==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-MAY-01 1J91 . COMPND 2 MOLECULE: CASEIN KINASE II, ALPHA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ZEA MAYS; . AUTHOR R.BATTISTUTTA,E.DE MOLINER,S.SARNO,G.ZANOTTI,L.A.PINNA . 654 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30817.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 443 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 1 0.2 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 . 62 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 89 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 189 28.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.7 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 8 3 1 2 1 0 3 0 2 1 1 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 2 1 4 2 0 1 2 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 . 2 2 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 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 7 A S 0 0 33 0, 0.0 178,-0.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 136.6 11.4 -16.1 -7.3 2 8 A K - 0 0 125 176,-0.1 202,-0.1 177,-0.1 5,-0.1 -0.978 360.0 -90.5-132.8 144.4 11.1 -16.1 -3.5 3 9 A A - 0 0 9 -2,-0.3 4,-0.3 200,-0.2 301,-0.1 -0.253 25.7-142.7 -54.6 135.7 10.8 -13.3 -1.1 4 10 A R S S+ 0 0 134 1,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.762 86.1 29.3 -69.7 -27.4 14.2 -12.1 0.2 5 11 A V S S+ 0 0 44 1,-0.1 200,-0.2 2,-0.0 -1,-0.1 -0.966 124.1 7.9-134.9 152.5 12.7 -11.5 3.6 6 12 A Y S > S+ 0 0 71 -2,-0.3 3,-0.9 1,-0.1 4,-0.3 0.709 76.0 143.5 53.4 25.3 9.8 -13.0 5.7 7 13 A A T 3 S+ 0 0 17 -4,-0.3 3,-0.2 1,-0.2 4,-0.2 0.825 71.0 35.7 -63.9 -34.3 9.4 -15.7 3.1 8 14 A D T 3> S+ 0 0 106 1,-0.2 4,-1.7 2,-0.1 -1,-0.2 0.231 81.2 109.7-108.5 16.2 8.6 -18.5 5.5 9 15 A V H <> S+ 0 0 29 -3,-0.9 4,-1.1 1,-0.2 -1,-0.2 0.890 80.0 48.0 -59.0 -42.8 6.5 -16.7 8.1 10 16 A N H 4 S+ 0 0 2 166,-0.4 -1,-0.2 -4,-0.3 8,-0.2 0.844 106.7 57.3 -70.1 -30.1 3.2 -18.2 7.3 11 17 A V H 4 S+ 0 0 108 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.2 0.944 106.8 49.1 -61.6 -47.7 4.6 -21.8 7.2 12 18 A L H < S+ 0 0 157 -4,-1.7 -1,-0.2 2,-0.0 -2,-0.2 0.766 103.5 74.9 -63.8 -28.3 5.8 -21.4 10.8 13 19 A R S < S- 0 0 85 -4,-1.1 5,-0.1 1,-0.1 0, 0.0 -0.503 97.1 -87.6 -86.6 157.8 2.4 -20.1 12.0 14 20 A P >> - 0 0 82 0, 0.0 3,-1.0 0, 0.0 4,-0.8 -0.138 35.8-111.3 -59.4 158.7 -0.7 -22.3 12.4 15 21 A K H 3> S+ 0 0 130 1,-0.2 4,-2.2 2,-0.2 3,-0.4 0.864 115.2 63.1 -58.1 -39.1 -3.0 -23.0 9.5 16 22 A E H 34 S+ 0 0 145 1,-0.2 -1,-0.2 2,-0.2 6,-0.0 0.771 93.6 62.9 -58.4 -31.6 -5.7 -20.9 11.2 17 23 A Y H <4 S+ 0 0 23 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.935 120.3 19.0 -61.9 -48.3 -3.6 -17.7 10.9 18 24 A W H < S+ 0 0 64 -4,-0.8 2,-1.7 -3,-0.4 -2,-0.2 0.558 99.9 92.3-101.8 -11.9 -3.5 -17.6 7.1 19 25 A D >< + 0 0 37 -4,-2.2 3,-0.8 1,-0.2 -1,-0.1 -0.585 45.7 165.8 -87.7 79.3 -6.4 -19.9 6.1 20 26 A Y G > + 0 0 31 -2,-1.7 3,-1.1 1,-0.2 -1,-0.2 0.669 64.3 68.5 -68.7 -21.9 -9.0 -17.2 5.8 21 27 A E G 3 S+ 0 0 103 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.824 96.7 56.5 -67.2 -30.3 -11.6 -19.3 3.9 22 28 A A G < S+ 0 0 70 -3,-0.8 2,-0.5 2,-0.1 -1,-0.3 -0.130 83.4 128.3 -91.5 36.3 -12.1 -21.3 7.1 23 29 A L < - 0 0 20 -3,-1.1 2,-0.8 1,-0.0 -3,-0.1 -0.843 42.1-167.8-100.0 124.3 -12.9 -18.1 9.0 24 30 A T - 0 0 127 -2,-0.5 -2,-0.1 49,-0.0 -3,-0.0 -0.783 23.8-144.6-110.4 86.0 -16.1 -18.0 11.1 25 31 A V - 0 0 21 -2,-0.8 2,-0.9 1,-0.1 48,-0.0 -0.075 6.9-130.7 -50.5 142.7 -16.5 -14.3 11.9 26 32 A Q - 0 0 179 69,-0.0 68,-0.3 0, 0.0 -1,-0.1 -0.828 29.7-143.8-100.4 97.6 -17.9 -13.3 15.3 27 33 A W - 0 0 82 -2,-0.9 68,-0.2 1,-0.1 2,-0.0 -0.332 13.3-160.6 -67.5 137.3 -20.6 -10.7 14.4 28 34 A G - 0 0 15 66,-3.1 2,-0.5 -2,-0.1 68,-0.3 0.128 37.2 -66.0 -92.9-149.2 -21.3 -7.7 16.6 29 35 A E > - 0 0 93 1,-0.1 3,-1.0 66,-0.1 66,-0.1 -0.928 25.4-162.1-116.1 119.7 -24.3 -5.5 16.8 30 36 A Q G > S+ 0 0 77 66,-0.6 3,-1.6 -2,-0.5 -1,-0.1 0.801 91.1 66.8 -63.6 -30.0 -25.4 -3.3 13.9 31 37 A D G 3 S+ 0 0 132 1,-0.3 -1,-0.2 3,-0.0 22,-0.2 0.807 87.3 68.3 -61.3 -31.5 -27.5 -1.2 16.3 32 38 A D G < S+ 0 0 43 -3,-1.0 21,-1.2 1,-0.1 2,-0.4 0.468 98.7 58.4 -68.9 -1.4 -24.4 0.0 18.1 33 39 A Y E < -A 52 0A 28 -3,-1.6 2,-0.4 19,-0.2 19,-0.2 -0.963 64.1-162.9-138.6 121.6 -23.4 2.1 15.0 34 40 A E E -A 51 0A 119 17,-2.1 17,-1.9 -2,-0.4 2,-0.6 -0.837 19.6-132.9-102.4 137.8 -25.3 4.8 13.1 35 41 A V E +A 50 0A 77 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.780 28.6 172.3 -89.6 123.0 -24.3 5.8 9.6 36 42 A V E - 0 0 83 13,-2.2 2,-0.3 -2,-0.6 14,-0.2 0.918 55.3 -9.0 -98.3 -58.2 -24.1 9.6 9.3 37 43 A R E -A 49 0A 143 12,-1.8 12,-3.0 0, 0.0 2,-0.4 -0.998 66.4-107.5-149.7 144.3 -22.7 10.7 5.9 38 44 A K E +A 48 0A 99 -2,-0.3 10,-0.3 10,-0.2 12,-0.0 -0.554 44.3 148.7 -77.5 125.0 -21.1 9.0 2.9 39 45 A V + 0 0 67 8,-2.3 9,-0.3 -2,-0.4 -1,-0.2 0.222 63.3 91.8-123.5 -4.5 -17.3 9.5 2.4 40 46 A G - 0 0 10 7,-4.2 2,-0.3 1,-0.1 6,-0.2 0.920 59.8-141.7 -66.4-120.1 -17.4 6.0 0.8 41 47 A R - 0 0 64 2,-0.0 -1,-0.1 3,-0.0 -2,-0.0 -0.927 19.9 -95.9-172.7-160.2 -17.8 4.4 -2.6 42 48 A G S S+ 0 0 73 -2,-0.3 4,-0.1 4,-0.1 -2,-0.0 -0.357 79.7 78.9-165.8 68.1 -18.8 2.1 -5.4 43 49 A K S S- 0 0 137 2,-0.5 3,-0.1 24,-0.0 -2,-0.0 0.259 125.5 -25.8-131.8 -82.5 -16.1 -0.5 -6.4 44 50 A Y S S+ 0 0 129 1,-0.1 21,-0.8 23,-0.0 2,-0.3 0.273 130.7 17.1-116.7 3.4 -16.4 -3.3 -3.8 45 51 A S E - B 0 64A 9 19,-0.2 -2,-0.5 21,-0.1 2,-0.4 -0.996 56.9-124.3-168.2 170.9 -17.7 -0.9 -1.1 46 52 A E E - B 0 63A 48 17,-2.2 17,-3.2 -2,-0.3 2,-0.5 -0.993 27.0-157.4-123.7 128.2 -19.3 2.2 0.4 47 53 A V E + B 0 62A 28 -2,-0.4 -7,-4.2 15,-0.2 -8,-2.3 -0.912 16.3 176.0-112.9 132.4 -17.5 4.1 3.1 48 54 A F E -AB 38 61A 21 13,-3.1 13,-2.3 -2,-0.5 2,-0.5 -0.856 32.6-120.3-130.3 167.6 -19.3 6.3 5.6 49 55 A E E +AB 37 60A 26 -12,-3.0 -13,-2.2 -2,-0.3 -12,-1.8 -0.935 48.2 155.3-106.2 125.4 -18.7 8.4 8.6 50 56 A G E -AB 35 59A 0 9,-2.7 9,-2.1 -2,-0.5 2,-0.3 -0.682 33.4-117.3-135.8-168.3 -20.7 7.2 11.6 51 57 A I E -AB 34 58A 29 -17,-1.9 -17,-2.1 7,-0.3 2,-0.9 -0.964 21.0-118.8-137.9 154.3 -20.9 7.2 15.4 52 58 A N E >>> -AB 33 57A 25 5,-2.8 4,-2.4 -2,-0.3 3,-2.0 -0.842 23.5-153.0 -93.2 104.4 -20.8 4.5 18.1 53 59 A V T 345S+ 0 0 58 -21,-1.2 -20,-0.1 -2,-0.9 -1,-0.1 0.167 88.7 60.2 -68.2 21.7 -24.1 4.9 19.9 54 60 A N T 345S+ 0 0 115 -2,-0.4 -1,-0.3 -22,-0.3 -21,-0.1 0.471 126.8 8.7-121.9 -12.3 -22.7 3.6 23.1 55 61 A N T <45S- 0 0 84 -3,-2.0 -2,-0.2 2,-0.1 0, 0.0 0.280 95.9-119.7-147.9 1.3 -20.0 6.2 23.7 56 62 A N T <5 + 0 0 137 -4,-2.4 2,-0.2 1,-0.2 -3,-0.2 0.578 60.2 149.0 64.5 14.7 -20.7 8.8 21.0 57 63 A E E < -B 52 0A 134 -5,-0.5 -5,-2.8 1,-0.1 -1,-0.2 -0.556 47.7-117.6 -81.9 142.6 -17.4 8.4 19.2 58 64 A K E +B 51 0A 99 -7,-0.2 51,-0.6 -2,-0.2 2,-0.3 -0.338 40.6 168.3 -71.1 158.3 -17.0 8.9 15.5 59 65 A C E -BC 50 108A 2 -9,-2.1 -9,-2.7 49,-0.2 2,-0.5 -0.961 36.0-103.0-161.0 170.8 -15.9 5.9 13.4 60 66 A I E -BC 49 107A 21 47,-2.1 47,-2.7 -2,-0.3 2,-0.5 -0.932 28.4-160.6-108.6 128.7 -15.6 4.8 9.8 61 67 A I E -BC 48 106A 4 -13,-2.3 -13,-3.1 -2,-0.5 2,-0.6 -0.943 3.3-167.7-112.6 120.5 -18.2 2.3 8.5 62 68 A K E -BC 47 105A 11 43,-2.7 43,-3.1 -2,-0.5 2,-0.6 -0.929 4.8-162.2-110.5 113.1 -17.4 0.3 5.4 63 69 A I E -BC 46 104A 32 -17,-3.2 -17,-2.2 -2,-0.6 2,-0.7 -0.862 13.0-140.0 -99.9 120.3 -20.3 -1.5 3.8 64 70 A L E -B 45 0A 13 39,-0.8 -19,-0.2 -2,-0.6 3,-0.2 -0.714 24.1-176.8 -84.6 115.1 -19.4 -4.3 1.4 65 71 A K - 0 0 80 -21,-0.8 2,-3.5 -2,-0.7 -1,-0.1 0.204 62.8 -7.7 -87.3-154.0 -21.7 -4.4 -1.7 66 72 A P S S+ 0 0 130 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 -0.069 95.9 118.6 -43.6 66.6 -21.6 -7.0 -4.5 67 73 A V - 0 0 16 -2,-3.5 5,-0.2 -3,-0.2 -23,-0.0 -0.846 53.1-156.3-137.6 92.5 -18.4 -8.6 -3.2 68 74 A K > - 0 0 186 -2,-0.4 4,-0.9 3,-0.1 -1,-0.0 0.583 34.7 -56.4 -55.9-151.4 -19.3 -12.1 -2.3 69 75 A K H > S+ 0 0 167 2,-0.1 4,-1.7 1,-0.1 3,-0.4 0.969 112.4 52.5 -70.0 -66.6 -17.6 -14.5 0.2 70 76 A K H > S+ 0 0 116 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.867 111.3 48.0 -35.0 -63.1 -13.8 -15.2 -0.2 71 77 A K H > S+ 0 0 91 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.871 108.0 53.5 -49.1 -50.3 -12.7 -11.5 -0.3 72 78 A I H X S+ 0 0 23 -4,-0.9 4,-2.4 -3,-0.4 -1,-0.2 0.943 112.7 42.9 -54.7 -52.2 -14.7 -10.4 2.7 73 79 A K H X S+ 0 0 66 -4,-1.7 4,-3.0 1,-0.2 5,-0.3 0.929 112.6 55.9 -59.2 -44.6 -13.3 -13.1 5.0 74 80 A R H X S+ 0 0 22 -4,-2.5 4,-1.9 -5,-0.3 -2,-0.2 0.923 110.2 42.7 -53.3 -52.2 -9.8 -12.4 3.5 75 81 A E H X S+ 0 0 9 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.897 114.8 51.1 -64.2 -41.3 -9.9 -8.7 4.4 76 82 A I H X S+ 0 0 1 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.913 111.1 47.2 -62.5 -44.7 -11.4 -9.4 7.9 77 83 A K H X S+ 0 0 32 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.877 112.5 48.8 -66.1 -39.9 -8.7 -12.0 8.8 78 84 A I H X S+ 0 0 0 -4,-1.9 4,-1.3 -5,-0.3 -1,-0.2 0.897 112.3 49.4 -67.5 -38.6 -5.9 -9.8 7.6 79 85 A L H X S+ 0 0 2 -4,-2.2 4,-1.7 2,-0.2 12,-0.3 0.927 111.9 47.5 -66.3 -44.0 -7.3 -6.8 9.6 80 86 A Q H < S+ 0 0 84 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.884 110.7 52.3 -64.9 -38.3 -7.7 -8.9 12.8 81 87 A N H < S+ 0 0 28 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.792 117.3 38.6 -68.2 -26.6 -4.1 -10.3 12.4 82 88 A L H >< S+ 0 0 0 -4,-1.3 3,-2.6 -3,-0.2 -2,-0.2 0.596 80.7 127.1-100.0 -14.4 -2.7 -6.8 12.1 83 89 A C T 3< S+ 0 0 52 -4,-1.7 7,-0.1 1,-0.3 6,-0.1 -0.189 77.1 26.5 -49.0 125.7 -4.9 -4.9 14.6 84 90 A G T 3 S+ 0 0 58 1,-0.3 -1,-0.3 4,-0.3 3,-0.1 0.280 90.8 133.0 102.6 -9.6 -2.5 -3.1 17.0 85 91 A G S X S- 0 0 9 -3,-2.6 3,-1.6 1,-0.1 -1,-0.3 -0.320 72.5 -76.9 -73.7 157.9 0.3 -2.8 14.5 86 92 A P T 3 S- 0 0 61 0, 0.0 54,-0.2 0, 0.0 -1,-0.1 -0.363 110.7 -16.0 -57.0 115.2 2.2 0.5 14.0 87 93 A N T 3 S+ 0 0 21 -2,-0.3 80,-2.2 1,-0.2 2,-0.5 0.758 95.3 140.6 59.9 29.7 -0.0 2.8 11.8 88 94 A I B < -e 167 0B 5 -3,-1.6 -4,-0.3 78,-0.2 -1,-0.2 -0.886 63.7-103.5-100.5 131.3 -2.4 0.0 10.6 89 95 A V - 0 0 5 78,-1.7 2,-0.6 -2,-0.5 -4,-0.1 -0.257 41.0-121.6 -52.6 139.9 -6.0 1.1 10.5 90 96 A K - 0 0 81 -7,-0.1 18,-1.9 -6,-0.1 2,-0.8 -0.775 11.5-146.0 -96.5 117.3 -7.8 -0.4 13.5 91 97 A L E +D 107 0A 17 -2,-0.6 16,-0.3 -12,-0.3 3,-0.1 -0.686 20.0 178.9 -79.0 110.6 -10.8 -2.7 12.9 92 98 A L E - 0 0 81 14,-2.1 2,-0.3 -2,-0.8 15,-0.2 0.901 58.9 -16.5 -80.3 -44.6 -13.1 -1.9 15.9 93 99 A D E -D 106 0A 48 13,-1.3 13,-2.9 -65,-0.0 2,-0.4 -0.962 49.8-137.7-155.5 169.0 -16.0 -4.2 15.2 94 100 A I E +D 105 0A 9 -2,-0.3 -66,-3.1 -68,-0.3 2,-0.2 -0.950 33.8 165.2-137.3 113.1 -17.7 -6.3 12.4 95 101 A V E +D 104 0A 2 9,-2.2 9,-1.1 -2,-0.4 2,-0.3 -0.700 11.6 165.6-124.7 176.6 -21.4 -6.2 12.1 96 102 A R - 0 0 98 -68,-0.3 -66,-0.6 -2,-0.2 2,-0.4 -0.941 41.3 -75.5-170.1-178.8 -24.3 -7.1 9.8 97 103 A D - 0 0 52 -2,-0.3 5,-0.2 5,-0.2 -68,-0.0 -0.787 26.5-132.4-102.8 142.6 -28.0 -7.5 9.8 98 104 A Q S S+ 0 0 137 -2,-0.4 -1,-0.1 1,-0.1 4,-0.0 0.842 99.9 33.4 -52.8 -39.7 -29.9 -10.5 11.3 99 105 A H S S- 0 0 158 3,-0.1 -1,-0.1 -3,-0.0 -2,-0.0 0.958 120.2 -52.2 -92.9 -58.3 -32.1 -10.9 8.2 100 106 A S S S+ 0 0 76 2,-0.1 2,-3.6 1,-0.0 -3,-0.1 0.534 92.8 89.3-146.3 -66.2 -30.5 -10.1 4.9 101 107 A K S S- 0 0 173 1,-0.1 -3,-0.1 -5,-0.1 -1,-0.0 0.164 72.5-158.9 -42.2 21.4 -28.7 -7.1 3.6 102 108 A T + 0 0 81 -2,-3.6 -5,-0.2 -5,-0.2 -1,-0.1 0.400 34.3 39.5 37.3-160.2 -25.1 -8.5 4.8 103 109 A P + 0 0 13 0, 0.0 -39,-0.8 0, 0.0 2,-0.3 0.334 37.7 161.3 -26.8 138.1 -21.4 -7.0 5.6 104 110 A S E -CD 63 95A 10 -9,-1.1 -9,-2.2 -41,-0.2 2,-0.4 -0.859 19.7-154.6-161.4 119.6 -20.2 -3.8 7.4 105 111 A L E -CD 62 94A 4 -43,-3.1 -43,-2.7 -2,-0.3 2,-0.5 -0.819 9.3-148.6-102.2 135.8 -16.7 -3.2 8.9 106 112 A I E -CD 61 93A 0 -13,-2.9 -14,-2.1 -2,-0.4 -13,-1.3 -0.908 19.7-178.8-106.8 128.4 -16.2 -0.7 11.7 107 113 A F E -CD 60 91A 15 -47,-2.7 -47,-2.1 -2,-0.5 -16,-0.2 -0.844 36.9 -92.8-123.6 158.7 -12.9 1.2 12.0 108 114 A E E -C 59 0A 31 -18,-1.9 -49,-0.2 -2,-0.3 2,-0.1 -0.343 64.3 -88.0 -59.8 151.3 -11.4 3.8 14.3 109 115 A Y - 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0 0 3 -4,-1.9 4,-0.5 -5,-0.4 27,-0.2 0.068 10.9-103.0 91.7 153.3 16.0 2.7 -19.2 245 251 A T H > S+ 0 0 8 25,-2.5 4,-2.4 2,-0.2 5,-0.2 0.725 109.8 71.1 -86.4 -23.3 15.3 -0.4 -21.4 246 252 A D H > S+ 0 0 127 24,-0.6 4,-1.7 1,-0.2 -1,-0.2 0.931 101.7 46.0 -58.7 -44.2 18.7 -2.1 -20.7 247 253 A G H > S+ 0 0 31 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.797 109.5 55.5 -67.9 -28.8 17.6 -2.8 -17.2 248 254 A L H X S+ 0 0 2 -4,-0.5 4,-2.1 2,-0.2 -2,-0.2 0.917 107.0 49.5 -69.1 -42.3 14.3 -4.0 -18.4 249 255 A N H X S+ 0 0 65 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.864 109.3 51.9 -64.7 -36.8 15.9 -6.5 -20.7 250 256 A V H X S+ 0 0 95 -4,-1.7 4,-2.5 -5,-0.2 -1,-0.2 0.935 110.4 49.0 -64.2 -45.9 18.1 -7.8 -17.8 251 257 A Y H X S+ 0 0 3 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.870 111.8 47.9 -60.2 -43.0 15.1 -8.3 -15.6 252 258 A L H <>S+ 0 0 10 -4,-2.1 5,-2.5 2,-0.2 4,-0.3 0.918 112.5 49.1 -66.3 -43.5 13.1 -10.2 -18.3 253 259 A N H ><5S+ 0 0 126 -4,-2.3 3,-0.8 3,-0.2 -2,-0.2 0.908 109.8 52.3 -61.5 -44.1 16.1 -12.5 -19.1 254 260 A K H 3<5S+ 0 0 91 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.888 117.5 35.4 -62.2 -42.7 16.7 -13.3 -15.4 255 261 A Y T 3<5S- 0 0 22 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.300 112.8-117.5 -96.5 11.3 13.1 -14.4 -14.7 256 262 A R T < 5 + 0 0 207 -3,-0.8 2,-0.4 -4,-0.3 -3,-0.2 0.958 60.0 149.2 53.2 62.9 12.7 -15.9 -18.1 257 263 A I < - 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0 0 29 -4,-2.5 2,-0.4 -5,-0.2 -1,-0.2 -0.364 45.1 -43.7 69.6-143.1 11.1 0.3 -27.7 269 275 A R + 0 0 228 -4,-0.1 2,-0.3 -2,-0.1 -1,-0.0 -0.997 60.8 167.6-131.6 130.5 14.6 1.3 -26.6 270 276 A H - 0 0 63 -2,-0.4 -25,-2.5 -30,-0.1 -24,-0.6 -0.992 29.5-124.3-143.7 149.0 15.4 4.1 -24.2 271 277 A S - 0 0 107 -2,-0.3 -27,-0.4 -27,-0.2 2,-0.3 -0.570 42.5 -93.8 -89.1 155.9 18.4 5.3 -22.2 272 278 A R - 0 0 114 -29,-0.2 -29,-0.2 -2,-0.2 -30,-0.1 -0.548 35.6-144.1 -70.0 126.4 18.2 5.7 -18.4 273 279 A K - 0 0 77 -31,-2.7 -1,-0.1 -2,-0.3 -29,-0.0 -0.860 23.5-119.9 -96.4 112.2 17.2 9.3 -17.5 274 280 A P > - 0 0 57 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.144 18.3-118.4 -51.3 141.5 19.1 10.3 -14.4 275 281 A W G > S+ 0 0 12 1,-0.3 3,-1.5 2,-0.2 4,-0.2 0.750 107.4 71.5 -54.4 -27.8 17.0 11.3 -11.4 276 282 A L G > S+ 0 0 118 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.723 80.9 74.7 -65.0 -19.4 18.4 14.8 -11.3 277 283 A K G < S+ 0 0 136 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.629 90.4 55.9 -69.0 -14.2 16.5 15.7 -14.6 278 284 A F G < S+ 0 0 33 -3,-1.5 -1,-0.3 -4,-0.2 2,-0.2 0.439 86.1 105.2 -95.5 -2.5 13.1 15.8 -12.7 279 285 A M < + 0 0 90 -3,-1.4 2,-0.3 -4,-0.2 -58,-0.1 -0.564 42.7 153.1 -80.1 142.0 14.5 18.4 -10.3 280 286 A N >> - 0 0 76 -2,-0.2 4,-1.7 1,-0.0 3,-0.7 -0.934 60.4 -86.9-155.6 174.0 13.4 22.1 -10.8 281 287 A A T 34 S+ 0 0 86 -2,-0.3 4,-0.3 1,-0.2 -2,-0.0 0.742 121.8 61.7 -61.7 -22.9 12.9 25.3 -8.8 282 288 A D T 34 S+ 0 0 95 1,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.854 120.6 19.9 -73.0 -35.5 9.4 24.1 -7.9 283 289 A N T X> S+ 0 0 0 -3,-0.7 3,-2.8 -62,-0.1 4,-0.8 0.403 92.0 110.3-114.0 0.2 10.5 21.0 -6.0 284 290 A Q G >< S+ 0 0 115 -4,-1.7 3,-1.1 1,-0.3 -3,-0.1 0.831 72.7 58.8 -42.2 -48.9 14.1 21.9 -5.3 285 291 A H G 34 S+ 0 0 102 -4,-0.3 -1,-0.3 1,-0.3 -161,-0.1 0.610 107.6 48.9 -62.8 -10.6 13.6 22.3 -1.6 286 292 A L G <4 S+ 0 0 1 -3,-2.8 2,-0.3 -66,-0.3 -1,-0.3 0.608 96.5 83.8-102.8 -16.4 12.5 18.7 -1.4 287 293 A V << + 0 0 23 -3,-1.1 3,-0.1 -4,-0.8 -163,-0.0 -0.679 47.8 153.2 -94.2 143.5 15.4 17.1 -3.4 288 294 A S > - 0 0 18 -2,-0.3 4,-1.9 1,-0.1 5,-0.2 -0.933 56.9 -97.0-154.2 168.7 18.7 16.2 -1.9 289 295 A P H > S+ 0 0 105 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.935 124.5 47.8 -60.6 -43.6 21.5 13.7 -2.6 290 296 A E H > S+ 0 0 69 1,-0.2 4,-2.5 2,-0.2 27,-0.2 0.850 107.7 55.0 -66.8 -33.1 20.1 11.2 -0.1 291 297 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.903 110.6 46.0 -66.5 -38.8 16.5 11.6 -1.4 292 298 A I H X S+ 0 0 25 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.885 112.9 50.3 -68.4 -39.3 17.7 10.6 -4.9 293 299 A D H X S+ 0 0 63 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.920 111.7 47.4 -64.5 -46.2 19.8 7.7 -3.5 294 300 A F H >X S+ 0 0 0 -4,-2.5 3,-0.8 1,-0.2 4,-0.5 0.955 113.0 47.9 -60.1 -52.2 16.8 6.3 -1.5 295 301 A L H >X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.3 3,-1.3 0.888 108.0 56.7 -56.4 -40.9 14.5 6.6 -4.4 296 302 A D H 3< S+ 0 0 35 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.804 105.0 51.9 -61.3 -31.1 17.0 4.9 -6.7 297 303 A K H << S+ 0 0 67 -4,-1.3 10,-1.8 -3,-0.8 -1,-0.3 0.495 112.9 45.0 -85.8 -4.3 17.1 1.9 -4.3 298 304 A L H << S+ 0 0 0 -3,-1.3 2,-1.8 -4,-0.5 -2,-0.2 0.816 101.4 62.9-102.6 -45.7 13.3 1.5 -4.4 299 305 A L S < S+ 0 0 1 -4,-2.4 2,-0.4 -86,-0.1 -1,-0.2 -0.529 70.4 138.7 -86.3 73.2 12.5 1.9 -8.1 300 306 A R - 0 0 65 -2,-1.8 6,-0.2 -3,-0.2 5,-0.1 -0.937 54.8-137.1-115.6 138.3 14.4 -1.1 -9.4 301 307 A Y S S+ 0 0 15 -2,-0.4 2,-0.7 1,-0.1 -106,-0.2 0.973 92.8 71.9 -54.7 -55.0 13.0 -3.4 -12.1 302 308 A D S >> S- 0 0 8 1,-0.2 3,-2.2 -55,-0.1 4,-0.8 -0.499 73.2-155.7 -68.8 107.4 14.2 -6.5 -10.2 303 309 A H G >4 S+ 0 0 2 -2,-0.7 3,-0.8 1,-0.3 -1,-0.2 0.835 92.9 60.9 -53.0 -34.7 11.9 -6.8 -7.1 304 310 A Q G 34 S+ 0 0 65 1,-0.2 -1,-0.3 -301,-0.1 -2,-0.1 0.689 101.2 54.7 -67.2 -18.3 14.7 -8.8 -5.3 305 311 A E G <4 S+ 0 0 101 -3,-2.2 -1,-0.2 2,-0.1 -2,-0.2 0.667 85.8 101.9 -88.1 -20.8 17.0 -5.8 -5.6 306 312 A R S << S- 0 0 3 -4,-0.8 -8,-0.2 -3,-0.8 2,-0.1 -0.244 83.1 -99.6 -64.5 152.0 14.7 -3.3 -3.9 307 313 A L - 0 0 21 -10,-1.8 2,-0.1 -13,-0.2 -1,-0.1 -0.461 36.1-126.2 -69.1 146.9 15.2 -2.2 -0.3 308 314 A T > - 0 0 25 -2,-0.1 4,-2.0 1,-0.1 5,-0.1 -0.422 29.4-105.0 -84.4 169.4 12.9 -4.0 2.2 309 315 A A H > S+ 0 0 2 2,-0.2 4,-1.7 1,-0.2 -170,-0.1 0.918 121.4 52.2 -64.8 -41.9 10.9 -1.7 4.4 310 316 A L H > S+ 0 0 92 1,-0.2 4,-0.6 2,-0.2 3,-0.5 0.954 111.6 44.9 -58.2 -51.5 13.2 -2.5 7.4 311 317 A E H >4 S+ 0 0 101 1,-0.2 3,-1.0 2,-0.2 4,-0.3 0.842 106.7 61.8 -61.7 -33.9 16.4 -1.7 5.4 312 318 A A H >< S+ 0 0 0 -4,-2.0 3,-1.8 1,-0.2 -1,-0.2 0.900 94.7 62.5 -58.3 -41.9 14.7 1.4 4.1 313 319 A M H 3< S+ 0 0 27 -4,-1.7 -1,-0.2 -3,-0.5 -2,-0.2 0.741 100.6 52.2 -57.4 -27.2 14.3 2.7 7.7 314 320 A T T << S+ 0 0 84 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.450 78.7 119.9 -91.7 -0.6 18.1 2.9 8.2 315 321 A H S X S- 0 0 11 -3,-1.8 3,-2.1 -4,-0.3 4,-0.4 -0.356 77.0-116.5 -62.3 144.1 18.9 4.9 5.0 316 322 A P G > S+ 0 0 79 0, 0.0 3,-1.1 0, 0.0 4,-0.4 0.738 109.1 77.0 -53.5 -26.3 20.6 8.3 5.9 317 323 A Y G 3 S+ 0 0 0 1,-0.3 3,-0.2 -27,-0.2 4,-0.2 0.797 102.0 38.4 -55.7 -30.4 17.6 10.1 4.5 318 324 A F G X> S+ 0 0 0 -3,-2.1 4,-2.8 -6,-0.2 3,-0.6 0.454 80.9 110.3-100.2 -3.8 15.7 9.2 7.7 319 325 A Q H <> S+ 0 0 60 -3,-1.1 4,-2.4 -4,-0.4 -1,-0.1 0.825 82.4 47.5 -42.8 -40.1 18.6 9.7 10.2 320 326 A Q H 3> S+ 0 0 32 -4,-0.4 4,-2.0 -3,-0.2 -1,-0.3 0.917 111.7 48.1 -70.8 -41.9 16.9 12.9 11.6 321 327 A V H <> S+ 0 0 2 -3,-0.6 4,-1.0 1,-0.2 -2,-0.2 0.929 113.8 50.4 -61.7 -42.3 13.5 11.2 11.9 322 328 A R H < S+ 0 0 67 -4,-2.8 3,-0.5 1,-0.2 -2,-0.2 0.914 108.5 49.9 -62.0 -47.8 15.2 8.3 13.6 323 329 A A H >< S+ 0 0 15 -4,-2.4 3,-2.7 -5,-0.3 -1,-0.2 0.933 105.0 55.7 -59.7 -49.3 17.2 10.4 16.1 324 330 A A H 3< S+ 0 0 2 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.806 97.7 67.1 -53.6 -29.7 14.2 12.4 17.3 325 331 A E T 3< S+ 0 0 53 -4,-1.0 2,-0.9 -3,-0.5 -1,-0.3 0.436 78.1 97.4 -72.7 -0.4 12.6 9.1 18.1 326 332 A N < 0 0 118 -3,-2.7 328,-0.1 1,-0.1 -1,-0.1 -0.799 360.0 360.0 -96.8 101.3 15.2 8.5 20.8 327 333 A S 0 0 124 -2,-0.9 326,-0.1 326,-0.2 -3,-0.1 -0.345 360.0 360.0 69.0 360.0 13.6 9.5 24.2 328 !* 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 0.0 329 7 B S 0 0 43 0, 0.0 178,-0.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 133.9 6.7 36.9 46.5 330 8 B K - 0 0 132 176,-0.1 202,-0.1 177,-0.1 5,-0.1 -0.969 360.0 -93.5-133.9 148.5 6.9 33.1 46.5 331 9 B A - 0 0 9 -2,-0.3 4,-0.2 1,-0.1 301,-0.1 -0.306 23.6-143.0 -58.9 136.8 7.3 30.5 43.7 332 10 B R S S+ 0 0 121 2,-0.1 2,-0.3 3,-0.1 -1,-0.1 0.804 85.7 32.2 -70.2 -31.7 4.0 29.0 42.4 333 11 B V S S+ 0 0 45 1,-0.1 200,-0.2 2,-0.1 -1,-0.1 -0.895 120.8 8.6-128.0 159.0 5.7 25.7 42.1 334 12 B Y S S+ 0 0 68 -2,-0.3 3,-0.5 1,-0.1 4,-0.3 0.775 73.3 147.5 45.0 37.8 8.5 23.7 43.8 335 13 B A S S+ 0 0 22 -4,-0.2 3,-0.2 1,-0.2 4,-0.2 0.890 70.7 35.8 -67.1 -42.0 8.6 26.2 46.6 336 14 B D S > S+ 0 0 111 1,-0.2 4,-2.2 2,-0.1 3,-0.3 0.325 82.3 110.7 -97.7 8.2 9.5 23.8 49.4 337 15 B V H > S+ 0 0 23 -3,-0.5 4,-1.0 1,-0.3 3,-0.4 0.931 83.4 41.5 -47.3 -59.9 11.8 21.4 47.4 338 16 B N H 4 S+ 0 0 0 166,-0.4 -1,-0.3 -4,-0.3 8,-0.2 0.802 112.2 57.4 -61.8 -27.3 15.0 22.4 49.2 339 17 B V H 4 S+ 0 0 103 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.901 107.2 46.3 -70.5 -39.6 13.3 22.5 52.5 340 18 B L H < S+ 0 0 158 -4,-2.2 -1,-0.2 -3,-0.4 -2,-0.2 0.633 101.8 80.4 -78.2 -15.2 12.1 18.9 52.4 341 19 B R S < S- 0 0 76 -4,-1.0 5,-0.1 -5,-0.2 0, 0.0 -0.555 94.2 -82.9 -93.1 159.7 15.5 17.5 51.2 342 20 B P >> - 0 0 92 0, 0.0 3,-1.1 0, 0.0 4,-0.7 -0.109 40.1-111.9 -55.1 155.2 18.5 16.8 53.4 343 21 B K H >> S+ 0 0 138 1,-0.3 4,-1.4 2,-0.2 3,-0.7 0.911 114.7 56.7 -56.6 -48.4 20.9 19.6 54.4 344 22 B E H 34 S+ 0 0 145 1,-0.2 -1,-0.3 2,-0.2 6,-0.0 0.685 92.2 74.8 -61.0 -17.2 23.8 18.3 52.3 345 23 B Y H <4 S+ 0 0 27 -3,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.948 114.5 17.1 -60.8 -51.4 21.6 18.3 49.2 346 24 B W H << S+ 0 0 70 -3,-0.7 2,-2.1 -4,-0.7 3,-0.3 0.463 100.3 102.2 -99.9 -5.1 21.7 22.1 48.8 347 25 B D < + 0 0 28 -4,-1.4 -1,-0.1 1,-0.2 -4,-0.0 -0.502 36.3 158.0 -80.5 73.8 24.7 22.7 51.0 348 26 B Y S > S+ 0 0 22 -2,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.841 73.0 58.5 -66.1 -32.3 27.2 23.2 48.2 349 27 B E T 3 S+ 0 0 105 1,-0.3 2,-0.8 -3,-0.3 -1,-0.2 0.919 100.9 56.4 -61.5 -43.1 29.4 25.0 50.6 350 28 B A T 3 S+ 0 0 69 2,-0.1 2,-0.4 51,-0.0 -1,-0.3 -0.132 92.0 106.5 -82.1 40.0 29.5 21.9 52.9 351 29 B L < - 0 0 24 -3,-1.0 2,-0.6 -2,-0.8 50,-0.0 -0.946 58.3-150.9-123.6 143.5 30.8 19.9 50.0 352 30 B T - 0 0 119 -2,-0.4 -2,-0.1 49,-0.0 -3,-0.0 -0.944 33.1-114.6-115.1 111.8 34.2 18.4 49.3 353 31 B V - 0 0 9 -2,-0.6 2,-1.4 1,-0.1 48,-0.0 -0.184 19.8-143.5 -47.7 118.1 35.0 18.1 45.6 354 32 B Q - 0 0 142 1,-0.0 68,-0.3 69,-0.0 -1,-0.1 -0.679 31.2-164.0 -88.4 85.7 35.4 14.4 44.8 355 33 B W - 0 0 73 -2,-1.4 68,-0.2 1,-0.1 2,-0.2 0.189 14.2-163.2 -63.8-178.9 38.2 14.6 42.2 356 34 B G - 0 0 19 66,-1.1 2,-0.6 65,-0.0 68,-0.3 -0.623 40.9 -61.5-144.2-158.0 39.5 12.3 39.6 357 35 B E > - 0 0 129 -2,-0.2 3,-1.7 1,-0.1 4,-0.2 -0.888 28.0-159.4-108.7 118.9 42.7 12.0 37.6 358 36 B Q G > S+ 0 0 57 -2,-0.6 3,-1.5 66,-0.3 -1,-0.1 0.758 89.0 71.9 -61.5 -25.9 43.6 14.8 35.2 359 37 B D G 3 S+ 0 0 138 1,-0.3 -1,-0.3 3,-0.1 22,-0.2 0.658 85.8 68.1 -65.6 -15.0 45.9 12.5 33.2 360 38 B D G < S+ 0 0 43 -3,-1.7 21,-1.6 1,-0.1 22,-0.5 0.689 99.3 52.8 -78.5 -17.7 42.8 10.7 31.9 361 39 B Y E < -H 380 0D 33 -3,-1.5 2,-0.5 -4,-0.2 19,-0.2 -0.967 66.3-164.1-125.9 132.0 41.8 13.7 29.8 362 40 B E E -H 379 0D 117 17,-2.2 17,-1.4 -2,-0.4 2,-0.1 -0.950 21.3-125.4-121.0 128.2 43.8 15.7 27.2 363 41 B V E +H 378 0D 75 -2,-0.5 15,-0.2 15,-0.2 3,-0.1 -0.387 31.0 170.9 -63.2 137.0 43.0 19.1 25.8 364 42 B V E - 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0 0 27 -37,-0.3 3,-2.1 1,-0.1 4,-0.4 -0.786 51.4-108.0-100.4 146.5 22.6 38.0 29.7 517 195 B R G > S+ 0 0 94 -2,-0.3 3,-1.4 1,-0.3 -1,-0.1 0.825 116.4 50.9 -40.0 -51.8 21.2 41.5 29.1 518 196 B Y G 3 S+ 0 0 56 1,-0.3 37,-0.3 39,-0.1 -1,-0.3 0.680 115.3 43.9 -67.0 -16.2 18.8 40.6 26.3 519 197 B F G < S+ 0 0 18 -3,-2.1 2,-0.3 35,-0.1 -1,-0.3 0.226 81.3 124.3-114.1 13.1 17.3 37.7 28.4 520 198 B K < - 0 0 19 -3,-1.4 -5,-0.1 -4,-0.4 -7,-0.0 -0.587 58.6-129.5 -75.4 129.0 17.0 39.5 31.8 521 199 B G >> - 0 0 0 -2,-0.3 4,-1.1 1,-0.1 3,-1.0 -0.285 26.0-103.8 -73.0 164.0 13.4 39.4 33.1 522 200 B P H 3> S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 3,-0.3 0.840 118.4 65.5 -56.1 -33.4 11.7 42.6 34.3 523 201 B E H 34>S+ 0 0 0 1,-0.3 5,-3.6 106,-0.2 4,-0.1 0.846 102.9 45.6 -58.4 -36.9 12.3 41.6 37.9 524 202 B L H <45S+ 0 0 6 -3,-1.0 3,-0.3 3,-0.2 -1,-0.3 0.756 111.7 53.1 -78.3 -24.2 16.1 41.9 37.5 525 203 B L H <5S+ 0 0 17 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.767 116.4 36.4 -83.6 -24.8 15.7 45.2 35.7 526 204 B V T <5S- 0 0 11 -4,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.185 116.4-109.3-108.9 13.6 13.6 46.8 38.5 527 205 B D T 5 + 0 0 97 -3,-0.3 2,-1.2 1,-0.2 -3,-0.2 0.846 56.1 162.2 64.4 37.2 15.5 45.1 41.3 528 206 B L < - 0 0 5 -5,-3.6 -1,-0.2 -6,-0.2 3,-0.2 -0.796 14.0-179.8 -88.5 100.1 12.7 42.7 42.4 529 207 B Q + 0 0 74 -2,-1.2 -19,-2.3 1,-0.2 2,-1.6 0.736 60.7 72.7 -78.2 -29.1 15.1 40.4 44.3 530 208 B D S S+ 0 0 46 -21,-0.2 -1,-0.2 -3,-0.1 -23,-0.1 -0.396 72.3 141.3 -87.3 61.4 12.9 37.7 45.7 531 209 B Y - 0 0 0 -2,-1.6 2,-0.2 -3,-0.2 -200,-0.1 -0.296 28.2-169.4 -92.1 179.9 12.4 36.1 42.3 532 210 B D > - 0 0 7 -202,-0.1 3,-2.5 -2,-0.1 4,-0.3 -0.661 47.3 -42.5-148.2-156.6 12.2 32.4 41.4 533 211 B Y T >> S+ 0 0 4 1,-0.3 3,-1.9 -200,-0.2 4,-0.6 0.807 117.0 75.9 -51.2 -32.6 12.1 29.7 38.7 534 212 B S H >> S+ 0 0 16 1,-0.3 4,-1.0 2,-0.2 3,-0.5 0.697 78.4 74.0 -56.3 -19.2 9.8 31.8 36.7 535 213 B L H X> S+ 0 0 1 -3,-2.5 4,-1.5 1,-0.2 3,-0.6 0.896 92.9 53.7 -61.1 -39.4 12.9 34.0 35.8 536 214 B D H <> S+ 0 0 0 -3,-1.9 4,-1.9 -4,-0.3 -1,-0.2 0.757 102.4 58.2 -66.9 -24.9 14.0 31.2 33.5 537 215 B M H S+ 0 0 8 -4,-2.1 5,-1.4 -5,-0.2 4,-0.5 0.879 112.6 44.6 -63.5 -40.0 13.4 35.5 18.7 547 225 B M H ><5S+ 0 0 10 -4,-2.2 3,-0.7 3,-0.2 -2,-0.2 0.969 116.5 41.8 -72.0 -53.4 13.1 32.2 16.9 548 226 B I H 3<5S+ 0 0 0 -4,-2.8 66,-0.3 1,-0.2 -2,-0.2 0.771 122.2 40.0 -68.4 -24.9 9.5 32.5 15.6 549 227 B F H 3<5S- 0 0 6 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.441 103.3-127.5-101.2 0.1 9.9 36.2 14.5 550 228 B R T <<5 + 0 0 58 -3,-0.7 2,-0.4 -4,-0.5 -3,-0.2 0.900 68.5 129.9 54.7 43.8 13.4 35.8 13.2 551 229 B K < - 0 0 88 -5,-1.4 -1,-0.2 -6,-0.3 -2,-0.1 -0.754 48.8-154.3-129.3 81.5 14.6 38.7 15.3 552 230 B E S S+ 0 0 139 -2,-0.4 2,-1.1 1,-0.2 -1,-0.3 0.780 86.8 29.4 -24.1 -99.4 17.7 37.4 17.1 553 231 B P S S- 0 0 39 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 -0.595 78.4-169.4 -71.0 112.3 17.9 39.5 20.2 554 232 B F S S+ 0 0 10 -2,-1.1 2,-0.8 1,-0.3 -2,-0.1 0.952 83.9 37.3 -62.4 -47.0 14.1 40.0 20.4 555 233 B F S S- 0 0 4 -37,-0.3 2,-1.0 -3,-0.2 -1,-0.3 -0.862 80.6-175.4-107.0 95.9 14.7 42.6 23.1 556 234 B Y + 0 0 122 -2,-0.8 2,-0.2 -3,-0.3 -38,-0.0 -0.715 10.3 169.9 -98.5 87.2 17.9 44.4 22.1 557 235 B G - 0 0 0 -2,-1.0 6,-0.1 1,-0.1 3,-0.1 -0.610 34.4-142.4 -94.3 157.0 18.8 46.9 24.8 558 236 B H S S- 0 0 125 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.675 82.7 -8.0 -90.4 -20.4 22.1 48.9 25.0 559 237 B D S > S- 0 0 80 -42,-0.1 4,-1.7 1,-0.0 -1,-0.2 -0.922 89.8 -77.2-159.9 178.6 22.3 48.6 28.7 560 238 B N H > S+ 0 0 50 -2,-0.3 4,-1.1 1,-0.2 -1,-0.0 0.857 127.5 44.7 -56.4 -40.2 20.2 47.5 31.7 561 239 B H H > S+ 0 0 72 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.899 113.5 49.2 -71.0 -42.4 18.0 50.6 31.8 562 240 B D H > S+ 0 0 31 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.743 101.9 65.5 -68.2 -24.4 17.5 50.6 28.0 563 241 B Q H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.937 102.5 46.7 -63.5 -45.3 16.6 46.9 28.2 564 242 B L H X S+ 0 0 0 -4,-1.1 4,-2.8 -3,-0.2 -1,-0.2 0.875 109.3 54.7 -65.1 -37.4 13.5 47.8 30.3 565 243 B V H X S+ 0 0 7 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.967 107.7 49.6 -59.4 -51.4 12.6 50.5 27.8 566 244 B K H < S+ 0 0 50 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.874 111.1 49.6 -56.1 -40.3 12.7 48.1 24.9 567 245 B I H >X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 3,-1.9 0.963 109.0 52.1 -64.4 -48.9 10.5 45.7 26.9 568 246 B A H 3X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.3 -2,-0.2 0.811 99.1 64.4 -57.6 -32.4 8.0 48.4 27.7 569 247 B K H 3< S+ 0 0 89 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.657 114.3 32.1 -67.1 -15.3 7.7 49.4 24.0 570 248 B V H <4 S+ 0 0 13 -3,-1.9 31,-2.6 -4,-0.4 -2,-0.2 0.818 126.1 36.1-105.3 -53.9 6.2 46.0 23.2 571 249 B L H < S- 0 0 6 -4,-2.3 4,-0.3 29,-0.2 29,-0.2 0.698 111.4-119.4 -75.4 -18.8 4.2 44.9 26.3 572 250 B G X - 0 0 3 -4,-1.8 4,-0.6 -5,-0.4 27,-0.2 0.057 11.2-101.2 94.3 152.4 3.1 48.5 27.0 573 251 B T H > S+ 0 0 7 25,-2.5 4,-2.5 1,-0.2 5,-0.2 0.731 111.2 69.2 -83.5 -23.3 3.6 50.7 30.0 574 252 B D H > S+ 0 0 126 24,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.878 101.9 47.1 -61.9 -37.8 0.2 50.2 31.6 575 253 B G H > S+ 0 0 31 -4,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.825 110.0 54.7 -72.3 -31.1 1.2 46.6 32.4 576 254 B L H X S+ 0 0 2 -4,-0.6 4,-3.3 2,-0.2 5,-0.2 0.938 109.4 45.5 -65.5 -48.6 4.5 47.9 33.8 577 255 B N H X S+ 0 0 76 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.873 111.8 50.9 -64.3 -40.2 2.8 50.3 36.2 578 256 B V H X S+ 0 0 105 -4,-1.8 4,-2.6 -5,-0.2 -1,-0.2 0.923 114.6 46.6 -62.2 -42.7 0.3 47.8 37.4 579 257 B Y H X S+ 0 0 5 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.937 113.8 44.9 -64.4 -51.0 3.2 45.4 38.0 580 258 B L H <>S+ 0 0 12 -4,-3.3 5,-3.4 1,-0.2 -1,-0.2 0.861 114.5 52.0 -62.1 -34.8 5.4 48.0 39.8 581 259 B N H ><5S+ 0 0 127 -4,-2.6 3,-1.4 -5,-0.2 -2,-0.2 0.918 107.0 51.9 -67.6 -45.1 2.3 49.0 41.8 582 260 B K H 3<5S+ 0 0 97 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.948 116.0 39.6 -56.4 -51.4 1.5 45.4 42.8 583 261 B Y T 3<5S- 0 0 40 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.178 111.5-119.7 -87.4 18.7 5.1 44.9 44.1 584 262 B R T < 5 + 0 0 231 -3,-1.4 2,-0.4 1,-0.2 -3,-0.2 0.880 59.1 155.4 46.1 49.5 5.3 48.4 45.6 585 263 B I < - 0 0 37 -5,-3.4 2,-0.5 -6,-0.1 -1,-0.2 -0.873 30.2-163.4-110.8 140.1 8.2 49.4 43.5 586 264 B E - 0 0 189 -2,-0.4 -5,-0.0 -60,-0.1 6,-0.0 -0.968 17.0-137.9-124.0 116.8 9.2 52.9 42.5 587 265 B L - 0 0 23 -2,-0.5 -61,-0.1 1,-0.1 0, 0.0 -0.239 35.3 -88.5 -67.6 158.2 11.6 53.3 39.6 588 266 B D >> - 0 0 81 1,-0.1 4,-2.3 2,-0.0 3,-2.1 -0.536 41.8-119.5 -66.7 127.8 14.5 55.9 39.7 589 267 B P H 3> S+ 0 0 103 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.741 114.2 52.8 -41.0 -33.1 12.9 59.1 38.4 590 268 B Q H 3> S+ 0 0 106 2,-0.2 4,-1.2 1,-0.2 -2,-0.0 0.812 111.4 45.8 -76.7 -29.6 15.5 59.2 35.5 591 269 B L H <> S+ 0 0 7 -3,-2.1 4,-2.3 2,-0.2 5,-0.2 0.866 109.4 54.3 -78.6 -38.5 14.5 55.6 34.5 592 270 B E H X S+ 0 0 120 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.928 111.4 45.1 -60.4 -45.2 10.8 56.3 34.7 593 271 B A H < S+ 0 0 76 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.866 111.2 54.1 -65.7 -36.7 11.2 59.3 32.4 594 272 B L H < S+ 0 0 93 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.854 110.7 45.7 -66.0 -36.5 13.4 57.1 30.1 595 273 B V H < S+ 0 0 2 -4,-2.3 -2,-0.2 1,-0.1 -1,-0.2 0.876 89.5 168.4 -74.6 -39.3 10.7 54.4 29.9 596 274 B G < - 0 0 31 -4,-2.3 2,-0.4 -5,-0.2 -1,-0.1 -0.281 44.3 -45.7 64.8-146.3 8.0 57.0 29.3 597 275 B R + 0 0 230 -4,-0.1 2,-0.3 -25,-0.0 -1,-0.0 -0.990 60.5 167.3-128.4 133.8 4.5 55.9 28.2 598 276 B H - 0 0 69 -2,-0.4 -25,-2.5 -30,-0.1 -24,-0.6 -0.998 30.0-121.2-148.5 149.4 3.7 53.3 25.4 599 277 B S - 0 0 108 -2,-0.3 -27,-0.3 -27,-0.2 2,-0.3 -0.545 42.5 -94.5 -86.8 153.5 0.8 51.3 24.1 600 278 B R - 0 0 117 -29,-0.2 -29,-0.2 -2,-0.2 -30,-0.1 -0.512 35.6-143.6 -68.0 127.2 0.9 47.5 24.0 601 279 B K - 0 0 79 -31,-2.6 -1,-0.1 -2,-0.3 -29,-0.0 -0.853 22.6-121.4 -96.2 111.0 2.0 46.4 20.5 602 280 B P > - 0 0 60 0, 0.0 3,-1.8 0, 0.0 4,-0.2 -0.163 16.8-120.8 -51.7 140.2 0.1 43.3 19.5 603 281 B W G > S+ 0 0 11 1,-0.3 3,-2.0 2,-0.2 4,-0.3 0.781 106.9 70.0 -54.7 -32.0 2.3 40.2 18.7 604 282 B L G > S+ 0 0 126 1,-0.3 3,-2.1 2,-0.2 -1,-0.3 0.813 82.9 74.2 -57.8 -29.2 0.9 39.9 15.2 605 283 B K G < S+ 0 0 145 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.590 88.5 59.5 -62.6 -10.3 2.8 43.1 14.3 606 284 B F G < S+ 0 0 34 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.576 83.7 103.9 -93.9 -8.2 6.1 41.2 14.3 607 285 B M < + 0 0 102 -3,-2.1 2,-0.3 -4,-0.3 -58,-0.1 -0.452 43.2 151.1 -74.3 143.8 4.9 38.8 11.6 608 286 B N > - 0 0 79 -2,-0.1 4,-1.6 1,-0.0 3,-0.1 -0.879 60.4 -78.2-155.5-176.1 6.2 39.3 8.1 609 287 B A T 4 S+ 0 0 90 -2,-0.3 4,-0.3 1,-0.2 -2,-0.0 0.826 124.0 53.0 -62.8 -34.2 7.0 37.4 4.9 610 288 B D T 4 S+ 0 0 100 1,-0.2 -1,-0.2 2,-0.1 3,-0.2 0.863 121.3 26.3 -71.7 -39.7 10.3 36.1 6.3 611 289 B N T >> S+ 0 0 0 -62,-0.1 3,-2.6 -5,-0.1 4,-0.7 0.484 89.9 105.6-104.4 -4.2 9.0 34.6 9.5 612 290 B Q G >< S+ 0 0 111 -4,-1.6 3,-1.0 1,-0.3 -1,-0.1 0.800 74.0 58.4 -44.3 -44.9 5.4 33.9 8.4 613 291 B H G 34 S+ 0 0 86 -4,-0.3 -1,-0.3 1,-0.2 -161,-0.2 0.619 107.1 50.1 -66.4 -10.9 5.9 30.1 8.1 614 292 B L G <4 S+ 0 0 0 -3,-2.6 2,-0.3 -66,-0.3 -1,-0.2 0.575 96.5 85.3-101.1 -13.8 6.9 30.0 11.8 615 293 B V << + 0 0 26 -3,-1.0 3,-0.1 -4,-0.7 -163,-0.0 -0.689 46.3 152.3 -96.0 143.4 3.9 32.0 13.2 616 294 B S > - 0 0 19 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.934 56.7 -97.9-154.6 168.8 0.5 30.5 14.1 617 295 B P H > S+ 0 0 104 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.905 123.7 48.7 -61.9 -41.2 -2.3 31.4 16.5 618 296 B E H > S+ 0 0 63 2,-0.2 4,-2.7 1,-0.2 27,-0.2 0.885 107.5 53.8 -68.4 -36.9 -1.0 28.9 19.0 619 297 B A H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.925 111.2 47.0 -61.8 -43.0 2.6 30.2 18.8 620 298 B I H X S+ 0 0 23 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.915 112.5 49.0 -63.5 -44.9 1.4 33.7 19.6 621 299 B D H X S+ 0 0 61 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.918 112.0 48.9 -61.6 -44.5 -0.8 32.5 22.5 622 300 B F H >< S+ 0 0 0 -4,-2.7 3,-1.1 1,-0.2 4,-0.4 0.964 112.2 47.6 -59.6 -54.1 2.1 30.5 24.0 623 301 B L H >X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.3 3,-1.7 0.883 107.4 57.7 -53.5 -43.2 4.5 33.4 23.7 624 302 B D H 3< S+ 0 0 35 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.777 104.4 51.7 -60.6 -29.8 1.9 35.7 25.3 625 303 B K T << S+ 0 0 67 -4,-1.2 10,-1.9 -3,-1.1 -1,-0.3 0.437 112.2 46.8 -88.4 -0.2 1.7 33.5 28.3 626 304 B L T <4 S+ 0 0 0 -3,-1.7 2,-1.8 -4,-0.4 -2,-0.2 0.802 100.7 61.7-103.7 -47.3 5.5 33.6 28.8 627 305 B L S < S+ 0 0 0 -4,-2.3 2,-0.4 -86,-0.1 -1,-0.2 -0.502 70.3 141.0 -86.0 73.3 6.4 37.3 28.4 628 306 B R - 0 0 63 -2,-1.8 6,-0.2 -3,-0.2 5,-0.1 -0.928 53.6-137.7-114.1 135.5 4.4 38.7 31.3 629 307 B Y S S+ 0 0 15 -2,-0.4 2,-0.6 1,-0.1 -106,-0.2 0.972 93.8 69.8 -52.0 -55.5 5.8 41.5 33.5 630 308 B D S >> S- 0 0 8 1,-0.2 3,-2.0 -3,-0.1 4,-0.6 -0.524 74.2-155.1 -69.8 110.0 4.5 39.7 36.6 631 309 B H G >4 S+ 0 0 2 -2,-0.6 3,-0.7 1,-0.3 -1,-0.2 0.806 92.5 63.5 -56.4 -29.7 6.6 36.6 37.1 632 310 B Q G 34 S+ 0 0 66 1,-0.2 -1,-0.3 -301,-0.1 -2,-0.1 0.686 100.3 54.1 -69.1 -17.0 3.7 35.0 39.0 633 311 B E G <4 S+ 0 0 107 -3,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.634 84.6 101.9 -90.8 -17.9 1.6 35.1 35.9 634 312 B R S << S- 0 0 3 -3,-0.7 -8,-0.2 -4,-0.6 -9,-0.1 -0.345 83.1 -99.2 -69.3 149.4 4.0 33.3 33.5 635 313 B L - 0 0 29 -10,-1.9 -1,-0.1 -13,-0.2 -2,-0.1 -0.389 37.6-123.0 -64.9 142.9 3.4 29.6 32.6 636 314 B T > - 0 0 16 1,-0.1 4,-1.9 -3,-0.1 5,-0.1 -0.306 29.4-104.4 -76.9 173.5 5.5 27.2 34.6 637 315 B A H > S+ 0 0 1 2,-0.2 4,-1.3 1,-0.2 -170,-0.1 0.939 122.4 49.2 -67.4 -42.8 7.7 24.9 32.6 638 316 B L H > S+ 0 0 90 1,-0.2 4,-0.5 2,-0.2 3,-0.4 0.924 111.0 48.1 -60.8 -48.0 5.3 22.0 33.3 639 317 B E H >4 S+ 0 0 71 1,-0.2 3,-1.5 2,-0.2 4,-0.3 0.895 106.3 59.6 -59.2 -42.6 2.2 23.9 32.3 640 318 B A H >< S+ 0 0 0 -4,-1.9 3,-1.7 1,-0.3 -1,-0.2 0.843 94.1 64.8 -54.5 -38.3 3.9 25.1 29.1 641 319 B M H 3< S+ 0 0 28 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.728 100.6 50.7 -62.0 -22.5 4.4 21.5 28.0 642 320 B T T << S+ 0 0 86 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.397 79.7 121.1 -97.6 4.0 0.6 20.9 27.7 643 321 B H S X S- 0 0 14 -3,-1.7 3,-2.0 -4,-0.3 4,-0.1 -0.404 77.0-115.3 -65.2 144.2 -0.0 24.0 25.6 644 322 B P G > S+ 0 0 71 0, 0.0 3,-2.1 0, 0.0 4,-0.3 0.738 109.3 75.3 -50.9 -28.9 -1.6 23.2 22.2 645 323 B Y G 3 S+ 0 0 0 1,-0.3 3,-0.3 -27,-0.2 4,-0.2 0.795 99.7 42.5 -56.2 -31.2 1.5 24.5 20.4 646 324 B F G <> S+ 0 0 2 -3,-2.0 4,-1.2 -6,-0.2 -1,-0.3 0.201 81.2 113.9-100.8 14.4 3.4 21.3 21.4 647 325 B Q T <4 S+ 0 0 80 -3,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.885 77.6 44.4 -54.4 -46.2 0.5 18.9 20.6 648 326 B Q T > S+ 0 0 34 -4,-0.3 4,-0.9 -3,-0.3 -1,-0.2 0.964 111.2 54.5 -62.4 -54.4 2.2 17.1 17.7 649 327 B V H > S+ 0 0 0 -4,-0.2 4,-0.9 1,-0.2 3,-0.2 0.918 87.4 73.9 -40.9 -77.7 5.6 16.7 19.5 650 328 B R H >< S+ 0 0 146 -4,-1.2 3,-0.6 1,-0.2 -1,-0.2 0.631 110.7 16.8 -11.1 -85.9 4.9 14.9 22.8 651 329 B A H >> S+ 0 0 62 -4,-0.4 3,-1.0 1,-0.2 4,-0.6 0.899 104.8 83.8 -69.7 -40.6 4.1 11.3 21.9 652 330 B A H 3< S+ 0 0 22 -4,-0.9 2,-0.5 1,-0.3 -1,-0.2 0.718 84.6 61.7 -32.4 -38.9 5.5 11.2 18.3 653 331 B E T << S+ 0 0 8 -4,-0.9 -1,-0.3 -3,-0.6 -326,-0.2 -0.097 122.4 8.5 -89.2 41.3 9.0 10.5 19.7 654 332 B N T <4 0 0 135 -3,-1.0 -2,-0.1 -2,-0.5 -3,-0.1 -0.079 360.0 360.0-168.7 -82.0 8.1 7.2 21.4 655 333 B S < 0 0 135 -4,-0.6 -3,-0.1 -569,-0.0 -4,-0.1 0.875 360.0 360.0-100.9 360.0 4.8 5.5 20.8