==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-APR-13 4KGM . COMPND 2 MOLECULE: THG1-LIKE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS THURINGIENSIS; . AUTHOR S.J.HYDE,B.S.RAO,B.E.ECKENROTH,J.E.JACKMAN,S.DOUBLIE . 911 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41459.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 640 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 146 16.0 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 . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 45 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 117 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 329 36.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 4 1 1 0 0 6 0 1 0 0 0 0 4 0 0 0 1 3 4 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 4 0 4 1 0 9 5 0 1 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 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 3 A S > 0 0 104 0, 0.0 4,-1.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-167.3 94.7 106.5 47.0 2 4 A I H > + 0 0 39 2,-0.2 4,-2.8 1,-0.1 5,-0.2 0.855 360.0 53.4 -79.7 -37.0 91.6 104.3 46.4 3 5 A G H > S+ 0 0 15 2,-0.2 4,-2.3 1,-0.2 -1,-0.1 0.854 107.3 51.4 -66.2 -36.5 91.8 102.7 49.9 4 6 A D H > S+ 0 0 97 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.907 112.1 46.8 -64.7 -42.8 91.9 106.1 51.5 5 7 A R H X S+ 0 0 72 -4,-1.1 4,-1.3 1,-0.2 3,-0.3 0.910 113.9 47.9 -65.1 -42.9 88.8 107.0 49.5 6 8 A M H X S+ 0 0 1 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.846 105.9 58.7 -66.8 -35.0 87.1 103.7 50.4 7 9 A K H X S+ 0 0 37 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.836 104.8 51.0 -63.8 -33.1 88.1 104.2 54.1 8 10 A R H X S+ 0 0 162 -4,-1.3 4,-0.9 -3,-0.3 -1,-0.2 0.844 106.0 53.5 -75.3 -34.8 86.1 107.5 54.2 9 11 A Y H < S+ 0 0 62 -4,-1.3 3,-0.4 1,-0.2 356,-0.3 0.915 113.1 44.7 -63.1 -42.2 83.0 106.0 52.7 10 12 A E H >< S+ 0 0 26 -4,-1.8 3,-1.6 1,-0.2 -2,-0.2 0.888 109.4 55.6 -68.4 -40.2 83.0 103.3 55.4 11 13 A N H >< S+ 0 0 86 -4,-1.9 3,-1.2 1,-0.3 -1,-0.2 0.654 86.9 79.5 -69.8 -15.5 83.8 105.8 58.1 12 14 A A T 3< S+ 0 0 65 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.749 108.3 29.9 -61.6 -22.6 80.7 107.8 57.2 13 15 A Y T < S+ 0 0 40 -3,-1.6 2,-1.9 -4,-0.3 -1,-0.3 0.069 82.7 120.2-125.9 22.7 78.8 105.2 59.2 14 16 A R < - 0 0 103 -3,-1.2 2,-0.3 81,-0.1 -3,-0.1 -0.585 50.0-176.9 -81.3 74.5 81.5 104.3 61.7 15 17 A I - 0 0 36 -2,-1.9 80,-2.8 79,-0.0 2,-0.4 -0.566 11.3-166.4 -83.2 136.4 79.2 105.3 64.5 16 18 A K B -A 94 0A 100 -2,-0.3 78,-0.2 78,-0.3 77,-0.1 -0.981 17.6-129.2-124.1 136.7 80.4 105.2 68.1 17 19 A L - 0 0 4 76,-2.9 2,-0.0 -2,-0.4 6,-0.0 -0.586 38.5 -99.7 -76.3 140.7 78.3 105.5 71.3 18 20 A P - 0 0 55 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.389 47.0-124.1 -58.7 139.1 79.5 108.1 73.8 19 21 A E S S+ 0 0 117 1,-0.2 63,-0.1 73,-0.1 69,-0.0 -0.096 80.0 44.5 -82.9 179.7 81.5 106.3 76.6 20 22 A R S S+ 0 0 134 61,-0.3 -1,-0.2 1,-0.1 62,-0.1 0.827 93.7 94.5 52.8 40.6 81.1 106.2 80.4 21 23 A M S S- 0 0 67 -3,-0.2 -1,-0.1 58,-0.1 60,-0.1 -0.982 85.3 -77.2-154.8 151.8 77.3 105.6 80.3 22 24 A P - 0 0 3 0, 0.0 111,-2.0 0, 0.0 2,-0.4 -0.168 42.6-156.9 -51.5 132.8 74.9 102.6 80.4 23 25 A V E -BC 79 132B 1 56,-3.7 56,-3.9 109,-0.2 2,-0.5 -0.954 3.7-161.8-115.0 133.0 74.6 100.7 77.1 24 26 A I E -BC 78 131B 1 107,-2.1 107,-1.3 -2,-0.4 2,-0.5 -0.959 3.9-170.6-115.1 128.9 71.6 98.5 76.3 25 27 A V E -BC 77 130B 0 52,-2.5 52,-3.0 -2,-0.5 2,-0.5 -0.976 3.6-167.6-117.2 123.9 71.6 95.9 73.6 26 28 A R E -BC 76 129B 19 103,-2.3 103,-1.6 -2,-0.5 2,-0.5 -0.941 2.1-168.4-112.8 131.6 68.4 94.2 72.4 27 29 A I E -BC 75 128B 0 48,-2.8 48,-2.9 -2,-0.5 2,-0.4 -0.971 7.4-173.2-116.9 127.4 68.3 91.0 70.3 28 30 A D E -BC 74 127B 49 99,-1.1 99,-2.1 -2,-0.5 46,-0.2 -0.981 26.5-113.7-128.2 130.2 65.0 89.9 68.7 29 31 A G E > - C 0 126B 3 44,-2.6 3,-0.6 -2,-0.4 2,-0.5 -0.288 31.5-121.4 -60.9 136.7 64.3 86.7 66.8 30 32 A A T 3 S- 0 0 26 95,-3.0 95,-0.4 1,-0.2 5,-0.2 -0.698 84.5 -14.3 -85.5 125.6 63.5 87.1 63.1 31 33 A H T >> S+ 0 0 153 -2,-0.5 4,-1.8 1,-0.1 3,-1.2 0.898 76.1 164.9 52.2 49.1 60.1 85.7 62.1 32 34 A F H <> + 0 0 15 -3,-0.6 4,-0.6 1,-0.3 -1,-0.1 0.322 64.5 73.3 -81.3 10.3 59.6 83.7 65.3 33 35 A H H 34 S+ 0 0 166 2,-0.1 -1,-0.3 3,-0.1 -2,-0.1 0.750 107.8 33.9 -84.8 -29.5 56.0 83.3 64.5 34 36 A T H X4 S+ 0 0 109 -3,-1.2 3,-0.5 2,-0.2 -2,-0.2 0.848 117.6 52.6 -88.3 -43.7 57.0 80.8 61.8 35 37 A Y H 3< S+ 0 0 13 -4,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.853 114.9 41.9 -63.2 -37.0 60.0 79.4 63.6 36 38 A T T >< S+ 0 0 40 -4,-0.6 3,-2.9 -5,-0.1 2,-1.8 0.511 83.0 113.1 -89.6 -6.0 58.0 78.6 66.7 37 39 A K T < S+ 0 0 75 -3,-0.5 3,-0.1 1,-0.3 -4,-0.1 -0.504 83.2 35.2 -66.1 88.4 55.1 77.4 64.7 38 40 A G T 3 S+ 0 0 72 -2,-1.8 -1,-0.3 1,-0.4 2,-0.2 0.231 95.9 109.9 142.1 -4.0 55.4 73.8 65.9 39 41 A C S < S- 0 0 25 -3,-2.9 2,-0.4 1,-0.1 -1,-0.4 -0.499 83.1 -76.7 -93.6 166.6 56.5 74.4 69.4 40 42 A A - 0 0 54 -2,-0.2 -1,-0.1 -3,-0.1 7,-0.1 -0.491 64.7-111.1 -67.1 116.6 54.5 73.8 72.6 41 43 A K S S+ 0 0 80 -2,-0.4 2,-0.1 1,-0.2 116,-0.1 -0.747 85.8 7.3 -97.1 146.6 51.9 76.6 73.0 42 44 A P S S+ 0 0 49 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 -0.946 138.5 7.7 -81.4 -24.3 51.6 78.8 74.9 43 45 A F - 0 0 30 -2,-0.1 2,-0.6 114,-0.1 -2,-0.1 -0.970 61.0-157.5-124.8 127.7 55.0 78.2 76.5 44 46 A D > - 0 0 19 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.902 4.0-161.5-105.2 120.6 57.7 75.8 75.4 45 47 A Q H > S+ 0 0 88 -2,-0.6 4,-1.9 1,-0.2 -1,-0.1 0.851 92.1 51.6 -67.5 -36.2 60.2 74.8 78.0 46 48 A D H > S+ 0 0 79 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.907 112.3 44.9 -67.6 -43.3 62.8 73.6 75.4 47 49 A L H >> S+ 0 0 23 2,-0.2 4,-1.3 1,-0.2 3,-0.6 0.919 113.7 49.8 -66.7 -44.8 62.7 76.9 73.5 48 50 A A H 3X S+ 0 0 6 -4,-2.2 4,-1.7 1,-0.2 3,-0.2 0.878 109.6 50.7 -62.9 -39.7 62.9 79.0 76.6 49 51 A E H 3X S+ 0 0 83 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.659 104.9 58.8 -73.9 -16.1 65.8 77.1 78.0 50 52 A A H X S+ 0 0 0 -4,-2.2 4,-0.9 2,-0.2 3,-0.8 0.940 110.8 47.5 -69.1 -49.3 76.1 86.4 75.7 59 61 A A H 3< S+ 0 0 4 -4,-1.9 3,-0.2 1,-0.2 6,-0.2 0.809 110.0 54.7 -64.0 -30.7 76.9 87.6 79.2 60 62 A Q H 3< S+ 0 0 116 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.742 115.9 36.8 -73.3 -24.7 80.1 85.5 79.3 61 63 A N H << S+ 0 0 75 -3,-0.8 2,-0.6 -4,-0.8 -2,-0.2 0.389 95.4 90.4-113.5 1.7 81.5 87.0 76.1 62 64 A I S >< S- 0 0 8 -4,-0.9 3,-1.9 -3,-0.2 2,-0.2 -0.898 75.0-125.9-107.8 118.9 80.4 90.7 76.3 63 65 A M T 3 S+ 0 0 100 -2,-0.6 27,-0.4 1,-0.3 -2,-0.1 -0.415 95.0 10.8 -62.7 122.3 82.8 93.2 77.9 64 66 A G T 3 S+ 0 0 20 1,-0.3 16,-2.4 -2,-0.2 -1,-0.3 0.493 84.8 159.5 88.9 5.1 81.0 95.1 80.7 65 67 A A E < +D 79 0B 9 -3,-1.9 -1,-0.3 14,-0.2 14,-0.2 -0.441 7.0 162.9 -65.7 126.1 77.9 92.9 80.7 66 68 A K E + 0 0 43 12,-2.8 135,-0.5 1,-0.4 2,-0.3 0.731 59.7 7.9-113.6 -38.3 76.1 93.2 84.0 67 69 A L E -D 78 0B 0 11,-1.1 11,-3.2 133,-0.1 2,-0.4 -0.997 52.2-160.8-152.0 142.5 72.6 91.9 83.4 68 70 A V E -DE 77 199B 0 131,-1.6 131,-2.9 -2,-0.3 2,-0.5 -0.980 9.3-162.2-123.1 138.8 70.6 90.0 80.7 69 71 A Y E -DE 76 198B 1 7,-2.9 7,-2.5 -2,-0.4 2,-0.4 -0.979 5.1-163.7-124.0 125.4 66.8 89.9 80.5 70 72 A H E +DE 75 197B 8 127,-2.6 127,-1.4 -2,-0.5 2,-0.3 -0.854 18.7 152.9-109.0 143.4 64.8 87.4 78.5 71 73 A Q E > -D 74 0B 10 3,-1.7 3,-2.5 -2,-0.4 2,-0.1 -0.867 65.6 -36.8-163.2 132.5 61.2 87.4 77.4 72 74 A S T 3 S- 0 0 45 -2,-0.3 -21,-0.1 1,-0.3 77,-0.0 -0.306 122.8 -26.1 52.5-119.6 59.5 85.7 74.4 73 75 A D T 3 S+ 0 0 35 -2,-0.1 -44,-2.6 -44,-0.1 2,-0.3 0.096 117.8 95.6-110.9 20.5 62.0 85.9 71.5 74 76 A E E < -BD 28 71B 8 -3,-2.5 -3,-1.7 -46,-0.2 2,-0.4 -0.853 51.1-163.4-116.8 150.3 63.9 89.0 72.7 75 77 A I E -BD 27 70B 0 -48,-2.9 -48,-2.8 -2,-0.3 2,-0.4 -0.954 4.3-166.7-134.6 114.0 67.1 89.4 74.7 76 78 A S E -BD 26 69B 0 -7,-2.5 -7,-2.9 -2,-0.4 2,-0.4 -0.853 6.7-165.4-101.0 134.8 68.0 92.7 76.4 77 79 A I E -BD 25 68B 0 -52,-3.0 -52,-2.5 -2,-0.4 2,-0.6 -0.976 11.0-148.0-124.8 125.9 71.6 93.2 77.7 78 80 A L E -BD 24 67B 0 -11,-3.2 -12,-2.8 -2,-0.4 -11,-1.1 -0.824 19.7-174.6 -92.1 118.9 72.8 95.9 80.1 79 81 A I E -BD 23 65B 8 -56,-3.9 -56,-3.7 -2,-0.6 2,-0.4 -0.952 5.2-172.2-116.4 129.9 76.4 96.9 79.5 80 82 A T + 0 0 2 -16,-2.4 3,-0.1 -2,-0.5 149,-0.0 -0.947 12.1 179.3-118.8 144.1 78.3 99.3 81.6 81 83 A N + 0 0 8 -2,-0.4 -61,-0.3 1,-0.1 -1,-0.1 -0.011 67.4 74.9-131.2 28.7 81.8 100.7 80.8 82 84 A Y + 0 0 22 -18,-0.1 149,-0.1 -62,-0.1 -1,-0.1 -0.004 49.2 119.4-132.6 28.3 82.5 103.0 83.8 83 85 A D S S+ 0 0 75 -3,-0.1 2,-0.2 148,-0.1 -1,-0.1 0.938 89.0 7.8 -58.9 -49.9 83.3 100.5 86.6 84 86 A K S S- 0 0 147 4,-0.1 3,-0.3 -3,-0.1 147,-0.0 -0.559 84.2-104.1-117.0-174.4 86.8 102.0 86.9 85 87 A L S S+ 0 0 160 -2,-0.2 -2,-0.0 1,-0.2 -1,-0.0 0.682 122.8 47.0 -82.8 -19.9 88.5 105.1 85.5 86 88 A T S S+ 0 0 106 2,-0.0 -1,-0.2 -4,-0.0 2,-0.1 0.266 80.0 137.7-105.0 9.4 90.4 102.8 83.1 87 89 A T - 0 0 40 -3,-0.3 2,-0.2 1,-0.1 -67,-0.1 -0.362 41.4-149.1 -61.1 127.8 87.5 100.7 82.0 88 90 A Q - 0 0 138 -2,-0.1 2,-0.3 -69,-0.0 -4,-0.1 -0.534 13.0-115.9 -93.3 164.6 87.5 100.1 78.2 89 91 A S > - 0 0 12 -2,-0.2 3,-2.4 -7,-0.0 2,-0.3 -0.804 30.3 -99.5-105.4 144.6 84.5 99.6 76.0 90 92 A W G > S- 0 0 19 -27,-0.4 3,-1.7 -2,-0.3 4,-0.3 -0.441 110.2 -11.1 -58.6 118.8 83.4 96.5 74.0 91 93 A F G > S- 0 0 58 -2,-0.3 3,-1.3 1,-0.3 -1,-0.3 0.740 121.7 -73.6 56.3 25.5 84.6 97.2 70.5 92 94 A E G < S- 0 0 111 -3,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.821 85.6 -64.6 58.2 34.4 85.3 100.7 71.6 93 95 A N G < S+ 0 0 4 -3,-1.7 -76,-2.9 1,-0.2 2,-0.5 0.734 81.4 171.6 59.3 27.2 81.5 101.4 71.6 94 96 A N B <> -A 16 0A 14 -3,-1.3 4,-2.5 -4,-0.3 -78,-0.3 -0.566 25.1-148.9 -65.3 117.1 81.3 100.8 67.8 95 97 A L H > S+ 0 0 0 -80,-2.8 4,-2.2 -2,-0.5 5,-0.2 0.940 90.2 42.2 -57.3 -58.5 77.6 100.8 67.1 96 98 A Q H > S+ 0 0 7 -81,-0.4 4,-1.7 -83,-0.3 265,-0.5 0.781 116.9 49.3 -64.1 -28.2 77.4 98.4 64.1 97 99 A K H > S+ 0 0 63 2,-0.2 4,-2.2 3,-0.2 5,-0.3 0.897 109.9 49.1 -79.2 -41.5 79.9 96.0 65.6 98 100 A I H X S+ 0 0 1 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.923 116.4 43.1 -61.8 -44.9 78.2 95.8 69.0 99 101 A A H X S+ 0 0 1 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.925 118.3 42.2 -68.3 -46.8 74.8 95.1 67.4 100 102 A S H X S+ 0 0 0 -4,-1.7 4,-2.9 261,-0.3 259,-0.2 0.927 114.6 48.0 -70.6 -46.9 75.9 92.6 64.8 101 103 A V H X S+ 0 0 4 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.862 111.3 52.8 -63.9 -35.1 78.4 90.6 66.9 102 104 A S H X S+ 0 0 0 -4,-1.4 4,-2.4 -5,-0.3 -1,-0.2 0.928 112.3 44.4 -62.5 -45.9 75.7 90.4 69.6 103 105 A A H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.878 113.9 51.3 -66.4 -38.1 73.2 89.0 67.0 104 106 A S H X S+ 0 0 0 -4,-2.9 4,-2.6 255,-0.3 -2,-0.2 0.936 111.1 46.7 -63.2 -48.6 75.9 86.7 65.7 105 107 A M H X S+ 0 0 18 -4,-3.0 4,-2.1 2,-0.2 5,-0.3 0.910 113.6 48.6 -60.1 -44.8 76.7 85.3 69.1 106 108 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.3 0.915 112.3 49.8 -61.3 -43.7 73.0 84.9 69.9 107 109 A T H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 5,-0.3 0.903 110.5 49.7 -60.9 -44.5 72.6 83.1 66.5 108 110 A A H X S+ 0 0 3 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.948 116.3 38.3 -63.4 -52.8 75.5 80.8 67.0 109 111 A K H X S+ 0 0 37 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.921 116.3 51.2 -66.6 -45.7 74.6 79.5 70.5 110 112 A F H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.3 5,-0.2 0.936 111.7 45.5 -60.0 -51.9 70.8 79.4 69.9 111 113 A N H X S+ 0 0 12 -4,-2.0 4,-1.6 -5,-0.3 -1,-0.2 0.887 112.6 53.0 -58.9 -40.9 71.0 77.3 66.7 112 114 A E H X S+ 0 0 47 -4,-1.7 4,-0.9 -5,-0.3 -2,-0.2 0.946 114.1 40.1 -59.5 -52.4 73.6 75.0 68.3 113 115 A V H >X S+ 0 0 28 -4,-2.5 4,-0.7 1,-0.2 3,-0.6 0.902 114.0 53.2 -64.9 -42.9 71.4 74.2 71.3 114 116 A M H 3X S+ 0 0 5 -4,-2.6 4,-1.7 1,-0.2 3,-0.2 0.785 100.0 62.4 -67.9 -27.5 68.2 74.0 69.4 115 117 A R H 3< S+ 0 0 58 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.882 90.6 70.4 -62.1 -38.1 69.6 71.5 66.9 116 118 A E H << S+ 0 0 146 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.891 118.2 15.3 -49.4 -52.8 70.1 69.0 69.8 117 119 A K H < S+ 0 0 63 -4,-0.7 -1,-0.3 -3,-0.2 -2,-0.2 0.566 139.2 37.4 -99.9 -13.1 66.4 68.3 70.3 118 120 A Y >< + 0 0 59 -4,-1.7 3,-1.3 -5,-0.2 -2,-0.2 -0.467 56.7 155.2-139.4 66.9 65.1 69.8 67.1 119 121 A P T 3 S+ 0 0 64 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.620 77.0 62.1 -70.0 -10.2 67.5 69.1 64.2 120 122 A D T 3 S+ 0 0 83 -5,-0.1 -5,-0.1 -3,-0.1 -2,-0.0 0.646 79.5 106.7 -87.2 -18.0 64.6 69.4 61.8 121 123 A K S < S- 0 0 26 -3,-1.3 3,-0.1 -7,-0.2 -86,-0.1 -0.335 75.1-117.6 -60.0 139.1 64.0 73.0 62.8 122 124 A P - 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0 0 1 -111,-1.9 5,-0.1 -2,-0.3 2,-0.0 -0.994 25.9-112.9-142.8 142.2 78.6 104.2 47.8 367 136 B P >> - 0 0 49 0, 0.0 3,-1.7 0, 0.0 4,-0.6 -0.373 38.1-109.5 -64.1 157.0 78.1 106.5 44.7 368 137 B Q G >4 S+ 0 0 80 1,-0.3 3,-0.7 2,-0.2 4,-0.5 0.830 117.5 57.1 -60.0 -34.7 77.5 104.5 41.5 369 138 B D G 34 S+ 0 0 101 1,-0.2 -1,-0.3 2,-0.1 4,-0.0 0.228 107.9 49.1 -84.6 15.7 81.0 105.5 40.1 370 139 B E G <> S+ 0 0 12 -3,-1.7 4,-1.7 2,-0.1 -1,-0.2 0.440 85.2 84.2-127.6 -8.4 82.7 104.0 43.2 371 140 B V H S+ 0 0 0 -4,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.904 112.2 54.5 -58.4 -41.3 83.4 98.9 40.9 373 142 B N H > S+ 0 0 22 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.828 101.6 59.0 -61.2 -34.3 86.2 100.6 42.7 374 143 B Y H X S+ 0 0 0 -4,-1.7 4,-1.8 -3,-0.3 -1,-0.2 0.925 110.0 40.9 -60.7 -47.0 85.1 99.1 46.0 375 144 B F H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.833 112.2 55.4 -73.7 -32.9 85.5 95.5 44.7 376 145 B I H X S+ 0 0 11 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.905 108.7 49.8 -60.2 -42.2 88.7 96.4 42.9 377 146 B W H X S+ 0 0 44 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.892 112.0 47.5 -61.9 -41.3 89.9 97.6 46.3 378 147 B R H X S+ 0 0 18 -4,-1.8 4,-1.2 1,-0.2 -2,-0.2 0.835 110.9 50.9 -70.9 -34.3 88.8 94.3 47.8 379 148 B Q H X S+ 0 0 7 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.852 107.8 52.5 -71.5 -36.2 90.4 92.2 45.1 380 149 B Q H X S+ 0 0 104 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.868 109.9 48.7 -67.1 -36.5 93.8 94.0 45.5 381 150 B D H X S+ 0 0 48 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.814 108.8 56.2 -69.2 -30.7 93.7 93.2 49.2 382 151 B A H X S+ 0 0 4 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.925 108.7 44.1 -66.0 -47.1 92.9 89.6 48.3 383 152 B S H X S+ 0 0 35 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.868 111.6 54.5 -66.0 -37.9 96.0 89.2 46.1 384 153 B K H X S+ 0 0 154 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.896 114.8 39.4 -64.2 -41.6 98.1 91.0 48.7 385 154 B N H X S+ 0 0 56 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.829 111.1 59.3 -76.9 -33.8 97.0 88.5 51.4 386 155 B S H X S+ 0 0 1 -4,-2.4 4,-2.2 42,-0.3 5,-0.2 0.960 107.1 45.2 -57.4 -55.0 97.1 85.5 49.1 387 156 B I H X S+ 0 0 12 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.906 114.2 50.0 -56.4 -45.1 100.8 85.9 48.3 388 157 B S H X S+ 0 0 54 -4,-1.3 4,-1.5 -5,-0.2 -1,-0.2 0.882 109.4 50.9 -62.7 -41.0 101.6 86.5 51.9 389 158 B M H X S+ 0 0 62 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.885 112.0 46.7 -66.0 -39.3 99.6 83.4 53.0 390 159 B V H < S+ 0 0 5 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.898 114.0 47.9 -68.6 -40.5 101.4 81.2 50.5 391 160 B A H X S+ 0 0 0 -4,-2.3 4,-0.7 -5,-0.2 3,-0.4 0.737 109.8 54.3 -71.8 -23.0 104.8 82.6 51.5 392 161 B Q H < S+ 0 0 64 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.831 105.9 50.3 -79.4 -33.7 104.0 82.1 55.2 393 162 B A T < S+ 0 0 46 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.298 117.3 41.0 -88.3 9.9 103.1 78.4 54.8 394 163 B N T 4 S+ 0 0 50 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.443 116.7 37.3-132.4 -9.2 106.4 77.7 53.0 395 164 B F S < S- 0 0 15 -4,-0.7 -1,-0.3 -3,-0.1 2,-0.0 -0.981 83.2-100.4-142.5 153.2 109.0 79.8 54.8 396 165 B P >> - 0 0 77 0, 0.0 4,-1.0 0, 0.0 3,-0.6 -0.323 42.7-107.7 -63.8 158.1 109.8 80.8 58.4 397 166 B H H 3> S+ 0 0 88 1,-0.2 4,-1.7 2,-0.2 3,-0.3 0.866 114.5 60.8 -59.5 -37.6 108.6 84.3 59.5 398 167 B K H 34 S+ 0 0 70 1,-0.2 -1,-0.2 2,-0.2 3,-0.0 0.887 98.7 57.1 -60.4 -39.9 112.1 85.8 59.5 399 168 B Q H <4 S+ 0 0 81 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.892 106.2 48.0 -62.2 -42.9 112.7 85.0 55.9 400 169 B L H >< S+ 0 0 24 -4,-1.0 3,-0.7 -3,-0.3 -1,-0.2 0.854 85.0 134.6 -64.8 -38.2 109.7 87.0 54.7 401 170 B Q T 3< S- 0 0 116 -4,-1.7 3,-0.1 1,-0.3 0, 0.0 -0.395 81.0 -3.8 -61.3 132.3 110.6 90.1 56.8 402 171 B G T 3 S+ 0 0 77 -2,-0.1 2,-0.4 1,-0.1 -1,-0.3 0.358 94.5 145.8-110.4 116.5 110.3 92.5 55.3 403 172 B L < - 0 0 61 -3,-0.7 -1,-0.1 1,-0.1 -3,-0.1 -0.889 39.3-122.7-122.7 140.8 109.5 91.5 51.7 404 173 B N > - 0 0 114 -2,-0.4 4,-2.3 1,-0.1 5,-0.2 -0.130 31.6-109.5 -66.6 164.2 107.4 92.9 48.9 405 174 B G H > S+ 0 0 34 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.896 122.5 49.0 -57.4 -43.2 104.5 91.1 47.2 406 175 B K H > S+ 0 0 121 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.853 110.9 51.7 -66.3 -35.3 106.7 90.8 44.1 407 176 B D H > S+ 0 0 74 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.953 109.6 46.3 -66.1 -52.5 109.6 89.5 46.2 408 177 B M H X S+ 0 0 18 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.800 112.1 54.4 -60.7 -29.3 107.5 86.7 47.9 409 178 B Q H X S+ 0 0 39 -4,-1.5 4,-0.9 -5,-0.2 11,-0.3 0.910 111.8 42.1 -70.3 -43.9 106.1 85.8 44.5 410 179 B D H X S+ 0 0 74 -4,-2.0 4,-2.0 1,-0.2 5,-0.3 0.859 113.0 53.4 -70.9 -36.8 109.6 85.4 43.0 411 180 B K H X S+ 0 0 36 -4,-2.9 4,-1.3 1,-0.2 5,-0.2 0.841 105.4 54.8 -67.2 -33.3 110.9 83.6 46.1 412 181 B L H X S+ 0 0 0 -4,-1.5 6,-2.7 -5,-0.2 4,-0.7 0.814 110.7 48.3 -65.7 -31.0 108.0 81.2 45.8 413 182 B M H X S+ 0 0 76 -4,-0.9 4,-1.3 4,-0.2 -2,-0.2 0.980 117.9 31.5 -75.5 -60.4 109.0 80.4 42.3 414 183 B T H < S+ 0 0 121 -4,-2.0 -2,-0.1 1,-0.2 -3,-0.1 0.666 127.2 39.7 -76.9 -17.9 112.8 79.7 42.4 415 184 B E H < S+ 0 0 101 -4,-1.3 -1,-0.2 -5,-0.3 -3,-0.2 0.581 132.0 17.0-112.4 -15.0 112.8 78.2 45.9 416 185 B K H < S- 0 0 103 -4,-0.7 -3,-0.2 -5,-0.2 -2,-0.2 0.313 94.1-118.3-138.6 3.5 109.7 76.1 46.1 417 186 B N < + 0 0 86 -4,-1.3 2,-0.7 1,-0.2 -4,-0.2 0.826 67.1 143.3 54.5 34.6 108.7 75.6 42.4 418 187 B I - 0 0 43 -6,-2.7 2,-0.8 -7,-0.1 -1,-0.2 -0.907 37.0-164.3-110.3 108.9 105.4 77.4 43.2 419 188 B N > - 0 0 54 -2,-0.7 3,-1.8 1,-0.2 4,-0.4 -0.829 6.1-159.4 -91.3 107.1 104.0 79.7 40.6 420 189 B W G > S+ 0 0 20 -2,-0.8 3,-1.5 -11,-0.3 -1,-0.2 0.840 89.0 61.1 -55.3 -37.8 101.4 81.9 42.3 421 190 B N G 3 S+ 0 0 81 1,-0.3 -1,-0.3 -3,-0.1 7,-0.1 0.716 96.0 61.5 -62.7 -22.5 99.7 82.7 39.0 422 191 B D G < S+ 0 0 129 -3,-1.8 -1,-0.3 2,-0.0 -2,-0.2 0.605 81.9 105.0 -82.2 -12.7 99.0 79.0 38.5 423 192 B L S < S- 0 0 41 -3,-1.5 5,-0.1 -4,-0.4 -3,-0.0 -0.226 87.3 -86.1 -61.7 155.8 96.8 78.8 41.6 424 193 B P >> - 0 0 58 0, 0.0 4,-1.1 0, 0.0 3,-0.9 -0.266 41.6-108.0 -62.2 157.1 93.1 78.7 41.1 425 194 B V H >> S+ 0 0 34 19,-0.3 4,-2.6 1,-0.3 3,-0.9 0.892 115.3 55.0 -55.4 -47.8 91.3 82.0 40.8 426 195 B W H 3> S+ 0 0 28 1,-0.3 4,-0.9 2,-0.2 -1,-0.3 0.752 108.3 50.1 -62.6 -24.8 89.6 82.0 44.2 427 196 B Q H <4 S+ 0 0 29 -3,-0.9 -1,-0.3 2,-0.1 -2,-0.2 0.735 114.9 43.7 -82.9 -24.2 92.9 81.5 46.0 428 197 B K H << S- 0 0 29 -4,-1.1 -42,-0.3 -3,-0.9 -2,-0.2 0.854 141.3 -8.6 -88.3 -39.3 94.6 84.4 44.1 429 198 B R H < S- 0 0 32 -4,-2.6 -3,-0.2 1,-0.3 -46,-0.2 0.132 95.8-111.3-151.4 22.1 91.9 87.1 44.3 430 199 B G < - 0 0 3 -4,-0.9 -1,-0.3 -5,-0.4 2,-0.3 -0.032 35.5-104.9 67.5-177.2 88.7 85.5 45.7 431 200 B I E -K 303 0D 0 -128,-1.5 -128,-2.6 -5,-0.2 2,-0.3 -0.900 16.7-120.7-141.9 171.0 85.5 85.0 43.8 432 201 B C E -KL 302 443D 0 11,-0.7 11,-2.5 -2,-0.3 2,-0.6 -0.860 11.8-137.8-115.8 149.8 82.0 86.3 43.3 433 202 B I E +KL 301 442D 0 -132,-2.9 -132,-1.5 -2,-0.3 2,-0.4 -0.941 31.7 178.9-103.9 118.8 78.5 84.7 43.7 434 203 B I E - L 0 441D 23 7,-2.0 7,-2.3 -2,-0.6 2,-0.4 -0.929 34.0-113.4-122.4 143.7 76.2 85.7 40.8 435 204 B K E L 0 440D 107 -136,-0.4 5,-0.3 -2,-0.4 -2,-0.0 -0.635 360.0 360.0 -69.8 125.1 72.6 84.8 39.9 436 205 B E 0 0 143 3,-3.1 3,-1.5 -2,-0.4 -1,-0.0 -0.801 360.0 360.0-110.2 360.0 72.7 82.7 36.8 437 ! 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 0.0 438 215 B S 0 0 132 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0 157.7 67.6 81.2 38.2 439 216 B R - 0 0 84 -3,-1.5 -3,-3.1 -5,-0.1 2,-0.6 -0.992 360.0-109.9-150.7 154.9 70.0 80.3 41.0 440 217 B W E +L 435 0D 25 -2,-0.3 2,-0.3 -5,-0.3 -5,-0.2 -0.786 48.4 168.7 -87.3 120.8 72.9 81.8 43.0 441 218 B S E -L 434 0D 24 -7,-2.3 -7,-2.0 -2,-0.6 2,-0.2 -0.930 38.1 -98.7-135.7 156.2 76.1 80.1 42.0 442 219 B V E -L 433 0D 27 -2,-0.3 2,-0.9 -9,-0.2 -9,-0.2 -0.527 26.5-146.6 -72.8 134.3 79.9 80.5 42.4 443 220 B D E > +L 432 0D 48 -11,-2.5 3,-1.5 -2,-0.2 -11,-0.7 -0.825 18.0 178.6-102.3 93.8 81.8 82.1 39.5 444 221 B H T 3 S+ 0 0 98 -2,-0.9 -19,-0.3 1,-0.3 -18,-0.1 0.531 82.4 59.6 -72.9 -3.8 85.1 80.4 39.5 445 222 B E T 3 S+ 0 0 75 -13,-0.1 -1,-0.3 -20,-0.1 -14,-0.1 0.010 72.9 154.4-108.3 24.9 86.0 82.5 36.4 446 223 B T < - 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0 0 1 -111,-2.0 2,-0.1 -2,-0.3 5,-0.1 -0.990 25.8-112.9-137.9 146.8 96.6 50.9 78.9 598 136 C P >> - 0 0 49 0, 0.0 3,-1.8 0, 0.0 4,-0.5 -0.455 39.6-106.5 -70.7 158.6 99.3 51.4 76.3 599 137 C Q G >4 S+ 0 0 80 1,-0.3 3,-0.9 2,-0.2 4,-0.5 0.848 117.2 55.7 -56.1 -39.3 98.0 51.9 72.7 600 138 C D G 34 S+ 0 0 98 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.301 106.9 51.4 -82.0 12.1 99.0 48.4 71.5 601 139 C E G <> S+ 0 0 12 -3,-1.8 4,-1.7 2,-0.1 -1,-0.2 0.450 82.8 86.7-120.8 -6.8 97.1 46.7 74.3 602 140 C V H S+ 0 0 0 -4,-0.5 4,-2.2 1,-0.2 3,-0.2 0.928 111.3 56.1 -59.8 -45.0 92.4 45.9 71.3 604 142 C N H > S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.814 101.8 57.9 -56.5 -33.0 93.9 43.0 73.4 605 143 C Y H X S+ 0 0 0 -4,-1.7 4,-2.2 -3,-0.3 -1,-0.2 0.935 109.2 42.8 -63.6 -47.2 91.8 44.2 76.4 606 144 C F H X S+ 0 0 1 -4,-1.5 4,-2.2 -3,-0.2 -2,-0.2 0.823 111.7 54.5 -71.1 -31.4 88.5 43.9 74.5 607 145 C I H X S+ 0 0 11 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.914 109.5 49.3 -62.6 -42.4 89.7 40.5 73.0 608 146 C W H X S+ 0 0 42 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.897 111.3 47.8 -62.8 -43.5 90.2 39.4 76.6 609 147 C R H X S+ 0 0 17 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.861 110.0 53.5 -66.8 -35.9 86.8 40.6 77.7 610 148 C Q H X S+ 0 0 9 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.838 106.5 52.1 -67.2 -34.6 85.2 38.9 74.7 611 149 C Q H X S+ 0 0 98 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.898 110.1 47.4 -70.2 -39.6 86.9 35.6 75.7 612 150 C D H X S+ 0 0 36 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.818 109.9 57.2 -65.9 -30.6 85.5 35.9 79.2 613 151 C A H X S+ 0 0 3 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.935 108.6 43.0 -63.8 -49.6 82.2 36.7 77.5 614 152 C S H X S+ 0 0 37 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.876 114.0 51.5 -66.5 -39.5 82.1 33.4 75.5 615 153 C K H X S+ 0 0 134 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.940 114.2 42.7 -62.8 -48.3 83.3 31.4 78.5 616 154 C N H X S+ 0 0 51 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.869 112.2 56.3 -64.3 -37.9 80.5 32.8 80.7 617 155 C S H X S+ 0 0 2 -4,-2.4 4,-2.4 36,-0.3 5,-0.2 0.963 108.0 44.9 -58.3 -57.6 78.0 32.5 77.9 618 156 C I H X S+ 0 0 16 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.896 115.8 48.5 -53.9 -44.3 78.5 28.8 77.4 619 157 C S H X S+ 0 0 32 -4,-1.8 4,-2.1 -5,-0.2 -1,-0.2 0.871 109.3 53.0 -65.0 -38.4 78.4 28.3 81.2 620 158 C M H X S+ 0 0 55 -4,-2.6 4,-0.5 1,-0.2 -2,-0.2 0.908 109.9 46.9 -64.7 -43.0 75.2 30.3 81.5 621 159 C V H >< S+ 0 0 11 -4,-2.4 3,-0.5 1,-0.2 4,-0.3 0.866 111.7 52.0 -66.9 -36.9 73.4 28.3 78.9 622 160 C A H >X S+ 0 0 8 -4,-1.8 3,-1.3 -5,-0.2 4,-0.7 0.889 106.2 52.6 -66.9 -40.4 74.5 25.1 80.5 623 161 C Q H 3< S+ 0 0 135 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.593 107.8 53.4 -73.5 -10.4 73.3 26.1 84.0 624 162 C A T << S+ 0 0 42 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.2 0.441 117.0 37.1 -98.5 -3.9 69.9 26.8 82.4 625 163 C N T <4 S+ 0 0 78 -3,-1.3 -2,-0.2 -4,-0.3 -3,-0.1 0.309 117.5 46.2-127.9 3.6 69.7 23.4 80.9 626 164 C F < 0 0 74 -4,-0.7 -1,-0.1 -5,-0.1 0, 0.0 -0.971 360.0 360.0-146.9 160.8 71.3 21.2 83.6 627 165 C P 0 0 154 0, 0.0 -3,-0.1 0, 0.0 -2,-0.0 -0.452 360.0 360.0 -70.0 360.0 71.3 20.6 87.4 628 ! 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 0.0 629 173 C N > 0 0 104 0, 0.0 4,-1.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0-158.8 85.1 22.2 80.6 630 174 C G H > + 0 0 39 2,-0.2 4,-1.3 3,-0.1 5,-0.1 0.973 360.0 29.9 -79.6 -63.4 84.5 24.7 77.8 631 175 C K H > S+ 0 0 63 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.755 117.9 62.2 -68.1 -24.7 84.0 22.5 74.7 632 176 C D H > S+ 0 0 55 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.926 105.5 43.6 -65.4 -46.3 82.7 19.8 77.0 633 177 C M H X S+ 0 0 62 -4,-1.0 4,-0.8 1,-0.2 -1,-0.2 0.776 114.6 51.7 -69.8 -26.7 79.8 22.0 78.1 634 178 C Q H X S+ 0 0 40 -4,-1.3 4,-0.6 2,-0.2 11,-0.3 0.890 111.6 44.2 -78.0 -40.6 79.2 23.1 74.5 635 179 C D H X S+ 0 0 104 -4,-2.4 4,-3.3 1,-0.2 3,-0.5 0.845 110.8 55.0 -71.3 -34.9 79.1 19.5 73.1 636 180 C K H X>S+ 0 0 43 -4,-1.9 4,-1.0 1,-0.2 5,-0.9 0.788 105.0 55.0 -67.1 -27.5 76.9 18.4 76.0 637 181 C L H <5S+ 0 0 2 -4,-0.8 6,-2.0 3,-0.2 -1,-0.2 0.722 117.4 36.0 -75.0 -22.1 74.5 21.2 75.0 638 182 C M H <5S+ 0 0 72 -4,-0.6 4,-0.4 -3,-0.5 -2,-0.2 0.870 121.5 38.9 -97.2 -48.0 74.4 19.8 71.4 639 183 C T H <5S+ 0 0 96 -4,-3.3 -3,-0.2 2,-0.1 -2,-0.1 0.712 128.3 29.2 -80.4 -21.2 74.5 16.0 71.8 640 184 C E T <5S+ 0 0 137 -4,-1.0 -3,-0.2 -5,-0.4 -1,-0.1 0.841 135.2 19.3-107.9 -48.7 72.3 15.7 74.8 641 185 C K S - 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0 0 0 -3,-1.4 -24,-0.1 -21,-0.1 3,-0.0 -0.379 38.4-131.6 -56.6 122.3 80.1 43.5 66.7 679 224 C P - 0 0 27 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 -0.180 24.0 -90.2 -76.5 166.8 82.9 41.4 65.3 680 225 C I >> - 0 0 58 1,-0.2 3,-2.7 2,-0.0 4,-1.0 -0.733 40.6-145.5 -73.6 108.4 85.3 39.1 67.1 681 226 C I T 34 S+ 0 0 0 -2,-0.9 3,-0.4 1,-0.3 6,-0.2 0.783 94.0 63.9 -52.3 -34.1 88.0 41.7 67.9 682 227 C S T 34 S+ 0 0 60 1,-0.2 -1,-0.3 2,-0.1 3,-0.3 0.737 109.6 40.7 -63.6 -21.5 90.8 39.2 67.4 683 228 C K T <4 S+ 0 0 169 -3,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.588 128.3 31.0 -99.6 -15.4 89.8 38.9 63.8 684 229 C D >< + 0 0 68 -4,-1.0 3,-1.6 -3,-0.4 4,-0.3 -0.533 64.7 164.5-143.2 70.4 89.2 42.6 63.3 685 230 C R T >> S+ 0 0 87 1,-0.3 4,-2.4 -3,-0.3 3,-1.5 0.802 71.1 68.9 -60.5 -32.2 91.5 44.5 65.5 686 231 C E H 3> S+ 0 0 110 1,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.709 81.2 76.9 -63.5 -20.6 90.9 47.8 63.7 687 232 C Y H <4 S+ 0 0 18 -3,-1.6 -1,-0.3 2,-0.2 -2,-0.2 0.871 113.2 22.3 -55.5 -38.3 87.3 47.8 65.0 688 233 C V H X4 S+ 0 0 0 -3,-1.5 3,-2.5 -4,-0.3 4,-0.4 0.853 119.2 60.7 -92.4 -45.9 88.8 49.0 68.3 689 234 C E H 3X S+ 0 0 32 -4,-2.4 4,-2.3 1,-0.3 3,-0.4 0.621 86.3 76.4 -65.5 -13.2 92.1 50.5 67.1 690 235 C Q T 3< S+ 0 0 82 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.1 0.740 102.1 42.4 -64.5 -22.5 90.2 53.0 65.0 691 236 C F T <4 S+ 0 0 31 -3,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.521 114.8 51.9 -98.4 -9.3 89.6 54.8 68.3 692 237 C V T 4 S+ 0 0 0 -3,-0.4 2,-0.7 -4,-0.4 -2,-0.2 0.899 104.6 48.9 -94.7 -52.2 93.1 54.3 69.6 693 238 C Y < 0 0 105 -4,-2.3 -1,-0.2 -94,-0.1 0, 0.0 -0.839 360.0 360.0 -95.8 113.8 95.4 55.5 66.9 694 239 C L 0 0 118 -2,-0.7 -4,-0.1 -3,-0.1 -3,-0.1 -0.682 360.0 360.0-114.1 360.0 94.3 59.0 65.7 695 !* 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 0.0 696 3 D S > 0 0 105 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 141.4 99.2 35.0 78.4 697 4 D I H > + 0 0 36 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.874 360.0 49.3 -63.8 -37.2 96.9 37.8 77.4 698 5 D G H > S+ 0 0 17 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.831 108.9 52.9 -71.1 -33.3 94.9 37.4 80.6 699 6 D D H > S+ 0 0 102 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.915 111.0 46.3 -67.0 -44.4 98.1 37.5 82.7 700 7 D R H X S+ 0 0 78 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.933 112.2 50.7 -62.0 -47.0 99.2 40.7 81.1 701 8 D M H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.856 105.8 55.4 -62.8 -38.2 95.8 42.4 81.5 702 9 D K H X S+ 0 0 36 -4,-1.9 4,-2.9 1,-0.2 -1,-0.2 0.915 107.0 50.9 -60.2 -43.0 95.6 41.5 85.2 703 10 D R H X S+ 0 0 162 -4,-1.6 4,-1.3 2,-0.2 -2,-0.2 0.887 107.8 52.0 -62.8 -40.4 98.9 43.3 85.8 704 11 D Y H < S+ 0 0 65 -4,-1.8 -108,-0.3 1,-0.2 4,-0.3 0.890 114.0 44.4 -61.7 -39.2 97.7 46.4 84.0 705 12 D E H >< S+ 0 0 26 -4,-1.9 3,-1.6 1,-0.2 -2,-0.2 0.890 108.9 56.1 -71.8 -41.0 94.6 46.3 86.2 706 13 D N H >< S+ 0 0 85 -4,-2.9 3,-1.7 1,-0.3 -1,-0.2 0.745 88.2 77.8 -64.1 -22.7 96.7 45.6 89.3 707 14 D A T 3< S+ 0 0 70 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.757 108.5 29.8 -58.8 -23.7 98.8 48.7 88.7 708 15 D Y T < S+ 0 0 43 -3,-1.6 2,-1.7 -4,-0.3 -1,-0.3 0.096 84.0 118.0-124.5 22.9 95.8 50.7 90.1 709 16 D R < - 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