==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 12-OCT-11 3U65 . COMPND 2 MOLECULE: TP33 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: TREPONEMA PALLIDUM SUBSP. PALLIDUM; . AUTHOR C.A.BRAUTIGAM,D.R.TOMCHICK,R.K.DEKA,M.V.NORGARD . 631 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28982.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 475 75.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 49 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 8.6 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 . 0 0.0 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 . 35 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 246 39.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.9 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 3 1 3 6 0 0 4 3 1 0 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 0 0 7 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 PARALLEL BRIDGES PER LADDER . 2 2 0 4 0 0 0 0 2 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 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 9 B K 0 0 189 0, 0.0 2,-0.6 0, 0.0 34,-0.2 0.000 360.0 360.0 360.0 155.0 -3.8 12.9 56.1 2 10 B V E -a 35 0A 15 32,-2.9 34,-2.0 2,-0.0 2,-0.7 -0.915 360.0-178.3-115.1 98.4 -1.7 12.7 52.9 3 11 B V E -a 36 0A 64 -2,-0.6 2,-0.6 32,-0.2 34,-0.2 -0.907 15.3-151.4 -99.0 113.6 0.3 15.9 52.5 4 12 B L E -a 37 0A 0 32,-2.9 34,-2.7 -2,-0.7 2,-0.6 -0.809 5.9-143.8 -87.2 121.7 2.4 15.6 49.4 5 13 B K E -a 38 0A 74 -2,-0.6 62,-2.7 32,-0.2 63,-1.6 -0.780 22.8-174.3 -90.2 118.6 5.6 17.7 49.6 6 14 B I E -ab 39 68A 0 32,-2.9 34,-2.3 -2,-0.6 63,-0.3 -0.951 18.6-144.9-124.0 115.5 6.3 19.1 46.1 7 15 B A E -ab 40 69A 0 61,-2.2 63,-2.5 -2,-0.5 2,-0.4 -0.537 28.3-166.9 -71.2 142.6 9.4 21.1 45.2 8 16 B S E -ab 41 70A 7 32,-2.9 34,-2.5 61,-0.2 35,-0.3 -0.977 36.7-161.4-144.8 134.5 8.5 23.8 42.7 9 17 B I + 0 0 33 61,-1.2 -1,-0.1 -2,-0.4 62,-0.1 0.465 62.7 116.8 -82.3 -2.5 10.3 26.2 40.4 10 18 B A S S- 0 0 9 60,-0.1 3,-0.1 6,-0.1 32,-0.1 -0.506 70.0-121.6 -70.1 126.0 7.2 28.4 40.3 11 19 B P > - 0 0 72 0, 0.0 3,-2.2 0, 0.0 6,-0.4 -0.309 39.0 -83.1 -65.6 149.5 8.0 31.8 41.7 12 20 B A T 3 S+ 0 0 55 1,-0.3 3,-0.1 5,-0.1 4,-0.1 -0.233 113.4 5.7 -50.2 131.4 6.0 33.0 44.7 13 21 B R T 3 S+ 0 0 208 1,-0.2 -1,-0.3 -3,-0.1 2,-0.1 0.481 97.3 138.7 72.5 6.7 2.7 34.6 43.7 14 22 B S S <> S- 0 0 19 -3,-2.2 4,-2.8 1,-0.1 -1,-0.2 -0.318 70.5-106.2 -76.9 165.0 3.1 33.7 40.1 15 23 B I H > S+ 0 0 45 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.891 121.2 53.3 -59.2 -39.3 0.3 32.4 37.9 16 24 B W H > S+ 0 0 37 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.940 110.6 45.6 -62.2 -46.1 1.9 28.9 38.0 17 25 B E H > S+ 0 0 47 -6,-0.4 4,-2.4 1,-0.2 5,-0.2 0.936 110.8 53.4 -63.9 -43.7 2.0 28.9 41.8 18 26 B T H X S+ 0 0 66 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.926 111.9 45.0 -56.0 -45.4 -1.6 30.2 42.1 19 27 B E H X S+ 0 0 9 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.876 110.5 53.1 -70.3 -36.4 -2.9 27.5 39.8 20 28 B L H X S+ 0 0 11 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.877 108.5 50.9 -67.0 -33.8 -0.9 24.8 41.6 21 29 B K H X S+ 0 0 125 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.899 109.0 51.2 -68.3 -37.2 -2.4 25.9 44.9 22 30 B K H X S+ 0 0 92 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.901 107.7 53.7 -62.2 -38.4 -5.8 25.7 43.4 23 31 B L H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.936 107.7 50.3 -63.8 -43.8 -5.0 22.2 42.3 24 32 B S H X S+ 0 0 15 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.931 111.0 48.1 -56.6 -47.6 -4.1 21.3 45.9 25 33 B A H X S+ 0 0 57 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.881 112.2 49.4 -63.4 -39.2 -7.4 22.7 47.1 26 34 B E H X S+ 0 0 43 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.903 107.9 53.5 -68.1 -37.8 -9.3 20.9 44.5 27 35 B W H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 8,-0.4 0.897 107.2 52.5 -61.4 -38.8 -7.5 17.6 45.3 28 36 B S H <>S+ 0 0 41 -4,-2.2 5,-2.8 -5,-0.2 6,-0.4 0.954 110.8 47.6 -59.9 -48.0 -8.6 18.2 48.9 29 37 B E H ><5S+ 0 0 150 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.954 112.1 48.9 -53.3 -55.0 -12.2 18.6 47.7 30 38 B I H 3<5S+ 0 0 44 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.858 115.6 43.9 -55.1 -39.3 -12.0 15.5 45.6 31 39 B T T ><5S- 0 0 4 -4,-2.1 3,-1.2 4,-0.2 -1,-0.3 0.223 113.0-110.7 -98.9 14.4 -10.5 13.4 48.4 32 40 B G T < 5S- 0 0 76 -3,-1.6 -3,-0.2 -4,-0.3 -4,-0.1 0.802 80.5 -48.1 66.2 27.1 -12.8 14.5 51.2 33 41 B G T 3 -a 8 0A 69 -2,-0.4 4,-1.3 -34,-0.2 -32,-0.2 -0.325 24.0-145.5 -59.1 125.7 10.8 26.6 46.6 42 50 B M H >>S+ 0 0 3 -34,-2.5 5,-2.6 1,-0.2 4,-0.5 0.932 95.6 47.6 -60.9 -49.9 13.2 24.7 44.4 43 51 B S H >45S+ 0 0 95 -35,-0.3 3,-1.5 1,-0.2 -1,-0.2 0.917 108.4 57.0 -58.8 -43.2 16.1 27.2 44.5 44 52 B S H 345S+ 0 0 102 1,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.810 106.4 48.6 -61.8 -30.8 15.8 27.5 48.3 45 53 B L H 3<5S- 0 0 36 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.479 136.5 -81.2 -90.3 0.9 16.2 23.7 48.7 46 54 B G T <<5S- 0 0 58 -3,-1.5 4,-0.3 -4,-0.5 -3,-0.2 0.414 73.2 -76.1 124.0 -1.8 19.3 23.8 46.4 47 55 B G >< - 0 0 21 -5,-2.6 4,-2.4 -6,-0.2 5,-0.1 -0.321 64.1 -55.7 104.9 177.8 18.0 23.7 42.8 48 56 B E H > S+ 0 0 13 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.838 130.0 53.6 -67.7 -36.5 16.6 21.2 40.5 49 57 B R H > S+ 0 0 110 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.905 111.9 46.9 -66.3 -38.3 19.4 18.6 40.7 50 58 B E H > S+ 0 0 48 -4,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.889 107.6 57.1 -65.2 -40.8 19.0 18.7 44.5 51 59 B G H X S+ 0 0 0 -4,-2.4 4,-0.6 2,-0.2 -2,-0.2 0.917 104.6 52.2 -54.8 -43.6 15.3 18.3 44.0 52 60 B I H >< S+ 0 0 39 -4,-2.2 3,-1.3 1,-0.2 4,-0.2 0.945 109.5 48.7 -58.7 -47.5 15.9 15.1 42.1 53 61 B R H >< S+ 0 0 146 -4,-1.8 3,-1.6 1,-0.3 -1,-0.2 0.879 106.0 57.9 -60.6 -37.0 18.1 13.7 44.9 54 62 B K H 3< S+ 0 0 65 -4,-2.3 12,-2.2 1,-0.3 -1,-0.3 0.562 90.6 72.1 -75.3 -6.8 15.4 14.6 47.5 55 63 B L T << S+ 0 0 8 -3,-1.3 2,-0.4 -4,-0.6 -1,-0.3 0.541 94.7 62.9 -80.4 -6.5 12.8 12.4 45.6 56 64 B K S < S- 0 0 146 -3,-1.6 2,-0.1 -4,-0.2 10,-0.1 -0.920 87.5-118.1-119.8 145.6 14.7 9.3 46.8 57 65 B S - 0 0 48 -2,-0.4 7,-0.2 7,-0.2 6,-0.1 -0.410 10.5-133.8 -81.3 157.5 15.1 8.2 50.4 58 66 B S S S+ 0 0 120 5,-0.3 -1,-0.1 1,-0.2 6,-0.1 0.733 91.1 24.4 -78.9 -26.6 18.5 7.9 52.2 59 67 B R S > S- 0 0 182 3,-0.1 3,-2.0 4,-0.1 -1,-0.2 -0.999 93.0 -96.6-140.9 142.4 17.6 4.5 53.6 60 68 B P T 3 S+ 0 0 129 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.241 109.9 26.2 -56.1 143.4 15.2 1.7 52.7 61 69 B G T 3 S+ 0 0 84 1,-0.3 2,-0.4 -4,-0.0 0, 0.0 0.296 100.1 108.0 86.7 -9.8 11.9 1.9 54.5 62 70 B Q S < S- 0 0 133 -3,-2.0 -1,-0.3 1,-0.0 -5,-0.1 -0.835 74.6-110.9-102.8 140.3 12.2 5.6 55.1 63 71 B A - 0 0 96 -2,-0.4 -5,-0.3 1,-0.1 -4,-0.1 -0.357 32.9-112.4 -65.6 138.8 10.1 8.2 53.3 64 72 B A - 0 0 24 -9,-0.2 -7,-0.2 -7,-0.2 -9,-0.1 -0.410 24.7-118.0 -64.0 150.0 11.8 10.5 50.7 65 73 B P S S+ 0 0 54 0, 0.0 2,-0.4 0, 0.0 -10,-0.2 0.850 99.4 38.7 -59.4 -34.3 12.0 14.1 51.7 66 74 B L - 0 0 5 -12,-2.2 -60,-0.2 -15,-0.1 -2,-0.1 -0.930 57.8-163.5-119.2 147.7 9.9 15.0 48.7 67 75 B D S S- 0 0 14 -62,-2.7 158,-2.3 -2,-0.4 2,-0.3 0.656 75.2 -20.8 -94.0 -25.2 6.9 13.3 47.0 68 76 B G E -bC 6 224A 0 -63,-1.6 -61,-2.2 156,-0.3 2,-0.3 -0.950 58.0-141.0-169.3-177.7 7.1 15.2 43.8 69 77 B A E -bC 7 223A 0 154,-2.3 154,-3.0 -63,-0.3 2,-0.6 -0.991 18.9-130.5-160.8 151.4 8.4 18.2 41.9 70 78 B V E -bC 8 222A 6 -63,-2.5 -61,-1.2 -2,-0.3 2,-0.3 -0.956 45.2-178.4-104.9 107.9 7.6 20.8 39.3 71 79 B F E - C 0 221A 0 150,-2.7 150,-2.2 -2,-0.6 2,-0.1 -0.769 26.9-137.1-110.6 152.0 10.7 20.8 37.0 72 80 B S > - 0 0 6 -2,-0.3 4,-2.5 148,-0.2 5,-0.2 -0.336 55.0 -82.1 -82.5-175.8 11.9 22.6 34.0 73 81 B C H > S+ 0 0 5 146,-0.4 4,-2.2 1,-0.2 5,-0.2 0.735 130.1 66.6 -65.8 -17.2 13.5 20.6 31.2 74 82 B L H > S+ 0 0 24 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.989 108.9 35.2 -60.7 -59.0 16.7 20.8 33.3 75 83 B G H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.909 118.8 51.2 -63.4 -41.5 15.2 18.6 36.1 76 84 B L H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.929 111.3 47.3 -63.3 -43.5 13.2 16.5 33.7 77 85 B S H < S+ 0 0 23 -4,-2.2 6,-0.3 -5,-0.2 -1,-0.2 0.816 115.2 44.6 -72.5 -28.6 16.2 15.7 31.5 78 86 B E H < S+ 0 0 79 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.811 110.7 54.1 -83.3 -27.0 18.5 14.8 34.4 79 87 B L H < S+ 0 0 20 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.880 125.1 24.4 -70.4 -39.7 15.8 12.7 36.1 80 88 B A S >< S- 0 0 7 -4,-2.0 3,-1.3 -5,-0.2 -1,-0.3 -0.817 88.4-151.1-127.2 87.7 15.3 10.6 33.0 81 89 B P T 3 S+ 0 0 97 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 -0.272 82.2 18.7 -62.1 151.3 18.5 10.8 30.9 82 90 B D T 3 S+ 0 0 134 -5,-0.2 -4,-0.1 1,-0.1 -5,-0.1 0.784 82.2 142.9 57.4 29.5 17.9 10.4 27.2 83 91 B S < - 0 0 11 -3,-1.3 219,-0.1 -6,-0.3 -1,-0.1 0.817 56.5-135.5 -62.4 -34.8 14.2 11.3 27.7 84 92 B G > + 0 0 4 217,-0.3 3,-2.0 -4,-0.2 220,-0.6 0.605 61.0 136.4 83.5 12.2 14.1 13.2 24.5 85 93 B I B > +E 303 0B 6 1,-0.3 3,-1.7 2,-0.2 134,-0.1 0.812 61.3 69.2 -66.7 -23.7 12.2 16.1 26.1 86 94 B Y G > S+ 0 0 8 216,-0.6 3,-1.8 1,-0.3 -1,-0.3 0.608 75.3 85.2 -71.2 -6.6 14.5 18.6 24.3 87 95 B T G X S+ 0 0 0 -3,-2.0 3,-1.6 215,-0.3 -1,-0.3 0.879 82.9 61.0 -53.1 -35.5 12.7 17.5 21.1 88 96 B L G < S+ 0 0 3 -3,-1.7 -1,-0.3 -4,-0.3 6,-0.3 0.623 97.5 58.5 -70.8 -11.5 10.1 20.1 22.2 89 97 B S G < S+ 0 0 9 -3,-1.8 -1,-0.3 127,-0.1 -2,-0.2 0.350 70.3 128.5 -97.9 1.5 12.8 22.8 21.9 90 98 B V S X> S- 0 0 5 -3,-1.6 3,-2.2 -4,-0.2 4,-0.5 -0.409 75.8 -95.8 -58.9 129.6 13.6 22.2 18.3 91 99 B P T 34 S- 0 0 4 0, 0.0 125,-0.2 0, 0.0 -1,-0.1 -0.239 100.6 -4.1 -59.0 132.2 13.4 25.7 16.6 92 100 B F T 34 S+ 0 0 0 123,-2.7 3,-0.2 2,-0.2 124,-0.1 0.460 97.9 114.7 67.1 7.3 10.1 26.3 15.0 93 101 B L T <4 S+ 0 0 0 -3,-2.2 2,-0.5 122,-0.4 123,-0.1 0.952 89.2 20.5 -67.9 -46.7 8.8 22.8 15.7 94 102 B I S < S+ 0 0 0 -4,-0.5 -1,-0.3 121,-0.3 -2,-0.2 -0.979 73.0 166.4-125.4 113.9 6.1 24.1 18.1 95 103 B Q + 0 0 36 -2,-0.5 119,-0.5 -3,-0.2 2,-0.3 0.492 52.9 25.7-111.0 -7.4 5.2 27.8 17.5 96 104 B N S > S- 0 0 68 1,-0.1 4,-2.3 117,-0.1 5,-0.2 -0.970 76.2-101.0-157.6 167.8 2.0 28.6 19.3 97 105 B E H > S+ 0 0 22 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.865 115.3 55.0 -64.2 -41.1 -0.3 27.8 22.2 98 106 B K H > S+ 0 0 173 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.931 112.6 44.0 -58.5 -44.1 -2.9 25.9 20.1 99 107 B D H > S+ 0 0 33 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.893 110.9 52.1 -74.3 -38.5 -0.2 23.6 18.7 100 108 B L H X S+ 0 0 5 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.938 109.9 50.9 -59.5 -45.1 1.5 23.0 22.1 101 109 B E H X S+ 0 0 50 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.898 108.1 52.3 -59.0 -40.5 -1.9 22.1 23.6 102 110 B R H X S+ 0 0 119 -4,-1.9 4,-3.0 -5,-0.2 5,-0.4 0.923 111.9 46.0 -61.9 -44.6 -2.4 19.6 20.7 103 111 B V H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.938 113.9 47.3 -61.7 -50.1 1.0 18.0 21.4 104 112 B L H < S+ 0 0 4 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.815 119.6 41.0 -66.4 -29.0 0.4 17.8 25.2 105 113 B H H >< S+ 0 0 113 -4,-2.2 3,-0.7 -5,-0.2 -2,-0.2 0.946 122.9 34.0 -77.2 -55.8 -3.0 16.4 24.7 106 114 B E H 3< S+ 0 0 94 -4,-3.0 3,-0.3 -5,-0.2 -3,-0.2 0.816 124.6 39.6 -77.8 -32.6 -2.5 13.9 21.8 107 115 B L T 3X S+ 0 0 17 -4,-2.2 4,-2.4 -5,-0.4 3,-0.3 0.131 76.2 121.2-107.3 22.3 1.0 12.7 22.6 108 116 B R H <> S+ 0 0 47 -3,-0.7 4,-2.4 1,-0.2 -1,-0.2 0.855 73.6 50.4 -52.8 -45.5 0.7 12.5 26.3 109 117 B E H > S+ 0 0 146 -3,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.897 112.5 47.6 -66.7 -36.4 1.5 8.8 26.6 110 118 B D H 4 S+ 0 0 31 -3,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.882 113.0 48.3 -69.4 -41.0 4.6 9.3 24.5 111 119 B L H < S+ 0 0 5 -4,-2.4 4,-0.3 1,-0.2 -2,-0.2 0.891 115.1 45.4 -64.2 -39.3 5.8 12.3 26.5 112 120 B D H >X S+ 0 0 18 -4,-2.4 4,-2.5 -5,-0.2 3,-1.0 0.733 88.2 91.0 -79.2 -21.6 5.3 10.6 29.7 113 121 B R H 3X S+ 0 0 123 -4,-1.3 4,-2.3 1,-0.3 -1,-0.2 0.832 86.5 45.0 -51.4 -50.2 6.9 7.2 28.8 114 122 B P H 3> S+ 0 0 34 0, 0.0 4,-0.8 0, 0.0 -1,-0.3 0.828 114.2 50.9 -66.2 -26.6 10.5 7.9 30.0 115 123 B F H <4>S+ 0 0 1 -3,-1.0 5,-2.1 -4,-0.3 3,-0.4 0.908 109.2 49.5 -75.9 -39.4 9.3 9.4 33.2 116 124 B R H ><5S+ 0 0 106 -4,-2.5 3,-1.8 1,-0.2 -1,-0.2 0.914 109.1 53.4 -60.7 -42.2 7.1 6.5 34.0 117 125 B A H 3<5S+ 0 0 92 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.735 105.7 54.7 -65.9 -24.4 10.1 4.2 33.3 118 126 B A T 3<5S- 0 0 36 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.410 129.2 -96.1 -86.3 -0.7 12.1 6.3 35.8 119 127 B G T < 5S+ 0 0 24 -3,-1.8 107,-2.5 1,-0.3 2,-0.4 0.706 85.3 115.0 95.9 23.6 9.4 5.6 38.5 120 128 B F E < -D 225 0A 11 -5,-2.1 2,-0.5 105,-0.3 -1,-0.3 -0.949 55.7-138.9-129.1 145.6 7.3 8.8 38.2 121 129 B R E -D 224 0A 62 103,-3.1 103,-2.2 -2,-0.4 2,-0.7 -0.859 22.6-134.2 -93.2 131.9 3.8 9.7 37.3 122 130 B V E -D 223 0A 3 -2,-0.5 101,-0.2 101,-0.2 3,-0.1 -0.803 24.1-178.9 -86.5 117.5 3.5 12.9 35.2 123 131 B I E - 0 0 0 99,-2.9 2,-0.3 -2,-0.7 -1,-0.2 0.907 61.8 -11.9 -83.7 -48.1 0.6 14.8 36.8 124 132 B T E -D 222 0A 2 98,-0.9 98,-2.8 123,-0.1 2,-0.4 -0.989 52.2-141.6-152.9 150.8 0.5 17.8 34.5 125 133 B W E +D 221 0A 0 -2,-0.3 2,-0.2 96,-0.2 96,-0.2 -0.898 31.7 158.7-103.0 140.7 2.5 19.5 31.7 126 134 B T E -D 220 0A 13 94,-2.8 94,-2.2 -2,-0.4 2,-0.3 -0.711 30.8-114.2-142.9-162.0 2.6 23.3 31.5 127 135 B N E -D 219 0A 5 92,-0.3 92,-0.2 -2,-0.2 3,-0.1 -0.999 6.7-156.8-149.6 133.7 4.8 25.9 30.0 128 136 B A E - 0 0 35 90,-2.9 2,-0.3 -2,-0.3 91,-0.1 0.646 68.5 -79.5 -82.8 -20.7 7.1 28.7 31.3 129 137 B G E - 0 0 0 89,-0.2 89,-1.2 65,-0.1 2,-0.5 -0.971 50.8 -61.3 151.6-165.6 6.9 30.7 28.1 130 138 B W E -D 217 0A 9 -2,-0.3 2,-0.3 87,-0.2 65,-0.3 -0.981 41.1-131.0-124.8 118.7 8.0 31.1 24.5 131 139 B L E +D 216 0A 4 85,-2.5 84,-2.5 -2,-0.5 85,-0.8 -0.561 35.9 168.3 -71.4 130.4 11.7 31.7 23.7 132 140 B S E -F 193 0C 0 61,-2.0 61,-2.0 -2,-0.3 2,-0.5 -0.973 35.2-108.4-137.8 157.7 12.1 34.6 21.2 133 141 B F E -F 192 0C 2 -2,-0.3 78,-2.6 59,-0.2 2,-0.5 -0.742 25.5-171.8 -91.0 126.8 15.0 36.7 19.9 134 142 B Y E +FG 191 210C 1 57,-2.9 57,-2.4 -2,-0.5 2,-0.3 -0.985 19.4 176.7-117.4 120.4 15.4 40.3 21.1 135 143 B T E -FG 190 209C 0 74,-2.5 73,-2.6 -2,-0.5 74,-2.2 -0.911 43.5-140.2-134.3 150.3 18.1 42.2 19.2 136 144 B R S S+ 0 0 105 53,-2.5 54,-0.1 -2,-0.3 -1,-0.1 0.827 95.9 34.4 -69.3 -35.7 19.8 45.6 18.8 137 145 B A S S- 0 0 45 52,-0.4 72,-0.1 72,-0.1 -1,-0.1 -0.881 83.6-115.9-123.8 154.1 20.0 45.1 15.1 138 146 B P - 0 0 71 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.192 23.8-142.3 -77.6 177.8 17.8 43.4 12.4 139 147 B Y - 0 0 26 1,-0.1 3,-0.1 -2,-0.0 4,-0.0 -0.996 11.0-151.8-147.7 139.1 18.9 40.4 10.3 140 148 B A S S+ 0 0 94 -2,-0.3 2,-0.3 1,-0.1 3,-0.1 0.509 81.8 10.8 -92.8 -6.2 18.2 39.6 6.6 141 149 B S S > S- 0 0 57 1,-0.1 4,-1.8 143,-0.0 5,-0.1 -0.968 79.4-101.9-160.6 165.6 18.4 35.9 7.1 142 150 B L H > S+ 0 0 4 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.896 121.0 57.0 -60.5 -40.9 18.6 33.2 9.7 143 151 B G H > S+ 0 0 19 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.888 104.2 52.1 -59.7 -38.7 22.3 32.8 9.1 144 152 B Q H > S+ 0 0 97 1,-0.2 4,-0.5 2,-0.2 3,-0.5 0.904 109.8 48.9 -65.8 -39.0 22.8 36.5 9.9 145 153 B L H >< S+ 0 0 0 -4,-1.8 3,-1.5 1,-0.2 25,-0.3 0.906 105.9 57.4 -61.9 -42.4 20.9 36.1 13.2 146 154 B K H 3< S+ 0 0 16 -4,-2.6 24,-1.7 1,-0.3 -1,-0.2 0.777 101.3 57.7 -61.9 -23.6 23.0 33.1 14.0 147 155 B K H 3< S+ 0 0 166 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.637 87.5 96.2 -81.0 -16.2 26.1 35.2 13.7 148 156 B Q S << S- 0 0 20 -3,-1.5 2,-0.8 -4,-0.5 22,-0.6 -0.467 83.5-117.7 -71.9 148.1 24.9 37.7 16.3 149 157 B T E -h 170 0C 38 -2,-0.1 40,-2.9 20,-0.1 41,-0.8 -0.789 41.9-177.6 -90.2 111.3 26.1 37.2 19.9 150 158 B I E -hi 171 190C 1 20,-2.5 22,-3.0 -2,-0.8 2,-0.3 -0.935 19.8-136.7-123.0 128.1 23.0 36.4 21.9 151 159 B A E -hi 172 191C 2 39,-2.4 41,-2.6 -2,-0.5 2,-0.4 -0.637 13.4-164.5 -83.6 139.0 22.7 35.8 25.6 152 160 B L E +hi 173 192C 0 20,-2.3 22,-2.3 -2,-0.3 41,-0.1 -0.987 16.5 166.5-123.7 127.4 20.5 33.0 27.0 153 161 B S + 0 0 26 39,-0.7 23,-0.5 -2,-0.4 40,-0.1 0.139 25.9 137.1-129.2 14.6 19.5 33.0 30.7 154 162 B S S > S- 0 0 32 38,-0.3 3,-1.6 1,-0.1 4,-0.2 -0.051 71.1-100.9 -51.8 163.8 16.7 30.4 31.0 155 163 B L T 3 S+ 0 0 113 1,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.812 126.8 37.9 -62.2 -29.0 16.6 27.9 33.9 156 164 B D T 3> S+ 0 0 16 1,-0.2 4,-2.2 2,-0.1 3,-0.3 -0.087 78.8 137.4-110.6 33.1 18.0 25.3 31.6 157 165 B S H <> + 0 0 11 -3,-1.6 4,-2.5 1,-0.2 5,-0.2 0.761 59.9 60.2 -57.5 -36.8 20.4 27.6 29.7 158 166 B S H > S+ 0 0 58 2,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.950 115.4 29.5 -58.0 -57.3 23.4 25.3 29.5 159 167 B V H > S+ 0 0 33 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.909 122.1 50.4 -72.9 -42.9 21.9 22.4 27.6 160 168 B L H X S+ 0 0 4 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.926 111.7 50.4 -61.1 -41.2 19.4 24.4 25.7 161 169 B G H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.3 -1,-0.2 0.894 106.9 54.1 -63.3 -38.9 22.3 26.7 24.7 162 170 B T H X S+ 0 0 50 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.911 107.7 50.8 -61.4 -44.6 24.4 23.7 23.6 163 171 B C H X S+ 0 0 8 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.938 112.5 45.8 -56.2 -49.1 21.5 22.6 21.3 164 172 B F H X>S+ 0 0 3 -4,-2.2 5,-2.1 1,-0.2 4,-0.6 0.846 108.9 55.9 -68.6 -32.3 21.2 26.1 19.8 165 173 B R H ><5S+ 0 0 90 -4,-2.7 3,-0.8 1,-0.2 -1,-0.2 0.886 105.6 51.7 -64.8 -37.0 25.0 26.3 19.4 166 174 B I H 3<5S+ 0 0 13 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.877 103.4 58.4 -65.8 -36.1 24.9 23.1 17.4 167 175 B C H 3<5S- 0 0 2 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.719 128.2-104.0 -62.9 -18.5 22.2 24.7 15.2 168 176 B G T <<5S+ 0 0 41 -3,-0.8 2,-0.2 -4,-0.6 -3,-0.2 0.381 74.4 138.3 111.0 -1.0 24.8 27.4 14.6 169 177 B F < - 0 0 6 -5,-2.1 2,-1.9 1,-0.1 -1,-0.4 -0.547 58.2-126.4 -75.1 142.8 23.6 30.3 16.8 170 178 B D E +h 149 0C 74 -24,-1.7 -20,-2.5 -22,-0.6 2,-0.5 -0.538 43.9 175.5 -85.2 70.1 26.3 32.2 18.7 171 179 B I E -h 150 0C 4 -2,-1.9 2,-0.6 -10,-0.2 -20,-0.2 -0.721 20.2-153.9 -84.3 128.3 24.5 31.7 22.0 172 180 B K E -h 151 0C 127 -22,-3.0 -20,-2.3 -2,-0.5 2,-0.1 -0.898 20.4-126.3-104.1 113.5 26.4 33.0 25.0 173 181 B D E +h 152 0C 57 -2,-0.6 -20,-0.2 -22,-0.2 -15,-0.1 -0.425 37.1 172.3 -59.1 136.5 25.4 31.1 28.1 174 182 B A > - 0 0 10 -22,-2.3 3,-2.0 -20,-0.1 2,-0.1 -0.276 11.7-173.2-154.3 56.3 24.4 33.8 30.6 175 183 B P T 3 S- 0 0 84 0, 0.0 3,-0.1 0, 0.0 -22,-0.1 -0.345 83.1 -16.3 -60.8 123.4 22.8 32.6 33.9 176 184 B N T 3 S+ 0 0 151 -23,-0.5 -23,-0.1 1,-0.2 -22,-0.0 0.710 95.8 177.1 54.3 23.0 21.5 35.6 35.9 177 185 B A < - 0 0 28 -3,-2.0 2,-1.7 1,-0.1 -1,-0.2 -0.279 36.6-128.6 -66.4 140.9 23.6 37.8 33.7 178 186 B R > + 0 0 210 1,-0.2 4,-0.6 -3,-0.1 -1,-0.1 -0.618 38.0 173.3 -88.8 81.6 23.4 41.5 34.2 179 187 B L H > + 0 0 1 -2,-1.7 4,-2.9 1,-0.2 5,-0.3 0.675 51.5 82.3 -71.4 -21.9 22.7 42.3 30.6 180 188 B A H > S+ 0 0 23 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.928 97.1 39.1 -58.7 -51.4 21.9 46.0 30.7 181 189 B P H > S+ 0 0 83 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.859 116.7 53.6 -66.8 -29.8 25.5 47.4 30.7 182 190 B L H X>S+ 0 0 63 -4,-0.6 5,-1.7 2,-0.2 4,-1.5 0.895 109.7 45.9 -69.5 -43.1 26.6 44.6 28.2 183 191 B L H <5S+ 0 0 1 -4,-2.9 -1,-0.2 2,-0.2 -3,-0.2 0.907 115.8 47.7 -61.9 -44.3 23.8 45.5 25.7 184 192 B K H <5S+ 0 0 136 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.864 114.6 45.0 -65.3 -37.4 24.7 49.2 26.1 185 193 B A H <5S- 0 0 79 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.705 110.7-121.0 -80.4 -22.2 28.4 48.6 25.7 186 194 B G T <5S+ 0 0 35 -4,-1.5 -3,-0.2 2,-0.2 -4,-0.1 0.633 73.9 129.4 89.2 16.9 27.9 46.3 22.7 187 195 B S S - 0 0 34 -2,-0.3 4,-1.3 -63,-0.2 3,-0.2 -0.418 51.8-103.7 -74.8 165.8 10.5 34.3 27.3 195 203 B H H > S+ 0 0 10 -65,-0.3 4,-1.4 1,-0.2 5,-0.1 0.814 116.3 56.8 -68.1 -35.8 8.3 37.5 27.2 196 204 B L H > S+ 0 0 67 1,-0.2 4,-3.9 2,-0.2 5,-0.3 0.918 104.3 55.7 -62.0 -41.6 8.0 38.2 30.9 197 205 B F H > S+ 0 0 54 -3,-0.2 4,-2.4 1,-0.2 6,-0.5 0.929 103.6 52.6 -53.5 -49.5 11.8 38.3 31.1 198 206 B T H < S+ 0 0 0 -4,-1.3 6,-1.7 1,-0.2 4,-0.3 0.852 119.7 36.3 -59.6 -35.4 12.1 41.0 28.5 199 207 B W H < S+ 0 0 96 -4,-1.4 3,-0.5 -3,-0.2 -2,-0.2 0.929 117.4 46.9 -83.5 -51.3 9.6 43.1 30.4 200 208 B A H < S+ 0 0 76 -4,-3.9 -3,-0.2 1,-0.3 -2,-0.2 0.850 115.0 45.8 -65.1 -39.8 10.5 42.4 34.1 201 209 B T S < S- 0 0 49 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.1 0.716 102.5-131.5 -68.9 -24.9 14.2 42.9 33.6 202 210 B G > + 0 0 10 -3,-0.5 3,-1.7 -5,-0.3 4,-0.2 0.495 68.8 129.7 81.5 3.7 13.7 46.0 31.6 203 211 B F G > + 0 0 23 -6,-0.5 3,-2.0 1,-0.3 -4,-0.1 0.704 52.6 78.6 -68.5 -18.9 16.1 44.7 29.0 204 212 B Y G > S+ 0 0 42 -6,-1.7 3,-1.1 1,-0.3 -1,-0.3 0.761 83.4 67.4 -54.0 -26.3 13.6 45.5 26.2 205 213 B R G < S+ 0 0 143 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.729 98.5 50.1 -70.7 -18.4 14.8 49.1 26.6 206 214 B Y G < S+ 0 0 55 -3,-2.0 2,-0.3 -4,-0.2 -1,-0.2 0.160 104.8 61.3-112.6 19.9 18.2 48.2 25.2 207 215 B I < - 0 0 9 -3,-1.1 -71,-0.3 -4,-0.1 3,-0.1 -0.862 59.4-156.8-135.2 169.7 17.2 46.3 22.1 208 216 B S + 0 0 59 -73,-2.6 64,-2.8 -2,-0.3 2,-0.4 0.527 69.5 52.0-124.2 -14.4 15.2 47.4 19.0 209 217 B Y E -Gj 135 272C 68 -74,-2.2 -74,-2.5 62,-0.2 2,-0.4 -0.990 50.7-170.9-136.2 137.9 13.7 44.2 17.5 210 218 B A E -Gj 134 273C 3 62,-2.5 64,-3.3 -2,-0.4 2,-0.5 -0.993 23.8-133.0-129.4 123.3 11.7 41.3 18.8 211 219 B L E - j 0 274C 3 -78,-2.6 64,-0.2 -2,-0.4 4,-0.1 -0.647 13.6-164.6 -76.7 120.9 11.0 38.3 16.6 212 220 B D + 0 0 64 62,-2.8 2,-0.8 -2,-0.5 -1,-0.2 0.716 68.3 87.6 -84.7 -17.2 7.3 37.5 16.8 213 221 B T S S- 0 0 16 61,-0.5 -117,-0.1 1,-0.0 -2,-0.1 -0.722 86.3-128.4 -81.3 111.0 7.6 34.0 15.4 214 222 B K - 0 0 31 -2,-0.8 -82,-0.2 -119,-0.5 -122,-0.2 -0.317 11.4-151.6 -68.9 138.8 8.3 31.9 18.5 215 223 B I - 0 0 2 -84,-2.5 -123,-2.7 1,-0.3 -122,-0.4 0.928 66.7 -41.9 -72.7 -48.0 11.4 29.7 18.5 216 224 B C E - D 0 131A 0 -85,-0.8 -85,-2.5 -125,-0.2 -1,-0.3 -0.966 56.9 -98.8-170.8 161.2 10.0 27.1 21.0 217 225 B P E - 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0 0 59 -220,-0.6 4,-2.5 -2,-0.4 5,-0.1 -0.907 16.9-165.8 -97.2 105.6 13.6 11.6 20.2 305 313 B M H > S+ 0 0 50 -2,-0.8 4,-2.3 1,-0.2 5,-0.2 0.798 84.8 55.0 -73.4 -27.3 13.2 11.2 16.5 306 314 B T H > S+ 0 0 101 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.936 112.1 44.4 -66.8 -44.9 10.0 9.1 16.6 307 315 B L H > S+ 0 0 9 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.911 111.1 55.5 -61.6 -43.4 8.4 11.9 18.8 308 316 B Y H X S+ 0 0 15 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.925 109.7 44.6 -55.0 -48.6 9.8 14.5 16.4 309 317 B E H X S+ 0 0 96 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.883 112.2 53.1 -67.6 -35.8 8.2 12.9 13.4 310 318 B K H X S+ 0 0 86 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.893 109.7 47.9 -65.8 -40.2 4.9 12.4 15.3 311 319 B I H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 5,-0.3 0.939 111.8 50.1 -66.8 -43.1 4.8 16.1 16.2 312 320 B K H X S+ 0 0 58 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.921 114.1 44.9 -60.1 -44.3 5.5 17.1 12.6 313 321 B H H X S+ 0 0 131 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.937 113.7 50.1 -64.6 -47.1 2.8 14.9 11.3 314 322 B L H < S+ 0 0 34 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.917 122.8 29.8 -58.6 -45.9 0.3 16.0 14.0 315 323 B L H < S+ 0 0 26 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.717 129.5 31.9 -89.5 -23.4 0.9 19.7 13.4 316 324 B Y H < 0 0 89 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.2 0.280 360.0 360.0-127.7 11.0 1.8 20.0 9.7 317 325 B S < 0 0 113 -4,-1.4 -4,-0.0 -5,-0.1 0, 0.0 -0.766 360.0 360.0 -87.2 360.0 -0.1 17.2 7.9 318 !* 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 0.0 319 9 A K 0 0 205 0, 0.0 2,-0.6 0, 0.0 34,-0.2 0.000 360.0 360.0 360.0 147.8 -6.1 68.3 31.3 320 10 A V E -k 353 0D 14 32,-2.9 34,-2.0 31,-0.1 2,-0.7 -0.895 360.0-179.6-115.1 97.7 -7.4 68.2 27.8 321 11 A V E -k 354 0D 53 -2,-0.6 2,-0.6 32,-0.2 34,-0.2 -0.890 17.9-149.5 -99.0 111.6 -8.7 64.7 26.9 322 12 A L E -k 355 0D 0 32,-3.2 34,-2.6 -2,-0.7 2,-0.7 -0.741 5.8-142.1 -87.6 121.6 -9.9 64.8 23.3 323 13 A K E -k 356 0D 88 -2,-0.6 61,-2.5 32,-0.2 62,-1.8 -0.763 23.5-172.9 -87.5 117.5 -12.8 62.5 22.6 324 14 A I E -kl 357 385D 0 32,-3.0 34,-2.3 -2,-0.7 62,-0.3 -0.947 18.2-144.8-121.0 118.4 -12.3 61.0 19.2 325 15 A A E -kl 358 386D 0 60,-2.2 62,-2.5 -2,-0.5 2,-0.4 -0.568 29.0-166.1 -75.1 142.4 -14.8 58.8 17.3 326 16 A S E -kl 359 387D 9 32,-2.8 34,-2.5 -2,-0.2 35,-0.3 -0.990 37.8-164.6-143.0 137.9 -13.0 56.1 15.3 327 17 A I + 0 0 41 60,-0.8 -1,-0.1 -2,-0.4 32,-0.1 0.428 59.7 119.7 -85.9 -3.1 -13.6 53.6 12.6 328 18 A A - 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