,-0.2 5,-0.2 137,-0.0 -0.890 60.6-156.7-139.2 171.1 -3.1 75.3 18.0 95 136 A S - 0 0 16 3,-2.5 3,-0.4 -2,-0.3 -17,-0.1 -0.778 46.4 -92.0-134.4 179.1 -6.7 76.4 18.0 96 137 A P S S+ 0 0 76 0, 0.0 -18,-2.9 0, 0.0 3,-0.1 0.727 129.0 31.4 -66.9 -16.0 -9.3 76.2 15.2 97 138 A Y S S+ 0 0 48 -20,-0.2 137,-0.4 1,-0.1 2,-0.3 0.353 121.7 30.7-120.3 -0.9 -8.2 79.7 14.3 98 139 A S - 0 0 1 -3,-0.4 -3,-2.5 135,-0.1 2,-0.4 -0.969 53.7-139.7-155.7 165.3 -4.5 79.9 15.2 99 140 A V E -DE 94 232A 2 133,-1.4 133,-2.2 -2,-0.3 -5,-0.2 -0.998 38.8-104.5-133.3 134.1 -1.1 78.3 15.5 100 141 A S E + E 0 231A 8 -7,-2.8 131,-0.3 -2,-0.4 3,-0.1 -0.287 38.3 177.5 -56.3 134.6 1.4 78.9 18.3 101 142 A Y E - 0 0 0 129,-3.1 168,-1.9 1,-0.4 169,-0.4 0.794 55.9 -14.7-115.0 -42.0 4.2 81.1 16.9 102 143 A E E -FE 268 230A 4 128,-1.3 128,-1.9 166,-0.3 2,-0.4 -0.971 56.6-128.1-162.7 152.9 6.6 81.8 19.8 103 144 A F E +FE 267 229A 17 164,-2.5 164,-2.8 -2,-0.3 2,-0.3 -0.893 26.2 171.5-109.8 137.4 6.8 81.7 23.6 104 145 A Y E - E 0 228A 24 124,-1.9 124,-3.3 -2,-0.4 2,-0.4 -0.915 18.1-137.2-133.4 164.6 7.8 84.5 26.0 105 146 A S E - E 0 227A 0 -2,-0.3 100,-2.7 122,-0.2 2,-0.6 -0.939 11.1-140.4-125.9 145.4 7.7 84.9 29.7 106 147 A S E -GE 204 226A 2 120,-2.0 120,-2.6 -2,-0.4 2,-0.3 -0.928 45.1-179.8 -91.4 123.5 6.8 87.6 32.2 107 148 A V E -G 203 0A 0 96,-3.3 96,-1.8 -2,-0.6 2,-0.8 -0.852 39.5-101.1-129.1 158.6 9.5 87.2 34.9 108 149 A L E -GE 202 221A 0 113,-0.6 113,-1.6 115,-0.3 2,-0.3 -0.733 46.6-172.3 -72.3 109.0 10.8 88.6 38.1 109 150 A A E +GE 201 220A 0 92,-3.5 92,-2.6 -2,-0.8 2,-0.3 -0.788 6.3 175.9-104.6 153.9 13.7 90.8 37.0 110 151 A Y E -GE 200 219A 39 109,-2.4 109,-2.4 -2,-0.3 2,-0.3 -0.993 32.8-100.0-158.6 152.7 16.1 92.4 39.5 111 152 A S E > - E 0 218A 13 88,-2.9 4,-2.2 -2,-0.3 107,-0.3 -0.625 16.4-155.4 -79.4 130.9 19.2 94.5 39.8 112 153 A Q T 4 S+ 0 0 79 105,-2.8 106,-0.2 -2,-0.3 -1,-0.1 0.702 96.1 60.8 -77.5 -20.3 22.5 92.7 40.5 113 154 A K T 4 S+ 0 0 153 104,-0.9 -1,-0.2 1,-0.1 105,-0.1 0.905 112.6 37.6 -69.1 -40.6 23.9 95.9 42.1 114 155 A T T 4 S+ 0 0 52 1,-0.3 -2,-0.2 85,-0.1 3,-0.2 0.870 129.9 32.4 -76.7 -38.0 21.1 95.7 44.7 115 156 A F < + 0 0 22 -4,-2.2 -1,-0.3 1,-0.2 4,-0.2 -0.674 64.2 153.9-123.9 77.8 21.2 92.0 45.0 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-2,-0.2 0.919 110.8 49.6 -69.6 -41.1 -1.8 84.7 43.5 151 192 A X H ><5S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.2 -1,-0.2 0.863 106.9 56.4 -62.8 -34.6 1.5 82.9 43.5 152 193 A A H 3<5S+ 0 0 8 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.833 101.8 57.1 -64.9 -32.0 2.7 85.5 46.1 153 194 A D T 3<5S- 0 0 62 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.230 132.5 -95.2 -84.3 14.8 -0.2 84.4 48.2 154 195 A G T < 5S+ 0 0 61 -3,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.443 75.0 146.8 94.4 1.2 1.2 80.9 48.1 155 196 A V < - 0 0 23 -5,-2.1 -1,-0.3 -6,-0.1 5,-0.1 -0.551 52.0-115.1 -74.7 132.1 -0.7 79.4 45.2 156 197 A A > - 0 0 42 -2,-0.3 3,-2.8 1,-0.1 4,-0.2 -0.444 20.5-120.1 -69.9 138.4 1.3 76.8 43.2 157 198 A P G > S+ 0 0 31 0, 0.0 3,-0.6 0, 0.0 142,-0.2 0.778 113.5 47.5 -48.1 -35.0 2.0 77.8 39.5 158 199 A D G 3 S+ 0 0 135 1,-0.2 -2,-0.1 140,-0.1 140,-0.0 0.327 108.3 55.4 -95.3 9.6 0.1 74.8 38.2 159 200 A K G < S+ 0 0 161 -3,-2.8 -1,-0.2 1,-0.1 -3,-0.1 0.146 76.1 103.0-120.7 18.3 -2.9 75.3 40.4 160 201 A L < + 0 0 6 -3,-0.6 4,-0.3 -4,-0.2 -2,-0.1 0.888 52.1 117.0 -71.0 -43.3 -3.8 78.8 39.4 161 202 A Y + 0 0 57 2,-0.1 2,-0.1 -3,-0.0 3,-0.0 -0.580 65.8 35.8 -93.5 143.6 -6.8 78.4 37.1 162 203 A P S S- 0 0 103 0, 0.0 2,-0.1 0, 0.0 -1,-0.0 0.584 104.3-125.7 -68.4 144.1 -9.6 79.3 37.3 163 204 A L - 0 0 12 -2,-0.1 2,-1.3 1,-0.1 3,-0.1 -0.332 1.7-133.1 -67.2 135.6 -8.1 82.4 39.0 164 205 A D > - 0 0 82 -4,-0.3 4,-1.9 1,-0.2 5,-0.1 -0.750 31.4-176.4 -80.9 94.0 -9.4 83.4 42.4 165 206 A V H > S+ 0 0 18 -2,-1.3 4,-2.5 2,-0.2 5,-0.2 0.892 74.4 51.7 -69.5 -44.2 -9.8 87.1 41.3 166 207 A D H > S+ 0 0 65 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.941 111.8 50.0 -53.0 -49.5 -10.9 88.6 44.6 167 208 A R H > S+ 0 0 91 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.883 109.7 50.4 -58.7 -40.5 -7.9 86.9 46.3 168 209 A A H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.933 111.7 47.2 -66.1 -43.2 -5.6 88.3 43.6 169 210 A F H X S+ 0 0 15 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.869 109.7 53.2 -66.6 -36.7 -6.9 91.9 44.0 170 211 A K H X S+ 0 0 172 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.951 110.4 47.7 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3,-0.4 0.932 117.0 47.3 -56.5 -44.9 12.6 78.4 10.4 257 298 A Q H >< S+ 0 0 0 -4,-3.1 3,-1.3 1,-0.2 -2,-0.2 0.899 106.8 54.7 -62.6 -45.4 11.2 78.2 13.9 258 299 A A H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.746 104.0 59.5 -62.1 -21.4 14.4 76.8 15.4 259 300 A N H >< S+ 0 0 48 -4,-1.4 3,-1.1 -3,-0.4 4,-0.3 0.712 87.4 74.6 -80.2 -19.5 16.1 79.8 13.9 260 301 A L G XX S+ 0 0 0 -3,-1.3 3,-2.3 -4,-0.6 4,-0.9 0.944 93.1 49.8 -60.7 -52.4 14.1 82.4 15.8 261 302 A P G 34 S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.482 96.9 72.6 -66.9 -2.4 15.7 81.9 19.3 262 303 A L G <4 S+ 0 0 73 -3,-1.1 -2,-0.2 1,-0.1 3,-0.1 0.676 110.3 30.6 -77.2 -15.3 19.1 82.2 17.5 263 304 A H T <4 S+ 0 0 93 -3,-2.3 2,-0.3 1,-0.3 -1,-0.1 0.527 129.3 19.7-122.1 -11.9 18.2 85.9 17.2 264 305 A I S < S- 0 0 24 -4,-0.9 2,-1.9 2,-0.2 -1,-0.3 -0.981 79.1-104.4-162.2 151.7 16.1 86.6 20.3 265 306 A D S S+ 0 0 11 -2,-0.3 2,-0.3 -59,-0.1 -56,-0.1 -0.196 80.3 110.8 -77.4 46.1 15.4 85.1 23.7 266 307 A Y - 0 0 27 -2,-1.9 -162,-0.2 21,-0.1 -2,-0.2 -0.876 65.7-117.0-119.4 155.6 12.0 83.7 22.8 267 308 A G E -F 103 0A 0 -164,-2.8 -164,-2.5 -2,-0.3 2,-0.2 -0.567 33.6 -99.3 -90.8 154.5 11.0 80.1 22.5 268 309 A P E -F 102 0A 2 0, 0.0 -166,-0.3 0, 0.0 -167,-0.1 -0.529 17.5-142.5 -73.0 133.4 9.7 78.4 19.2 269 310 A G S S+ 0 0 0 -168,-1.9 -167,-0.2 -2,-0.2 -169,-0.2 0.836 94.4 65.6 -58.2 -33.5 5.9 78.1 19.0 270 311 A N S > S- 0 0 3 -169,-0.4 3,-2.6 1,-0.1 4,-0.2 -0.817 72.5-160.0 -96.8 106.4 6.6 74.7 17.3 271 312 A P G > S+ 0 0 28 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.685 86.1 76.4 -60.0 -17.9 8.2 72.4 19.8 272 313 A K G > S+ 0 0 90 1,-0.3 3,-2.0 2,-0.2 4,-0.1 0.745 76.7 77.9 -62.1 -23.4 9.5 70.3 16.9 273 314 A A G X S+ 0 0 0 -3,-2.6 3,-1.5 1,-0.3 5,-0.4 0.816 84.4 61.7 -53.0 -32.9 12.1 73.0 16.4 274 315 A F G < S+ 0 0 70 -3,-1.5 -1,-0.3 1,-0.3 3,-0.2 0.617 98.6 55.8 -73.5 -13.3 14.0 71.5 19.4 275 316 A E G < S+ 0 0 132 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.307 88.7 81.0 -96.9 5.9 14.5 68.3 17.5 276 317 A T S < S- 0 0 40 -3,-1.5 -1,-0.2 -4,-0.1 -2,-0.1 0.693 91.1-129.7 -88.8 -21.2 16.2 70.1 14.5 277 318 A N S S+ 0 0 161 -4,-0.3 -3,-0.1 -3,-0.2 3,-0.1 0.870 79.5 105.6 73.4 36.6 19.7 70.4 15.9 278 319 A V + 0 0 43 -5,-0.4 2,-0.7 1,-0.1 -4,-0.1 0.610 65.4 71.3-111.1 -26.4 20.1 74.1 15.1 279 320 A I S S- 0 0 22 -6,-0.3 -2,-0.2 4,-0.0 -1,-0.1 -0.826 81.2-138.6 -93.5 112.8 19.7 75.3 18.7 280 321 A K >> - 0 0 141 -2,-0.7 4,-2.3 1,-0.1 3,-0.9 -0.358 22.0-113.4 -67.7 149.6 22.7 74.4 20.9 281 322 A P H 3> S+ 0 0 105 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.865 116.0 55.2 -51.1 -45.8 22.1 73.1 24.4 282 323 A E H 34 S+ 0 0 156 1,-0.2 4,-0.1 2,-0.2 -3,-0.0 0.821 112.1 44.0 -58.3 -35.2 23.6 76.2 26.1 283 324 A R H X4 S+ 0 0 40 -3,-0.9 3,-1.6 1,-0.2 -1,-0.2 0.876 109.6 53.7 -79.6 -40.9 21.3 78.4 24.1 284 325 A A H >< S+ 0 0 11 -4,-2.3 3,-2.6 1,-0.3 6,-0.3 0.879 96.5 68.8 -59.5 -37.8 18.1 76.4 24.6 285 326 A A T 3< S+ 0 0 50 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.573 98.3 52.8 -59.0 -9.9 18.8 76.5 28.4 286 327 A Q T < S+ 0 0 102 -3,-1.6 -1,-0.3 -20,-0.1 -2,-0.2 0.401 88.3 104.6-105.0 -1.1 18.0 80.3 28.2 287 328 A L S X S- 0 0 0 -3,-2.6 3,-1.0 -4,-0.1 6,-0.2 -0.574 71.3-130.1 -94.3 147.8 14.6 80.0 26.5 288 329 A P T 3 S+ 0 0 0 0, 0.0 -184,-0.1 0, 0.0 -1,-0.1 0.836 106.5 41.5 -60.1 -37.9 11.2 80.4 28.1 289 330 A S T 3 S+ 0 0 21 -186,-0.2 -185,-0.0 4,-0.1 -5,-0.0 0.298 77.7 125.8-100.4 8.4 9.7 77.2 26.6 290 331 A E S X> S- 0 0 41 -3,-1.0 4,-2.8 -6,-0.3 3,-1.1 -0.519 74.7-114.3 -63.0 133.1 12.7 74.9 27.2 291 332 A P H 3> S+ 0 0 96 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.805 113.0 47.3 -42.7 -47.4 11.3 72.0 29.2 292 333 A A H 34 S+ 0 0 60 1,-0.2 4,-0.4 2,-0.2 -7,-0.0 0.825 116.1 44.1 -69.8 -31.9 13.3 72.7 32.4 293 334 A N H X4 S+ 0 0 19 -3,-1.1 3,-1.0 -6,-0.2 4,-0.2 0.885 111.3 54.1 -75.3 -39.2 12.4 76.4 32.4 294 335 A A H >< S+ 0 0 31 -4,-2.8 3,-1.8 1,-0.2 -2,-0.2 0.854 99.5 62.8 -60.4 -37.3 8.8 75.7 31.6 295 336 A A T 3< S+ 0 0 88 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.746 101.3 51.7 -63.2 -24.8 8.5 73.4 34.5 296 337 A K T < S+ 0 0 100 -3,-1.0 -72,-2.7 -4,-0.4 -1,-0.3 0.476 105.2 78.6 -85.1 -4.6 9.3 76.3 36.9 297 338 A Q S < S- 0 0 12 -3,-1.8 2,-0.6 -4,-0.2 -71,-0.2 -0.650 79.9-113.5-114.5 161.0 6.6 78.5 35.4 298 339 A A E -j 226 0A 0 -73,-3.0 -71,-3.3 -2,-0.2 2,-0.8 -0.795 31.9-139.0 -83.9 124.5 2.8 79.1 35.3 299 340 A L E -j 227 0A 113 -2,-0.6 -71,-0.2 -142,-0.2 -73,-0.1 -0.777 25.0-122.4 -85.5 111.1 1.5 78.3 31.9 300 341 A X - 0 0 9 -73,-2.4 2,-0.9 -2,-0.8 3,-0.1 -0.283 16.1-137.5 -55.7 130.9 -1.0 81.0 31.1 301 342 A S > - 0 0 37 1,-0.2 4,-2.2 2,-0.1 5,-0.1 -0.815 20.9-178.8 -92.0 100.5 -4.5 79.7 30.3 302 343 A Y H > S+ 0 0 30 -2,-0.9 4,-2.0 1,-0.2 -1,-0.2 0.779 83.5 62.7 -67.1 -27.6 -5.8 81.6 27.3 303 344 A A H 4 S+ 0 0 67 2,-0.2 -1,-0.2 1,-0.2 4,-0.2 0.901 107.4 43.5 -62.1 -40.6 -9.1 79.6 27.6 304 345 A W H >4 S+ 0 0 20 1,-0.2 3,-1.5 2,-0.2 6,-0.8 0.964 114.3 48.3 -69.2 -49.2 -9.5 81.2 31.1 305 346 A W H 3< S+ 0 0 4 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.788 113.7 47.1 -62.0 -30.3 -8.6 84.8 30.0 306 347 A S T 3< S+ 0 0 6 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.353 97.8 91.9 -93.6 3.5 -10.8 84.7 26.9 307 348 A S S <> S- 0 0 30 -3,-1.5 4,-2.3 -4,-0.2 3,-0.4 -0.467 97.5 -95.7 -90.4 168.7 -13.8 83.3 28.9 308 349 A P H > S+ 0 0 23 0, 0.0 4,-2.6 0, 0.0 65,-0.2 0.842 127.4 53.0 -50.3 -39.4 -16.5 85.4 30.6 309 350 A A H > S+ 0 0 34 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.879 107.4 51.5 -66.4 -37.2 -14.6 85.2 33.9 310 351 A G H > S+ 0 0 0 -6,-0.8 4,-2.2 -3,-0.4 -1,-0.2 0.924 110.8 47.9 -63.5 -43.6 -11.5 86.5 32.1 311 352 A E H X S+ 0 0 58 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.947 110.5 51.2 -61.8 -50.0 -13.4 89.5 30.7 312 353 A A H X S+ 0 0 37 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.927 109.4 51.3 -52.3 -48.0 -15.0 90.3 34.1 313 354 A A H >X S+ 0 0 1 -4,-2.5 4,-0.8 1,-0.2 3,-0.6 0.926 109.6 50.1 -56.6 -45.1 -11.5 90.2 35.6 314 355 A E H >X S+ 0 0 47 -4,-2.2 3,-1.1 1,-0.2 4,-0.8 0.913 106.7 54.4 -59.9 -45.1 -10.2 92.6 33.0 315 356 A K H 3X S+ 0 0 161 -4,-2.6 4,-0.6 1,-0.3 -1,-0.2 0.763 103.3 57.7 -61.4 -26.1 -13.1 95.0 33.5 316 357 A R H 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0 3 -4,-1.9 239,-0.2 -5,-0.2 -2,-0.2 0.836 136.9 6.3 -92.7 -37.6 -49.7 79.0 26.6 344 62 B I T X5S+ 0 0 0 -4,-2.9 4,-2.1 -5,-0.3 -3,-0.2 0.806 122.0 48.4-115.4 -55.2 -46.2 77.7 27.4 345 63 B L H > S+ 0 0 41 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.875 115.2 48.8 -61.8 -36.4 -48.6 74.1 31.1 348 66 B S H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.913 112.5 47.4 -68.2 -43.5 -44.9 73.2 31.0 349 67 B A H X>S+ 0 0 15 -4,-2.9 5,-1.7 -5,-0.2 4,-1.6 0.927 114.4 46.8 -61.6 -45.9 -44.6 73.8 34.7 350 68 B K H <5S+ 0 0 185 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.911 114.5 47.5 -64.6 -40.0 -47.7 71.7 35.4 351 69 B K H <5S+ 0 0 147 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.888 119.2 38.0 -68.5 -40.1 -46.4 69.0 33.0 352 70 B L H <5S- 0 0 55 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.597 104.8-125.4 -87.7 -13.2 -42.9 68.8 34.5 353 71 B G T <5 + 0 0 47 -4,-1.6 -28,-0.3 1,-0.2 2,-0.2 0.887 68.2 122.7 69.0 39.6 -44.0 69.3 38.1 354 72 B I < - 0 0 19 -5,-1.7 2,-0.5 -6,-0.2 -28,-0.2 -0.698 64.1-111.9-123.5 176.0 -41.7 72.3 38.5 355 73 B T E 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55.7 -64.2 -38.9 -27.9 105.0 4.9 493 211 B K H X S+ 0 0 161 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.952 111.2 43.7 -57.8 -49.8 -28.1 107.0 1.7 494 212 B K H X S+ 0 0 30 -4,-2.3 4,-1.5 1,-0.2 3,-0.2 0.886 113.5 52.7 -61.1 -38.8 -31.9 106.2 1.4 495 213 B L H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.886 104.9 53.3 -64.9 -37.4 -32.3 106.8 5.1 496 214 B E H < S+ 0 0 109 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.790 107.6 55.1 -69.6 -23.2 -30.7 110.2 4.9 497 215 B E H < S+ 0 0 102 -4,-1.1 -1,-0.2 -3,-0.2 -2,-0.2 0.859 112.1 38.4 -78.6 -36.7 -33.2 111.0 2.2 498 216 B I H >< S+ 0 0 3 -4,-1.5 3,-2.5 1,-0.2 4,-0.4 0.673 93.6 94.2 -84.2 -17.7 -36.3 110.2 4.1 499 217 B K G >< S+ 0 0 50 -4,-1.4 3,-1.9 1,-0.3 -1,-0.2 0.831 78.4 53.0 -53.2 -45.8 -34.9 111.7 7.3 500 218 B P G 3 S+ 0 0 107 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.751 109.2 54.7 -62.6 -15.8 -36.4 115.2 7.0 501 219 B H G < S+ 0 0 94 -3,-2.5 2,-0.6 -4,-0.1 -42,-0.5 0.417 82.2 103.0 -97.5 -0.9 -39.8 113.5 6.6 502 220 B I E < -s 459 0C 17 -3,-1.9 -42,-0.2 -4,-0.4 3,-0.1 -0.749 49.3-170.8 -85.6 122.3 -39.6 111.5 9.7 503 221 B T E S+ 0 0 59 -44,-2.9 2,-0.4 -2,-0.6 -43,-0.2 0.932 72.1 7.3 -75.0 -48.4 -41.8 113.0 12.4 504 222 B V E -s 460 0C 33 -45,-1.2 -43,-1.3 2,-0.0 2,-0.8 -0.998 54.6-150.1-139.0 137.2 -40.6 110.8 15.3 505 223 B W E -s 461 0C 41 -2,-0.4 -43,-0.2 -45,-0.2 -45,-0.1 -0.908 36.2-146.2 -99.7 101.2 -37.9 108.2 15.7 506 224 B W E -s 462 0C 2 -45,-1.8 -43,-3.1 -2,-0.8 3,-0.1 -0.278 22.7-171.4 -76.5 159.1 -39.5 105.9 18.3 507 225 B T + 0 0 102 1,-0.2 2,-0.3 -45,-0.2 -1,-0.1 0.477 66.2 42.2-126.2 -14.6 -37.6 104.1 21.0 508 226 B S S > S- 0 0 51 1,-0.1 4,-2.4 0, 0.0 -1,-0.2 -0.990 71.5-125.6-137.9 153.5 -40.2 101.8 22.6 509 227 B G H > S+ 0 0 8 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.926 112.5 53.0 -54.6 -48.9 -43.0 99.6 21.4 510 228 B A H > S+ 0 0 11 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.903 108.7 49.9 -57.2 -44.3 -45.5 101.3 23.7 511 229 B Q H > S+ 0 0 64 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.918 108.5 53.1 -59.1 -44.0 -44.5 104.7 22.2 512 230 B S H X S+ 0 0 0 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.865 110.7 47.0 -62.9 -35.2 -44.9 103.3 18.7 513 231 B A H X S+ 0 0 3 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.930 111.3 50.5 -70.5 -46.0 -48.5 102.1 19.5 514 232 B Q H X S+ 0 0 6 -4,-2.6 4,-2.7 1,-0.2 6,-0.3 0.896 105.9 57.0 -56.6 -43.4 -49.5 105.5 21.1 515 233 B L H <>S+ 0 0 14 -4,-2.7 6,-1.6 1,-0.2 5,-0.8 0.887 112.6 40.6 -55.9 -43.5 -48.2 107.4 18.1 516 234 B L H ><5S+ 0 0 6 -4,-1.2 3,-0.7 -3,-0.2 -2,-0.2 0.899 114.8 52.6 -69.9 -44.5 -50.5 105.4 15.8 517 235 B N H 3<5S+ 0 0 29 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.863 113.4 41.2 -62.2 -39.0 -53.4 105.5 18.3 518 236 B D T 3<5S- 0 0 34 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.428 110.5-115.5 -94.9 3.0 -53.4 109.3 18.8 519 237 B G T < 5S+ 0 0 41 -3,-0.7 -3,-0.2 -4,-0.3 -61,-0.2 0.541 74.5 132.9 77.8 6.7 -52.8 110.1 15.1 520 238 B E S -R 429 0C 53 -2,-0.3 4,-1.7 -98,-0.2 3,-0.3 -0.589 38.3-128.3 -73.4 140.6 -43.9 95.5 15.5 528 246 B N H > S+ 0 0 0 -100,-2.2 4,-3.1 1,-0.2 5,-0.2 0.861 106.2 58.4 -66.0 -32.8 -47.0 93.7 14.3 529 247 B G H > S+ 0 0 10 -101,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.911 105.8 48.8 -60.1 -43.8 -48.0 92.7 17.9 530 248 B R H > S+ 0 0 62 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.893 114.1 45.6 -62.5 -39.9 -48.1 96.4 18.9 531 249 B V H X S+ 0 0 2 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.941 111.8 51.8 -71.2 -46.5 -50.3 97.4 15.9 532 250 B S H X S+ 0 0 17 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.918 109.8 49.7 -50.9 -49.3 -52.6 94.4 16.4 533 251 B A H X S+ 0 0 53 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.905 111.1 48.1 -64.2 -42.1 -53.1 95.3 20.0 534 252 B V H <>S+ 0 0 2 -4,-1.9 5,-1.9 1,-0.2 4,-0.4 0.881 110.9 51.2 -65.6 -37.4 -54.0 98.9 19.3 535 253 B A H ><5S+ 0 0 39 -4,-2.4 3,-1.0 1,-0.2 -2,-0.2 0.882 107.3 53.8 -68.7 -36.2 -56.3 97.9 16.5 536 254 B K H 3<5S+ 0 0 111 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.861 100.6 60.4 -62.1 -36.5 -58.1 95.5 19.0 537 255 B E T 3<5S- 0 0 32 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.655 131.0 -95.3 -66.4 -16.3 -58.6 98.5 21.4 538 256 B G T < 5S+ 0 0 57 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.369 74.3 146.2 118.6 -2.2 -60.6 100.1 18.6 539 257 B A < - 0 0 18 -5,-1.9 2,-2.2 1,-0.1 -1,-0.3 -0.416 55.6-120.7 -68.0 139.0 -58.1 102.3 16.8 540 258 B K S S+ 0 0 132 -23,-0.2 -105,-2.6 -2,-0.1 -104,-0.9 -0.467 72.3 115.2 -81.5 72.0 -58.7 102.7 13.0 541 259 B V E + P 0 434C 9 -2,-2.2 2,-0.3 -107,-0.3 -107,-0.2 -0.897 33.3 166.8-135.3 164.7 -55.2 101.3 12.0 542 260 B S E - P 0 433C 38 -109,-2.0 -109,-2.6 -2,-0.3 2,-0.3 -0.889 14.3-150.1-158.8-175.4 -53.9 98.3 10.2 543 261 B F E - P 0 432C 38 -111,-0.3 2,-0.4 -2,-0.3 -111,-0.2 -0.961 12.0-126.8-157.3 169.7 -50.7 97.0 8.6 544 262 B T E - P 0 431C 18 -113,-1.9 -113,-0.8 -2,-0.3 -2,-0.0 -0.953 9.2-145.4-123.5 150.4 -49.5 94.8 5.8 545 263 B Y E > + 0 0 18 -2,-0.4 3,-3.0 -115,-0.1 -1,-0.1 0.616 65.8 121.0 -79.0 -17.0 -47.0 91.9 5.9 546 264 B N E 3 S- 0 0 44 1,-0.3 -115,-0.3 -115,-0.1 74,-0.2 -0.284 92.5 -6.3 -53.6 121.1 -45.9 92.9 2.4 547 265 B Q E 3 S+ 0 0 26 72,-2.5 -1,-0.3 1,-0.2 73,-0.2 0.666 98.2 153.6 62.0 17.6 -42.1 93.7 2.7 548 266 B G E < - 0 0 0 -3,-3.0 73,-2.8 71,-0.1 2,-0.7 -0.287 49.8-115.8 -65.0 160.2 -42.3 93.1 6.5 549 267 B I E -uP 621 429C 0 -120,-2.4 -120,-1.7 71,-0.2 2,-0.5 -0.902 26.3-145.9-105.4 109.6 -39.1 92.0 8.2 550 268 B L E +uP 622 428C 8 71,-3.1 73,-2.5 -2,-0.7 2,-0.2 -0.620 29.7 164.5 -82.0 122.2 -39.6 88.6 9.7 551 269 B Q E - P 0 427C 6 -124,-2.9 -124,-1.8 -2,-0.5 2,-0.3 -0.725 16.2-159.0-130.6 173.2 -37.7 88.1 12.9 552 270 B S E - P 0 426C 9 -126,-0.3 -166,-2.2 -2,-0.2 2,-0.3 -0.996 14.6-138.5-152.7 157.3 -37.6 85.7 15.9 553 271 B T E -NP 385 425C 4 -128,-1.9 -129,-2.9 -2,-0.3 -128,-1.6 -0.859 24.3-161.3-108.7 156.8 -36.5 85.1 19.5 554 272 B S E -NP 384 423C 3 -170,-2.6 -170,-2.3 -2,-0.3 2,-0.4 -0.850 17.8-115.3-129.8 165.1 -35.0 81.9 20.7 555 273 B L E +NP 383 422C 0 -133,-2.4 -133,-1.5 -2,-0.3 2,-0.3 -0.845 36.8 167.7-102.4 141.8 -34.5 80.2 24.0 556 274 B C E -N 382 0C 2 -174,-1.8 -174,-2.3 -2,-0.4 2,-0.5 -0.928 29.8-122.8-144.2 167.8 -31.1 79.6 25.4 557 275 B I E -N 381 0C 0 -137,-0.4 -158,-3.1 -158,-0.3 -176,-0.2 -0.966 29.0-115.9-118.6 127.2 -29.6 78.6 28.8 558 276 B L B > -V 398 0D 0 -178,-2.3 3,-2.2 -2,-0.5 2,-0.3 -0.289 35.7-105.8 -57.9 139.5 -27.0 80.7 30.6 559 277 B K T 3 S+ 0 0 100 -162,-2.2 -184,-0.1 1,-0.3 -1,-0.1 -0.551 111.8 20.5 -64.2 126.2 -23.6 79.0 31.0 560 278 B G T 3 S+ 0 0 41 -2,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.457 85.1 176.2 89.7 1.3 -23.5 78.0 34.7 561 279 B A X - 0 0 9 -3,-2.2 3,-1.0 -181,-0.2 -1,-0.2 -0.086 33.1-134.5 -35.9 129.8 -27.2 78.2 35.1 562 280 B P T 3 S+ 0 0 59 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.739 103.3 39.8 -68.7 -20.4 -27.9 77.0 38.6 563 281 B N T 3> S+ 0 0 41 1,-0.1 4,-2.8 -235,-0.1 5,-0.2 -0.324 71.9 148.2-123.4 53.3 -30.7 74.7 37.4 564 282 B L H <> S+ 0 0 65 -3,-1.0 4,-2.6 1,-0.2 5,-0.2 0.872 70.8 48.5 -53.0 -51.3 -29.2 73.4 34.1 565 283 B E H > S+ 0 0 144 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.934 115.5 43.3 -58.2 -52.0 -30.9 69.9 34.2 566 284 B T H > S+ 0 0 22 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.905 112.3 55.0 -62.0 -40.0 -34.4 71.3 34.8 567 285 B A H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.924 105.3 52.3 -59.7 -46.1 -33.8 74.1 32.3 568 286 B V H X S+ 0 0 27 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.898 110.5 48.6 -55.5 -42.6 -32.9 71.5 29.6 569 287 B K H X S+ 0 0 120 -4,-1.7 4,-1.5 1,-0.2 -2,-0.2 0.882 109.2 53.2 -68.1 -38.5 -36.2 69.7 30.4 570 288 B F H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 3,-0.2 0.929 102.1 57.7 -61.1 -44.8 -38.1 73.0 30.2 571 289 B L H X S+ 0 0 4 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.902 104.2 53.5 -52.4 -42.9 -36.8 73.8 26.7 572 290 B N H < S+ 0 0 25 -4,-1.3 -1,-0.2 1,-0.2 3,-0.2 0.910 112.8 42.6 -60.0 -42.3 -38.2 70.6 25.4 573 291 B E H >< S+ 0 0 19 -4,-1.5 3,-1.4 -3,-0.2 -1,-0.2 0.846 106.2 64.1 -71.1 -33.9 -41.6 71.5 26.8 574 292 B A H 3< S+ 0 0 0 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.834 109.7 37.8 -60.9 -33.5 -41.3 75.1 25.6 575 293 B V T 3< S+ 0 0 2 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.154 80.3 135.4-108.4 19.9 -41.2 74.0 21.9 576 294 B D <> - 0 0 36 -3,-1.4 4,-3.0 1,-0.1 5,-0.3 -0.489 64.1-123.7 -59.5 134.0 -43.7 71.2 22.2 577 295 B P H > S+ 0 0 17 0, 0.0 4,-2.1 0, 0.0 22,-0.1 0.873 107.3 47.5 -56.3 -42.0 -45.9 71.6 19.2 578 296 B V H > S+ 0 0 68 2,-0.2 4,-1.1 1,-0.2 -2,-0.0 0.913 113.9 45.9 -68.0 -42.4 -49.2 71.9 21.1 579 297 B H H >> S+ 0 0 25 1,-0.2 3,-0.8 2,-0.2 4,-0.8 0.945 114.6 49.7 -62.6 -45.4 -47.8 74.4 23.7 580 298 B Q H >< S+ 0 0 0 -4,-3.0 3,-0.8 1,-0.3 -2,-0.2 0.865 106.5 55.7 -59.0 -37.8 -46.3 76.3 20.8 581 299 B A H 3< S+ 0 0 0 -4,-2.1 4,-0.3 -5,-0.3 -1,-0.3 0.737 101.0 59.1 -71.1 -22.4 -49.6 76.3 19.0 582 300 B N H X< S+ 0 0 45 -4,-1.1 3,-0.9 -3,-0.8 4,-0.4 0.729 87.8 74.9 -78.9 -20.3 -51.4 77.9 21.9 583 301 B L G XX S+ 0 0 0 -4,-0.8 3,-2.3 -3,-0.8 4,-1.3 0.942 92.6 51.6 -58.9 -50.2 -49.2 81.0 21.9 584 302 B P G 34 S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 -2,-0.2 0.692 97.6 69.6 -61.9 -18.7 -50.9 82.5 18.8 585 303 B L G <4 S+ 0 0 75 -3,-0.9 -2,-0.2 -4,-0.3 3,-0.1 0.704 112.6 29.2 -66.5 -17.9 -54.3 82.0 20.6 586 304 B H T <4 S+ 0 0 96 -3,-2.3 2,-0.3 -4,-0.4 -1,-0.2 0.530 130.2 20.2-122.6 -12.6 -53.2 84.7 23.0 587 305 B I S < S- 0 0 22 -4,-1.3 2,-1.0 2,-0.2 -1,-0.3 -0.977 78.8-107.8-156.3 157.7 -50.9 87.0 21.0 588 306 B D S S+ 0 0 6 -2,-0.3 2,-0.3 -59,-0.1 -56,-0.1 -0.157 77.9 111.8 -85.9 41.1 -50.3 87.7 17.3 589 307 B Y - 0 0 25 -2,-1.0 -162,-0.2 -6,-0.2 -2,-0.2 -0.850 65.1-118.0-112.1 152.8 -46.9 86.0 17.0 590 308 B G E -Q 426 0C 0 -164,-2.5 -164,-2.7 -2,-0.3 2,-0.1 -0.536 34.7 -96.3 -89.3 155.9 -46.1 82.8 15.1 591 309 B P E -Q 425 0C 2 0, 0.0 -166,-0.3 0, 0.0 -1,-0.1 -0.441 15.7-140.6 -71.1 138.0 -44.8 79.6 16.7 592 310 B G S S+ 0 0 0 -168,-2.0 -167,-0.2 -2,-0.1 -169,-0.2 0.853 96.8 63.3 -58.2 -34.8 -41.1 79.0 16.7 593 311 B N S > S- 0 0 8 -169,-0.4 3,-2.6 1,-0.2 4,-0.2 -0.807 73.2-159.5 -97.0 110.0 -42.0 75.3 16.0 594 312 B P G > S+ 0 0 33 0, 0.0 3,-2.0 0, 0.0 4,-0.3 0.772 86.2 76.6 -63.5 -21.1 -43.7 75.1 12.6 595 313 B K G > S+ 0 0 107 1,-0.3 3,-1.6 2,-0.2 4,-0.3 0.709 75.9 80.6 -59.7 -15.4 -45.2 71.7 13.6 596 314 B A G X S+ 0 0 0 -3,-2.6 3,-1.3 1,-0.3 5,-0.5 0.839 82.5 61.7 -59.1 -32.7 -47.6 73.9 15.7 597 315 B F G < S+ 0 0 64 -3,-2.0 3,-0.4 1,-0.2 -1,-0.3 0.679 99.2 56.4 -66.5 -18.0 -49.6 74.5 12.5 598 316 B E G < S+ 0 0 138 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.2 0.499 86.0 80.2 -92.1 -4.0 -50.3 70.7 12.2 599 317 B T S < S- 0 0 35 -3,-1.3 -1,-0.2 -4,-0.3 -2,-0.1 0.607 91.1-133.8 -78.4 -11.4 -51.9 70.5 15.7 600 318 B N S S+ 0 0 147 -3,-0.4 -3,-0.1 -4,-0.2 -2,-0.1 0.630 76.2 116.0 63.6 13.5 -55.3 71.8 14.5 601 319 B V + 0 0 46 -5,-0.5 2,-0.4 2,-0.1 -4,-0.1 0.891 60.0 68.2 -76.1 -40.7 -55.2 74.0 17.6 602 320 B I S S- 0 0 20 -6,-0.4 -2,-0.1 1,-0.1 -20,-0.1 -0.644 86.2-123.5 -85.3 131.9 -55.1 77.3 15.6 603 321 B K >> - 0 0 146 -2,-0.4 4,-2.7 1,-0.1 3,-0.5 -0.447 22.1-119.8 -70.2 144.9 -58.2 78.4 13.6 604 322 B P H 3> S+ 0 0 97 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.919 113.6 51.0 -50.8 -50.0 -57.5 78.9 9.9 605 323 B E H 34 S+ 0 0 130 1,-0.2 4,-0.2 2,-0.2 -3,-0.0 0.833 113.1 46.7 -58.9 -34.0 -58.6 82.6 10.1 606 324 B R H X4 S+ 0 0 37 -3,-0.5 3,-1.8 1,-0.2 4,-0.3 0.901 107.3 55.8 -75.5 -42.2 -56.3 83.1 13.0 607 325 B A H >< S+ 0 0 16 -4,-2.7 3,-2.1 1,-0.3 6,-0.2 0.881 98.9 62.4 -54.3 -41.9 -53.3 81.4 11.3 608 326 B A T 3< S+ 0 0 52 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.612 99.7 56.4 -64.3 -10.3 -53.6 83.7 8.3 609 327 B Q T < S+ 0 0 82 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.478 84.8 107.4 -97.7 -2.9 -52.8 86.6 10.7 610 328 B L S X S- 0 0 0 -3,-2.1 3,-1.4 -4,-0.3 6,-0.2 -0.536 71.0-131.5 -88.2 142.3 -49.5 85.2 11.9 611 329 B P T 3 S+ 0 0 0 0, 0.0 -184,-0.1 0, 0.0 -1,-0.1 0.849 106.8 41.6 -53.1 -38.8 -46.1 86.6 11.0 612 330 B S T 3 S+ 0 0 20 -186,-0.3 -185,-0.0 4,-0.1 -5,-0.0 0.280 77.1 126.4-102.6 10.3 -44.7 83.2 10.1 613 331 B E S <> S- 0 0 41 -3,-1.4 4,-3.6 -6,-0.2 3,-0.3 -0.481 72.9-115.9 -60.0 139.2 -47.7 81.7 8.3 614 332 B P H > S+ 0 0 93 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.894 113.7 47.6 -50.8 -51.7 -46.2 80.5 4.9 615 333 B A H > S+ 0 0 58 1,-0.2 4,-0.5 2,-0.2 -7,-0.1 0.886 118.2 43.7 -57.2 -40.5 -48.2 82.9 2.7 616 334 B N H >4 S+ 0 0 16 -3,-0.3 3,-1.0 -6,-0.2 4,-0.3 0.908 111.1 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86.6-120.8 -87.8 132.3 17.4 103.7 -8.2 925 321 C K > - 0 0 157 -2,-0.4 4,-2.9 1,-0.1 3,-0.4 -0.447 25.1-117.7 -66.9 143.9 15.6 103.2 -11.5 926 322 C P H > S+ 0 0 118 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.891 115.9 51.8 -49.2 -41.6 14.7 106.4 -13.3 927 323 C E H 4 S+ 0 0 92 1,-0.2 4,-0.3 2,-0.2 -3,-0.0 0.893 111.4 45.7 -65.7 -38.9 11.0 105.5 -13.0 928 324 C R H >4 S+ 0 0 47 -3,-0.4 3,-1.8 1,-0.2 4,-0.2 0.914 108.6 56.5 -71.1 -41.4 11.2 104.8 -9.3 929 325 C A H >< S+ 0 0 17 -4,-2.9 3,-1.7 1,-0.3 -2,-0.2 0.887 100.0 59.6 -56.0 -42.8 13.2 108.0 -8.7 930 326 C A T 3< S+ 0 0 52 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.574 100.6 56.6 -65.7 -11.0 10.4 110.0 -10.2 931 327 C Q T < S+ 0 0 77 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.369 84.3 109.3 -96.7 1.1 7.9 108.7 -7.6 932 328 C L S X S- 0 0 0 -3,-1.7 3,-1.4 -4,-0.2 6,-0.2 -0.600 70.6-131.8 -89.6 143.5 9.9 109.9 -4.6 933 329 C P T 3 S+ 0 0 0 0, 0.0 -184,-0.1 0, 0.0 -1,-0.1 0.820 106.5 44.1 -55.7 -37.1 8.8 112.8 -2.3 934 330 C S T 3 S+ 0 0 20 -186,-0.2 -185,-0.0 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4,-2.5 2,-0.2 -1,-0.2 0.910 108.7 53.0 -65.3 -43.4 -31.8 105.7 54.8 1118 190 D A H X S+ 0 0 0 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.917 110.1 48.8 -57.9 -43.2 -29.0 108.3 54.9 1119 191 D L H <>S+ 0 0 4 -4,-2.3 5,-2.3 1,-0.2 3,-0.4 0.908 110.8 49.4 -65.3 -41.1 -31.1 110.4 57.4 1120 192 D X H ><5S+ 0 0 1 -4,-2.1 3,-1.9 1,-0.2 -1,-0.2 0.884 107.0 55.9 -64.4 -37.3 -31.7 107.4 59.6 1121 193 D A H 3<5S+ 0 0 8 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.774 102.9 56.8 -63.3 -26.2 -28.0 106.5 59.5 1122 194 D D T 3<5S- 0 0 56 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.233 132.3 -94.7 -91.8 12.2 -27.4 110.1 60.8 1123 195 D G T < 5S+ 0 0 59 -3,-1.9 2,-0.2 1,-0.3 -3,-0.2 0.466 74.2 147.1 96.3 3.5 -29.6 109.2 63.7 1124 196 D V < - 0 0 22 -5,-2.3 -1,-0.3 -6,-0.1 5,-0.1 -0.544 52.3-113.3 -73.5 135.0 -33.1 110.5 62.6 1125 197 D A > - 0 0 41 -2,-0.2 3,-2.6 3,-0.1 4,-0.1 -0.418 21.5-118.4 -67.2 142.5 -36.0 108.4 64.0 1126 198 D P T 3 S+ 0 0 38 0, 0.0 3,-0.5 0, 0.0 142,-0.3 0.764 115.2 46.6 -51.5 -30.3 -38.0 106.4 61.3 1127 199 D 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1137 209 D A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.934 110.2 47.6 -62.4 -46.1 -29.1 113.4 53.6 1138 210 D F H X S+ 0 0 6 -4,-2.6 4,-3.1 2,-0.2 5,-0.2 0.897 107.5 54.0 -64.1 -43.5 -26.6 114.3 50.8 1139 211 D K H X S+ 0 0 139 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.936 111.9 47.6 -52.5 -45.5 -23.8 115.1 53.2 1140 212 D K H X S+ 0 0 32 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.887 111.8 48.7 -65.1 -39.9 -24.3 111.7 54.8 1141 213 D L H X S+ 0 0 0 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.890 108.2 53.8 -67.3 -39.4 -24.4 110.0 51.3 1142 214 D E H < S+ 0 0 115 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.899 104.8 57.2 -60.8 -38.2 -21.2 111.8 50.3 1143 215 D E H < S+ 0 0 114 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.881 112.8 37.7 -58.0 -42.7 -19.6 110.4 53.5 1144 216 D I H >< S+ 0 0 3 -4,-1.4 3,-3.1 1,-0.2 4,-0.4 0.674 92.3 95.2 -83.4 -18.9 -20.4 106.8 52.6 1145 217 D K G >< S+ 0 0 56 -4,-1.5 3,-2.2 1,-0.3 -1,-0.2 0.847 77.8 55.1 -46.6 -50.0 -19.7 107.2 48.8 1146 218 D P G 3 S+ 0 0 103 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.608 109.8 51.0 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1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.921 108.8 50.9 -59.9 -43.6 -32.1 91.9 38.9 1157 229 D Q H > S+ 0 0 63 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.920 107.8 52.3 -57.5 -44.3 -28.7 93.5 39.2 1158 230 D S H X S+ 0 0 0 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.866 111.1 47.8 -64.9 -32.7 -29.3 94.0 42.9 1159 231 D A H X S+ 0 0 4 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.901 110.4 51.5 -70.6 -41.6 -30.2 90.3 43.3 1160 232 D Q H X S+ 0 0 5 -4,-2.5 4,-2.3 1,-0.2 6,-0.3 0.871 103.4 58.7 -64.7 -37.8 -27.1 89.2 41.3 1161 233 D L H <>S+ 0 0 5 -4,-2.5 6,-1.6 1,-0.2 5,-1.1 0.884 111.9 40.1 -59.9 -40.0 -24.8 91.3 43.5 1162 234 D L H ><5S+ 0 0 8 -4,-1.1 3,-0.6 -5,-0.2 -2,-0.2 0.881 113.8 55.1 -73.1 -38.9 -25.9 89.4 46.6 1163 235 D N H 3<5S+ 0 0 25 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.864 114.1 37.2 -65.6 -38.2 -26.0 86.1 44.8 1164 236 D D T 3<5S- 0 0 29 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.397 110.5-116.5 -99.0 3.3 -22.4 86.2 43.6 1165 237 D G T < 5S+ 0 0 32 -3,-0.6 -3,-0.2 -4,-0.3 -61,-0.1 0.672 71.0 136.7 75.2 18.4 -21.0 87.8 46.7 1166 238 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0.903 71.4 48.1 -54.0 -53.1 -63.3 104.3 31.7 1211 283 D E H > S+ 0 0 142 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.920 115.8 44.0 -59.9 -46.0 -66.5 102.6 32.7 1212 284 D T H > S+ 0 0 21 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.881 110.6 56.6 -64.5 -36.9 -64.9 99.1 32.5 1213 285 D A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.864 104.8 51.9 -62.4 -37.4 -61.8 100.3 34.2 1214 286 D V H X S+ 0 0 29 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.922 108.9 49.5 -67.2 -43.3 -63.8 101.5 37.2 1215 287 D K H X S+ 0 0 118 -4,-1.6 4,-1.2 1,-0.2 -2,-0.2 0.906 110.8 50.9 -61.4 -41.3 -65.5 98.1 37.6 1216 288 D F H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 3,-0.2 0.883 102.2 60.2 -62.2 -41.0 -62.1 96.4 37.4 1217 289 D L H X S+ 0 0 3 -4,-2.0 4,-1.1 1,-0.2 -1,-0.2 0.900 102.3 53.9 -55.2 -42.4 -60.7 98.7 40.1 1218 290 D N H < S+ 0 0 31 -4,-1.5 -1,-0.2 1,-0.2 3,-0.2 0.875 112.6 42.2 -60.4 -41.2 -63.4 97.4 42.5 1219 291 D E H >< S+ 0 0 18 -4,-1.2 3,-1.3 -3,-0.2 -1,-0.2 0.804 104.9 64.8 -75.2 -30.6 -62.3 93.8 41.8 1220 292 D A H 3< S+ 0 0 0 -4,-2.5 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110.2 -56.2 96.3 51.1 1240 312 D P G > S+ 0 0 34 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.687 85.6 78.1 -65.6 -14.3 -55.6 95.4 54.7 1241 313 D K G > S+ 0 0 88 1,-0.3 3,-2.0 2,-0.2 4,-0.3 0.704 74.4 81.5 -66.1 -16.1 -59.0 93.6 54.8 1242 314 D A G X >S+ 0 0 0 -3,-2.3 3,-1.7 1,-0.3 5,-0.5 0.866 81.8 61.7 -53.6 -36.5 -57.0 90.8 53.0 1243 315 D F G < 5S+ 0 0 70 -3,-1.5 3,-0.4 1,-0.3 -1,-0.3 0.672 95.2 63.0 -67.2 -11.7 -55.7 89.7 56.4 1244 316 D E G < 5S+ 0 0 147 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.580 87.9 71.8 -87.3 -6.3 -59.3 89.0 57.4 1245 317 D T T < 5S- 0 0 42 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.1 0.648 92.4-131.2 -85.5 -17.4 -59.9 86.3 54.8 1246 318 D N T 5S+ 0 0 151 -3,-0.4 -3,-0.1 -4,-0.3 -2,-0.1 0.761 77.3 115.7 65.1 26.8 -57.7 83.5 56.3 1247 319 D V < + 0 0 36 -5,-0.5 2,-0.7 1,-0.1 -4,-0.1 0.808 62.1 68.0 -87.4 -37.2 -56.1 83.1 52.9 1248 320 D I S S- 0 0 16 -6,-0.4 -2,-0.1 4,-0.0 -1,-0.1 -0.763 85.0-136.2 -88.6 113.2 -52.7 84.1 54.1 1249 321 D K > - 0 0 140 -2,-0.7 4,-2.8 1,-0.1 5,-0.2 -0.302 21.7-112.2 -66.4 150.1 -51.2 81.6 56.6 1250 322 D P H > S+ 0 0 96 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.876 116.3 49.9 -49.9 -50.1 -49.5 83.0 59.8 1251 323 D E H 4 S+ 0 0 131 1,-0.2 3,-0.4 2,-0.2 4,-0.4 0.944 113.7 45.3 -55.7 -54.2 -46.0 81.9 58.7 1252 324 D R H >4 S+ 0 0 52 1,-0.2 3,-1.9 2,-0.2 4,-0.3 0.902 108.6 56.4 -55.8 -45.5 -46.4 83.6 55.3 1253 325 D A H >< S+ 0 0 14 -4,-2.8 3,-1.7 1,-0.3 6,-0.2 0.847 96.7 65.2 -60.1 -32.7 -47.9 86.7 56.8 1254 326 D A T 3< S+ 0 0 49 -4,-1.7 -1,-0.3 -3,-0.4 -2,-0.2 0.646 98.7 54.7 -63.8 -15.7 -44.8 87.1 59.0 1255 327 D Q T < S+ 0 0 91 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.509 85.8 106.1 -93.8 -6.9 -42.7 87.7 55.9 1256 328 D L X - 0 0 0 -3,-1.7 3,-1.3 -4,-0.3 6,-0.2 -0.563 69.4-133.0 -90.7 141.0 -44.8 90.6 54.4 1257 329 D P T 3 S+ 0 0 0 0, 0.0 -184,-0.1 0, 0.0 9,-0.1 0.779 105.3 42.3 -52.1 -35.5 -43.7 94.2 54.4 1258 330 D S T 3 S+ 0 0 20 -186,-0.2 -185,-0.0 4,-0.1 -5,-0.0 0.312 76.0 123.9-107.1 5.3 -47.1 95.5 55.7 1259 331 D E S X> S- 0 0 48 -3,-1.3 4,-3.0 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104.8 56.1 1269 341 D X - 0 0 8 -73,-2.6 2,-0.8 -2,-0.7 3,-0.1 -0.309 19.3-135.0 -59.6 135.4 -42.6 106.6 52.9 1270 342 D S > - 0 0 32 1,-0.2 4,-1.9 2,-0.0 5,-0.1 -0.833 21.2-177.4 -95.3 104.5 -44.4 110.0 52.6 1271 343 D Y H > S+ 0 0 31 -2,-0.8 4,-2.6 1,-0.2 5,-0.2 0.767 83.0 65.2 -72.8 -23.0 -45.8 110.3 49.1 1272 344 D A H > S+ 0 0 69 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.934 107.5 43.0 -59.0 -43.8 -47.1 113.8 49.9 1273 345 D W H 4 S+ 0 0 23 1,-0.2 6,-0.8 2,-0.2 3,-0.4 0.928 117.0 44.1 -70.3 -46.4 -43.4 114.7 50.2 1274 346 D W H < S+ 0 0 16 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.816 112.4 51.6 -70.5 -31.6 -42.2 112.9 47.1 1275 347 D S H < S+ 0 0 3 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.699 100.0 84.2 -77.0 -16.9 -45.0 114.1 44.9 1276 348 D S S >X S- 0 0 30 -4,-0.8 4,-1.4 -3,-0.4 3,-0.7 -0.160 101.1 -94.1 -77.7 174.3 -44.4 117.7 45.9 1277 349 D P H 3> S+ 0 0 104 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.820 123.6 62.8 -58.3 -31.0 -41.8 120.1 44.4 1278 350 D A H 3> S+ 0 0 42 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.886 101.4 52.0 -62.0 -36.0 -39.3 119.2 47.1 1279 351 D G H <> S+ 0 0 0 -6,-0.8 4,-2.0 -3,-0.7 -1,-0.2 0.934 109.8 48.1 -62.7 -46.6 -39.3 115.6 45.7 1280 352 D E H X S+ 0 0 62 -4,-1.4 4,-1.8 1,-0.2 -2,-0.2 0.904 111.5 49.9 -59.6 -44.2 -38.6 116.9 42.2 1281 353 D A H X S+ 0 0 49 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.875 107.7 54.0 -64.6 -37.7 -35.8 119.1 43.5 1282 354 D A H X S+ 0 0 1 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.923 107.8 50.9 -62.3 -40.3 -34.3 116.1 45.3 1283 355 D E H X S+ 0 0 48 -4,-2.0 4,-0.9 1,-0.2 -2,-0.2 0.869 107.4 52.6 -64.8 -38.0 -34.4 114.1 42.1 1284 356 D K H X S+ 0 0 150 -4,-1.8 4,-0.9 1,-0.2 -1,-0.2 0.816 106.4 53.6 -67.8 -34.7 -32.6 116.9 40.2 1285 357 D R H X S+ 0 0 91 -4,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.772 95.3 71.9 -69.5 -26.4 -29.8 117.0 42.8 1286 358 D W H X S+ 0 0 16 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.934 94.0 51.0 -55.4 -49.5 -29.3 113.3 42.4 1287 359 D A H < S+ 0 0 69 -4,-0.9 3,-0.4 1,-0.2 4,-0.2 0.941 112.4 47.2 -55.1 -49.7 -27.7 113.6 39.0 1288 360 D S H >< S+ 0 0 88 -4,-0.9 3,-1.1 1,-0.2 -1,-0.2 0.896 109.8 55.3 -55.8 -44.6 -25.3 116.2 40.4 1289 361 D F H 3< S+ 0 0 18 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.839 85.4 79.2 -58.1 -39.4 -24.5 114.0 43.4 1290 362 D X T 3< 0 0 45 -4,-1.9 -1,-0.2 -3,-0.4 -2,-0.1 0.554 360.0 360.0 -60.5 -6.2 -23.4 110.9 41.4 1291 363 D Q < 0 0 175 -3,-1.1 -1,-0.2 -4,-0.2 -4,-0.0 -0.823 360.0 360.0-110.3 360.0 -20.0 112.4 40.8