==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 27-OCT-11 3UDB . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE SRK2E; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR T.XIE,R.REN,Y.PANG,C.YAN . 1621 24 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 75025.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1039 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 198 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 133 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 164 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 491 30.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 0.9 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 12 6 0 3 4 7 7 7 2 0 0 0 0 1 5 0 5 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 6 6 0 2 13 3 6 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 6 0 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 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 12 A L 0 0 114 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0-178.7 -37.2 -4.9 12.4 2 13 A P - 0 0 3 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.692 360.0 -97.2 -90.6 137.5 -34.5 -2.6 11.0 3 14 A I - 0 0 151 -2,-0.3 74,-0.1 1,-0.1 0, 0.0 -0.152 55.7 -84.6 -50.5 139.3 -33.6 -2.5 7.3 4 15 A M - 0 0 47 -3,-0.1 2,-0.3 1,-0.1 3,-0.2 -0.025 53.6-167.9 -44.6 147.4 -30.6 -4.6 6.4 5 16 A H + 0 0 20 1,-0.2 4,-0.1 -3,-0.1 5,-0.1 -0.999 59.0 18.6-153.7 149.5 -27.2 -2.9 6.8 6 17 A D >> + 0 0 50 -2,-0.3 4,-2.2 1,-0.1 3,-1.9 0.934 66.5 170.1 48.0 50.0 -23.6 -3.3 5.9 7 18 A S T 34 S+ 0 0 81 1,-0.3 -1,-0.1 2,-0.2 5,-0.1 0.798 70.4 67.3 -41.8 -30.0 -25.1 -5.7 3.4 8 19 A D T 34 S+ 0 0 116 1,-0.2 -1,-0.3 3,-0.1 3,-0.1 0.617 110.6 25.6 -82.6 -19.1 -21.5 -5.6 2.2 9 20 A R T <4 S+ 0 0 97 -3,-1.9 21,-2.1 1,-0.3 22,-0.4 0.542 124.9 47.4-117.0 -19.0 -19.9 -7.3 5.2 10 21 A Y E < -A 29 0A 6 -4,-2.2 2,-0.7 19,-0.2 -1,-0.3 -0.991 67.0-147.3-131.9 131.3 -22.9 -9.4 6.3 11 22 A E E -A 28 0A 46 17,-3.5 17,-2.4 -2,-0.4 2,-0.1 -0.859 29.0-120.6 -98.6 115.6 -25.3 -11.6 4.3 12 23 A L E +A 27 0A 22 -2,-0.7 15,-0.2 15,-0.2 3,-0.1 -0.325 33.5 176.6 -55.7 120.4 -28.8 -11.6 5.7 13 24 A V E - 0 0 10 13,-2.4 2,-0.3 1,-0.3 14,-0.2 0.869 56.5 -44.7 -92.9 -47.5 -29.7 -15.2 6.6 14 25 A K E -A 26 0A 43 12,-1.6 12,-2.6 1543,-0.0 2,-0.7 -0.934 44.7-112.6-179.7 158.1 -33.1 -14.8 8.2 15 26 A D E -A 25 0A 63 -2,-0.3 10,-0.2 10,-0.2 2,-0.1 -0.881 35.4-171.1-110.2 103.2 -35.2 -12.7 10.6 16 27 A I - 0 0 47 8,-0.8 8,-0.4 -2,-0.7 3,-0.1 -0.340 16.2-172.1 -85.8 170.4 -36.2 -14.7 13.7 17 28 A G + 0 0 60 1,-0.3 6,-0.2 6,-0.2 2,-0.2 0.021 63.5 32.9-154.7 33.8 -38.7 -13.6 16.4 18 29 A A S S+ 0 0 69 4,-0.6 -1,-0.3 3,-0.0 2,-0.3 -0.848 72.0 69.0 175.2 148.8 -38.5 -16.1 19.2 19 30 A G S > S- 0 0 62 -2,-0.2 3,-1.0 1,-0.1 4,-0.0 -0.913 96.7 -38.5 134.7-161.3 -36.1 -18.5 21.0 20 31 A N T 3 S+ 0 0 44 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.497 135.2 58.0 -77.5 -4.0 -33.1 -18.3 23.3 21 32 A F T 3 S- 0 0 21 1,-0.4 -1,-0.2 -3,-0.1 -5,-0.1 0.039 98.6-142.4-113.1 24.0 -32.1 -15.3 21.2 22 33 A G < - 0 0 40 -3,-1.0 -4,-0.6 -5,-0.1 2,-0.5 -0.174 65.4 -19.3 50.6-142.2 -35.2 -13.2 21.7 23 34 A V S S+ 0 0 85 -6,-0.2 17,-0.4 -3,-0.1 2,-0.2 -0.876 95.9 138.3 -93.0 124.3 -36.3 -11.3 18.6 24 35 A A - 0 0 0 -2,-0.5 -8,-0.8 -8,-0.4 2,-0.4 -0.818 50.3-109.5-152.2-176.2 -33.2 -11.2 16.3 25 36 A R E -AB 15 38A 6 13,-1.8 13,-1.9 -2,-0.2 2,-0.4 -0.977 23.0-145.5-134.3 122.4 -31.6 -11.3 12.9 26 37 A L E +AB 14 37A 3 -12,-2.6 -13,-2.4 -2,-0.4 -12,-1.6 -0.684 27.0 174.1 -85.7 136.1 -29.3 -14.1 11.8 27 38 A M E -AB 12 36A 2 9,-2.8 9,-2.2 -2,-0.4 2,-0.6 -0.968 30.2-132.9-140.3 155.7 -26.5 -13.0 9.4 28 39 A R E -AB 11 35A 67 -17,-2.4 -17,-3.5 -2,-0.3 2,-0.7 -0.957 21.9-136.3-109.6 123.1 -23.5 -14.6 7.9 29 40 A D E > -AB 10 34A 32 5,-2.1 5,-0.9 -2,-0.6 4,-0.3 -0.718 15.6-143.5 -77.9 115.1 -20.4 -12.5 8.2 30 41 A K T > 5S+ 0 0 91 -21,-2.1 3,-0.7 -2,-0.7 2,-0.3 0.860 84.8 57.3 -55.4 -46.8 -18.9 -12.8 4.7 31 42 A Q T 3 5S+ 0 0 164 -22,-0.4 3,-0.3 1,-0.2 -2,-0.0 -0.661 119.2 18.3 -79.0 144.3 -15.2 -12.8 5.9 32 43 A A T 3 5S- 0 0 77 -2,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.373 105.6-125.8 72.7 -7.8 -14.5 -15.7 8.3 33 44 A N T < 5 + 0 0 106 -3,-0.7 2,-0.3 -4,-0.3 -1,-0.2 0.828 58.2 136.2 32.9 78.3 -17.8 -17.2 6.9 34 45 A E E < -B 29 0A 84 -5,-0.9 -5,-2.1 -3,-0.3 -1,-0.1 -0.986 56.0-102.4-155.3 146.3 -19.7 -17.7 10.1 35 46 A L E +B 28 0A 41 -2,-0.3 50,-0.9 -7,-0.2 2,-0.3 -0.305 38.6 178.6 -65.8 148.4 -23.2 -17.3 11.5 36 47 A V E -BC 27 84A 2 -9,-2.2 -9,-2.8 48,-0.2 2,-0.4 -0.974 20.4-136.1-149.7 146.4 -23.8 -14.4 13.8 37 48 A A E -BC 26 83A 1 46,-3.1 46,-2.6 -2,-0.3 2,-0.5 -0.920 15.6-154.8-112.2 144.5 -26.9 -13.1 15.6 38 49 A V E -BC 25 82A 0 -13,-1.9 -13,-1.8 -2,-0.4 2,-0.3 -0.958 4.8-164.9-122.3 131.0 -27.9 -9.5 15.8 39 50 A K E - C 0 81A 48 42,-2.6 42,-2.9 -2,-0.5 2,-0.4 -0.819 12.8-148.4-106.8 151.9 -30.0 -7.8 18.4 40 51 A Y E - C 0 80A 20 -17,-0.4 2,-0.5 -2,-0.3 40,-0.2 -0.972 11.1-170.4-128.9 125.4 -31.4 -4.3 17.9 41 52 A I E - C 0 79A 17 38,-2.6 38,-2.9 -2,-0.4 6,-0.1 -0.961 34.0-110.1-114.6 132.7 -32.2 -1.5 20.3 42 53 A E E - C 0 78A 99 -2,-0.5 36,-0.2 36,-0.2 4,-0.1 -0.251 24.2-124.2 -57.6 139.5 -34.1 1.5 19.3 43 54 A R S S+ 0 0 43 34,-1.8 4,-0.2 33,-0.1 -1,-0.1 0.697 80.2 96.0 -60.1 -24.9 -32.1 4.7 19.1 44 55 A G S > S- 0 0 35 33,-0.2 3,-1.5 1,-0.2 -3,-0.0 0.465 108.5 -57.4 -51.2-160.0 -34.3 6.7 21.5 45 56 A E T 3 S+ 0 0 176 1,-0.3 -1,-0.2 232,-0.1 -2,-0.1 0.469 115.0 98.2 -65.3 0.9 -33.7 7.1 25.2 46 57 A K T 3 + 0 0 109 1,-0.2 2,-1.3 -4,-0.1 -1,-0.3 0.628 62.5 84.1 -63.7 -12.4 -33.8 3.3 25.2 47 58 A I < + 0 0 5 -3,-1.5 -1,-0.2 -4,-0.2 2,-0.1 -0.607 63.0 148.2 -93.7 74.6 -30.0 3.6 25.2 48 59 A D > - 0 0 72 -2,-1.3 4,-1.5 1,-0.0 3,-0.5 -0.412 65.5 -91.6 -99.5 178.2 -29.4 4.1 28.9 49 60 A E H > S+ 0 0 42 1,-0.2 4,-4.3 2,-0.2 5,-0.2 0.871 120.3 68.7 -59.6 -41.4 -26.4 3.0 30.9 50 61 A N H > S+ 0 0 82 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.917 104.6 43.4 -42.0 -52.7 -28.0 -0.3 31.8 51 62 A V H > S+ 0 0 15 -3,-0.5 4,-2.4 2,-0.2 -1,-0.3 0.909 114.2 51.0 -59.0 -44.3 -27.7 -1.2 28.1 52 63 A K H X S+ 0 0 4 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.934 109.0 51.5 -59.4 -47.1 -24.1 0.2 28.2 53 64 A R H X S+ 0 0 81 -4,-4.3 4,-3.0 1,-0.2 5,-0.2 0.952 111.6 45.8 -54.5 -55.9 -23.3 -1.9 31.2 54 65 A E H X S+ 0 0 50 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.895 110.4 53.4 -56.8 -44.0 -24.5 -5.1 29.7 55 66 A I H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.929 114.0 42.3 -57.1 -47.9 -22.7 -4.5 26.4 56 67 A I H X S+ 0 0 6 -4,-2.3 4,-1.1 2,-0.2 3,-0.4 0.960 112.9 51.8 -64.7 -52.8 -19.4 -4.0 28.2 57 68 A N H >< S+ 0 0 7 -4,-3.0 3,-0.7 1,-0.3 4,-0.4 0.889 113.8 44.5 -50.7 -44.7 -19.9 -6.9 30.6 58 69 A H H >< S+ 0 0 4 -4,-2.6 3,-0.7 1,-0.2 11,-0.6 0.777 107.3 61.1 -71.4 -27.0 -20.6 -9.2 27.6 59 70 A R H 3< S+ 0 0 21 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.674 99.7 56.0 -73.9 -18.0 -17.7 -7.7 25.7 60 71 A S T << S+ 0 0 0 -4,-1.1 2,-0.7 -3,-0.7 -1,-0.2 0.636 81.5 100.3 -88.1 -14.5 -15.3 -8.8 28.4 61 72 A L < + 0 0 0 -3,-0.7 8,-0.6 -4,-0.4 2,-0.4 -0.629 42.2 168.0 -82.3 113.3 -16.2 -12.5 28.2 62 73 A R + 0 0 75 -2,-0.7 -1,-0.1 6,-0.1 5,-0.1 -0.770 25.1 121.2-127.8 84.7 -13.6 -14.4 26.2 63 74 A H > - 0 0 19 -2,-0.4 3,-1.5 3,-0.3 5,-0.2 -0.991 63.3-126.2-147.1 147.1 -14.1 -18.1 26.6 64 75 A P T 3 S+ 0 0 66 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.763 111.9 48.9 -70.5 -22.3 -14.8 -20.9 24.1 65 76 A N T 3 S+ 0 0 0 47,-0.1 82,-2.6 81,-0.1 2,-0.4 0.251 100.5 82.1 -98.7 10.6 -17.8 -22.1 26.0 66 77 A I B < S-e 147 0B 0 -3,-1.5 2,-1.3 80,-0.2 -3,-0.3 -0.934 91.5-106.7-118.2 141.5 -19.3 -18.6 26.3 67 78 A V - 0 0 1 80,-2.5 82,-0.2 -2,-0.4 -6,-0.1 -0.473 49.3-145.0 -63.2 94.5 -21.4 -16.7 23.8 68 79 A R - 0 0 73 -2,-1.3 16,-1.9 -5,-0.2 2,-0.2 -0.281 6.3-118.2 -68.3 147.5 -18.7 -14.3 22.8 69 80 A F E -D 83 0A 2 -11,-0.6 14,-0.2 -8,-0.6 -1,-0.1 -0.550 28.0-177.0 -84.4 154.1 -19.4 -10.6 21.9 70 81 A K E - 0 0 65 12,-1.8 2,-0.2 1,-0.2 193,-0.2 0.764 45.3 -45.5-117.0 -56.5 -18.6 -9.5 18.4 71 82 A E E -D 82 0A 32 11,-1.5 11,-2.6 191,-0.1 2,-0.4 -0.881 37.3-121.7 173.9 140.6 -19.2 -5.8 17.6 72 83 A V E -D 81 0A 1 -2,-0.2 2,-0.4 9,-0.2 9,-0.2 -0.874 27.1-171.2 -98.3 144.2 -21.6 -2.9 17.9 73 84 A I E -D 80 0A 15 7,-2.3 7,-3.2 -2,-0.4 2,-0.6 -0.996 14.6-137.7-132.7 138.5 -22.8 -1.2 14.8 74 85 A L E +D 79 0A 46 -2,-0.4 5,-0.2 5,-0.2 3,-0.0 -0.872 22.1 174.4-103.2 125.6 -24.8 2.0 14.6 75 86 A T - 0 0 13 3,-2.5 -70,-0.0 -2,-0.6 -32,-0.0 -0.848 43.4-113.9-116.4 158.0 -27.7 2.4 12.1 76 87 A P S S+ 0 0 113 0, 0.0 -33,-0.1 0, 0.0 -1,-0.1 0.912 117.4 45.5 -61.0 -41.9 -29.9 5.5 12.1 77 88 A T S S- 0 0 65 1,-0.2 -34,-1.8 -74,-0.1 2,-0.3 0.888 125.9 -12.8 -64.9 -42.8 -32.9 3.4 13.2 78 89 A H E -C 42 0A 33 -36,-0.2 -3,-2.5 -35,-0.1 2,-0.5 -0.985 63.3 -96.4-156.8 162.2 -31.1 1.4 16.0 79 90 A L E -CD 41 74A 0 -38,-2.9 -38,-2.6 -2,-0.3 2,-0.6 -0.755 41.5-146.8 -78.3 127.8 -28.0 0.2 17.8 80 91 A A E -CD 40 73A 0 -7,-3.2 -7,-2.3 -2,-0.5 2,-0.6 -0.901 8.9-162.4-100.3 122.8 -27.0 -3.2 16.5 81 92 A I E -CD 39 72A 0 -42,-2.9 -42,-2.6 -2,-0.6 2,-0.5 -0.915 10.8-163.0-104.5 114.0 -25.4 -5.7 18.9 82 93 A V E +CD 38 71A 2 -11,-2.6 -12,-1.8 -2,-0.6 -11,-1.5 -0.843 17.0 160.9-103.2 127.2 -23.7 -8.5 17.0 83 94 A M E -CD 37 69A 4 -46,-2.6 -46,-3.1 -2,-0.5 -14,-0.2 -0.925 45.3 -81.6-139.3 163.4 -22.7 -11.7 18.8 84 95 A E E -C 36 0A 25 -16,-1.9 2,-0.5 -2,-0.3 -48,-0.2 -0.403 44.3-137.7 -66.3 139.7 -21.8 -15.3 17.9 85 96 A Y - 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0 0 3 78,-2.8 2,-0.1 -2,-0.3 -6,-0.0 -0.354 32.3-107.6 -78.3 156.2 -67.0 -13.5 44.0 657 113 C S > - 0 0 65 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.412 39.5-106.9 -66.1 160.3 -69.1 -11.3 46.2 658 114 C E H > S+ 0 0 39 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.913 120.0 50.8 -55.4 -43.7 -68.5 -12.0 49.9 659 115 C D H > S+ 0 0 84 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.845 110.2 48.6 -67.1 -36.9 -71.8 -13.8 50.3 660 116 C E H > S+ 0 0 58 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.851 109.7 51.6 -71.8 -35.8 -71.2 -16.1 47.3 661 117 C A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.885 109.3 50.8 -69.2 -34.3 -67.7 -16.9 48.6 662 118 C R H X S+ 0 0 9 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.860 104.7 59.2 -66.5 -34.3 -69.3 -17.8 52.0 663 119 C F H X S+ 0 0 53 -4,-1.5 4,-1.1 1,-0.2 -1,-0.2 0.887 114.1 34.9 -60.1 -42.6 -71.7 -20.0 50.1 664 120 C F H X S+ 0 0 2 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.857 114.3 56.5 -81.6 -38.8 -68.9 -22.1 48.6 665 121 C F H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.857 103.4 55.3 -64.0 -36.6 -66.6 -22.0 51.6 666 122 C Q H X S+ 0 0 5 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.966 111.5 44.2 -59.6 -50.6 -69.3 -23.4 53.8 667 123 C Q H X S+ 0 0 0 -4,-1.1 4,-2.8 1,-0.2 5,-0.2 0.930 112.4 52.8 -55.8 -47.9 -69.6 -26.4 51.4 668 124 C L H X S+ 0 0 4 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.908 113.1 42.4 -55.0 -47.9 -65.8 -26.8 51.2 669 125 C I H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.864 113.1 52.6 -73.8 -37.3 -65.3 -26.9 54.9 670 126 C S H X S+ 0 0 3 -4,-2.3 4,-1.6 -5,-0.3 -1,-0.2 0.929 113.7 44.2 -62.7 -41.0 -68.3 -29.2 55.4 671 127 C G H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.892 115.4 46.6 -69.3 -39.4 -66.9 -31.6 52.8 672 128 C V H X S+ 0 0 0 -4,-2.2 4,-1.6 -5,-0.2 -1,-0.2 0.850 109.5 54.4 -75.1 -35.6 -63.4 -31.5 54.1 673 129 C S H X S+ 0 0 30 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.906 110.2 48.2 -64.3 -39.9 -64.5 -31.9 57.7 674 130 C Y H >X S+ 0 0 51 -4,-1.6 4,-0.8 1,-0.2 3,-0.5 0.960 109.1 51.2 -63.7 -52.9 -66.3 -35.1 56.6 675 131 C A H 3< S+ 0 0 18 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.834 109.2 53.3 -54.1 -31.8 -63.4 -36.4 54.8 676 132 C H H >< S+ 0 0 25 -4,-1.6 3,-1.2 1,-0.2 -1,-0.2 0.852 106.7 49.3 -75.4 -36.1 -61.3 -35.9 57.8 677 133 C A H << S+ 0 0 89 -4,-1.6 -1,-0.2 -3,-0.5 -2,-0.2 0.577 104.4 62.9 -75.5 -9.8 -63.6 -37.8 60.1 678 134 C M T 3< 0 0 85 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.279 360.0 360.0-101.5 8.8 -63.6 -40.5 57.6 679 135 C Q < 0 0 201 -3,-1.2 -3,-0.1 -5,-0.1 -4,-0.0 -0.285 360.0 360.0-162.6 360.0 -59.8 -41.0 58.0 680 ! 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 0.0 681 140 C D 0 0 180 0, 0.0 2,-0.3 0, 0.0 38,-0.0 0.000 360.0 360.0 360.0 146.8 -55.6 -36.6 50.1 682 141 C L - 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0 0 9 0, 0.0 2,-0.6 0, 0.0 -4,-0.1 0.255 10.9-126.1 -27.3 144.4 -73.6 -24.9 41.8 696 155 C R - 0 0 77 -29,-0.0 -6,-2.1 -77,-0.0 -32,-0.1 -0.905 25.1-118.7-102.8 120.0 -72.8 -27.5 44.5 697 156 C L E -U 689 0I 1 -2,-0.6 2,-0.4 -8,-0.2 -8,-0.2 -0.248 33.0-162.4 -56.3 138.6 -69.1 -27.7 45.3 698 157 C K E -U 688 0I 13 -10,-3.0 -10,-3.1 -8,-0.1 2,-0.4 -0.960 10.1-153.5-131.7 126.1 -67.7 -31.2 44.5 699 158 C I B -s 621 0H 1 -79,-2.2 -77,-2.3 -2,-0.4 2,-0.6 -0.759 16.1-140.3 -97.1 132.9 -64.5 -32.7 45.8 700 159 C A 0 0 23 -2,-0.4 -17,-0.5 -17,-0.2 -77,-0.0 -0.832 360.0 360.0-100.3 113.9 -62.8 -35.4 43.6 701 160 C D 0 0 91 -2,-0.6 -1,-0.1 -79,-0.2 -19,-0.0 -0.338 360.0 360.0-116.6 360.0 -61.2 -38.5 45.1 702 ! 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 0.0 703 179 C T 0 0 62 0, 0.0 3,-0.4 0, 0.0 -501,-0.2 0.000 360.0 360.0 360.0-164.7 -49.2 -24.4 42.2 704 180 C P > + 0 0 6 0, 0.0 3,-1.9 0, 0.0 51,-0.0 0.741 360.0 72.3 -85.4 -21.4 -47.1 -23.1 45.1 705 181 C A T 3 S+ 0 0 0 1,-0.3 24,-0.1 24,-0.0 37,-0.0 0.856 90.9 64.0 -58.9 -31.3 -49.4 -20.7 47.0 706 182 C Y T 3 S+ 0 0 10 -3,-0.4 2,-1.0 1,-0.1 -1,-0.3 0.580 79.2 107.7 -67.2 -5.3 -51.4 -23.7 48.3 707 183 C I < - 0 0 0 -3,-1.9 5,-0.1 18,-0.1 -1,-0.1 -0.608 65.6-142.5 -85.8 103.4 -48.3 -24.9 50.1 708 184 C A > - 0 0 0 -2,-1.0 4,-0.7 14,-0.2 3,-0.1 -0.139 22.6-117.0 -46.4 151.4 -48.6 -24.4 53.9 709 185 C P H >> S+ 0 0 0 0, 0.0 3,-1.4 0, 0.0 4,-0.7 0.919 112.4 66.7 -60.5 -46.6 -45.3 -23.3 55.6 710 186 C E H >> S+ 0 0 7 72,-0.3 4,-4.8 1,-0.3 3,-1.4 0.890 102.6 50.8 -31.8 -53.6 -45.2 -26.5 57.7 711 187 C V H 34 S+ 0 0 3 1,-0.3 -1,-0.3 2,-0.3 -3,-0.1 0.764 109.2 46.1 -62.9 -34.8 -44.6 -28.2 54.3 712 188 C L H << S+ 0 0 8 -3,-1.4 -1,-0.3 -4,-0.7 -2,-0.2 0.334 126.2 36.2 -87.1 5.9 -41.8 -25.9 53.2 713 189 C L H << S+ 0 0 104 -3,-1.4 2,-0.4 -4,-0.7 -2,-0.3 0.704 107.3 56.8-124.9 -43.1 -40.4 -26.4 56.7 714 190 C K < - 0 0 118 -4,-4.8 3,-0.3 -5,-0.3 -1,-0.2 -0.844 55.9-147.7-110.9 135.5 -41.0 -30.0 58.0 715 191 C K S S+ 0 0 98 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.792 101.8 24.7 -56.9 -29.4 -40.0 -33.4 56.6 716 192 C E S S+ 0 0 156 -6,-0.1 -1,-0.3 -3,-0.0 2,-0.1 -0.855 78.9 165.3-146.3 106.3 -43.2 -34.6 58.3 717 193 C Y - 0 0 93 -2,-0.3 2,-0.6 -3,-0.3 -6,-0.0 -0.417 43.5 -89.3-105.0-177.8 -46.2 -32.4 59.1 718 194 C D > - 0 0 90 -2,-0.1 4,-1.6 1,-0.1 3,-0.4 -0.879 29.3-157.5 -95.0 120.7 -49.9 -32.8 60.0 719 195 C G H > S+ 0 0 32 -2,-0.6 4,-0.8 1,-0.2 -1,-0.1 0.580 85.7 62.1 -80.6 -10.3 -52.1 -33.0 56.9 720 196 C K H > S+ 0 0 91 2,-0.2 4,-1.0 1,-0.1 -1,-0.2 0.832 108.6 41.9 -80.2 -37.4 -55.3 -31.9 58.6 721 197 C V H > S+ 0 0 33 -3,-0.4 4,-1.7 2,-0.2 -2,-0.2 0.828 110.8 57.0 -76.4 -35.2 -53.9 -28.5 59.5 722 198 C A H X S+ 0 0 7 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.838 103.4 56.1 -62.7 -33.2 -52.2 -28.2 56.1 723 199 C D H X S+ 0 0 23 -4,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.866 101.2 55.5 -65.3 -39.4 -55.7 -28.6 54.6 724 200 C V H X S+ 0 0 2 -4,-1.0 4,-2.1 2,-0.2 -2,-0.2 0.941 106.4 51.2 -59.9 -46.4 -57.1 -25.7 56.5 725 201 C W H >X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 3,-0.6 0.957 109.1 51.2 -53.5 -50.7 -54.4 -23.5 55.0 726 202 C S H 3X S+ 0 0 6 -4,-1.9 4,-2.0 1,-0.3 -1,-0.2 0.871 107.9 52.0 -52.8 -41.6 -55.4 -24.8 51.6 727 203 C C H 3X S+ 0 0 0 -4,-2.3 4,-1.5 1,-0.2 -1,-0.3 0.834 106.8 55.0 -67.2 -30.0 -59.0 -23.9 52.4 728 204 C G H - 0 0 56 -2,-0.3 3,-0.6 1,-0.1 -9,-0.1 -0.321 36.2-126.6 -65.1 152.9 -53.6 -16.1 44.5 740 216 C P T 3 S+ 0 0 5 0, 0.0 21,-0.4 0, 0.0 -1,-0.1 0.661 96.3 43.9 -76.2 -24.8 -52.6 -14.8 48.0 741 217 C F T 3 S+ 0 0 0 19,-0.1 2,-0.4 2,-0.0 13,-0.3 -0.189 90.5 88.6-122.6 49.4 -48.8 -15.2 47.9 742 218 C E < 0 0 52 -3,-0.6 9,-0.1 12,-0.1 6,-0.0 -0.976 360.0 360.0-146.4 127.5 -47.6 -13.9 44.5 743 219 C D 0 0 90 -2,-0.4 4,-0.1 4,-0.1 8,-0.0 -0.095 360.0 360.0 -93.7 360.0 -46.6 -10.4 43.4 744 ! 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 0.0 745 223 C P 0 0 107 0, 0.0 3,-0.0 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 -28.9 -46.0 -13.8 38.9 746 224 C K + 0 0 130 0, 0.0 2,-0.9 0, 0.0 5,-0.1 0.378 360.0 126.0-152.8 -27.7 -43.8 -16.9 38.7 747 225 C N >> - 0 0 103 1,-0.2 4,-3.3 2,-0.1 3,-1.0 -0.186 42.3-164.9 -45.9 89.3 -40.7 -16.2 40.8 748 226 C F H 3> S+ 0 0 24 -2,-0.9 4,-3.6 1,-0.3 5,-0.3 0.851 88.5 52.9 -48.4 -39.2 -41.0 -19.3 42.9 749 227 C R H 3> S+ 0 0 65 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.850 112.5 43.7 -66.5 -36.2 -38.5 -17.8 45.3 750 228 C K H <> S+ 0 0 106 -3,-1.0 4,-1.3 2,-0.2 -2,-0.2 0.898 119.6 42.5 -75.2 -43.2 -40.6 -14.6 45.6 751 229 C T H X S+ 0 0 1 -4,-3.3 4,-1.8 2,-0.2 3,-0.4 0.964 117.5 45.2 -65.2 -54.2 -43.8 -16.6 45.9 752 230 C I H X S+ 0 0 3 -4,-3.6 4,-1.9 -5,-0.3 -3,-0.2 0.870 110.1 55.7 -59.0 -39.3 -42.4 -19.2 48.3 753 231 C H H X S+ 0 0 37 -4,-1.5 4,-1.8 -5,-0.3 -1,-0.2 0.859 105.6 52.1 -63.1 -35.7 -40.8 -16.5 50.4 754 232 C R H <>S+ 0 0 78 -4,-1.3 5,-2.1 -3,-0.4 -1,-0.2 0.887 106.1 54.5 -67.3 -38.9 -44.1 -14.7 50.8 755 233 C I H ><5S+ 0 0 0 -4,-1.8 3,-1.1 -14,-0.3 -2,-0.2 0.915 107.3 50.7 -59.7 -44.3 -45.7 -18.0 52.0 756 234 C L H 3<5S+ 0 0 39 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.916 114.2 41.7 -61.6 -46.9 -43.0 -18.4 54.7 757 235 C N T 3<5S- 0 0 83 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.287 105.4-128.5 -85.7 11.0 -43.4 -14.9 56.1 758 236 C V T < 5 + 0 0 34 -3,-1.1 2,-0.9 1,-0.2 -3,-0.2 0.880 50.2 162.3 41.9 48.6 -47.2 -15.1 55.8 759 237 C Q < + 0 0 113 -5,-2.1 2,-0.3 -6,-0.1 -1,-0.2 -0.814 3.7 147.1-103.9 96.7 -47.2 -11.8 53.9 760 238 C Y - 0 0 62 -2,-0.9 2,-0.3 -3,-0.1 -19,-0.1 -0.863 27.9-157.2-122.6 160.0 -50.5 -11.4 52.0 761 239 C A - 0 0 73 -21,-0.4 3,-0.1 -2,-0.3 -2,-0.0 -0.821 13.3-142.0-145.6 107.0 -52.4 -8.2 51.2 762 240 C I - 0 0 23 -2,-0.3 -2,-0.0 1,-0.1 -30,-0.0 -0.465 40.4-112.8 -61.7 120.6 -56.1 -7.8 50.3 763 241 C P > - 0 0 32 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 -0.080 21.6-113.9 -52.1 156.5 -56.1 -5.1 47.6 764 242 C D T 3 S+ 0 0 159 1,-0.2 -2,-0.1 -3,-0.1 0, 0.0 0.891 113.0 57.6 -60.8 -44.0 -57.8 -1.7 48.6 765 243 C Y T 3 S+ 0 0 81 2,-0.1 2,-0.7 72,-0.0 -1,-0.2 0.553 88.1 88.6 -68.1 -7.8 -60.7 -2.1 46.1 766 244 C V < - 0 0 2 -3,-1.0 2,-0.8 2,-0.0 -30,-0.1 -0.857 64.0-165.5 -93.1 115.1 -61.7 -5.4 47.8 767 245 C H + 0 0 142 -2,-0.7 2,-0.3 0, 0.0 -109,-0.2 -0.871 14.1 168.6-106.6 103.6 -64.1 -4.6 50.6 768 246 C I - 0 0 17 -2,-0.8 5,-0.0 1,-0.1 -2,-0.0 -0.873 40.1-100.7-108.6 152.2 -64.7 -7.5 53.0 769 247 C S > - 0 0 27 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.214 33.7-116.3 -56.6 150.0 -66.4 -7.5 56.4 770 248 C P H > S+ 0 0 94 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.816 115.7 58.6 -67.7 -26.1 -64.0 -7.4 59.4 771 249 C E H > S+ 0 0 70 2,-0.2 4,-2.5 1,-0.2 27,-0.2 0.934 108.2 47.6 -62.9 -43.3 -65.3 -10.8 60.6 772 250 C C H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.917 110.6 50.7 -61.0 -44.0 -64.2 -12.1 57.2 773 251 C R H X S+ 0 0 108 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.858 109.7 52.3 -62.7 -36.0 -60.9 -10.4 57.5 774 252 C H H X S+ 0 0 98 -4,-2.3 4,-1.7 2,-0.2 3,-0.3 0.967 107.0 50.5 -64.2 -53.7 -60.5 -12.0 61.0 775 253 C L H >X S+ 0 0 0 -4,-2.5 4,-1.3 1,-0.2 3,-0.8 0.935 109.4 51.2 -50.6 -54.0 -61.2 -15.5 59.8 776 254 C I H 3X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 3,-0.4 0.872 109.4 50.7 -51.1 -40.6 -58.6 -15.2 57.0 777 255 C S H 3< S+ 0 0 45 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.776 107.6 53.5 -73.4 -24.7 -56.0 -14.0 59.5 778 256 C R H << S+ 0 0 73 -4,-1.7 10,-2.1 -3,-0.8 3,-0.3 0.688 111.7 45.8 -79.5 -21.7 -56.7 -16.9 61.7 779 257 C I H < S+ 0 0 0 -4,-1.3 2,-1.9 -3,-0.4 -2,-0.2 0.884 101.6 65.2 -86.9 -42.0 -56.1 -19.3 58.9 780 258 C F S < S+ 0 0 4 -4,-2.3 2,-0.4 -5,-0.2 -1,-0.2 -0.441 71.0 127.9 -83.8 64.9 -52.9 -17.8 57.5 781 259 C V - 0 0 35 -2,-1.9 6,-0.2 -3,-0.3 -56,-0.1 -0.983 51.9-149.3-117.0 129.3 -50.8 -18.5 60.6 782 260 C A S S+ 0 0 37 -2,-0.4 -72,-0.3 1,-0.1 -1,-0.1 0.913 79.2 80.7 -66.6 -41.6 -47.4 -20.3 60.0 783 261 C D >> - 0 0 74 1,-0.2 3,-3.4 2,-0.1 4,-1.1 -0.545 69.9-155.7 -76.0 108.4 -47.4 -22.1 63.3 784 262 C P G >4 S+ 0 0 47 0, 0.0 3,-0.6 0, 0.0 -1,-0.2 0.843 92.8 60.2 -51.1 -41.8 -49.6 -25.2 62.8 785 263 C A G 34 S+ 0 0 90 1,-0.2 -2,-0.1 -3,-0.1 -3,-0.0 0.746 111.8 40.5 -57.0 -24.0 -50.3 -25.4 66.4 786 264 C K G <4 S+ 0 0 135 -3,-3.4 -1,-0.2 2,-0.1 3,-0.1 0.569 87.7 107.7-107.3 -11.9 -51.7 -21.9 66.3 787 265 C R S << S- 0 0 11 -4,-1.1 -8,-0.2 -3,-0.6 -9,-0.1 -0.362 81.8 -99.1 -64.9 143.4 -53.7 -22.1 63.0 788 266 C I - 0 0 9 -10,-2.1 2,-0.3 -13,-0.2 -1,-0.1 -0.244 41.1-131.0 -62.1 156.4 -57.4 -22.2 63.5 789 267 C S > - 0 0 40 1,-0.1 4,-2.4 -3,-0.1 3,-0.4 -0.766 20.4-105.4-111.8 158.8 -59.0 -25.7 63.3 790 268 C I H > S+ 0 0 11 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.887 121.0 50.5 -46.2 -48.5 -62.0 -27.0 61.3 791 269 C P H 4 S+ 0 0 84 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.923 112.3 47.5 -62.1 -37.2 -64.2 -27.1 64.4 792 270 C E H >4 S+ 0 0 98 -3,-0.4 3,-0.5 1,-0.2 -2,-0.2 0.826 109.4 53.5 -67.9 -33.8 -63.2 -23.5 65.3 793 271 C I H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 6,-0.2 0.875 102.8 57.3 -68.3 -37.3 -63.9 -22.4 61.8 794 272 C R T 3< S+ 0 0 79 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.686 109.7 47.1 -66.7 -17.2 -67.4 -24.0 62.0 795 273 C N T < S+ 0 0 128 -3,-0.5 -1,-0.3 -4,-0.5 2,-0.2 0.360 84.9 118.2-103.7 2.3 -68.0 -21.7 65.0 796 274 C H S X> S- 0 0 22 -3,-1.4 4,-2.2 -4,-0.2 3,-0.9 -0.489 70.9-125.3 -76.7 138.1 -66.7 -18.5 63.5 797 275 C E H 3> S+ 0 0 144 1,-0.3 4,-1.2 2,-0.2 -1,-0.1 0.833 111.6 50.3 -46.5 -41.8 -69.1 -15.6 63.2 798 276 C W H 34 S+ 0 0 2 -27,-0.2 -1,-0.3 1,-0.2 -26,-0.1 0.801 110.6 49.4 -70.6 -32.1 -68.4 -15.3 59.5 799 277 C F H <4 S+ 0 0 0 -3,-0.9 -2,-0.2 -6,-0.2 -1,-0.2 0.834 107.6 54.1 -76.5 -32.2 -69.0 -19.0 58.9 800 278 C L H >< S+ 0 0 83 -4,-2.2 3,-2.2 2,-0.1 -2,-0.2 0.790 79.8 106.7 -75.5 -28.1 -72.3 -19.0 60.8 801 279 C K T 3< S- 0 0 104 -4,-1.2 -5,-0.0 1,-0.3 -3,-0.0 -0.332 104.6 -13.2 -53.4 117.0 -73.9 -16.2 58.7 802 280 C N T 3 S+ 0 0 115 1,-0.2 -1,-0.3 -2,-0.2 -2,-0.1 0.708 87.5 165.0 64.1 17.7 -76.5 -17.8 56.4 803 281 C L < - 0 0 40 -3,-2.2 -1,-0.2 1,-0.1 -140,-0.1 -0.601 46.4-115.2 -71.4 109.1 -75.1 -21.3 57.1 804 282 C P - 0 0 48 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 -0.195 13.7-132.0 -45.8 133.4 -77.9 -23.5 55.8 805 283 C A S S+ 0 0 111 1,-0.2 -2,-0.1 3,-0.0 -3,-0.0 0.575 107.8 62.8 -63.1 -7.2 -79.2 -25.4 58.8 806 284 C D S S+ 0 0 155 2,-0.0 -1,-0.2 0, 0.0 -3,-0.0 0.959 83.2 83.3 -80.4 -58.8 -78.8 -28.3 56.4 807 285 C L 0 0 21 1,-0.3 -140,-0.1 -3,-0.0 -141,-0.0 -0.102 360.0 360.0 -53.3 145.8 -75.0 -28.2 55.8 808 286 C M 0 0 72 -141,-0.1 -1,-0.3 -142,-0.0 -2,-0.0 0.792 360.0 360.0 55.5 360.0 -72.8 -30.0 58.4 809 ! 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 0.0 810 302 C G 0 0 102 0, 0.0 -184,-0.1 0, 0.0 -185,-0.0 0.000 360.0 360.0 360.0-160.8 -77.6 -47.7 46.2 811 303 C Q - 0 0 25 -186,-0.6 2,-0.1 1,-0.1 0, 0.0 -0.280 360.0-104.9 -68.5 156.0 -76.6 -51.4 46.0 812 304 C S > - 0 0 38 1,-0.1 4,-2.2 4,-0.0 5,-0.2 -0.339 26.1-109.3 -79.4 162.6 -75.3 -53.2 49.0 813 305 C I H > S+ 0 0 71 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.803 122.4 52.9 -59.6 -29.1 -71.7 -54.2 49.8 814 306 C E H > S+ 0 0 140 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.884 106.5 50.3 -74.0 -40.9 -72.7 -57.8 49.1 815 307 C E H > S+ 0 0 103 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.880 113.9 46.1 -64.0 -39.0 -74.3 -56.9 45.7 816 308 C I H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.901 110.4 52.3 -70.6 -42.7 -71.1 -55.1 44.7 817 309 C M H X S+ 0 0 73 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.890 109.9 49.4 -60.8 -41.0 -68.8 -57.8 45.9 818 310 C Q H X S+ 0 0 115 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.905 109.9 50.1 -65.3 -43.0 -70.7 -60.4 43.9 819 311 C I H X S+ 0 0 33 -4,-1.7 4,-1.1 1,-0.2 -1,-0.2 0.776 109.7 52.6 -67.1 -26.5 -70.6 -58.3 40.7 820 312 C I H X S+ 0 0 8 -4,-1.6 4,-1.0 2,-0.2 -1,-0.2 0.810 106.2 53.7 -78.1 -31.4 -66.8 -57.9 41.2 821 313 C A H >X S+ 0 0 44 -4,-1.5 3,-0.8 2,-0.2 4,-0.5 0.960 107.6 48.0 -67.0 -53.2 -66.3 -61.6 41.6 822 314 C E H >< S+ 0 0 79 -4,-1.9 3,-1.6 1,-0.3 -1,-0.2 0.876 107.7 57.4 -54.9 -40.1 -68.0 -62.5 38.3 823 315 C A H 3< S+ 0 0 0 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.827 95.1 65.1 -61.4 -32.4 -66.0 -59.8 36.5 824 316 C T H << 0 0 70 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.705 360.0 360.0 -63.5 -19.1 -62.8 -61.5 37.7 825 317 C V << 0 0 117 -3,-1.6 -226,-0.0 -4,-0.5 -225,-0.0 -0.714 360.0 360.0 -88.7 360.0 -63.8 -64.4 35.5 826 !* 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 0.0 827 12 D L 0 0 116 0, 0.0 3,-0.1 0, 0.0 23,-0.0 0.000 360.0 360.0 360.0 -33.8 -53.7 0.2 32.5 828 13 D P - 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0 0 41 1,-0.2 4,-1.2 2,-0.1 3,-0.4 0.028 53.6-173.3 -30.3 95.9 -54.4 -16.7 9.4 1570 226 F F H > S+ 0 0 38 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.678 78.5 67.1 -73.5 -17.4 -54.8 -20.0 7.5 1571 227 F R H > S+ 0 0 61 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.872 101.9 45.2 -69.7 -38.1 -57.5 -18.3 5.4 1572 228 F K H > S+ 0 0 62 -3,-0.4 4,-1.4 -6,-0.2 -2,-0.2 0.839 113.5 50.0 -73.8 -34.6 -55.0 -16.0 3.8 1573 229 F T H X S+ 0 0 11 -4,-1.2 4,-1.8 1,-0.2 -2,-0.2 0.875 105.5 56.0 -71.1 -38.7 -52.5 -18.9 3.2 1574 230 F I H X S+ 0 0 4 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.822 107.1 51.1 -63.3 -31.4 -55.1 -21.1 1.7 1575 231 F H H X S+ 0 0 36 -4,-1.0 4,-1.6 2,-0.2 -1,-0.2 0.877 107.2 51.2 -74.1 -38.9 -55.8 -18.4 -0.9 1576 232 F R H <>S+ 0 0 66 -4,-1.4 5,-3.1 -15,-0.2 -2,-0.2 0.842 108.8 54.1 -66.1 -33.3 -52.2 -18.0 -1.8 1577 233 F I H ><5S+ 0 0 0 -4,-1.8 3,-2.0 -16,-0.2 -2,-0.2 0.970 106.9 49.3 -62.3 -54.1 -52.0 -21.7 -2.3 1578 234 F L H 3<5S+ 0 0 29 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.806 118.4 40.0 -61.4 -28.5 -54.9 -21.7 -4.8 1579 235 F N T 3<5S- 0 0 109 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.286 108.6-124.7-103.5 11.3 -53.4 -18.9 -6.8 1580 236 F V T < 5 + 0 0 35 -3,-2.0 2,-0.6 1,-0.2 -3,-0.2 0.902 47.2 171.0 49.3 51.7 -49.9 -20.3 -6.4 1581 237 F Q < + 0 0 72 -5,-3.1 2,-0.3 -6,-0.1 -1,-0.2 -0.859 16.1 119.4-100.2 114.8 -48.6 -17.1 -5.0 1582 238 F Y - 0 0 59 -2,-0.6 2,-0.3 -21,-0.1 -21,-0.1 -0.948 34.2-165.2-161.2 157.1 -45.1 -17.2 -3.6 1583 239 F A - 0 0 75 -2,-0.3 3,-0.0 -23,-0.3 -2,-0.0 -0.976 27.4-120.9-149.1 143.7 -41.8 -15.4 -4.4 1584 240 F I - 0 0 18 -2,-0.3 6,-0.1 1,-0.1 -2,-0.0 -0.777 46.2-112.6 -84.6 113.9 -38.3 -16.2 -3.3 1585 241 F P > - 0 0 34 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.052 22.3-110.3 -53.9 159.2 -37.2 -13.1 -1.4 1586 242 F D T 3 S+ 0 0 152 1,-0.3 -2,-0.0 3,-0.0 0, 0.0 0.698 114.4 57.3 -68.4 -21.7 -34.5 -10.9 -3.0 1587 243 F Y T 3 S+ 0 0 73 1,-0.1 2,-1.0 2,-0.1 -1,-0.3 0.768 86.9 86.3 -76.0 -25.6 -31.9 -11.8 -0.4 1588 244 F V < - 0 0 5 -3,-1.1 2,-0.5 2,-0.0 -1,-0.1 -0.658 69.5-160.2 -80.3 101.7 -32.2 -15.5 -1.1 1589 245 F H + 0 0 146 -2,-1.0 2,-0.4 0, 0.0 -117,-0.2 -0.778 17.5 173.2 -93.0 131.1 -29.8 -16.1 -4.1 1590 246 F I - 0 0 16 -2,-0.5 5,-0.1 -6,-0.1 -6,-0.0 -0.998 36.1-104.4-151.5 118.5 -30.6 -19.2 -5.9 1591 247 F S > - 0 0 27 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.012 31.7-122.1 -48.1 146.9 -29.3 -20.8 -9.1 1592 248 F P H > S+ 0 0 91 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.831 113.4 57.7 -69.9 -24.0 -31.7 -20.4 -12.0 1593 249 F E H > S+ 0 0 68 2,-0.2 4,-2.5 1,-0.2 27,-0.2 0.933 108.9 46.9 -61.6 -44.6 -31.8 -24.2 -12.5 1594 250 F C H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.910 110.9 51.3 -60.5 -43.6 -33.0 -24.4 -8.9 1595 251 F R H X S+ 0 0 113 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.875 109.3 51.8 -62.2 -38.6 -35.5 -21.6 -9.6 1596 252 F H H X S+ 0 0 93 -4,-2.4 4,-1.6 2,-0.2 3,-0.3 0.975 106.9 51.5 -61.8 -56.4 -36.8 -23.6 -12.6 1597 253 F L H >X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.3 3,-0.7 0.898 109.2 50.3 -45.0 -52.9 -37.3 -26.8 -10.6 1598 254 F I H 3X S+ 0 0 4 -4,-2.0 4,-2.5 1,-0.2 3,-0.5 0.899 108.9 52.9 -55.9 -39.6 -39.4 -25.0 -8.0 1599 255 F S H 3< S+ 0 0 51 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.761 106.8 52.1 -72.6 -23.0 -41.5 -23.4 -10.7 1600 256 F R H << S+ 0 0 72 -4,-1.6 10,-2.0 -3,-0.7 -1,-0.3 0.693 111.7 47.3 -82.4 -23.3 -42.2 -26.8 -12.2 1601 257 F I H < S+ 0 0 0 -4,-1.4 2,-2.2 -3,-0.5 -2,-0.2 0.907 100.5 64.6 -82.8 -44.5 -43.4 -28.1 -8.9 1602 258 F F S < S+ 0 0 9 -4,-2.5 2,-0.4 -5,-0.2 -1,-0.2 -0.449 72.2 132.9 -83.0 67.9 -45.6 -25.3 -7.9 1603 259 F V - 0 0 39 -2,-2.2 6,-0.1 -3,-0.3 -58,-0.1 -0.976 51.4-143.2-118.4 134.8 -48.1 -25.8 -10.7 1604 260 F A S S+ 0 0 40 -2,-0.4 -74,-0.4 -75,-0.1 -1,-0.1 0.915 81.2 67.3 -68.9 -51.4 -51.8 -25.8 -9.9 1605 261 F D S >> S- 0 0 66 1,-0.2 3,-2.1 -76,-0.1 4,-0.8 -0.648 77.2-142.7 -85.7 118.0 -53.2 -28.4 -12.2 1606 262 F P G >4 S+ 0 0 21 0, 0.0 3,-0.7 0, 0.0 -1,-0.2 0.794 95.3 61.3 -53.6 -35.5 -51.9 -31.8 -11.1 1607 263 F A G 34 S+ 0 0 91 1,-0.2 -3,-0.0 -3,-0.0 -2,-0.0 0.822 107.7 44.5 -61.2 -31.3 -51.5 -33.1 -14.7 1608 264 F K G <4 S+ 0 0 150 -3,-2.1 -1,-0.2 2,-0.1 -4,-0.1 0.601 88.5 109.1 -92.6 -10.2 -49.0 -30.4 -15.6 1609 265 F R S << S- 0 0 9 -4,-0.8 -8,-0.2 -3,-0.7 -9,-0.1 -0.361 81.9-100.5 -65.2 144.6 -47.0 -30.7 -12.4 1610 266 F I - 0 0 6 -10,-2.0 2,-0.3 -13,-0.2 -1,-0.1 -0.287 41.0-130.4 -64.2 151.4 -43.5 -32.2 -12.8 1611 267 F S > - 0 0 42 1,-0.1 4,-3.0 -3,-0.1 3,-0.3 -0.719 19.1-107.2-107.2 157.4 -43.3 -35.8 -11.8 1612 268 F I H > S+ 0 0 13 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.913 120.4 51.6 -45.1 -51.6 -40.8 -37.7 -9.6 1613 269 F P H 4 S+ 0 0 94 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 0.927 112.4 45.7 -56.1 -42.6 -39.2 -39.4 -12.7 1614 270 F E H >4 S+ 0 0 91 -3,-0.3 3,-1.3 1,-0.2 -2,-0.2 0.892 109.7 55.1 -67.0 -37.7 -38.7 -35.9 -14.3 1615 271 F I H >< S+ 0 0 0 -4,-3.0 3,-2.0 1,-0.3 6,-0.3 0.922 102.9 56.2 -59.5 -41.6 -37.4 -34.5 -11.1 1616 272 F R T 3< S+ 0 0 96 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.647 108.8 48.7 -64.6 -13.8 -34.8 -37.2 -11.0 1617 273 F N T < S+ 0 0 126 -3,-1.3 2,-0.3 -4,-0.4 -1,-0.3 0.223 84.3 121.6-109.3 11.7 -33.7 -36.0 -14.4 1618 274 F H X> - 0 0 22 -3,-2.0 4,-2.5 1,-0.1 3,-0.5 -0.579 68.6-128.9 -79.3 136.5 -33.5 -32.3 -13.5 1619 275 F E H 3> S+ 0 0 140 -2,-0.3 4,-1.2 1,-0.3 -1,-0.1 0.846 111.0 49.3 -49.9 -39.0 -30.2 -30.6 -14.1 1620 276 F W H 34 S+ 0 0 3 -27,-0.2 -1,-0.3 1,-0.2 -26,-0.1 0.851 110.8 48.6 -71.5 -35.6 -30.4 -29.3 -10.5 1621 277 F F H <4 S+ 0 0 4 -3,-0.5 -2,-0.2 -6,-0.3 -1,-0.2 0.830 108.0 55.5 -74.6 -30.8 -31.2 -32.6 -9.0 1622 278 F L H >< S+ 0 0 77 -4,-2.5 3,-2.3 2,-0.1 -1,-0.2 0.835 79.4 107.3 -73.5 -31.9 -28.4 -34.4 -10.9 1623 279 F K T 3< S- 0 0 106 -4,-1.2 -5,-0.0 1,-0.3 -3,-0.0 -0.249 101.6 -9.2 -47.1 115.2 -25.6 -32.0 -9.5 1624 280 F N T 3 S+ 0 0 112 1,-0.2 -1,-0.3 -2,-0.1 -2,-0.1 0.691 85.9 174.8 70.1 17.2 -23.6 -34.0 -7.0 1625 281 F L < - 0 0 81 -3,-2.3 -1,-0.2 1,-0.1 -3,-0.1 -0.432 25.9-133.4 -61.1 116.0 -26.0 -36.9 -7.0 1626 282 F P 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.030 360.0 360.0 -63.1 173.2 -24.4 -39.6 -4.8 1627 283 F A 0 0 159 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.951 360.0 360.0 -85.2 360.0 -24.1 -43.3 -5.8 1628 ! 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 1629 302 F G 0 0 126 0, 0.0 2,-0.5 0, 0.0 -189,-0.1 0.000 360.0 360.0 360.0 -12.1 -33.5 -61.9 9.9 1630 303 F Q - 0 0 28 -191,-0.1 5,-0.1 4,-0.0 0, 0.0 -0.952 360.0-131.6-117.4 117.0 -37.0 -62.9 10.8 1631 304 F S >> - 0 0 52 -2,-0.5 4,-1.9 1,-0.1 3,-0.7 -0.298 24.7-114.7 -63.9 147.6 -39.0 -65.1 8.4 1632 305 F I H 3> S+ 0 0 89 1,-0.3 4,-2.2 2,-0.2 -1,-0.1 0.800 120.8 55.3 -52.3 -29.2 -42.5 -64.0 7.6 1633 306 F E H 3> S+ 0 0 156 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.889 102.6 53.8 -71.0 -41.0 -43.6 -67.2 9.3 1634 307 F E H <> S+ 0 0 94 -3,-0.7 4,-1.6 2,-0.2 -2,-0.2 0.884 111.9 45.8 -60.4 -39.4 -41.7 -66.3 12.5 1635 308 F I H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.936 113.4 47.4 -69.3 -48.3 -43.6 -63.0 12.6 1636 309 F M H X S+ 0 0 65 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.860 110.8 53.8 -61.4 -36.4 -47.0 -64.5 11.9 1637 310 F Q H X S+ 0 0 91 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.894 111.2 44.9 -64.9 -41.0 -46.3 -67.1 14.5 1638 311 F I H X S+ 0 0 27 -4,-1.6 4,-1.4 1,-0.2 -2,-0.2 0.868 109.0 56.0 -70.9 -37.9 -45.5 -64.5 17.1 1639 312 F I H < S+ 0 0 9 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.834 108.9 50.1 -63.1 -32.7 -48.5 -62.4 16.1 1640 313 F A H >X S+ 0 0 40 -4,-1.5 3,-5.5 2,-0.2 4,-0.8 0.998 108.1 46.4 -67.6 -70.7 -50.7 -65.4 16.8 1641 314 F E H 3< S+ 0 0 84 -4,-1.7 3,-0.2 1,-0.3 -1,-0.2 0.774 112.2 56.6 -43.1 -28.3 -49.5 -66.4 20.2 1642 315 F A T 3< S+ 0 0 0 -4,-1.4 -1,-0.3 1,-0.2 -229,-0.2 0.578 92.2 71.6 -81.5 -10.6 -49.9 -62.7 20.9 1643 316 F T T <4 0 0 66 -3,-5.5 -1,-0.2 1,-0.2 -2,-0.2 0.887 360.0 360.0 -71.1 -40.4 -53.6 -62.9 19.8 1644 317 F V < 0 0 138 -4,-0.8 -1,-0.2 -3,-0.2 -232,-0.1 0.426 360.0 360.0 -32.2 360.0 -54.6 -64.8 23.0