==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 22-APR-13 4KAE . COMPND 2 MOLECULE: MALEYLACETOACETATE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ANAEROMYXOBACTER DEHALOGENANS; . AUTHOR J.KIM,R.TORO,R.BHOSLE,N.F.AL OBAIDI,L.L.MORISCO,S.R.WASSERMA . 435 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19168.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 315 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 25 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 190 43.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 2 0 0 0 4 4 2 0 0 4 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 0 0 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 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 -4 A L 0 0 178 0, 0.0 2,-2.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 146.6 -10.5 -4.6 44.7 2 -3 A Y - 0 0 121 2,-0.0 4,-0.1 4,-0.0 2,-0.1 -0.399 360.0-165.9 -78.3 63.6 -7.4 -4.3 42.5 3 -2 A F - 0 0 72 -2,-2.7 3,-0.1 1,-0.1 0, 0.0 -0.405 12.4-147.5 -58.7 141.2 -5.7 -7.0 44.6 4 -1 A Q S S+ 0 0 180 1,-0.2 2,-1.4 -2,-0.1 -1,-0.1 0.717 82.9 73.8 -99.8 -26.8 -2.0 -7.0 43.7 5 0 A S + 0 0 96 2,-0.0 2,-0.4 58,-0.0 58,-0.4 -0.651 62.5 139.5 -84.3 67.8 -1.2 -10.6 44.2 6 1 A M - 0 0 31 -2,-1.4 2,-0.4 56,-0.1 56,-0.2 -0.949 38.2-155.3 -93.1 133.0 -2.9 -11.8 41.0 7 2 A T E -A 61 0A 76 54,-2.4 54,-2.6 -2,-0.4 2,-0.4 -0.942 9.6-144.0 -99.2 149.4 -1.0 -14.4 39.1 8 3 A L E -A 60 0A 12 -2,-0.4 26,-2.9 24,-0.4 2,-0.4 -0.879 16.4-176.2-118.6 137.1 -1.5 -14.8 35.4 9 4 A R E -Ab 59 34A 88 50,-2.6 50,-3.3 -2,-0.4 2,-0.6 -0.976 11.9-156.6-132.8 120.2 -1.6 -17.9 33.2 10 5 A L E -Ab 58 35A 0 24,-2.7 26,-3.2 -2,-0.4 2,-0.6 -0.856 9.6-148.3-101.0 124.0 -2.0 -17.7 29.5 11 6 A Y E +Ab 57 36A 49 46,-2.8 46,-1.0 -2,-0.6 2,-0.3 -0.750 42.1 160.3 -82.0 113.8 -3.3 -20.6 27.4 12 7 A S E - b 0 37A 0 24,-2.2 26,-2.2 -2,-0.6 2,-0.4 -0.964 41.3-148.2-141.1 154.0 -1.5 -20.0 24.2 13 8 A Y > - 0 0 22 -2,-0.3 3,-1.7 24,-0.2 7,-0.1 -0.979 35.4-118.7-122.0 138.1 -0.3 -21.7 21.0 14 9 A W T 3 S+ 0 0 6 -2,-0.4 195,-0.1 1,-0.3 -1,-0.1 0.847 108.3 28.4 -49.1 -48.3 2.9 -20.5 19.5 15 10 A R T 3 S+ 0 0 15 192,-0.1 2,-0.5 191,-0.1 -1,-0.3 0.291 83.2 125.2-108.4 20.7 1.5 -19.2 16.2 16 11 A S <> - 0 0 15 -3,-1.7 4,-2.4 1,-0.2 5,-0.1 -0.606 48.0-156.9 -71.2 118.0 -2.0 -18.4 17.2 17 12 A S H > S+ 0 0 4 -2,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.892 93.4 55.6 -66.2 -34.3 -2.5 -14.7 16.1 18 13 A S H > S+ 0 0 19 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.929 111.7 42.1 -65.5 -41.9 -5.3 -14.4 18.6 19 14 A A H >> S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 3,-0.6 0.890 108.1 60.8 -67.4 -41.4 -3.0 -15.5 21.5 20 15 A W H 3X S+ 0 0 4 -4,-2.4 4,-2.3 1,-0.3 -2,-0.2 0.882 97.0 59.7 -53.6 -39.9 -0.1 -13.4 20.2 21 16 A R H 3X S+ 0 0 4 -4,-1.9 4,-1.9 1,-0.2 -1,-0.3 0.878 108.6 44.4 -54.2 -47.7 -2.2 -10.3 20.6 22 17 A V H S+ 0 0 0 -4,-2.6 5,-2.8 2,-0.2 4,-0.3 0.928 114.6 45.6 -66.9 -47.3 1.3 -8.6 28.5 27 22 A A H ><5S+ 0 0 27 -4,-2.4 3,-1.1 3,-0.2 -2,-0.2 0.907 111.9 50.9 -61.3 -44.1 4.8 -7.9 27.3 28 23 A L H 3<5S+ 0 0 26 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.849 112.1 47.2 -70.6 -26.8 4.1 -4.2 26.7 29 24 A K T 3<5S- 0 0 17 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.449 112.3-122.1 -89.2 -3.5 2.7 -3.8 30.2 30 25 A G T < 5 + 0 0 65 -3,-1.1 2,-0.5 -4,-0.3 -3,-0.2 0.860 55.8 159.7 66.3 35.2 5.8 -5.7 31.6 31 26 A L < - 0 0 35 -5,-2.8 -1,-0.2 -6,-0.1 2,-0.2 -0.810 35.5-136.4-100.6 124.6 3.6 -8.3 33.2 32 27 A A + 0 0 93 -2,-0.5 -24,-0.4 -5,-0.0 2,-0.3 -0.488 31.6 168.1 -74.3 145.0 4.9 -11.7 34.1 33 28 A Y - 0 0 65 -2,-0.2 2,-0.4 -26,-0.1 -24,-0.2 -0.993 36.8-110.6-153.6 158.9 2.8 -14.7 33.3 34 29 A E E -b 9 0A 106 -26,-2.9 -24,-2.7 -2,-0.3 2,-0.6 -0.714 31.8-136.1 -87.2 130.6 2.9 -18.5 33.1 35 30 A Y E -b 10 0A 47 -2,-0.4 2,-0.7 -26,-0.2 -24,-0.2 -0.831 18.0-171.1 -91.9 120.0 2.7 -20.0 29.6 36 31 A R E -b 11 0A 116 -26,-3.2 -24,-2.2 -2,-0.6 2,-0.2 -0.915 19.3-141.3-110.9 108.5 0.3 -22.9 29.2 37 32 A A E -b 12 0A 44 -2,-0.7 2,-0.5 -26,-0.2 -24,-0.2 -0.422 14.5-167.1 -74.2 142.6 0.8 -24.5 25.8 38 33 A V - 0 0 2 -26,-2.2 2,-1.5 -2,-0.2 3,-0.1 -0.980 16.5-143.9-127.0 110.8 -2.3 -25.7 23.9 39 34 A D > + 0 0 86 -2,-0.5 4,-2.1 1,-0.2 5,-0.2 -0.607 22.9 176.0 -82.6 92.6 -1.2 -27.8 21.0 40 35 A L H > S+ 0 0 55 -2,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.748 78.1 56.2 -70.6 -27.8 -3.8 -26.9 18.4 41 36 A L H > S+ 0 0 47 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.937 108.1 47.5 -65.9 -47.5 -2.1 -29.0 15.7 42 37 A A H > S+ 0 0 43 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.912 113.0 49.3 -61.3 -39.3 -2.4 -32.1 17.9 43 38 A Q H X S+ 0 0 72 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.931 111.0 49.3 -71.2 -36.8 -6.0 -31.3 18.6 44 39 A E H X S+ 0 0 89 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.924 114.4 44.8 -60.8 -46.4 -6.8 -30.8 14.9 45 40 A Q H X S+ 0 0 121 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.838 114.7 48.1 -70.4 -39.6 -5.1 -34.1 14.0 46 41 A F H X S+ 0 0 164 -4,-2.4 4,-1.0 -5,-0.2 -2,-0.2 0.944 112.1 49.3 -64.5 -47.7 -6.8 -36.0 16.9 47 42 A Q H < S+ 0 0 81 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.815 113.8 48.3 -64.1 -31.0 -10.2 -34.6 16.0 48 43 A A H < S+ 0 0 75 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.1 0.995 109.2 45.4 -71.5 -72.2 -9.8 -35.6 12.3 49 44 A A H < 0 0 96 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.595 360.0 360.0 -55.3 -11.1 -8.6 -39.2 12.5 50 45 A H < 0 0 105 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.1 -0.221 360.0 360.0 89.0 360.0 -11.4 -39.5 15.0 51 ! 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 52 51 A M 0 0 155 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 125.7 -12.9 -28.0 22.8 53 52 A S - 0 0 51 -15,-0.0 2,-0.2 2,-0.0 -10,-0.0 -0.689 360.0-164.7-154.6 118.5 -10.0 -25.9 23.9 54 53 A Q - 0 0 147 -2,-0.2 -43,-0.1 2,-0.0 3,-0.0 -0.594 15.9-109.6-107.5 157.8 -9.8 -22.3 22.7 55 54 A V S S+ 0 0 12 1,-0.2 -36,-0.2 -2,-0.2 -43,-0.1 -0.999 83.8 36.4-142.4 131.8 -7.0 -19.8 22.7 56 55 A P + 0 0 9 0, 0.0 15,-0.7 0, 0.0 2,-0.4 0.509 63.1 157.5 -83.5 155.6 -6.4 -17.3 24.2 57 56 A V E -AC 11 70A 23 -46,-1.0 -46,-2.8 13,-0.1 2,-0.7 -0.991 25.2-155.7-131.9 126.2 -7.6 -17.8 27.7 58 57 A L E -AC 10 69A 0 11,-2.6 11,-2.7 -2,-0.4 2,-0.5 -0.939 9.1-158.3-102.4 109.7 -6.1 -15.7 30.5 59 58 A E E -AC 9 68A 28 -50,-3.3 -50,-2.6 -2,-0.7 2,-0.5 -0.823 6.5-165.3 -88.7 122.5 -6.5 -17.4 33.8 60 59 A V E -AC 8 67A 0 7,-2.8 7,-2.8 -2,-0.5 2,-0.4 -0.970 4.2-169.3-115.2 119.9 -6.3 -15.0 36.7 61 60 A E E +AC 7 66A 29 -54,-2.6 -54,-2.4 -2,-0.5 2,-0.3 -0.919 13.4 164.9-114.5 131.9 -5.7 -16.4 40.2 62 61 A E E > S- C 0 65A 9 3,-2.4 3,-2.8 -2,-0.4 -56,-0.1 -0.944 70.9 -30.4-143.2 121.4 -6.0 -14.5 43.4 63 62 A D T 3 S- 0 0 130 -58,-0.4 3,-0.1 -2,-0.3 -57,-0.0 0.830 124.9 -40.6 36.1 69.1 -6.3 -16.2 46.8 64 63 A G T 3 S+ 0 0 91 1,-0.2 2,-0.5 0, 0.0 -1,-0.3 0.473 115.0 111.6 65.9 1.8 -8.1 -19.4 45.7 65 64 A R E < -C 62 0A 35 -3,-2.8 -3,-2.4 2,-0.0 2,-0.5 -0.926 49.7-163.6-104.7 130.1 -10.4 -17.6 43.3 66 65 A T E -C 61 0A 79 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.968 5.7-170.2-112.6 132.1 -9.9 -18.3 39.6 67 66 A H E -C 60 0A 50 -7,-2.8 -7,-2.8 -2,-0.5 2,-0.6 -0.980 9.7-153.4-117.0 136.5 -11.2 -16.2 36.8 68 67 A L E -C 59 0A 110 -2,-0.4 2,-0.5 -9,-0.2 -9,-0.2 -0.918 11.4-162.8-109.2 117.0 -11.0 -17.3 33.1 69 68 A L E -C 58 0A 13 -11,-2.7 -11,-2.6 -2,-0.6 2,-0.3 -0.879 9.8-174.4-103.9 126.9 -11.0 -14.5 30.7 70 69 A V E +C 57 0A 53 -2,-0.5 -13,-0.1 -13,-0.2 4,-0.1 -0.807 43.2 51.6-117.9 165.4 -11.8 -15.2 27.0 71 70 A Q S > S- 0 0 28 -15,-0.7 4,-2.6 -2,-0.3 3,-0.4 0.793 73.1-119.7 74.3 115.3 -11.7 -13.2 23.7 72 71 A S H > S+ 0 0 2 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.857 112.0 49.6 -48.6 -45.7 -8.5 -11.3 23.0 73 72 A M H > S+ 0 0 5 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.913 112.2 47.1 -65.9 -40.7 -10.2 -7.9 22.9 74 73 A A H > S+ 0 0 1 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.899 113.3 49.4 -64.1 -40.8 -11.9 -8.5 26.2 75 74 A I H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.933 112.3 47.3 -63.4 -47.9 -8.7 -9.7 27.8 76 75 A L H X S+ 0 0 2 -4,-2.8 4,-2.2 -5,-0.3 -2,-0.2 0.884 110.1 52.0 -65.7 -35.5 -6.8 -6.7 26.5 77 76 A E H X S+ 0 0 3 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.875 110.2 50.5 -68.7 -33.9 -9.4 -4.3 27.7 78 77 A W H X S+ 0 0 1 -4,-2.0 4,-3.0 2,-0.2 5,-0.3 0.945 109.4 49.9 -65.3 -44.6 -9.2 -6.0 31.2 79 78 A L H X S+ 0 0 1 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.887 110.4 50.8 -59.3 -42.8 -5.4 -5.6 31.1 80 79 A E H < S+ 0 0 17 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.875 114.3 43.1 -66.8 -37.7 -5.8 -1.9 30.2 81 80 A E H < S+ 0 0 36 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.880 120.2 41.4 -71.1 -42.8 -8.3 -1.3 33.1 82 81 A R H < S+ 0 0 26 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.840 129.5 26.7 -75.4 -36.6 -6.3 -3.3 35.7 83 82 A H S < S+ 0 0 45 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.1 -0.745 70.7 174.2-128.0 77.0 -2.9 -2.1 34.7 84 83 A P + 0 0 75 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 0.685 43.3 101.2 -70.5 -17.2 -3.3 1.3 33.2 85 84 A E S S+ 0 0 169 1,-0.2 2,-0.1 2,-0.1 3,-0.0 -0.974 78.8 30.4-118.5 134.6 0.4 2.2 32.7 86 85 A P S S- 0 0 72 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.536 100.6-138.7 -77.3 141.9 1.8 2.0 30.2 87 86 A A - 0 0 55 -2,-0.1 -2,-0.1 1,-0.1 -7,-0.0 -0.528 24.0-173.4 -76.3 133.7 -1.4 2.8 28.4 88 87 A L S S+ 0 0 6 -2,-0.2 76,-2.6 -12,-0.1 77,-0.3 0.438 81.5 52.3-102.7 3.1 -2.3 0.9 25.2 89 88 A L S S- 0 0 3 -5,-0.2 7,-0.1 74,-0.2 -1,-0.1 -0.990 92.0-122.4-127.8 138.5 -5.3 3.2 24.7 90 89 A P - 0 0 18 0, 0.0 -2,-0.1 0, 0.0 6,-0.0 -0.167 19.4-117.3 -76.2 166.5 -4.9 6.9 24.7 91 90 A P S S+ 0 0 123 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.677 88.7 88.0 -81.4 -16.4 -6.8 9.1 27.2 92 91 A D S > S- 0 0 78 1,-0.1 4,-2.0 4,-0.0 5,-0.1 -0.650 76.4-135.2 -83.4 142.5 -8.7 11.1 24.5 93 92 A L H > S+ 0 0 52 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.822 100.3 53.0 -69.8 -39.5 -11.9 9.6 23.4 94 93 A W H > S+ 0 0 54 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.925 111.4 47.8 -59.2 -43.9 -11.5 10.1 19.6 95 94 A G H > S+ 0 0 4 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.860 109.0 53.8 -66.8 -37.7 -8.1 8.3 19.7 96 95 A R H X S+ 0 0 45 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.922 110.0 48.1 -60.1 -48.1 -9.6 5.5 21.8 97 96 A A H X S+ 0 0 4 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.883 112.2 49.3 -61.0 -36.7 -12.3 5.0 19.2 98 97 A R H X S+ 0 0 84 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.929 111.6 47.3 -67.9 -45.4 -9.8 5.0 16.4 99 98 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.919 112.6 49.9 -64.5 -45.0 -7.5 2.5 18.1 100 99 A R H X S+ 0 0 3 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.894 109.2 52.4 -61.5 -35.5 -10.4 0.2 18.8 101 100 A A H X S+ 0 0 3 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.932 108.5 49.5 -65.9 -40.3 -11.6 0.4 15.2 102 101 A L H X S+ 0 0 4 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.920 113.3 48.0 -65.6 -40.1 -8.1 -0.5 13.9 103 102 A A H >X S+ 0 0 0 -4,-2.3 4,-3.2 1,-0.2 3,-0.7 0.936 111.1 50.8 -62.5 -46.6 -8.1 -3.5 16.3 104 103 A E H 3X>S+ 0 0 1 -4,-2.7 4,-2.6 1,-0.3 5,-1.4 0.821 97.4 65.3 -67.5 -28.1 -11.6 -4.5 15.3 105 104 A H H 3<5S+ 0 0 28 -4,-2.2 -1,-0.3 3,-0.2 -2,-0.2 0.873 116.5 31.7 -56.8 -35.9 -10.8 -4.4 11.6 106 105 A V H S+ 0 0 2 -4,-1.0 5,-2.2 -3,-0.7 4,-1.4 0.916 121.0 48.3 -80.8 -52.3 -8.5 -7.3 12.5 107 106 A N H <5S+ 0 0 2 -4,-3.2 -3,-0.2 1,-0.2 -2,-0.2 0.853 135.5 9.1 -57.8 -49.2 -10.4 -8.9 15.3 108 107 A S T <5S+ 0 0 9 -4,-2.6 -1,-0.2 -5,-0.2 -3,-0.2 0.640 132.2 48.1-105.0 -23.1 -13.7 -9.0 13.6 109 108 A G T 4<5S+ 0 0 0 -4,-1.4 3,-0.8 -6,-0.2 4,-0.4 0.551 115.8 54.8-130.6 -62.7 -10.0 -10.1 9.0 111 110 A Q G > S+ 0 0 1 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.892 100.7 57.4 -57.4 -28.4 -12.3 -14.8 11.5 113 112 A M G < S+ 0 0 14 -3,-0.8 -2,-0.2 1,-0.3 24,-0.1 0.571 114.1 38.1 -80.1 -8.6 -12.2 -15.3 7.7 114 113 A Q G < S+ 0 0 12 -3,-1.7 -1,-0.3 -4,-0.4 -3,-0.1 0.173 83.4 132.5-125.7 20.0 -8.9 -17.1 7.9 115 114 A N <> - 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0 0 30 -5,-2.6 -1,-0.2 -6,-0.2 2,-0.2 -0.833 35.8-142.0 -99.2 124.7 -29.5 9.8 22.3 252 27 B A + 0 0 93 -2,-0.6 2,-0.3 -5,-0.0 -24,-0.2 -0.530 26.7 173.5 -72.5 150.2 -31.1 11.4 19.3 253 28 B Y - 0 0 60 -2,-0.2 2,-0.4 -26,-0.1 -24,-0.2 -0.989 36.0-107.9-155.7 154.2 -29.4 11.0 15.9 254 29 B E E -e 229 0B 86 -26,-2.5 -24,-3.0 -2,-0.3 2,-0.5 -0.692 34.9-136.4 -80.4 131.3 -30.0 11.7 12.3 255 30 B Y E -e 230 0B 30 -2,-0.4 2,-0.6 -26,-0.2 -24,-0.2 -0.781 19.1-171.5 -91.1 123.4 -30.6 8.5 10.4 256 31 B R E -e 231 0B 87 -26,-2.9 -24,-2.3 -2,-0.5 2,-0.1 -0.923 16.5-143.0-119.2 106.2 -28.8 8.3 7.1 257 32 B A E -e 232 0B 62 -2,-0.6 2,-0.4 -26,-0.2 -24,-0.2 -0.395 8.1-154.8 -71.3 138.4 -30.0 5.3 5.0 258 33 B V - 0 0 27 -26,-2.0 2,-1.9 -2,-0.1 3,-0.2 -0.952 19.4-130.8-111.7 133.3 -27.5 3.3 2.9 259 34 B D > + 0 0 114 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 -0.602 39.2 170.0 -81.6 73.9 -28.7 1.4 -0.2 260 35 B L H > + 0 0 16 -2,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.821 67.0 56.7 -64.0 -34.6 -26.8 -1.7 1.0 261 36 B L H > S+ 0 0 104 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.958 111.3 43.2 -67.4 -42.7 -28.3 -4.1 -1.5 262 37 B A H > S+ 0 0 47 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.906 114.6 51.9 -65.6 -39.7 -27.1 -1.9 -4.4 263 38 B Q H X S+ 0 0 52 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.907 110.0 47.5 -60.5 -47.2 -23.8 -1.5 -2.7 264 39 B E H X S+ 0 0 65 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.872 107.7 55.6 -68.1 -29.5 -23.3 -5.2 -2.2 265 40 B Q H X S+ 0 0 137 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.930 111.2 45.3 -66.3 -44.7 -24.2 -6.0 -5.8 266 41 B F H X S+ 0 0 103 -4,-2.2 4,-0.8 1,-0.2 6,-0.2 0.935 111.8 52.0 -59.9 -49.3 -21.4 -3.6 -6.9 267 42 B Q H ><>S+ 0 0 12 -4,-2.5 5,-3.4 1,-0.2 3,-1.1 0.921 107.8 51.9 -54.7 -42.8 -19.0 -5.0 -4.4 268 43 B A H ><5S+ 0 0 19 -4,-2.4 3,-0.8 1,-0.3 -1,-0.2 0.880 110.3 47.2 -64.9 -40.1 -19.6 -8.5 -5.6 269 44 B A H 3<5S+ 0 0 60 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.544 116.9 45.8 -77.2 -7.1 -19.0 -7.6 -9.2 270 45 B H T X<5S- 0 0 85 -3,-1.1 3,-1.7 -4,-0.8 -1,-0.2 -0.161 116.2-100.4-136.1 39.9 -15.8 -5.7 -8.3 271 46 B Q T < 5 - 0 0 137 -3,-0.8 -3,-0.2 1,-0.3 -4,-0.1 0.702 65.4 -81.8 56.3 23.0 -13.9 -8.0 -5.9 272 47 B A T 3 - F 0 288B 35 3,-2.4 3,-2.1 -2,-0.5 -60,-0.2 -0.973 64.5 -2.6-154.1 136.1 -18.2 18.8 17.7 286 62 B D T 3 S- 0 0 71 -62,-3.1 -61,-0.1 -2,-0.3 3,-0.1 0.826 128.7 -54.7 52.4 41.0 -16.4 22.1 17.9 287 63 B G T 3 S+ 0 0 65 1,-0.2 2,-0.4 -63,-0.2 -1,-0.3 0.508 115.9 109.1 77.5 6.0 -16.2 22.4 14.1 288 64 B R E < -F 285 0B 145 -3,-2.1 -3,-2.4 -64,-0.2 2,-0.4 -0.899 56.3-144.6-120.4 143.6 -14.5 19.1 13.6 289 65 B T E -F 284 0B 78 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.860 11.6-169.7-111.9 135.8 -16.0 15.9 12.1 290 66 B H E -F 283 0B 34 -7,-2.4 -7,-2.9 -2,-0.4 2,-0.7 -0.995 11.1-153.3-124.7 131.5 -15.2 12.4 13.3 291 67 B L E -F 282 0B 91 -2,-0.4 2,-0.6 -9,-0.2 -9,-0.2 -0.938 15.1-162.4-107.9 106.4 -16.2 9.2 11.4 292 68 B L E -F 281 0B 13 -11,-3.1 -11,-2.8 -2,-0.7 2,-0.3 -0.844 11.2-176.9 -93.9 125.5 -16.4 6.3 13.9 293 69 B V E +F 280 0B 45 -2,-0.6 -13,-0.1 -13,-0.2 4,-0.1 -0.786 41.7 53.2-119.0 165.7 -16.4 2.8 12.4 294 70 B Q S > S- 0 0 18 -15,-0.7 4,-2.6 -2,-0.3 3,-0.4 0.796 72.6-120.9 74.3 112.2 -16.8 -0.7 13.9 295 71 B S H > S+ 0 0 3 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.853 111.0 49.3 -46.9 -42.8 -19.8 -1.4 16.0 296 72 B M H > S+ 0 0 4 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.894 112.3 47.8 -70.8 -39.6 -17.8 -2.3 19.1 297 73 B A H > S+ 0 0 1 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.911 113.4 48.5 -65.6 -41.8 -15.6 0.8 18.9 298 74 B I H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.924 112.2 48.4 -61.6 -46.3 -18.6 3.0 18.4 299 75 B L H X S+ 0 0 3 -4,-2.7 4,-2.2 -5,-0.3 -2,-0.2 0.895 110.7 50.4 -67.2 -39.4 -20.4 1.4 21.4 300 76 B E H X S+ 0 0 2 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.871 110.6 50.9 -60.2 -40.0 -17.4 1.7 23.6 301 77 B W H X S+ 0 0 1 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.939 109.0 50.3 -63.9 -44.5 -17.2 5.4 22.6 302 78 B L H X S+ 0 0 2 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.918 110.5 50.2 -60.3 -39.8 -20.8 5.9 23.4 303 79 B E H < S+ 0 0 20 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.894 116.5 40.9 -67.5 -35.1 -20.3 4.3 26.9 304 80 B E H < S+ 0 0 48 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.866 120.5 42.8 -78.3 -33.8 -17.2 6.6 27.5 305 81 B R H < S+ 0 0 75 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.768 129.8 23.5 -87.4 -31.4 -18.8 9.8 26.1 306 82 B H S < S+ 0 0 66 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.1 -0.683 72.9 177.9-137.5 79.3 -22.2 9.4 27.6 307 83 B P + 0 0 71 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.741 42.1 102.9 -63.3 -27.1 -21.9 7.1 30.7 308 84 B E S S+ 0 0 141 1,-0.1 2,-0.1 2,-0.1 3,-0.0 -0.905 77.6 30.7-118.4 132.5 -25.5 7.1 32.0 309 85 B P S S- 0 0 60 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.579 101.0-134.4 -75.3 149.4 -27.3 4.9 31.6 310 86 B A - 0 0 43 1,-0.1 -2,-0.1 -2,-0.1 -7,-0.0 -0.528 24.8-174.0 -78.2 134.9 -24.4 2.4 31.7 311 87 B L S S+ 0 0 6 -2,-0.3 76,-2.6 -4,-0.1 77,-0.3 0.409 76.3 56.5-105.2 3.0 -24.1 -0.4 29.2 312 88 B L S S- 0 0 5 74,-0.2 7,-0.1 75,-0.1 6,-0.0 -0.977 91.1-112.1-121.2 148.6 -21.1 -1.9 30.9 313 89 B P - 0 0 13 0, 0.0 -2,-0.1 0, 0.0 6,-0.0 -0.208 24.8-118.2 -68.2 167.8 -21.1 -3.0 34.5 314 90 B P S S+ 0 0 124 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 0.776 86.4 79.4 -80.5 -19.4 -18.9 -1.2 37.0 315 91 B D S > S- 0 0 72 1,-0.1 4,-2.2 4,-0.0 5,-0.2 -0.572 79.0-126.2-100.6 148.1 -16.6 -4.1 38.0 316 92 B L H > S+ 0 0 27 -2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.859 107.4 49.5 -60.5 -42.1 -13.6 -5.4 36.1 317 93 B W H > S+ 0 0 64 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.940 112.4 46.8 -66.7 -42.1 -14.7 -9.0 36.0 318 94 B G H > S+ 0 0 4 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.854 110.1 54.2 -68.9 -32.6 -18.2 -8.2 34.7 319 95 B R H X S+ 0 0 43 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.915 109.4 47.8 -65.4 -44.8 -16.8 -5.8 32.1 320 96 B A H X S+ 0 0 5 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.868 112.7 49.5 -63.4 -40.2 -14.6 -8.6 30.7 321 97 B R H X S+ 0 0 48 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.959 112.1 46.7 -65.4 -47.3 -17.5 -11.0 30.7 322 98 B V H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.907 112.4 50.0 -63.6 -41.4 -19.8 -8.6 28.9 323 99 B R H X S+ 0 0 3 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.899 109.8 51.6 -64.7 -36.5 -17.1 -7.7 26.3 324 100 B A H X S+ 0 0 7 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.922 109.7 48.9 -65.8 -42.2 -16.5 -11.4 25.7 325 101 B L H X S+ 0 0 5 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.934 112.7 48.0 -60.4 -45.6 -20.2 -12.1 25.1 326 102 B A H >X S+ 0 0 0 -4,-2.4 4,-3.2 1,-0.2 3,-0.6 0.924 111.8 50.1 -60.2 -47.2 -20.3 -9.2 22.7 327 103 B E H 3X>S+ 0 0 1 -4,-2.7 4,-2.7 1,-0.2 5,-1.1 0.801 97.1 67.7 -66.6 -27.7 -17.2 -10.4 20.9 328 104 B H H 3<5S+ 0 0 33 -4,-2.0 -1,-0.2 3,-0.2 4,-0.2 0.902 115.8 29.9 -56.1 -35.6 -18.6 -13.9 20.5 329 105 B V H S+ 0 0 1 -4,-1.0 5,-2.2 -3,-0.6 4,-1.3 0.912 121.6 50.1 -86.1 -51.3 -21.1 -12.3 18.2 330 106 B N H <5S+ 0 0 2 -4,-3.2 -3,-0.2 1,-0.2 -2,-0.2 0.905 134.7 9.4 -57.3 -44.1 -19.0 -9.4 16.8 331 107 B S T <5S+ 0 0 13 -4,-2.7 -1,-0.2 -5,-0.2 -3,-0.2 0.606 133.1 47.4-109.7 -21.2 -16.0 -11.6 15.9 332 108 B G T 4X5S+ 0 0 1 -4,-1.3 3,-0.7 -6,-0.2 4,-0.7 0.498 116.7 54.3-129.2 -56.4 -20.7 -15.4 14.6 334 110 B Q G >44 S+ 0 0 0 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.866 100.0 59.9 -61.3 -33.2 -18.5 -12.4 10.2 336 112 B M G <4 S+ 0 0 5 -3,-0.7 -2,-0.2 1,-0.2 24,-0.1 0.732 111.4 40.5 -58.7 -30.3 -19.3 -16.0 9.1 337 113 B Q G << S+ 0 0 16 -3,-1.4 -1,-0.2 -4,-0.7 -3,-0.1 0.127 81.8 137.5-110.7 20.4 -22.6 -14.7 7.7 338 114 B N <> - 0 0 28 -3,-1.3 4,-2.6 -4,-0.2 3,-0.3 -0.361 65.3-117.4 -67.5 140.2 -21.5 -11.5 6.1 339 115 B A H > S+ 0 0 35 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.845 113.9 50.1 -55.4 -32.5 -23.0 -10.9 2.7 340 116 B L H > S+ 0 0 23 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.903 109.9 49.2 -70.2 -45.2 -19.6 -11.0 1.0 341 117 B V H > S+ 0 0 2 -3,-0.3 4,-1.9 -6,-0.2 -2,-0.2 0.955 114.6 45.1 -55.9 -51.1 -18.6 -14.2 2.7 342 118 B L H X S+ 0 0 9 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.882 111.6 52.8 -68.0 -33.6 -21.8 -15.8 1.7 343 119 B R H X S+ 0 0 86 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.2 0.913 108.8 50.0 -65.7 -44.2 -21.7 -14.4 -1.9 344 120 B M H X S+ 0 0 37 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.883 112.5 46.8 -64.2 -37.9 -18.2 -15.8 -2.4 345 121 B L H >X S+ 0 0 0 -4,-1.9 4,-2.8 -5,-0.2 3,-0.6 0.947 112.2 50.8 -61.3 -42.3 -19.3 -19.2 -1.1 346 122 B R H 3< S+ 0 0 94 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.675 106.0 55.3 -75.2 -27.7 -22.4 -19.1 -3.4 347 123 B E H 3< S+ 0 0 108 -4,-1.8 -1,-0.3 2,-0.1 -2,-0.2 0.751 114.6 39.4 -71.5 -35.4 -20.3 -18.2 -6.5 348 124 B K H << S+ 0 0 98 -4,-1.0 -2,-0.2 -3,-0.6 -3,-0.1 0.894 137.7 8.3 -83.7 -43.4 -18.1 -21.3 -6.0 349 125 B V S >< S- 0 0 41 -4,-2.8 3,-2.3 -5,-0.1 4,-0.4 -0.843 80.6-131.1-142.9 98.4 -20.9 -23.7 -5.0 350 126 B P T 3 S+ 0 0 113 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.190 93.7 19.2 -53.7 137.9 -24.5 -22.6 -5.2 351 127 B G T 3> S+ 0 0 48 1,-0.1 4,-1.4 -5,-0.0 3,-0.5 0.118 92.9 104.1 89.2 -19.3 -26.4 -23.3 -1.9 352 128 B W H <> S+ 0 0 7 -3,-2.3 4,-3.0 1,-0.2 5,-0.2 0.847 71.3 66.9 -61.5 -33.4 -23.2 -23.6 0.2 353 129 B D H > S+ 0 0 26 -4,-0.4 4,-2.7 1,-0.2 5,-0.2 0.907 101.0 46.1 -54.7 -44.9 -24.0 -20.2 1.6 354 130 B R H > S+ 0 0 126 -3,-0.5 4,-2.3 2,-0.2 5,-0.2 0.936 113.6 47.8 -67.0 -45.6 -27.1 -21.4 3.4 355 131 B E H X S+ 0 0 106 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.945 115.1 46.7 -57.3 -45.0 -25.4 -24.5 4.8 356 132 B W H X S+ 0 0 1 -4,-3.0 4,-3.0 1,-0.2 5,-0.3 0.934 112.0 48.0 -66.3 -52.6 -22.4 -22.4 6.0 357 133 B A H X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.2 5,-0.3 0.921 113.6 48.2 -56.2 -47.3 -24.5 -19.6 7.6 358 134 B R H X S+ 0 0 81 -4,-2.3 4,-2.3 -5,-0.2 5,-0.3 0.928 113.2 47.9 -61.4 -42.8 -26.7 -22.1 9.4 359 135 B F H X S+ 0 0 82 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.955 117.1 40.8 -62.0 -50.0 -23.7 -24.1 10.7 360 136 B F H X S+ 0 0 8 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.865 115.3 48.6 -73.4 -37.1 -21.7 -21.1 11.9 361 137 B I H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.3 5,-0.2 0.942 114.0 47.5 -65.2 -47.2 -24.7 -19.2 13.4 362 138 B A H X S+ 0 0 27 -4,-2.3 4,-2.7 -5,-0.3 -2,-0.2 0.924 112.0 50.6 -59.2 -41.8 -25.8 -22.3 15.3 363 139 B R H X S+ 0 0 138 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.933 112.9 45.8 -62.0 -47.3 -22.3 -23.0 16.5 364 140 B G H X S+ 0 0 10 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.905 113.7 48.5 -62.5 -42.7 -21.9 -19.4 17.7 365 141 B L H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.900 107.8 54.1 -69.3 -34.9 -25.3 -19.4 19.4 366 142 B A H X S+ 0 0 47 -4,-2.7 4,-1.6 -5,-0.2 -1,-0.2 0.917 113.1 43.4 -62.6 -44.8 -24.7 -22.8 21.1 367 143 B A H X S+ 0 0 57 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.895 114.0 51.3 -66.9 -36.3 -21.4 -21.4 22.6 368 144 B L H X S+ 0 0 4 -4,-2.4 4,-3.1 2,-0.2 5,-0.3 0.895 104.5 56.9 -71.0 -37.5 -23.2 -18.1 23.5 369 145 B E H X S+ 0 0 15 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.942 108.9 46.3 -56.9 -47.3 -26.0 -20.0 25.3 370 146 B T H X S+ 0 0 105 -4,-1.6 4,-1.3 1,-0.2 -1,-0.2 0.916 116.0 45.3 -62.4 -45.6 -23.6 -21.7 27.6 371 147 B A H < S+ 0 0 31 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.896 114.4 46.8 -67.5 -42.6 -21.7 -18.5 28.3 372 148 B V H X S+ 0 0 1 -4,-3.1 4,-1.6 1,-0.2 -2,-0.2 0.897 104.7 60.1 -64.3 -42.4 -24.7 -16.4 28.8 373 149 B R H < S+ 0 0 179 -4,-2.5 2,-1.9 -5,-0.3 3,-0.3 0.896 94.0 69.8 -58.6 -31.8 -26.4 -18.9 31.1 374 150 B D T < S+ 0 0 137 -4,-1.3 -1,-0.2 1,-0.2 -4,-0.0 -0.546 121.8 4.6 -86.2 76.3 -23.4 -18.6 33.5 375 151 B G T 4 S+ 0 0 38 -2,-1.9 7,-2.0 1,-0.4 -1,-0.2 0.188 92.6 132.4 135.9 -13.0 -24.2 -15.0 34.7 376 152 B A B < +g 382 0C 23 -4,-1.6 -1,-0.4 -3,-0.3 4,-0.2 -0.399 21.1 169.7 -63.7 139.5 -27.5 -14.0 33.1 377 153 B G S S- 0 0 21 2,-1.7 6,-0.2 5,-1.2 -1,-0.1 0.081 78.7 -36.1-102.5-119.9 -30.2 -12.5 35.3 378 154 B R S S+ 0 0 137 -2,-0.1 40,-0.2 3,-0.1 5,-0.2 0.807 141.2 31.7 -65.4 -37.1 -33.2 -11.0 33.5 379 155 B F S S- 0 0 9 3,-2.6 -2,-1.7 5,-0.1 3,-0.3 -0.490 110.7 -79.4-114.2-177.6 -30.7 -9.9 30.8 380 156 B S S S+ 0 0 1 1,-0.3 2,-0.4 -4,-0.2 3,-0.1 0.818 124.8 26.4 -56.2 -35.3 -27.4 -11.4 29.4 381 157 B H S > S- 0 0 40 3,-0.4 3,-0.8 1,-0.2 -1,-0.3 -0.927 126.8 -53.5-132.3 108.2 -25.5 -10.0 32.4 382 158 B G B 3 S-g 376 0C 24 -7,-2.0 -3,-2.6 -2,-0.4 -5,-1.2 -0.219 95.8 -39.3 60.2-146.0 -27.5 -9.5 35.5 383 159 B D T 3 S+ 0 0 126 -6,-0.2 -1,-0.2 -5,-0.2 -7,-0.0 0.287 114.2 61.9-113.1 17.0 -30.6 -7.5 35.6 384 160 B A S < S- 0 0 55 -3,-0.8 -3,-0.4 -5,-0.0 -5,-0.1 -0.974 88.6 -94.4-134.8 154.8 -30.0 -4.6 33.3 385 161 B P + 0 0 26 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.320 46.9 175.5 -65.3 146.2 -29.3 -4.4 29.6 386 162 B T >> - 0 0 8 -4,-0.1 4,-1.2 -64,-0.0 3,-1.1 -0.804 51.3 -81.2-136.5 177.1 -25.7 -4.2 28.6 387 163 B L H 3> S+ 0 0 1 -76,-2.6 4,-1.2 1,-0.3 5,-0.2 0.797 123.2 67.8 -50.9 -31.3 -23.6 -4.2 25.4 388 164 B A H >> S+ 0 0 4 -77,-0.3 4,-2.0 1,-0.2 3,-0.5 0.914 99.8 47.0 -59.6 -42.5 -24.0 -8.0 25.4 389 165 B D H <> S+ 0 0 0 -3,-1.1 4,-2.0 1,-0.2 -1,-0.2 0.817 103.6 62.5 -71.1 -25.6 -27.7 -7.7 24.7 390 166 B C H 3< S+ 0 0 0 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.786 112.1 38.4 -67.7 -26.6 -27.0 -5.2 21.9 391 167 B Y H S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.888 112.0 55.2 -64.7 -35.1 -29.8 -8.6 16.2 395 171 B Q H X S+ 0 0 1 -4,-1.3 4,-2.1 1,-0.2 -2,-0.2 0.905 105.3 51.2 -67.6 -35.7 -28.0 -11.9 15.9 396 172 B L H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.881 107.0 54.9 -65.0 -39.9 -31.1 -13.9 16.9 397 173 B Y H X S+ 0 0 26 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.943 109.2 47.6 -59.8 -40.8 -33.1 -12.1 14.3 398 174 B N H X S+ 0 0 9 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.918 107.2 55.8 -67.8 -38.4 -30.6 -13.1 11.7 399 175 B A H <>S+ 0 0 0 -4,-2.1 5,-2.3 1,-0.2 3,-0.3 0.908 106.8 51.0 -58.4 -40.1 -30.6 -16.7 12.9 400 176 B R H ><5S+ 0 0 115 -4,-2.1 3,-2.1 1,-0.2 -1,-0.2 0.900 104.1 57.9 -66.9 -36.7 -34.4 -16.7 12.3 401 177 B R H 3<5S+ 0 0 139 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.857 105.5 50.5 -60.7 -33.5 -33.9 -15.3 8.8 402 178 B F T 3<5S- 0 0 38 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.297 120.5-111.3 -89.9 10.1 -31.7 -18.4 8.0 403 179 B G T < 5 + 0 0 46 -3,-2.1 2,-0.3 1,-0.2 -3,-0.2 0.672 59.3 162.3 75.9 17.4 -34.5 -20.7 9.3 404 180 B L < - 0 0 19 -5,-2.3 2,-0.3 1,-0.1 -1,-0.2 -0.547 42.0-120.4 -76.5 137.2 -32.6 -21.9 12.5 405 181 B D - 0 0 106 -2,-0.3 -1,-0.1 1,-0.1 -5,-0.0 -0.570 21.2-166.9 -68.4 124.9 -34.4 -23.4 15.3 406 182 B L > + 0 0 15 -2,-0.3 3,-2.2 1,-0.2 7,-0.2 0.443 62.8 100.5 -95.4 0.2 -33.9 -21.3 18.5 407 183 B E T 3 S+ 0 0 118 1,-0.3 -1,-0.2 2,-0.1 6,-0.1 0.867 73.4 63.1 -51.2 -39.8 -35.3 -23.9 20.8 408 184 B P T 3 S+ 0 0 66 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.545 97.8 59.7 -68.2 1.1 -31.7 -25.1 21.8 409 185 B Y <> + 0 0 17 -3,-2.2 4,-2.5 1,-0.1 5,-0.2 -0.541 58.3 157.4-125.9 66.1 -30.9 -21.6 23.3 410 186 B P H > S+ 0 0 59 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.873 75.0 50.2 -64.1 -37.3 -33.5 -21.1 26.0 411 187 B T H > S+ 0 0 9 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.946 111.0 49.4 -64.9 -44.0 -31.5 -18.5 28.0 412 188 B L H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.911 112.4 49.2 -60.3 -40.8 -30.8 -16.5 24.8 413 189 B R H X S+ 0 0 68 -4,-2.5 4,-2.2 -7,-0.2 -1,-0.2 0.908 109.4 49.9 -66.6 -40.5 -34.5 -16.6 24.0 414 190 B R H X S+ 0 0 109 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.925 113.5 47.3 -64.2 -41.4 -35.6 -15.5 27.5 415 191 B V H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.929 109.8 52.8 -65.2 -44.7 -33.2 -12.6 27.4 416 192 B D H X S+ 0 0 19 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.903 109.3 49.9 -56.0 -44.0 -34.4 -11.6 23.9 417 193 B E H X S+ 0 0 121 -4,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.893 109.4 50.8 -64.3 -38.4 -38.0 -11.6 25.2 418 194 B A H < S+ 0 0 7 -4,-2.0 3,-0.5 -40,-0.2 -2,-0.2 0.921 113.7 45.6 -65.8 -37.7 -37.0 -9.4 28.1 419 195 B C H >< S+ 0 0 0 -4,-2.6 3,-2.1 1,-0.2 6,-0.3 0.877 104.4 61.5 -71.1 -39.9 -35.3 -7.0 25.8 420 196 B A H 3< S+ 0 0 54 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.759 96.5 61.4 -61.6 -27.0 -38.2 -6.9 23.3 421 197 B A T 3< S+ 0 0 67 -4,-0.9 2,-0.4 -3,-0.5 -1,-0.3 0.519 87.7 93.9 -73.1 -11.8 -40.5 -5.5 25.9 422 198 B L S X> S- 0 0 55 -3,-2.1 4,-2.1 -4,-0.2 3,-0.7 -0.716 76.9-131.7 -94.8 136.3 -38.3 -2.4 26.3 423 199 B A H 3> S+ 0 0 66 -2,-0.4 4,-2.5 1,-0.3 5,-0.2 0.858 104.8 54.6 -52.5 -40.6 -39.0 0.8 24.4 424 200 B P H 3> S+ 0 0 37 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.870 108.9 48.3 -63.8 -37.7 -35.5 1.3 23.2 425 201 B F H <> S+ 0 0 10 -3,-0.7 4,-0.8 -6,-0.3 -2,-0.2 0.913 110.8 51.2 -67.1 -41.3 -35.3 -2.1 21.7 426 202 B Q H >< S+ 0 0 90 -4,-2.1 3,-0.8 1,-0.2 6,-0.2 0.935 110.3 49.9 -59.3 -39.1 -38.6 -1.5 20.0 427 203 B A H 3< S+ 0 0 36 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.777 111.1 48.3 -68.9 -33.8 -37.3 1.7 18.5 428 204 B A H 3< S+ 0 0 0 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.544 84.1 116.9 -82.0 -14.7 -34.1 0.2 17.2 429 205 B H S X< S- 0 0 57 -4,-0.8 3,-1.9 -3,-0.8 4,-0.4 -0.282 76.5-115.3 -61.2 142.5 -35.8 -2.8 15.5 430 206 B P G > S+ 0 0 0 0, 0.0 3,-1.6 0, 0.0 6,-0.2 0.825 112.4 60.4 -42.0 -41.0 -35.4 -3.0 11.7 431 207 B D G 3 S+ 0 0 107 1,-0.3 5,-0.1 5,-0.1 -4,-0.1 0.703 102.1 53.1 -72.9 -15.6 -39.2 -2.6 11.1 432 208 B R G < S+ 0 0 160 -3,-1.9 -1,-0.3 -6,-0.2 -3,-0.1 0.435 86.1 107.4 -92.8 -1.5 -39.2 0.9 12.7 433 209 B Q S X S- 0 0 14 -3,-1.6 3,-2.0 -4,-0.4 -199,-0.0 -0.497 79.2-119.1 -85.4 156.5 -36.4 2.3 10.6 434 210 B P T 3 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.768 112.5 50.3 -64.6 -28.3 -37.0 4.9 7.9 435 211 B D T 3 S+ 0 0 42 -5,-0.1 -201,-0.1 2,-0.0 -4,-0.1 0.364 81.6 117.5 -89.3 2.3 -35.7 2.6 5.2 436 212 B A S < S- 0 0 20 -3,-2.0 -5,-0.1 -6,-0.2 0, 0.0 -0.449 77.7 -95.2 -64.9 143.9 -37.7 -0.4 6.1 437 213 B P 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.275 360.0 360.0 -54.2 146.8 -40.2 -1.6 3.4 438 214 B P 0 0 181 0, 0.0 -3,-0.0 0, 0.0 -7,-0.0 0.101 360.0 360.0 -32.1 360.0 -43.8 -0.3 3.8