==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL TRANSPORT 23-JUN-09 3HYR . COMPND 2 MOLECULE: FERROUS IRON TRANSPORT PROTEIN B; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.J.MAHER,M.JORMAKKA . 759 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32974.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 568 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 70 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 3 0.4 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 . 59 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 85 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 287 37.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.6 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 0 0 3 0 3 3 0 9 3 3 3 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 2 1 6 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 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 3 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 K 0 0 186 0, 0.0 49,-2.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 148.5 -1.2 40.0 -24.4 2 3 A K E +a 50 0A 77 47,-0.2 2,-0.4 49,-0.1 49,-0.2 -0.791 360.0 177.1 -99.7 130.6 -0.2 36.8 -22.7 3 4 A L E -a 51 0A 7 47,-2.0 49,-2.2 -2,-0.4 2,-0.5 -0.956 20.2-144.6-121.3 148.2 3.2 36.2 -21.2 4 5 A T E -a 52 0A 34 -2,-0.4 77,-2.7 47,-0.2 78,-1.2 -0.978 20.6-171.2-113.2 130.1 4.5 33.2 -19.4 5 6 A I E -ab 53 82A 0 47,-2.6 49,-2.9 -2,-0.5 2,-0.4 -0.971 13.7-146.3-122.7 130.8 6.9 33.9 -16.6 6 7 A G E -ab 54 83A 0 76,-1.9 78,-3.0 -2,-0.4 2,-0.5 -0.811 12.4-144.3 -96.6 140.2 9.0 31.5 -14.6 7 8 A L E +ab 55 84A 0 47,-2.6 49,-2.4 -2,-0.4 2,-0.3 -0.926 28.6 171.9-108.8 124.4 9.7 32.3 -10.9 8 9 A I E + b 0 85A 1 76,-2.7 78,-1.9 -2,-0.5 2,-0.3 -0.994 10.2 118.9-144.5 135.4 13.1 31.2 -9.8 9 10 A G E - b 0 86A 1 -2,-0.3 50,-1.9 76,-0.2 78,-0.1 -0.969 59.0 -62.0-173.2 177.0 15.4 31.6 -6.7 10 11 A N > - 0 0 2 76,-0.5 3,-0.8 -2,-0.3 5,-0.3 -0.268 63.6 -95.2 -62.7 156.7 17.3 29.8 -3.9 11 12 A P T 3 S+ 0 0 45 0, 0.0 -1,-0.1 0, 0.0 48,-0.0 -0.285 111.4 30.6 -65.4 169.6 15.2 27.9 -1.4 12 13 A N T 3 S+ 0 0 148 1,-0.1 -2,-0.1 -3,-0.1 0, 0.0 0.756 88.6 114.8 56.6 27.4 14.3 29.9 1.7 13 14 A S S < S- 0 0 6 -3,-0.8 -1,-0.1 -4,-0.0 101,-0.1 0.239 92.5 -97.9-116.9 16.2 14.3 33.1 -0.2 14 15 A G S > S+ 0 0 21 100,-0.1 4,-2.1 74,-0.1 5,-0.2 0.672 81.4 132.8 81.6 16.9 10.7 34.3 -0.1 15 16 A K H > S+ 0 0 15 -5,-0.3 4,-2.4 2,-0.2 5,-0.1 0.926 72.2 46.1 -66.2 -46.5 9.9 32.9 -3.5 16 17 A T H > S+ 0 0 63 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.913 111.1 54.5 -63.7 -42.3 6.6 31.2 -2.4 17 18 A T H > S+ 0 0 87 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.913 109.4 45.9 -56.2 -46.2 5.6 34.4 -0.6 18 19 A L H X S+ 0 0 1 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.956 111.0 55.8 -61.2 -45.6 6.1 36.5 -3.7 19 20 A F H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 5,-0.3 0.938 110.2 42.8 -49.6 -56.7 4.1 33.8 -5.6 20 21 A N H X S+ 0 0 72 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.885 113.5 53.1 -60.5 -41.0 1.1 34.0 -3.3 21 22 A Q H < S+ 0 0 108 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.906 114.2 41.9 -59.4 -44.4 1.3 37.8 -3.3 22 23 A L H < S+ 0 0 3 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.891 126.7 29.6 -70.4 -39.7 1.2 37.9 -7.1 23 24 A T H >< S- 0 0 0 -4,-2.5 3,-2.5 -5,-0.2 20,-0.3 0.550 76.6-177.0-103.4 -13.0 -1.4 35.2 -7.7 24 25 A G T 3< S- 0 0 39 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.1 -0.197 76.4 -19.6 47.6-128.4 -3.8 35.3 -4.7 25 26 A S T 3 S+ 0 0 118 1,-0.1 2,-1.6 17,-0.0 -1,-0.3 0.424 115.2 99.1 -87.8 -0.5 -6.4 32.6 -5.1 26 27 A R < + 0 0 116 -3,-2.5 17,-2.3 17,-0.2 2,-0.3 -0.550 60.1 111.5 -87.1 69.6 -5.8 32.3 -8.8 27 28 A Q E -C 42 0A 60 -2,-1.6 2,-0.4 15,-0.2 15,-0.3 -1.000 50.0-153.1-147.4 144.3 -3.5 29.3 -8.7 28 29 A R E -C 41 0A 198 13,-2.3 13,-1.9 -2,-0.3 2,-0.6 -0.936 13.6-140.7-115.4 135.7 -3.6 25.6 -9.8 29 30 A V E +C 40 0A 93 -2,-0.4 11,-0.2 11,-0.2 2,-0.1 -0.870 38.1 151.8 -95.8 123.9 -1.6 22.7 -8.2 30 31 A G E -C 39 0A 39 9,-2.7 9,-0.9 -2,-0.6 2,-0.3 -0.332 38.5-103.1-125.2-150.4 -0.3 20.3 -10.7 31 32 A N E -C 38 0A 89 7,-0.3 7,-0.2 -2,-0.1 2,-0.2 -0.992 29.0-106.8-150.9 137.0 2.6 18.0 -11.1 32 33 A W > - 0 0 25 5,-2.9 3,-2.5 -2,-0.3 5,-0.2 -0.472 59.1 -86.3 -67.4 131.0 5.9 18.1 -13.1 33 34 A A T 3 S- 0 0 97 1,-0.3 -1,-0.2 -2,-0.2 3,-0.1 -0.046 106.7 -3.5 -48.9 122.4 5.7 15.7 -16.0 34 35 A G T 3 S+ 0 0 85 1,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.413 120.7 77.9 80.1 -3.0 6.6 12.2 -15.1 35 36 A V S < S- 0 0 40 -3,-2.5 -1,-0.2 2,-0.2 0, 0.0 -0.757 81.0-121.5-125.0 176.3 7.6 13.0 -11.4 36 37 A T + 0 0 138 -2,-0.2 2,-0.2 -5,-0.1 -3,-0.1 0.307 68.5 125.0-102.6 7.2 5.6 13.6 -8.2 37 38 A V - 0 0 27 -5,-0.2 -5,-2.9 1,-0.1 2,-0.2 -0.499 67.5-114.2 -65.9 130.5 7.1 17.1 -7.6 38 39 A E E -C 31 0A 102 -7,-0.2 2,-0.5 -2,-0.2 -7,-0.3 -0.476 25.5-158.2 -67.3 132.0 4.3 19.6 -7.3 39 40 A R E -C 30 0A 53 -9,-0.9 -9,-2.7 -2,-0.2 2,-0.4 -0.970 7.0-159.9-115.7 111.1 4.1 22.3 -10.0 40 41 A K E +C 29 0A 45 -2,-0.5 15,-1.9 15,-0.4 2,-0.3 -0.779 10.7 179.8 -89.9 135.0 2.3 25.5 -9.1 41 42 A E E +CD 28 54A 46 -13,-1.9 -13,-2.3 -2,-0.4 2,-0.3 -0.946 5.6 175.0-126.9 154.8 0.9 27.9 -11.7 42 43 A G E -CD 27 53A 2 11,-1.7 11,-2.8 -2,-0.3 2,-0.4 -0.955 20.8-127.7-157.7 166.1 -1.0 31.1 -11.1 43 44 A Q E + D 0 52A 62 -17,-2.3 2,-0.3 -20,-0.3 -17,-0.2 -0.970 28.4 153.0-126.9 132.7 -2.5 34.1 -12.9 44 45 A F E - D 0 51A 0 7,-2.1 7,-3.1 -2,-0.4 2,-0.3 -0.948 28.2-133.7-141.0 166.2 -2.1 37.8 -12.4 45 46 A S E - D 0 50A 54 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.854 11.7-165.7-117.1 159.2 -2.5 40.7 -14.8 46 47 A T - 0 0 21 3,-3.2 109,-0.1 -2,-0.3 105,-0.0 -0.489 48.5 -82.4-116.6-167.4 -0.4 43.8 -15.5 47 48 A T S S+ 0 0 61 107,-0.2 636,-0.2 -2,-0.2 108,-0.1 0.912 128.4 15.0 -68.1 -39.5 -1.3 47.0 -17.4 48 49 A D S S+ 0 0 53 634,-0.1 2,-0.3 635,-0.0 -1,-0.2 0.473 122.8 58.6-110.6 -6.5 -0.6 45.4 -20.8 49 50 A H - 0 0 27 -47,-0.0 -3,-3.2 2,-0.0 2,-0.5 -0.902 56.8-144.0-137.4 153.6 -0.5 41.7 -20.0 50 51 A Q E -aD 2 45A 83 -49,-2.7 -47,-2.0 -2,-0.3 2,-0.5 -0.983 38.7-152.2-109.7 123.3 -2.2 38.6 -18.6 51 52 A V E -aD 3 44A 0 -7,-3.1 -7,-2.1 -2,-0.5 2,-0.6 -0.892 20.0-161.4-114.0 126.5 0.5 36.6 -16.9 52 53 A T E -aD 4 43A 33 -49,-2.2 -47,-2.6 -2,-0.5 2,-0.5 -0.938 21.5-159.6 -96.8 116.2 0.8 32.9 -16.3 53 54 A L E -aD 5 42A 0 -11,-2.8 -11,-1.7 -2,-0.6 2,-0.6 -0.869 5.8-162.5-105.3 123.3 3.3 32.5 -13.5 54 55 A V E -aD 6 41A 0 -49,-2.9 -47,-2.6 -2,-0.5 2,-0.4 -0.906 12.0-144.2-111.1 110.0 5.1 29.1 -13.1 55 56 A D E -a 7 0A 18 -15,-1.9 -15,-0.4 -2,-0.6 -47,-0.1 -0.574 16.7-155.7 -69.6 118.0 6.8 28.5 -9.7 56 57 A L - 0 0 0 -49,-2.4 -47,-0.2 -2,-0.4 3,-0.1 -0.755 30.4 -91.9 -92.4 149.2 10.0 26.6 -10.2 57 58 A P - 0 0 17 0, 0.0 -48,-0.1 0, 0.0 14,-0.1 -0.334 52.7 -94.6 -58.4 135.3 11.4 24.4 -7.3 58 59 A G + 0 0 22 -50,-0.1 2,-0.3 -48,-0.1 -48,-0.2 -0.139 56.2 167.5 -45.0 142.8 13.9 26.3 -5.2 59 60 A T - 0 0 7 -50,-1.9 3,-0.1 -3,-0.1 39,-0.1 -0.981 39.4-151.2-161.0 150.7 17.5 25.7 -6.3 60 61 A Y S S+ 0 0 108 -2,-0.3 2,-0.3 1,-0.3 -50,-0.1 0.640 86.5 12.7 -95.5 -15.9 21.0 27.2 -5.7 61 62 A S - 0 0 22 1,-0.1 -1,-0.3 37,-0.1 11,-0.1 -0.992 54.7-141.0-160.7 145.1 22.4 26.2 -9.1 62 63 A L 0 0 5 -2,-0.3 10,-0.1 -3,-0.1 -1,-0.1 0.804 360.0 360.0 -81.1 -29.6 21.3 25.0 -12.5 63 64 A T 0 0 43 -3,-0.1 -1,-0.1 145,-0.0 6,-0.1 -0.506 360.0 360.0 -66.5 360.0 24.3 22.8 -12.7 64 ! 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 65 71 A S > 0 0 107 0, 0.0 4,-1.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.9 18.4 16.2 -6.6 66 72 A L H > + 0 0 76 1,-0.2 4,-1.6 2,-0.2 3,-0.4 0.895 360.0 57.5 -54.1 -51.7 15.1 16.2 -8.6 67 73 A D H >> S+ 0 0 69 1,-0.2 4,-1.7 2,-0.2 3,-1.2 0.937 104.3 49.4 -45.5 -64.9 14.1 19.7 -7.8 68 74 A E H 3> S+ 0 0 48 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.842 110.8 52.8 -42.2 -41.6 17.3 21.4 -9.1 69 75 A Q H 3X S+ 0 0 101 -4,-1.3 4,-2.1 -3,-0.4 -1,-0.3 0.804 104.7 54.0 -71.6 -32.8 16.9 19.4 -12.4 70 76 A I H - e 0 114A 6 -2,-0.4 3,-2.1 3,-0.2 7,-0.3 -0.639 14.8-160.3 -77.9 109.9 17.7 37.5 -1.0 89 95 A A G > S+ 0 0 1 25,-2.2 3,-0.7 -2,-0.8 -1,-0.2 0.761 90.8 59.9 -63.8 -22.8 19.3 40.9 -0.5 90 96 A S G 3 S+ 0 0 10 1,-0.2 -1,-0.3 24,-0.2 25,-0.1 0.339 116.0 32.3 -87.5 0.5 20.6 39.7 2.9 91 97 A N G <> S+ 0 0 54 -3,-2.1 4,-2.2 2,-0.0 -1,-0.2 -0.259 77.7 151.3-143.2 51.0 22.6 36.9 1.1 92 98 A L H <> + 0 0 12 -3,-0.7 4,-2.0 1,-0.2 5,-0.2 0.897 67.0 48.2 -57.7 -54.1 23.4 38.6 -2.2 93 99 A E H > S+ 0 0 64 1,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.874 114.3 44.8 -58.2 -51.8 26.6 36.8 -3.1 94 100 A R H >4 S+ 0 0 136 1,-0.2 3,-0.6 2,-0.2 4,-0.4 0.858 115.6 49.3 -56.5 -42.8 25.4 33.3 -2.5 95 101 A N H >X S+ 0 0 2 -4,-2.2 4,-1.1 -7,-0.3 3,-0.7 0.745 100.3 64.1 -70.4 -30.0 22.1 34.1 -4.3 96 102 A L H 3X S+ 0 0 1 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.586 82.2 78.0 -76.4 -14.8 23.8 35.6 -7.5 97 103 A Y H S+ 0 0 0 -3,-0.7 4,-1.7 -4,-0.4 3,-0.4 0.919 113.1 55.3 -66.6 -42.3 22.0 31.2 -9.7 99 105 A T H X S+ 0 0 0 -4,-1.1 4,-2.5 1,-0.2 5,-0.2 0.915 103.4 56.0 -57.8 -44.9 21.4 34.7 -11.3 100 106 A L H X S+ 0 0 1 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.867 104.5 51.6 -56.4 -39.2 24.6 34.5 -13.2 101 107 A Q H X S+ 0 0 0 -4,-1.0 4,-2.8 -3,-0.4 -1,-0.2 0.915 109.0 50.0 -67.6 -42.3 23.7 31.3 -14.9 102 108 A L H X>S+ 0 0 0 -4,-1.7 5,-1.5 2,-0.2 4,-1.0 0.944 114.0 45.6 -58.0 -47.9 20.3 32.7 -16.0 103 109 A L H ><5S+ 0 0 7 -4,-2.5 3,-0.6 1,-0.2 -2,-0.2 0.900 111.2 51.8 -65.4 -41.9 22.1 35.7 -17.5 104 110 A E H 3<5S+ 0 0 22 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.902 107.2 53.8 -59.1 -41.7 24.8 33.6 -19.1 105 111 A L H 3<5S- 0 0 4 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.715 110.6-131.2 -63.2 -22.7 21.9 31.5 -20.6 106 112 A G T <<5 + 0 0 31 -4,-1.0 57,-0.3 -3,-0.6 -3,-0.2 0.637 49.6 155.1 85.4 16.9 20.7 34.9 -22.0 107 113 A I < - 0 0 18 -5,-1.5 -1,-0.2 1,-0.1 -24,-0.1 -0.596 56.9 -95.6 -79.8 132.2 17.1 34.4 -20.9 108 114 A P - 0 0 33 0, 0.0 -25,-1.9 0, 0.0 2,-0.3 -0.191 58.0-173.7 -46.6 132.7 15.1 37.7 -20.3 109 115 A C E -e 83 0A 2 52,-0.3 2,-0.4 -27,-0.2 52,-0.2 -0.966 30.2-171.8-138.2 145.1 15.4 38.4 -16.6 110 116 A I E -e 84 0A 1 -27,-1.7 -25,-2.9 -2,-0.3 2,-0.6 -0.977 21.9-143.2-133.3 127.5 14.1 40.7 -13.9 111 117 A V E -ef 85 139A 0 27,-2.3 29,-3.5 -2,-0.4 2,-0.8 -0.786 7.4-160.4 -93.4 119.3 15.7 40.5 -10.5 112 118 A A E -ef 86 140A 0 -27,-2.6 -25,-2.5 -2,-0.6 2,-0.8 -0.902 15.2-146.1-100.4 106.5 13.2 41.0 -7.7 113 119 A L E -ef 87 141A 0 27,-2.2 29,-2.9 -2,-0.8 3,-0.3 -0.655 24.8-171.2 -80.9 112.5 15.4 41.9 -4.8 114 120 A N E +e 88 0A 25 -27,-3.4 -25,-2.2 -2,-0.8 -24,-0.2 -0.390 50.3 36.7-101.4 173.8 13.7 40.5 -1.7 115 121 A X > + 0 0 45 27,-0.2 4,-2.2 -27,-0.2 -1,-0.2 0.856 56.0 156.9 54.3 43.8 14.2 40.7 2.1 116 122 A L H > S+ 0 0 43 26,-0.4 4,-3.8 -3,-0.3 5,-0.2 0.890 73.0 54.8 -59.0 -38.0 15.1 44.4 2.2 117 123 A D H > S+ 0 0 104 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.788 108.4 46.6 -71.0 -30.8 14.0 44.6 5.8 118 124 A I H > S+ 0 0 81 2,-0.2 4,-1.3 3,-0.1 -1,-0.2 0.904 115.6 47.1 -73.3 -43.5 16.3 41.7 6.9 119 125 A A H ><>S+ 0 0 3 -4,-2.2 5,-1.9 2,-0.2 3,-1.6 0.987 110.4 50.8 -59.7 -57.9 19.1 43.3 4.9 120 126 A E H ><5S+ 0 0 64 -4,-3.8 3,-1.7 1,-0.3 -1,-0.2 0.872 106.4 58.3 -45.6 -45.0 18.5 46.8 6.4 121 127 A K H 3<5S+ 0 0 178 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.796 108.6 42.8 -58.3 -35.0 18.5 45.2 9.9 122 128 A Q T <<5S- 0 0 111 -3,-1.6 -1,-0.3 -4,-1.3 -2,-0.2 0.125 120.2-104.4-102.0 24.3 22.0 43.9 9.5 123 129 A N T < 5S+ 0 0 155 -3,-1.7 2,-0.6 1,-0.2 -3,-0.2 0.766 73.0 142.6 61.5 30.9 23.4 47.1 7.9 124 130 A I < - 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0 0 120 -52,-0.2 -52,-0.3 3,-0.0 3,-0.1 -0.918 49.0 -55.6-157.3 173.3 13.2 43.3 -22.9 162 168 A A - 0 0 64 -2,-0.3 -55,-0.1 -54,-0.1 3,-0.1 -0.318 68.6 -98.9 -56.5 141.1 16.2 41.2 -23.8 163 169 A N - 0 0 28 -57,-0.3 -26,-0.2 1,-0.1 2,-0.2 -0.229 43.0 -94.6 -57.9 152.6 19.0 41.6 -21.2 164 170 A E - 0 0 112 -28,-3.2 2,-1.6 1,-0.1 -1,-0.1 -0.535 36.8-121.8 -68.7 138.7 21.9 44.0 -22.0 165 171 A N + 0 0 136 -2,-0.2 2,-0.1 -3,-0.1 -1,-0.1 -0.356 53.6 157.1 -86.6 55.7 24.6 42.0 -23.6 166 172 A V - 0 0 55 -2,-1.6 2,-0.2 -31,-0.1 -32,-0.0 -0.445 51.3-101.3 -75.8 148.8 27.3 42.9 -21.0 167 173 A E + 0 0 97 1,-0.2 3,-0.1 -2,-0.1 -1,-0.1 -0.579 45.4 175.6 -68.2 135.1 30.3 40.7 -20.4 168 174 A L + 0 0 21 1,-0.5 2,-0.3 -2,-0.2 -1,-0.2 0.709 56.9 19.2-106.7 -86.7 29.7 38.6 -17.3 169 175 A V - 0 0 12 -69,-0.1 2,-0.9 1,-0.0 -1,-0.5 -0.710 69.9-140.6 -89.5 139.5 32.3 36.0 -16.4 170 176 A H - 0 0 19 -2,-0.3 2,-0.2 71,-0.3 74,-0.1 -0.811 25.4-170.5-101.9 89.0 35.7 36.5 -17.9 171 177 A Y - 0 0 10 -2,-0.9 2,-0.1 1,-0.1 67,-0.1 -0.501 33.7 -96.6 -77.3 149.3 36.9 33.0 -18.8 172 178 A A >> - 0 0 14 -2,-0.2 3,-1.6 1,-0.1 4,-1.4 -0.473 42.5-112.8 -58.2 137.2 40.4 32.2 -20.0 173 179 A Q H 3> S+ 0 0 100 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.820 111.2 58.4 -43.9 -48.1 40.3 32.1 -23.8 174 180 A P H 3> S+ 0 0 36 0, 0.0 4,-2.4 0, 0.0 -1,-0.3 0.752 104.4 52.7 -65.6 -23.0 41.1 28.4 -24.2 175 181 A L H <> S+ 0 0 0 -3,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.895 110.6 47.0 -69.7 -47.5 38.0 27.5 -22.2 176 182 A L H X S+ 0 0 61 -4,-1.4 4,-2.4 2,-0.2 5,-0.2 0.921 113.1 51.3 -56.1 -42.8 35.9 29.7 -24.5 177 183 A N H X S+ 0 0 79 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.938 111.7 44.1 -63.1 -49.8 37.7 28.0 -27.4 178 184 A E H X S+ 0 0 20 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.870 112.9 52.5 -61.1 -40.3 36.9 24.5 -26.2 179 185 A A H X S+ 0 0 2 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.870 106.8 53.6 -62.8 -39.9 33.3 25.4 -25.4 180 186 A D H X S+ 0 0 60 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.910 108.6 50.2 -59.3 -43.9 32.9 26.9 -28.9 181 187 A S H < S+ 0 0 34 -4,-1.8 4,-0.4 1,-0.2 -2,-0.2 0.909 112.1 45.2 -64.8 -44.2 34.0 23.6 -30.3 182 188 A L H >< S+ 0 0 2 -4,-2.2 3,-1.1 1,-0.2 -1,-0.2 0.873 110.0 58.9 -61.1 -38.1 31.6 21.5 -28.2 183 189 A A H >< S+ 0 0 1 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.851 96.2 58.7 -64.8 -38.2 28.8 24.0 -29.0 184 190 A K T 3< S+ 0 0 156 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.611 102.9 53.3 -74.1 -6.5 29.0 23.5 -32.8 185 191 A V T < S+ 0 0 45 -3,-1.1 31,-0.6 -4,-0.4 30,-0.4 -0.072 92.2 100.6-112.5 34.3 28.3 19.8 -32.6 186 192 A X S < S- 0 0 15 -3,-1.2 28,-0.2 29,-0.2 27,-0.1 -0.820 90.3 -74.1-116.3 154.4 25.1 20.2 -30.5 187 193 A P > - 0 0 47 0, 0.0 3,-1.4 0, 0.0 -2,-0.1 -0.262 40.9-143.0 -50.2 121.2 21.4 20.1 -31.4 188 194 A S T 3 S+ 0 0 103 1,-0.3 4,-0.1 -4,-0.1 7,-0.1 0.565 88.1 85.4 -69.8 -12.0 20.7 23.4 -33.2 189 195 A D T 3 S+ 0 0 138 2,-0.1 -1,-0.3 0, 0.0 0, 0.0 0.608 82.7 79.0 -59.5 -11.6 17.2 23.8 -31.8 190 196 A I S < S- 0 0 15 -3,-1.4 -4,-0.1 -4,-0.1 5,-0.1 -0.865 96.2-106.3-103.8 132.4 19.2 25.4 -28.9 191 197 A P > - 0 0 71 0, 0.0 4,-2.8 0, 0.0 3,-0.3 -0.206 25.7-117.6 -53.8 145.3 20.5 29.0 -29.2 192 198 A L H > S+ 0 0 79 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.848 115.9 55.5 -51.8 -40.2 24.2 29.5 -29.8 193 199 A K H > S+ 0 0 90 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.910 111.3 43.1 -62.3 -43.1 24.5 31.3 -26.5 194 200 A Q H > S+ 0 0 17 -3,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.850 110.8 55.6 -72.9 -35.2 23.0 28.3 -24.6 195 201 A R H X S+ 0 0 40 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.942 108.7 47.8 -61.2 -47.2 25.1 25.9 -26.6 196 202 A R H X S+ 0 0 115 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.904 112.1 50.0 -56.0 -43.2 28.2 27.7 -25.5 197 203 A W H X S+ 0 0 7 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.903 109.2 51.5 -63.9 -42.3 26.9 27.7 -21.9 198 204 A L H X S+ 0 0 1 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.883 108.6 51.6 -61.9 -40.7 26.2 23.9 -22.1 199 205 A G H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.892 107.3 53.0 -60.1 -43.3 29.8 23.3 -23.4 200 206 A L H X S+ 0 0 10 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.910 108.4 49.9 -63.2 -41.4 31.2 25.3 -20.5 201 207 A Q H X>S+ 0 0 0 -4,-2.1 5,-2.5 1,-0.2 4,-0.8 0.885 108.4 52.3 -63.8 -41.5 29.3 23.2 -17.9 202 208 A X H ><5S+ 0 0 0 -4,-1.9 3,-1.0 1,-0.2 -1,-0.2 0.922 107.0 53.2 -61.4 -41.8 30.5 19.9 -19.5 203 209 A L H 3<5S+ 0 0 3 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.797 106.5 52.7 -64.0 -27.5 34.1 21.1 -19.3 204 210 A E H 3<5S- 0 0 50 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.622 127.6-101.7 -85.4 -13.9 33.6 21.8 -15.6 205 211 A G T <<5 + 0 0 42 -3,-1.0 -3,-0.2 -4,-0.8 2,-0.2 0.506 64.4 156.0 110.9 9.1 32.3 18.3 -15.2 206 212 A D < - 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0 0 47 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.247 41.1-142.9 -51.4 122.7 55.8 68.9 -31.5 443 194 B S T 3 S+ 0 0 100 1,-0.3 4,-0.1 -4,-0.1 7,-0.1 0.570 87.5 86.2 -74.8 -9.0 53.3 66.6 -33.2 444 195 B D T 3 S+ 0 0 134 2,-0.1 -1,-0.3 0, 0.0 0, 0.0 0.622 82.3 78.5 -62.0 -10.1 54.7 63.4 -31.7 445 196 B I S < S- 0 0 15 -3,-1.4 -4,-0.1 -4,-0.1 5,-0.1 -0.878 96.9-105.6-105.2 132.1 52.3 64.4 -28.9 446 197 B P > - 0 0 71 0, 0.0 4,-2.8 0, 0.0 3,-0.3 -0.202 25.8-117.6 -54.0 142.8 48.6 63.7 -29.2 447 198 B L H > S+ 0 0 78 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.854 115.4 56.0 -46.4 -41.0 46.3 66.7 -29.9 448 199 B K H > S+ 0 0 91 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.930 111.3 41.8 -65.4 -45.2 44.5 66.1 -26.6 449 200 B Q H > S+ 0 0 17 -3,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.853 111.4 55.9 -69.3 -37.7 47.8 66.3 -24.6 450 201 B R H X S+ 0 0 38 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.937 108.8 48.7 -58.1 -45.1 49.0 69.3 -26.7 451 202 B R H X S+ 0 0 115 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.903 111.7 48.9 -59.5 -43.1 45.8 71.1 -25.7 452 203 B W H X S+ 0 0 9 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.924 108.7 53.7 -61.9 -47.1 46.4 70.1 -22.0 453 204 B L H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.891 107.6 51.2 -55.6 -41.5 50.0 71.4 -22.3 454 205 B G H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.878 107.0 53.2 -64.9 -39.1 48.8 74.7 -23.5 455 206 B L H X S+ 0 0 9 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.902 108.1 50.5 -64.2 -41.1 46.4 75.1 -20.7 456 207 B Q H X>S+ 0 0 0 -4,-2.1 5,-2.3 1,-0.2 4,-0.7 0.899 109.0 51.4 -64.8 -42.2 49.1 74.5 -18.1 457 208 B X H ><5S+ 0 0 0 -4,-2.0 3,-0.9 1,-0.2 -1,-0.2 0.902 107.4 52.6 -61.3 -42.3 51.3 77.1 -19.7 458 209 B L H 3<5S+ 0 0 3 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.788 107.4 52.9 -64.1 -26.8 48.5 79.7 -19.6 459 210 B E H 3<5S- 0 0 49 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.588 127.6-101.6 -84.1 -14.3 48.1 79.0 -15.9 460 211 B G T <<5 + 0 0 42 -3,-0.9 -3,-0.2 -4,-0.7 2,-0.1 0.497 64.6 155.1 111.3 5.9 51.8 79.6 -15.5 461 212 B D < - 0 0 25 -5,-2.3 4,-0.3 1,-0.1 -1,-0.3 -0.422 23.5-167.8 -65.8 135.4 53.4 76.2 -15.2 462 213 B I S >> S+ 0 0 116 -2,-0.1 3,-1.0 2,-0.1 4,-0.6 0.875 79.0 61.4 -93.5 -42.8 57.1 76.1 -16.2 463 214 B Y G >4 S+ 0 0 50 1,-0.2 3,-0.8 2,-0.2 4,-0.3 0.806 98.9 60.5 -53.3 -34.7 57.8 72.3 -16.5 464 215 B S G >> S+ 0 0 3 1,-0.2 3,-1.8 2,-0.2 4,-0.9 0.834 90.8 67.7 -61.2 -38.7 55.2 72.0 -19.3 465 216 B R G <4 S+ 0 0 75 -3,-1.0 3,-0.4 -4,-0.3 7,-0.3 0.795 88.0 69.3 -49.9 -35.2 57.1 74.5 -21.5 466 217 B A G << S+ 0 0 86 -3,-0.8 3,-0.3 -4,-0.6 -1,-0.3 0.736 105.0 37.9 -58.5 -28.8 59.8 71.9 -21.8 467 218 B Y T <4 S+ 0 0 56 -3,-1.8 -1,-0.2 -4,-0.3 -2,-0.2 0.679 101.4 76.2 -92.1 -20.3 57.6 69.5 -24.0 468 219 B A S >< S- 0 0 0 -4,-0.9 3,-2.1 -3,-0.4 -1,-0.1 0.272 72.6-165.9 -87.2 7.3 56.0 72.3 -25.9 469 220 B G G > S+ 0 0 42 1,-0.3 3,-0.8 -3,-0.3 -1,-0.2 -0.175 75.1 7.8 47.8-118.0 58.8 73.1 -28.4 470 221 B E G > S+ 0 0 115 -30,-0.4 3,-2.2 1,-0.2 4,-0.4 0.769 109.0 90.0 -59.3 -31.3 58.0 76.5 -30.1 471 222 B A G X> + 0 0 0 -3,-2.1 3,-2.0 -31,-0.5 4,-0.8 0.689 69.7 70.4 -48.3 -33.6 55.0 77.3 -28.0 472 223 B S G <4 S+ 0 0 52 -3,-0.8 4,-0.5 1,-0.3 -1,-0.3 0.698 93.5 56.3 -67.5 -17.9 56.7 79.2 -25.2 473 224 B Q G <4 S+ 0 0 143 -3,-2.2 4,-0.3 1,-0.2 -1,-0.3 0.601 107.5 50.7 -83.6 -9.7 57.5 82.2 -27.4 474 225 B H T <> S+ 0 0 73 -3,-2.0 4,-2.7 -4,-0.4 -2,-0.2 0.585 90.7 82.3 -97.8 -12.9 53.8 82.5 -28.2 475 226 B L H X S+ 0 0 1 -4,-0.8 4,-3.5 2,-0.2 5,-0.2 0.895 87.5 49.0 -63.6 -48.0 52.7 82.4 -24.5 476 227 B D H > S+ 0 0 117 -4,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.918 114.9 47.3 -61.5 -42.4 53.2 86.1 -23.5 477 228 B A H > S+ 0 0 47 -4,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.922 113.9 48.4 -57.8 -49.3 51.3 87.1 -26.7 478 229 B A H X S+ 0 0 1 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.939 113.9 45.5 -54.6 -53.3 48.6 84.5 -25.7 479 230 B L H X S+ 0 0 26 -4,-3.5 4,-1.8 2,-0.2 -2,-0.2 0.860 110.4 53.5 -61.7 -40.1 48.4 85.8 -22.1 480 231 B A H < S+ 0 0 55 -4,-2.5 4,-0.3 -5,-0.2 -1,-0.2 0.874 111.2 47.7 -62.8 -38.4 48.3 89.4 -23.2 481 232 B R H >X S+ 0 0 119 -4,-1.9 3,-1.5 1,-0.2 4,-0.6 0.944 109.6 52.7 -63.8 -50.8 45.4 88.6 -25.5 482 233 B L H >X S+ 0 0 1 -4,-2.5 3,-1.6 1,-0.3 4,-1.4 0.825 96.5 65.4 -56.0 -40.0 43.5 86.7 -22.7 483 234 B R H 3< S+ 0 0 145 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.612 97.7 56.7 -67.6 -12.7 43.7 89.5 -20.2 484 235 B N H <4 S+ 0 0 137 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.748 110.8 44.1 -76.9 -28.9 41.5 91.6 -22.5 485 236 B E H << S+ 0 0 125 -3,-1.6 2,-0.3 -4,-0.6 -2,-0.2 0.622 126.5 9.4 -97.0 -17.9 38.8 88.8 -22.4 486 237 B X < - 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0 0 25 -5,-2.5 4,-0.3 1,-0.1 -1,-0.3 -0.431 23.1-167.6 -67.6 135.3 -8.8 69.0 -15.4 717 213 C I S >> S+ 0 0 115 -2,-0.1 3,-1.0 2,-0.1 4,-0.6 0.877 79.2 61.3 -92.9 -42.6 -10.6 72.1 -16.5 718 214 C Y G >4 S+ 0 0 53 1,-0.2 3,-0.7 2,-0.2 4,-0.3 0.791 98.9 60.8 -53.8 -33.2 -7.7 74.7 -16.8 719 215 C S G >> S+ 0 0 5 1,-0.2 3,-1.7 2,-0.2 4,-1.0 0.834 90.4 67.8 -63.0 -38.3 -6.1 72.5 -19.6 720 216 C R G <4 S+ 0 0 73 -3,-1.0 3,-0.3 -4,-0.3 7,-0.3 0.809 88.3 68.8 -50.2 -35.2 -9.2 72.9 -21.8 721 217 C A G << S+ 0 0 87 -3,-0.7 3,-0.3 -4,-0.6 -1,-0.3 0.766 104.9 38.4 -59.0 -30.8 -8.3 76.6 -22.2 722 218 C Y T <4 S+ 0 0 56 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.2 0.713 101.7 76.4 -89.0 -21.0 -5.2 75.8 -24.3 723 219 C A S >< S- 0 0 0 -4,-1.0 3,-2.0 -3,-0.3 -1,-0.2 0.284 72.5-166.2 -84.9 6.8 -6.7 73.0 -26.2 724 220 C G G > S+ 0 0 44 -3,-0.3 3,-0.8 1,-0.3 -1,-0.2 -0.201 75.0 7.8 48.6-116.6 -8.9 75.0 -28.7 725 221 C E G > S+ 0 0 114 -30,-0.4 3,-2.1 1,-0.2 4,-0.3 0.787 109.0 89.6 -62.2 -32.7 -11.4 72.6 -30.4 726 222 C A G X> + 0 0 0 -3,-2.0 3,-1.9 -31,-0.6 4,-0.7 0.646 69.4 70.6 -44.7 -34.3 -10.6 69.6 -28.2 727 223 C S G <4 S+ 0 0 50 -3,-0.8 4,-0.5 1,-0.3 -1,-0.3 0.688 93.6 56.4 -68.6 -17.1 -13.1 70.2 -25.4 728 224 C Q G <4 S+ 0 0 146 -3,-2.1 4,-0.3 1,-0.2 -1,-0.3 0.591 107.6 50.4 -84.5 -10.3 -16.1 69.3 -27.6 729 225 C H T <> S+ 0 0 76 -3,-1.9 4,-2.6 -4,-0.3 -2,-0.2 0.567 90.9 82.5 -97.7 -11.6 -14.5 65.9 -28.3 730 226 C L H X S+ 0 0 0 -4,-0.7 4,-3.5 2,-0.2 5,-0.2 0.889 87.5 48.6 -66.2 -48.3 -13.8 65.1 -24.7 731 227 C D H > S+ 0 0 113 -4,-0.5 4,-2.8 2,-0.2 -1,-0.2 0.908 114.8 48.2 -58.9 -42.1 -17.3 63.7 -23.7 732 228 C A H > S+ 0 0 44 -4,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.927 113.7 47.6 -60.3 -48.2 -17.2 61.5 -26.8 733 229 C A H X S+ 0 0 1 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.925 114.5 45.4 -57.0 -50.5 -13.6 60.4 -25.9 734 230 C L H X S+ 0 0 27 -4,-3.5 4,-1.7 2,-0.2 -2,-0.2 0.870 110.4 53.7 -63.8 -40.3 -14.6 59.7 -22.3 735 231 C A H < S+ 0 0 54 -4,-2.8 4,-0.3 -5,-0.2 -1,-0.2 0.861 111.5 47.2 -61.0 -37.2 -17.8 57.9 -23.4 736 232 C R H >X S+ 0 0 118 -4,-1.9 3,-1.4 -5,-0.2 4,-0.6 0.938 109.5 53.4 -66.3 -50.0 -15.6 55.7 -25.6 737 233 C L H >X S+ 0 0 1 -4,-2.5 4,-1.4 1,-0.3 3,-1.3 0.804 96.0 65.3 -57.2 -38.1 -13.0 55.1 -22.8 738 234 C R H 3< S+ 0 0 146 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.1 0.622 97.8 56.8 -69.4 -13.0 -15.5 53.8 -20.2 739 235 C N H <4 S+ 0 0 139 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.755 111.0 43.7 -75.6 -30.1 -16.2 50.8 -22.5 740 236 C E H << S+ 0 0 127 -3,-1.3 2,-0.3 -4,-0.6 -2,-0.2 0.623 127.3 9.5 -96.3 -17.8 -12.5 49.9 -22.4 741 237 C X < - 0 0 17 -4,-1.4 -1,-0.2 -57,-0.1 0, 0.0 -0.977 66.9-121.0-160.3 160.7 -11.8 50.4 -18.7 742 238 C D S S+ 0 0 150 -2,-0.3 -4,-0.1 1,-0.2 -1,-0.0 0.716 101.7 13.2 -83.0 -25.3 -13.8 51.0 -15.4 743 239 C D > - 0 0 98 -6,-0.1 4,-2.7 1,-0.1 3,-0.5 -0.560 61.1-179.2-152.2 84.9 -12.3 54.3 -14.3 744 240 C P H > S+ 0 0 5 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.853 86.7 47.0 -53.2 -44.9 -10.2 56.2 -16.9 745 241 C A H > S+ 0 0 32 2,-0.2 4,-1.8 1,-0.2 -31,-0.1 0.800 113.9 48.0 -69.3 -31.8 -9.3 59.1 -14.6 746 242 C L H > S+ 0 0 85 -3,-0.5 4,-3.5 2,-0.2 -1,-0.2 0.867 106.8 55.6 -77.1 -37.7 -8.3 56.8 -11.7 747 243 C H H X S+ 0 0 82 -4,-2.7 4,-1.7 2,-0.2 -2,-0.2 0.829 109.2 49.8 -58.4 -34.8 -6.2 54.6 -14.1 748 244 C I H X S+ 0 0 0 -4,-1.3 4,-2.1 -5,-0.2 -2,-0.2 0.917 111.7 46.6 -67.9 -46.9 -4.4 57.9 -14.9 749 245 C A H X S+ 0 0 35 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.935 113.7 50.1 -58.9 -47.7 -4.0 58.6 -11.1 750 246 C D H X S+ 0 0 88 -4,-3.5 4,-2.6 2,-0.2 -1,-0.2 0.820 108.3 50.7 -61.8 -36.7 -2.8 55.0 -10.5 751 247 C A H X S+ 0 0 10 -4,-1.7 4,-2.5 2,-0.2 -71,-0.3 0.922 110.3 49.4 -73.2 -41.1 -0.2 55.0 -13.3 752 248 C R H X S+ 0 0 1 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.915 113.7 46.3 -58.4 -46.9 1.4 58.3 -12.1 753 249 C Y H X S+ 0 0 86 -4,-2.2 4,-3.1 2,-0.2 5,-0.3 0.948 110.8 52.3 -63.1 -49.0 1.6 57.0 -8.5 754 250 C Q H X S+ 0 0 14 -4,-2.6 4,-2.1 1,-0.2 5,-0.2 0.927 111.2 48.1 -49.3 -50.7 3.0 53.6 -9.7 755 251 C C H X S+ 0 0 5 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.915 115.1 43.6 -58.4 -46.2 5.7 55.5 -11.6 756 252 C I H X S+ 0 0 8 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.911 114.2 48.8 -68.9 -47.8 6.6 57.8 -8.7 757 253 C A H X S+ 0 0 4 -4,-3.1 4,-2.0 2,-0.2 -1,-0.2 0.851 108.9 53.5 -63.4 -33.7 6.6 55.1 -6.0 758 254 C A H X S+ 0 0 16 -4,-2.1 4,-1.1 -5,-0.3 -1,-0.2 0.927 111.7 47.3 -66.6 -40.0 8.8 52.8 -8.2 759 255 C I H >X S+ 0 0 10 -4,-1.6 4,-2.4 -5,-0.2 3,-0.6 0.957 112.7 48.2 -61.5 -47.5 11.3 55.7 -8.5 760 256 C C H 3X S+ 0 0 4 -4,-2.7 4,-2.3 1,-0.3 -1,-0.2 0.823 103.6 59.9 -70.7 -30.5 11.2 56.4 -4.8 761 257 C D H 3< S+ 0 0 23 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.855 115.7 34.7 -62.2 -37.2 11.7 52.8 -3.7 762 258 C V H << S+ 0 0 16 -4,-1.1 -634,-0.2 -3,-0.6 -2,-0.2 0.887 122.6 45.0 -79.7 -37.1 15.0 52.7 -5.6 763 259 C V H < 0 0 0 -4,-2.4 -126,-3.3 -5,-0.2 -3,-0.2 0.816 360.0 360.0 -87.2 -35.7 16.1 56.2 -5.0 764 260 C S < 0 0 83 -4,-2.3 -128,-0.2 -128,-0.2 -130,-0.1 -0.705 360.0 360.0 -97.7 360.0 15.5 57.0 -1.3