==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT/ANTIBIOTIC 27-SEP-12 4HAV . COMPND 2 MOLECULE: GTP-BINDING NUCLEAR PROTEIN RAN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Q.SUN,Y.M.CHOOK . 1343 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 58163.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1023 76.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 63 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 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 . 61 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 150 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 690 51.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.1 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 5 2 4 4 0 0 1 4 0 5 9 0 5 5 2 3 3 3 0 2 1 0 0 0 0 1 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 1 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 PARALLEL BRIDGES PER LADDER . 2 0 1 1 2 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 9 A V 0 0 143 0, 0.0 51,-2.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -50.7 15.8 58.2 45.7 2 10 A Q E -a 52 0A 88 49,-0.2 2,-0.4 51,-0.1 51,-0.2 -0.935 360.0-170.2-138.1 137.0 15.5 54.7 44.1 3 11 A F E -a 53 0A 28 49,-2.4 51,-2.8 -2,-0.3 2,-0.6 -0.984 23.0-129.8-135.6 133.6 13.2 51.6 44.3 4 12 A K E -a 54 0A 23 -2,-0.4 72,-2.8 70,-0.3 73,-1.1 -0.662 29.0-174.7 -78.4 117.4 13.4 48.0 42.9 5 13 A L E -ab 55 77A 0 49,-2.3 51,-3.2 -2,-0.6 2,-0.5 -0.968 8.5-157.5-112.9 126.6 10.1 47.2 41.1 6 14 A V E -ab 56 78A 0 71,-2.0 73,-2.3 -2,-0.5 2,-0.5 -0.904 2.3-157.8-106.3 135.7 9.5 43.7 39.8 7 15 A L E +ab 57 79A 1 49,-2.5 51,-2.1 -2,-0.5 2,-0.3 -0.953 21.0 168.8-115.7 120.2 7.1 43.2 37.0 8 16 A V E + b 0 80A 0 71,-2.5 73,-2.9 -2,-0.5 2,-0.2 -0.897 12.7 106.5-130.9 158.2 5.6 39.6 36.7 9 17 A G E - b 0 81A 0 -2,-0.3 73,-0.1 71,-0.2 3,-0.1 -0.733 64.7 -43.0 151.1 167.6 2.8 37.8 34.8 10 18 A D > - 0 0 22 71,-0.5 3,-1.5 79,-0.3 5,-0.3 -0.059 69.9 -86.3 -52.9 152.6 2.2 35.4 32.0 11 19 A G T 3 S+ 0 0 22 49,-0.6 -1,-0.1 1,-0.2 48,-0.1 -0.323 112.6 20.9 -59.7 134.8 3.9 35.7 28.6 12 20 A G T 3 S+ 0 0 26 -3,-0.1 -1,-0.2 20,-0.1 -2,-0.1 0.490 83.0 118.6 86.9 4.4 2.2 38.1 26.2 13 21 A T S < S- 0 0 0 -3,-1.5 69,-0.2 68,-0.1 101,-0.1 0.695 89.0-103.7 -78.0 -17.9 0.3 40.0 28.8 14 22 A G S > S+ 0 0 11 -4,-0.2 4,-2.7 67,-0.1 5,-0.2 0.648 73.3 139.3 109.2 22.0 2.2 43.2 27.9 15 23 A K H > S+ 0 0 11 -5,-0.3 4,-2.4 1,-0.2 5,-0.2 0.943 79.9 39.8 -59.5 -53.5 4.7 43.8 30.6 16 24 A T H > S+ 0 0 25 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.876 114.4 53.3 -68.9 -38.5 7.5 44.9 28.3 17 25 A T H > S+ 0 0 29 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.935 110.5 48.3 -61.0 -47.1 5.2 46.9 26.1 18 26 A F H X S+ 0 0 0 -4,-2.7 4,-1.7 2,-0.2 -2,-0.2 0.923 112.6 47.6 -57.7 -50.7 3.9 48.8 29.2 19 27 A V H X S+ 0 0 2 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.940 112.4 49.1 -57.1 -48.9 7.5 49.5 30.4 20 28 A K H X>S+ 0 0 59 -4,-2.7 4,-2.8 1,-0.2 5,-1.0 0.880 105.9 57.3 -60.7 -41.0 8.6 50.7 27.0 21 29 A R H X5S+ 0 0 12 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.926 111.0 43.8 -54.1 -44.3 5.6 53.0 26.7 22 30 A H H <5S+ 0 0 4 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.844 117.8 45.2 -69.4 -35.6 6.8 54.6 30.0 23 31 A L H <5S+ 0 0 47 -4,-2.1 -2,-0.2 -5,-0.1 -3,-0.2 0.940 135.2 4.0 -74.5 -52.9 10.5 54.8 28.9 24 32 A T H <5S- 0 0 29 -4,-2.8 -3,-0.2 2,-0.2 -2,-0.1 0.564 92.1-115.0-114.2 -14.8 10.4 56.1 25.4 25 33 A G S < -CD 49 168A 9 3,-1.4 3,-1.9 -2,-0.5 122,-0.2 -0.797 50.5-101.0-127.9 170.1 6.7 64.5 41.7 47 55 A N T 3 S+ 0 0 78 120,-1.8 121,-0.1 1,-0.3 119,-0.0 0.586 125.7 52.8 -66.3 -9.9 5.7 67.3 44.1 48 56 A R T 3 S- 0 0 144 1,-0.5 -1,-0.3 119,-0.3 120,-0.1 0.055 125.6 -93.9-109.5 21.8 8.1 65.5 46.5 49 57 A G E < - C 0 46A 29 -3,-1.9 -3,-1.4 2,-0.1 -1,-0.5 -0.397 68.8 -26.2 96.0-174.6 11.0 65.5 44.0 50 58 A P E - C 0 45A 88 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.454 52.5-161.5 -75.6 145.1 12.2 62.8 41.6 51 59 A I E - C 0 44A 4 -7,-2.9 -7,-3.0 -2,-0.1 2,-0.5 -0.999 5.8-156.9-124.6 130.7 11.4 59.2 42.2 52 60 A K E -aC 2 43A 68 -51,-2.4 -49,-2.4 -2,-0.4 2,-0.5 -0.925 4.1-164.6-111.3 124.9 13.4 56.5 40.4 53 61 A F E -aC 3 42A 0 -11,-3.6 -11,-2.5 -2,-0.5 2,-1.0 -0.944 11.8-151.7-100.8 125.1 12.2 53.0 39.8 54 62 A N E -aC 4 41A 32 -51,-2.8 -49,-2.3 -2,-0.5 2,-0.6 -0.855 26.3-151.8 -91.0 102.1 14.6 50.4 38.8 55 63 A V E -aC 5 40A 0 -15,-3.0 -15,-2.9 -2,-1.0 2,-1.1 -0.710 14.9-163.5 -89.7 114.0 12.2 48.2 36.8 56 64 A W E -aC 6 39A 9 -51,-3.2 -49,-2.5 -2,-0.6 2,-0.9 -0.795 10.4-165.2 -95.5 91.5 13.0 44.5 36.6 57 65 A D E -aC 7 38A 0 -19,-2.7 -19,-2.4 -2,-1.1 2,-0.1 -0.722 16.5-158.1 -82.5 106.3 10.8 43.4 33.7 58 66 A T E - C 0 37A 3 -51,-2.1 2,-0.3 -2,-0.9 -21,-0.2 -0.451 17.9 -99.1 -93.4 163.5 10.7 39.6 34.0 59 67 A A - 0 0 7 -23,-2.4 -50,-0.2 6,-0.2 -48,-0.1 -0.593 23.5-170.0 -79.2 132.0 10.0 36.8 31.6 60 68 A G + 0 0 14 -2,-0.3 -49,-0.6 -50,-0.1 2,-0.4 0.678 62.2 91.5 -93.1 -23.9 6.5 35.2 31.7 61 69 A Q S > S- 0 0 47 -27,-0.3 3,-1.5 -51,-0.2 4,-0.2 -0.627 73.4-141.1 -75.2 126.9 7.2 32.3 29.4 62 70 A E G > S+ 0 0 129 -2,-0.4 3,-1.9 1,-0.3 4,-0.2 0.907 101.5 57.4 -54.1 -46.5 8.3 29.3 31.5 63 71 A K G 3 S+ 0 0 128 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.708 115.3 37.8 -56.8 -22.2 10.9 28.3 28.9 64 72 A F G < S+ 0 0 71 -3,-1.5 -28,-2.4 1,-0.1 -1,-0.3 0.164 80.9 117.9-114.7 17.2 12.5 31.8 29.2 65 73 A G X - 0 0 13 -3,-1.9 3,-1.9 1,-0.2 -6,-0.2 0.682 44.2-179.7 -67.4 -22.5 12.0 32.2 33.0 66 74 A G T 3 S- 0 0 11 1,-0.3 -1,-0.2 -4,-0.2 3,-0.1 -0.344 70.1 -2.7 62.5-129.5 15.7 32.4 33.9 67 75 A L T > S- 0 0 0 1,-0.2 3,-2.7 -2,-0.1 -1,-0.3 0.518 88.7-171.2 -72.3 -6.7 16.4 32.9 37.6 68 76 A R G X S+ 0 0 100 -3,-1.9 3,-2.2 1,-0.3 -1,-0.2 -0.239 72.6 9.5 56.1-120.7 12.6 33.0 38.2 69 77 A D G > S+ 0 0 19 1,-0.3 3,-1.6 2,-0.2 4,-0.4 0.678 115.0 81.2 -69.7 -14.6 12.0 34.1 41.8 70 78 A G G X S+ 0 0 0 -3,-2.7 3,-0.7 1,-0.3 -1,-0.3 0.774 85.2 62.2 -53.1 -28.0 15.7 34.8 42.1 71 79 A Y G < S+ 0 0 1 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.720 94.3 61.5 -70.2 -21.8 14.7 38.1 40.4 72 80 A Y G X + 0 0 5 -3,-1.6 3,-2.4 -4,-0.2 -1,-0.2 0.608 69.0 124.2 -86.1 -13.8 12.4 39.1 43.3 73 81 A I T < S+ 0 0 1 -3,-0.7 31,-0.1 -4,-0.4 -3,-0.0 -0.244 88.1 0.9 -55.3 126.5 15.1 39.3 46.0 74 82 A Q T 3 S+ 0 0 105 29,-0.3 -70,-0.3 1,-0.2 -1,-0.3 0.622 87.6 160.8 64.3 17.9 15.0 42.8 47.7 75 83 A A < - 0 0 9 -3,-2.4 -1,-0.2 1,-0.1 -70,-0.2 -0.433 26.5-163.7 -56.4 138.1 12.1 44.0 45.5 76 84 A Q S S- 0 0 82 -72,-2.8 2,-0.3 1,-0.3 -71,-0.2 0.459 70.0 -1.9-104.6 -7.0 10.6 47.0 47.2 77 85 A C E -b 5 0A 0 -73,-1.1 -71,-2.0 30,-0.2 2,-0.3 -0.962 67.2-154.3-171.3 166.7 7.4 46.9 45.1 78 86 A A E -be 6 109A 0 30,-1.8 32,-2.3 -2,-0.3 2,-0.4 -0.995 13.5-147.3-152.5 155.2 5.7 44.9 42.3 79 87 A I E -be 7 110A 0 -73,-2.3 -71,-2.5 -2,-0.3 2,-0.5 -0.999 13.8-159.2-119.7 129.7 3.3 44.9 39.4 80 88 A I E -be 8 111A 0 30,-2.9 32,-3.0 -2,-0.4 2,-0.4 -0.960 18.4-158.4-105.7 127.3 1.4 41.7 38.6 81 89 A M E +be 9 112A 1 -73,-2.9 -71,-0.5 -2,-0.5 2,-0.3 -0.839 18.8 166.2-111.4 136.8 0.1 41.8 35.0 82 90 A F E - e 0 113A 0 30,-2.4 32,-3.5 -2,-0.4 2,-0.5 -0.899 32.8-120.1-134.7 177.2 -2.7 39.9 33.2 83 91 A D E > - e 0 114A 11 3,-0.4 3,-2.0 -2,-0.3 7,-0.3 -0.974 10.0-150.1-121.7 118.3 -4.5 40.3 29.9 84 92 A V T 3 S+ 0 0 0 30,-2.5 39,-3.0 -2,-0.5 38,-2.1 0.560 97.9 60.7 -71.4 -10.3 -8.3 40.8 30.1 85 93 A T T 3 S+ 0 0 24 29,-0.3 2,-0.4 36,-0.2 -1,-0.3 0.422 101.9 60.3 -89.6 -2.4 -8.6 39.1 26.7 86 94 A S X> - 0 0 24 -3,-2.0 4,-0.9 1,-0.1 3,-0.6 -0.891 60.0-169.0-136.1 110.3 -7.1 35.9 28.1 87 95 A R H 3> S+ 0 0 166 -2,-0.4 4,-2.5 1,-0.3 3,-0.4 0.829 87.2 61.9 -64.1 -37.4 -8.6 34.0 31.0 88 96 A V H 3> S+ 0 0 32 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.884 99.6 58.5 -60.2 -35.2 -5.7 31.7 31.6 89 97 A T H <4 S+ 0 0 7 -3,-0.6 -79,-0.3 -6,-0.2 -1,-0.2 0.862 109.2 42.2 -64.0 -37.1 -3.6 34.8 32.4 90 98 A Y H >< S+ 0 0 42 -4,-0.9 3,-1.4 -3,-0.4 -1,-0.2 0.890 110.2 58.3 -71.3 -40.2 -6.0 35.8 35.2 91 99 A K H 3< S+ 0 0 97 -4,-2.5 4,-0.2 1,-0.3 -2,-0.2 0.852 106.7 49.1 -52.8 -38.7 -6.2 32.1 36.4 92 100 A N T >X S+ 0 0 27 -4,-1.9 4,-2.0 1,-0.2 3,-0.7 0.486 83.5 93.9 -83.5 -6.6 -2.4 32.2 36.9 93 101 A V H <> S+ 0 0 0 -3,-1.4 4,-2.5 1,-0.2 -1,-0.2 0.874 82.6 53.5 -55.1 -42.2 -2.4 35.5 38.9 94 102 A P H 3> S+ 0 0 38 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.800 107.1 53.5 -63.5 -29.0 -2.5 33.6 42.2 95 103 A N H <> S+ 0 0 24 -3,-0.7 4,-2.2 -4,-0.2 -2,-0.2 0.920 111.0 44.1 -70.1 -44.7 0.6 31.6 41.1 96 104 A W H X S+ 0 0 40 -4,-2.0 4,-2.0 2,-0.2 5,-0.2 0.925 114.9 50.2 -65.0 -42.6 2.6 34.7 40.3 97 105 A H H X S+ 0 0 18 -4,-2.5 4,-2.8 -5,-0.2 5,-0.3 0.924 109.6 50.5 -60.0 -49.3 1.4 36.3 43.6 98 106 A R H X S+ 0 0 28 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.935 112.0 45.8 -51.8 -54.8 2.4 33.2 45.6 99 107 A D H X S+ 0 0 47 -4,-2.2 4,-0.6 1,-0.2 -1,-0.2 0.881 116.0 48.6 -62.3 -35.4 5.9 33.0 44.1 100 108 A L H >X S+ 0 0 0 -4,-2.0 4,-2.8 -5,-0.2 3,-0.8 0.919 111.1 44.9 -70.4 -47.8 6.4 36.8 44.7 101 109 A V H 3< S+ 0 0 40 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.767 102.2 67.0 -77.6 -21.5 5.2 37.1 48.3 102 110 A R H 3< S+ 0 0 33 -4,-1.8 -1,-0.2 -5,-0.3 3,-0.2 0.800 117.0 27.9 -59.7 -29.1 7.2 34.1 49.3 103 111 A V H << S+ 0 0 8 -3,-0.8 2,-0.6 -4,-0.6 -29,-0.3 0.764 130.1 39.9 -97.4 -38.2 10.3 36.2 48.6 104 112 A C >< + 0 0 8 -4,-2.8 3,-0.5 1,-0.1 -1,-0.2 -0.848 68.9 176.3-118.5 93.1 8.9 39.7 49.2 105 113 A E T 3 S+ 0 0 108 -2,-0.6 -1,-0.1 1,-0.2 2,-0.1 0.760 70.7 23.1 -80.5 -26.0 6.7 39.4 52.2 106 114 A N T 3 S+ 0 0 135 2,-0.1 -1,-0.2 -29,-0.0 -5,-0.0 -0.495 84.8 123.8-141.6 69.9 5.5 43.0 52.8 107 115 A I < - 0 0 30 -3,-0.5 2,-0.3 -2,-0.1 -30,-0.2 -0.915 64.2 -99.4-125.8 153.1 5.7 45.1 49.7 108 116 A P - 0 0 26 0, 0.0 -30,-1.8 0, 0.0 2,-0.4 -0.572 43.2-170.3 -71.9 132.7 3.1 47.2 47.9 109 117 A I E -e 78 0A 8 26,-0.3 28,-2.1 -2,-0.3 2,-0.4 -0.985 13.0-157.3-129.6 131.6 1.8 45.3 44.8 110 118 A V E -ef 79 137A 0 -32,-2.3 -30,-2.9 -2,-0.4 2,-0.5 -0.902 8.6-150.9-103.9 135.0 -0.4 46.5 42.0 111 119 A L E -ef 80 138A 0 26,-3.5 28,-2.3 -2,-0.4 2,-0.5 -0.950 17.8-166.8-101.8 128.5 -2.5 44.1 40.0 112 120 A C E -ef 81 139A 0 -32,-3.0 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-38,-2.1 2,-1.0 -2,-0.3 -37,-0.2 0.738 68.6 66.9-105.8 -32.4 -12.9 37.8 28.3 123 131 A V S S- 0 0 2 -39,-3.0 -1,-0.2 3,-0.0 5,-0.1 -0.811 85.8-140.3 -95.4 97.4 -12.1 38.5 32.0 124 132 A K >> - 0 0 118 -2,-1.0 3,-1.3 1,-0.1 4,-0.7 -0.256 12.8-124.2 -59.0 139.9 -15.2 40.3 33.1 125 133 A A G >4 S+ 0 0 37 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.912 113.3 57.8 -48.7 -48.8 -14.8 43.3 35.5 126 134 A K G 34 S+ 0 0 106 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.754 101.0 58.0 -51.5 -34.0 -17.1 41.5 38.0 127 135 A S G <4 S+ 0 0 51 -3,-1.3 2,-1.2 1,-0.1 -1,-0.3 0.686 80.5 95.3 -69.9 -23.1 -14.7 38.5 38.0 128 136 A I << + 0 0 5 -3,-1.6 -1,-0.1 -4,-0.7 -15,-0.0 -0.611 40.2 120.9 -85.0 95.9 -11.7 40.4 39.1 129 137 A V >> + 0 0 64 -2,-1.2 3,-1.3 2,-0.1 4,-0.5 0.350 34.0 102.4-134.0 0.3 -11.6 39.9 42.9 130 138 A F H 3> S+ 0 0 41 1,-0.3 4,-0.6 -3,-0.2 3,-0.2 0.838 78.6 60.6 -60.9 -35.8 -8.2 38.3 43.7 131 139 A H H 3>>S+ 0 0 3 1,-0.2 5,-2.0 2,-0.1 4,-0.9 0.736 88.2 75.9 -60.6 -26.4 -6.7 41.5 44.9 132 140 A R H X45S+ 0 0 46 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K H > S+ 0 0 100 2,-0.2 4,-2.3 1,-0.2 56,-0.2 0.956 109.3 42.9 -52.2 -49.6 -12.7 58.0 55.1 632 299 C A H > S+ 0 0 36 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.942 112.7 51.6 -64.7 -49.9 -10.2 60.3 56.9 633 300 C T H X>S+ 0 0 45 -4,-2.2 4,-1.1 1,-0.2 5,-0.6 0.926 112.3 46.6 -52.0 -47.8 -8.3 57.5 58.5 634 301 C Y H ><5S+ 0 0 5 -4,-2.9 3,-0.7 1,-0.2 -1,-0.2 0.927 109.3 52.9 -64.5 -49.4 -7.9 55.7 55.2 635 302 C A H 3<5S+ 0 0 54 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.842 105.1 56.2 -51.9 -40.5 -6.8 58.9 53.3 636 303 C N H 3<5S- 0 0 96 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.793 88.2-163.6 -65.1 -29.0 -4.1 59.5 56.0 637 304 C A T <<5 + 0 0 33 -4,-1.1 2,-0.2 -3,-0.7 -3,-0.1 0.835 16.6 177.4 49.9 40.0 -2.8 56.0 55.2 638 305 C N > < - 0 0 100 -5,-0.6 3,-2.6 2,-0.1 4,-0.3 -0.518 52.8 -39.2 -70.8 143.7 -0.7 55.8 58.4 639 306 C G T 3 S- 0 0 77 1,-0.3 3,-0.3 -2,-0.2 -477,-0.0 -0.051 122.9 -24.9 44.3-128.0 1.2 52.6 59.1 640 307 C N T 3> S+ 0 0 110 1,-0.2 4,-2.3 2,-0.1 -1,-0.3 0.009 98.9 120.5-103.5 27.5 -1.0 49.6 58.0 641 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C F H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.952 115.2 43.4 -64.7 -52.3 -14.5 40.3 57.6 652 319 C L H X S+ 0 0 0 -4,-3.0 4,-2.6 2,-0.2 5,-0.3 0.922 116.7 45.7 -63.9 -46.6 -17.7 42.2 58.2 653 320 C T H X S+ 0 0 13 -4,-2.5 4,-2.1 -5,-0.3 -1,-0.2 0.909 115.8 46.7 -66.4 -40.7 -19.1 41.6 54.7 654 321 C T H X S+ 0 0 23 -4,-2.0 4,-1.3 -5,-0.3 -2,-0.2 0.918 116.8 43.0 -64.0 -48.8 -18.2 37.8 54.7 655 322 C Y H X S+ 0 0 0 -4,-2.6 4,-3.0 -5,-0.2 3,-0.3 0.952 116.2 46.3 -63.3 -51.1 -19.6 37.2 58.2 656 323 C L H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.3 5,-0.3 0.900 107.0 58.1 -66.0 -38.4 -22.8 39.2 57.7 657 324 C A H < S+ 0 0 47 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.873 119.7 30.4 -54.7 -39.9 -23.5 37.6 54.3 658 325 C R H < S+ 0 0 92 -4,-1.3 -2,-0.2 -3,-0.3 -1,-0.2 0.865 135.3 22.1 -85.1 -38.1 -23.5 34.1 55.9 659 326 C N H >X S+ 0 0 21 -4,-3.0 3,-1.6 -5,-0.2 4,-0.5 0.385 76.3 106.8-122.7 0.6 -24.7 34.8 59.4 660 327 C R H >X S+ 0 0 11 -4,-2.3 3,-1.6 1,-0.3 4,-0.8 0.829 78.3 68.0 -60.8 -25.2 -26.7 38.0 59.9 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515 C I T X< S+ 0 0 1 -4,-0.9 3,-1.8 -3,-0.6 4,-0.3 0.250 72.0 138.6 -96.0 13.6 -33.8 55.1 39.5 812 516 C S T < + 0 0 35 -3,-1.5 46,-0.1 1,-0.2 -3,-0.0 -0.384 67.0 30.4 -59.6 132.1 -36.1 55.3 36.5 813 517 C G T 3 S+ 0 0 56 2,-0.1 -1,-0.2 -2,-0.1 4,-0.1 0.241 94.4 93.9 103.3 -9.1 -38.7 52.5 36.7 814 518 C T S < S+ 0 0 29 -3,-1.8 2,-0.2 2,-0.1 -2,-0.1 0.699 76.1 63.1 -90.6 -23.1 -38.8 52.3 40.5 815 519 C M S S- 0 0 12 -4,-0.3 2,-0.2 1,-0.1 -2,-0.1 -0.545 92.5 -95.9 -97.6 165.5 -41.7 54.6 41.0 816 520 C S > - 0 0 62 -2,-0.2 4,-3.9 1,-0.1 5,-0.3 -0.538 38.5-112.5 -72.9 148.1 -45.4 54.4 39.9 817 521 C E H > S+ 0 0 103 1,-0.2 4,-3.0 2,-0.2 -1,-0.1 0.895 119.7 51.9 -47.4 -41.3 -46.1 56.2 36.7 818 522 C D H > S+ 0 0 110 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.885 114.9 37.8 -69.2 -42.3 -48.2 58.6 38.8 819 523 C T H > S+ 0 0 32 -3,-0.3 4,-3.0 2,-0.2 -2,-0.2 0.874 115.8 54.5 -74.1 -41.0 -45.5 59.4 41.4 820 524 C E H X S+ 0 0 3 -4,-3.9 4,-3.3 2,-0.2 5,-0.4 0.932 103.7 58.1 -51.9 -51.1 -42.8 59.3 38.6 821 525 C K H X S+ 0 0 89 -4,-3.0 4,-2.0 -5,-0.3 -2,-0.2 0.925 113.0 36.9 -41.0 -57.8 -45.0 61.9 36.8 822 526 C R H X S+ 0 0 138 -4,-1.4 4,-2.8 1,-0.2 -2,-0.2 0.912 116.9 52.6 -70.2 -44.6 -44.9 64.4 39.7 823 527 C F H X S+ 0 0 0 -4,-3.0 4,-3.0 2,-0.2 -2,-0.2 0.930 112.6 42.7 -53.7 -53.0 -41.2 63.6 40.6 824 528 C V H X S+ 0 0 5 -4,-3.3 4,-3.6 2,-0.2 5,-0.3 0.932 112.8 54.2 -64.4 -47.2 -39.9 64.1 37.0 825 529 C V H X S+ 0 0 36 -4,-2.0 4,-2.5 -5,-0.4 5,-0.2 0.949 112.3 44.3 -47.6 -53.6 -42.0 67.2 36.7 826 530 C T H X S+ 0 0 51 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.952 116.2 46.0 -59.6 -50.3 -40.5 68.6 39.9 827 531 C V H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.908 114.8 46.1 -61.1 -47.3 -36.9 67.6 38.9 828 532 C I H X S+ 0 0 12 -4,-3.6 4,-2.4 2,-0.2 -1,-0.2 0.913 110.8 52.6 -63.6 -44.9 -37.1 69.0 35.4 829 533 C K H X S+ 0 0 132 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.905 113.1 45.9 -56.8 -41.3 -38.7 72.2 36.5 830 534 C D H X S+ 0 0 38 -4,-2.1 4,-3.1 -5,-0.2 -2,-0.2 0.892 110.1 51.1 -72.6 -40.9 -35.9 72.7 39.0 831 535 C L H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.863 110.8 51.0 -63.8 -36.0 -33.1 71.8 36.5 832 536 C L H X S+ 0 0 94 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.944 110.6 48.0 -63.2 -49.0 -34.6 74.4 34.1 833 537 C D H X S+ 0 0 82 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.962 110.5 53.5 -51.9 -51.2 -34.6 77.0 36.9 834 538 C L H X S+ 0 0 2 -4,-3.1 4,-0.7 1,-0.2 -1,-0.2 0.868 105.8 52.7 -53.4 -42.0 -31.0 76.0 37.6 835 539 C C H >< S+ 0 0 26 -4,-1.9 3,-0.9 1,-0.2 -1,-0.2 0.920 106.9 50.7 -63.4 -46.2 -29.9 76.5 34.0 836 540 C V H 3< S+ 0 0 95 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.918 110.1 50.2 -58.0 -47.2 -31.3 80.1 33.8 837 541 C K H 3< S+ 0 0 116 -4,-1.9 2,-1.0 -5,-0.2 -1,-0.3 0.639 95.3 84.6 -67.4 -15.8 -29.5 81.1 37.0 838 542 C K << - 0 0 47 -3,-0.9 -1,-0.2 -4,-0.7 6,-0.1 -0.690 65.4-163.0-104.0 85.0 -26.2 79.7 35.7 839 543 C R + 0 0 179 -2,-1.0 4,-0.3 4,-0.1 -2,-0.0 -0.146 48.5 46.9 -43.2 143.9 -24.3 82.2 33.5 840 544 C G S > S- 0 0 46 3,-0.1 4,-1.7 2,-0.1 5,-0.1 0.135 82.6 -94.7 99.2 158.2 -21.5 80.9 31.3 841 545 C K H > S+ 0 0 134 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.792 117.8 54.0 -82.2 -29.3 -20.7 78.1 28.8 842 546 C D H > S+ 0 0 44 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.894 112.6 45.5 -67.9 -41.2 -19.1 75.6 31.3 843 547 C N H > S+ 0 0 37 -4,-0.3 4,-2.7 2,-0.2 5,-0.2 0.916 112.8 49.2 -66.0 -46.6 -22.1 75.8 33.6 844 548 C K H X S+ 0 0 80 -4,-1.7 4,-2.7 1,-0.2 5,-0.2 0.887 110.0 52.1 -61.9 -41.7 -24.6 75.5 30.7 845 549 C A H X S+ 0 0 3 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.881 111.7 46.7 -61.7 -40.9 -22.7 72.4 29.4 846 550 C V H X S+ 0 0 1 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.965 116.6 42.4 -64.9 -51.6 -22.9 70.8 32.8 847 551 C V H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.861 114.9 50.4 -69.4 -34.5 -26.6 71.5 33.4 848 552 C A H X S+ 0 0 10 -4,-2.7 4,-2.6 -5,-0.2 5,-0.2 0.905 108.5 52.0 -69.0 -41.5 -27.5 70.5 29.8 849 553 C S H X S+ 0 0 0 -4,-1.9 4,-1.8 -5,-0.2 -2,-0.2 0.915 112.2 48.4 -57.3 -40.5 -25.6 67.2 30.1 850 554 C D H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.921 112.3 45.9 -69.7 -42.0 -27.6 66.6 33.3 851 555 C I H X S+ 0 0 33 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.899 112.2 51.4 -68.7 -42.6 -31.0 67.4 31.8 852 556 C M H X S+ 0 0 7 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.888 110.7 49.9 -60.1 -40.2 -30.4 65.4 28.7 853 557 C Y H X S+ 0 0 3 -4,-1.8 4,-1.1 -5,-0.2 -2,-0.2 0.952 112.2 45.8 -64.3 -49.9 -29.4 62.4 30.8 854 558 C V H >X S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 4,-0.6 0.959 114.4 46.4 -58.9 -53.1 -32.5 62.6 33.1 855 559 C V H >< S+ 0 0 8 -4,-2.5 3,-1.1 1,-0.3 7,-0.2 0.883 110.3 54.0 -62.6 -37.8 -35.0 63.0 30.2 856 560 C G H 3< S+ 0 0 6 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.753 105.4 55.2 -66.1 -23.4 -33.4 60.2 28.3 857 561 C Q H << S+ 0 0 33 -4,-1.1 -1,-0.2 -3,-1.1 -2,-0.2 0.588 102.8 58.5 -83.6 -11.5 -33.7 57.9 31.3 858 562 C Y S+ 0 0 30 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.813 70.7 65.1 -69.3 -26.8 -39.2 57.4 28.3 860 564 C R H > S+ 0 0 84 1,-0.2 4,-0.7 2,-0.2 5,-0.1 0.927 105.8 45.2 -59.6 -42.9 -42.3 56.3 30.1 861 565 C F H >> S+ 0 0 12 -3,-0.3 3,-1.2 1,-0.2 4,-0.6 0.942 112.0 51.5 -60.5 -49.1 -42.8 59.9 31.0 862 566 C L H >< S+ 0 0 2 -4,-1.7 3,-1.3 1,-0.3 7,-0.4 0.891 105.3 55.1 -59.3 -41.7 -42.0 61.1 27.5 863 567 C K H 3< S+ 0 0 98 -4,-3.1 -1,-0.3 1,-0.3 3,-0.2 0.712 111.0 46.6 -63.3 -22.6 -44.5 58.7 25.9 864 568 C A H << S+ 0 0 55 -3,-1.2 2,-0.3 -4,-0.7 -1,-0.3 0.484 110.3 53.8 -97.2 -6.9 -47.2 60.2 28.1 865 569 C H S+ 0 0 31 -2,-0.3 4,-3.0 1,-0.3 5,-0.3 0.922 77.9 52.3 -61.1 -51.2 -46.2 64.7 23.8 867 571 C N H > S+ 0 0 113 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.873 115.5 45.7 -49.9 -39.5 -45.9 68.5 24.0 868 572 C F H > S+ 0 0 57 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.940 111.8 49.0 -70.9 -48.0 -43.0 67.9 26.3 869 573 C L H X S+ 0 0 0 -4,-2.9 4,-2.4 -7,-0.4 -2,-0.2 0.938 112.7 48.7 -56.0 -50.1 -41.4 65.1 24.2 870 574 C R H X S+ 0 0 64 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.906 111.8 48.3 -55.9 -47.9 -41.6 67.3 21.0 871 575 C T H X S+ 0 0 74 -4,-1.7 4,-1.7 -5,-0.3 -1,-0.2 0.856 109.2 54.6 -66.2 -34.3 -40.1 70.3 22.8 872 576 C V H X S+ 0 0 17 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.947 109.9 46.7 -62.0 -45.6 -37.3 68.1 24.1 873 577 C I H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.929 109.4 52.4 -65.1 -43.7 -36.5 67.0 20.6 874 578 C L H X S+ 0 0 77 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.871 110.7 50.1 -59.0 -33.6 -36.6 70.5 19.2 875 579 C K H X S+ 0 0 96 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.866 106.9 52.5 -73.3 -38.7 -34.2 71.5 21.9 876 580 C L H X S+ 0 0 4 -4,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.891 107.6 53.7 -60.4 -40.8 -31.8 68.6 21.1 877 581 C F H >< S+ 0 0 19 -4,-2.6 3,-0.8 2,-0.2 4,-0.4 0.887 104.5 54.2 -62.2 -39.4 -31.9 69.9 17.5 878 582 C E H >< S+ 0 0 112 -4,-1.7 3,-2.1 1,-0.2 -2,-0.2 0.957 105.3 54.0 -57.4 -46.0 -30.8 73.3 18.8 879 583 C F H >< S+ 0 0 31 -4,-2.2 3,-1.5 1,-0.3 -1,-0.2 0.665 90.7 74.6 -63.2 -17.5 -27.9 71.6 20.5 880 584 C M T << S+ 0 0 0 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.685 97.5 49.2 -68.2 -16.1 -26.9 70.1 17.2 881 585 C H T < S+ 0 0 81 -3,-2.1 -1,-0.3 -4,-0.4 2,-0.2 0.182 85.8 126.7-102.1 12.0 -25.7 73.6 16.3 882 586 C E < - 0 0 73 -3,-1.5 6,-0.1 1,-0.1 -3,-0.0 -0.496 55.4-149.5 -71.3 139.8 -23.7 74.0 19.6 883 587 C T S S+ 0 0 135 -2,-0.2 2,-0.9 5,-0.0 -1,-0.1 0.725 82.9 88.2 -77.2 -25.7 -20.0 75.0 19.3 884 588 C H S > S- 0 0 27 1,-0.2 4,-1.8 2,-0.0 3,-0.2 -0.695 71.3-159.2 -73.1 109.5 -19.4 73.0 22.5 885 589 C E H > S+ 0 0 113 -2,-0.9 4,-2.0 1,-0.2 5,-0.2 0.708 84.0 60.2 -72.6 -22.8 -18.7 69.6 20.9 886 590 C G H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.1 -1,-0.2 0.950 107.8 44.4 -63.9 -51.2 -19.5 67.6 24.1 887 591 C V H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.912 113.4 52.0 -59.4 -44.8 -23.1 69.0 24.2 888 592 C Q H X S+ 0 0 11 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.902 110.9 45.8 -59.8 -47.6 -23.6 68.5 20.5 889 593 C D H X S+ 0 0 25 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.896 112.6 51.4 -64.0 -42.0 -22.4 64.8 20.6 890 594 C M H X S+ 0 0 1 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.858 104.8 57.0 -64.0 -34.6 -24.6 64.2 23.6 891 595 C A H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.912 108.4 47.2 -63.6 -42.1 -27.6 65.7 21.8 892 596 C C H X S+ 0 0 3 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.931 113.9 46.2 -61.5 -50.0 -27.2 63.2 19.0 893 597 C D H X S+ 0 0 60 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.882 113.7 49.2 -62.1 -42.3 -26.8 60.2 21.4 894 598 C T H X S+ 0 0 10 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.857 107.2 56.3 -66.4 -36.4 -29.8 61.4 23.5 895 599 C F H X S+ 0 0 2 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.957 112.1 40.6 -60.0 -49.7 -31.9 61.8 20.3 896 600 C I H X S+ 0 0 18 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.902 113.6 54.8 -71.1 -37.1 -31.4 58.2 19.3 897 601 C K H X S+ 0 0 41 -4,-2.4 4,-0.8 2,-0.2 -1,-0.2 0.931 111.6 43.7 -57.0 -48.6 -31.8 56.9 22.9 898 602 C I H >X S+ 0 0 2 -4,-2.6 4,-2.6 1,-0.2 3,-0.9 0.942 114.4 50.8 -62.3 -43.8 -35.2 58.6 23.2 899 603 C V H 3X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.3 -2,-0.2 0.847 99.7 62.7 -66.4 -35.5 -36.2 57.4 19.7 900 604 C Q H 3< S+ 0 0 87 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.810 118.8 28.5 -58.5 -30.6 -35.2 53.8 20.5 901 605 C K H << S+ 0 0 122 -3,-0.9 -2,-0.2 -4,-0.8 -1,-0.2 0.748 129.6 36.2 -99.6 -30.5 -37.9 53.8 23.2 902 606 C C H >< S+ 0 0 1 -4,-2.6 3,-2.0 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-4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.916 110.1 48.3 -57.7 -48.1 -8.3 52.9 -9.6 1035 739 C I H X S+ 0 0 1 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.941 113.4 46.5 -58.5 -49.6 -6.7 51.2 -6.6 1036 740 C S H X S+ 0 0 43 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.938 112.3 51.6 -60.6 -45.6 -5.0 48.6 -8.8 1037 741 C A H X S+ 0 0 56 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.902 110.3 48.6 -55.0 -45.6 -3.8 51.4 -11.2 1038 742 C Q H X S+ 0 0 52 -4,-2.4 4,-2.8 2,-0.2 5,-0.4 0.896 111.2 48.9 -68.0 -39.7 -2.4 53.4 -8.3 1039 743 C V H X S+ 0 0 21 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.908 112.5 49.3 -64.3 -40.5 -0.5 50.4 -6.9 1040 744 C A H < S+ 0 0 90 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.900 118.8 38.9 -62.7 -40.9 0.9 49.6 -10.4 1041 745 C A H < S+ 0 0 85 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.809 131.8 22.3 -83.1 -33.9 2.0 53.2 -10.8 1042 746 C E H < S- 0 0 95 -4,-2.8 3,-0.3 1,-0.2 -3,-0.2 0.585 103.5-118.2-110.6 -13.6 3.3 54.1 -7.3 1043 747 C G >< - 0 0 31 -4,-2.0 3,-2.0 -5,-0.4 -1,-0.2 -0.324 51.9 -50.8 95.6 173.8 4.1 50.7 -5.7 1044 748 C L G > S+ 0 0 86 1,-0.3 3,-2.3 2,-0.2 4,-0.3 0.787 126.4 76.0 -54.4 -30.5 2.6 49.0 -2.6 1045 749 C I G >> S+ 0 0 63 1,-0.3 3,-2.1 -3,-0.3 4,-0.7 0.787 78.2 76.7 -54.6 -27.4 3.2 52.2 -0.6 1046 750 C A G X4 S+ 0 0 0 -3,-2.0 3,-0.9 1,-0.3 6,-0.4 0.826 81.7 66.2 -45.7 -38.5 0.1 53.5 -2.6 1047 751 C T G <4 S+ 0 0 10 -3,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.656 100.6 50.1 -66.4 -14.6 -2.0 51.5 -0.1 1048 752 C K G <4 S+ 0 0 95 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 0.686 88.2 104.7 -93.6 -20.3 -0.9 53.8 2.7 1049 753 C T S S+ 0 0 40 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.903 111.5 56.7 -55.1 -41.5 -4.8 59.0 1.8 1051 755 C K H > S+ 0 0 46 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.956 111.8 39.9 -53.9 -55.8 -6.1 58.7 -1.8 1052 756 C V H > S+ 0 0 0 -6,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.879 113.4 53.8 -67.0 -35.9 -6.0 54.9 -1.8 1053 757 C R H X S+ 0 0 60 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.883 108.4 52.4 -64.7 -33.7 -7.3 54.6 1.8 1054 758 C G H X S+ 0 0 18 -4,-2.3 4,-1.3 -5,-0.2 -1,-0.2 0.895 109.3 48.5 -65.9 -40.5 -10.2 56.8 0.7 1055 759 C L H X S+ 0 0 4 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.887 110.6 50.0 -70.0 -37.4 -10.9 54.5 -2.2 1056 760 C R H X S+ 0 0 41 -4,-2.5 4,-3.3 1,-0.2 5,-0.2 0.850 102.8 61.3 -70.3 -32.4 -10.7 51.3 -0.1 1057 761 C T H X S+ 0 0 37 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.910 102.8 51.9 -55.9 -43.0 -13.2 52.9 2.4 1058 762 C I H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.951 111.5 46.2 -58.5 -49.2 -15.7 53.0 -0.4 1059 763 C K H X S+ 0 0 1 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.940 114.3 47.9 -59.6 -47.6 -15.1 49.3 -1.1 1060 764 C K H X S+ 0 0 60 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.889 111.5 49.2 -61.4 -40.4 -15.4 48.4 2.6 1061 765 C E H X S+ 0 0 22 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.883 109.5 52.5 -71.3 -33.9 -18.5 50.4 3.1 1062 766 C I H X S+ 0 0 2 -4,-2.3 4,-2.2 -5,-0.2 5,-0.2 0.942 111.6 46.0 -62.5 -47.3 -20.2 48.8 0.1 1063 767 C L H X S+ 0 0 2 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.889 112.4 51.9 -61.3 -40.4 -19.3 45.4 1.5 1064 768 C K H X S+ 0 0 108 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.894 109.2 49.8 -63.4 -44.1 -20.6 46.4 4.9 1065 769 C L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.920 113.8 44.1 -59.6 -47.8 -23.9 47.7 3.5 1066 770 C V H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.916 115.6 49.1 -66.3 -42.0 -24.5 44.4 1.6 1067 771 C E H X S+ 0 0 39 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.918 110.1 51.3 -59.2 -47.0 -23.4 42.4 4.6 1068 772 C T H X S+ 0 0 11 -4,-2.9 4,-0.9 1,-0.2 -2,-0.2 0.919 112.9 45.0 -60.2 -47.2 -25.8 44.4 6.9 1069 773 C Y H >X S+ 0 0 5 -4,-2.4 4,-1.0 1,-0.2 3,-0.9 0.950 113.7 47.3 -63.2 -51.4 -28.7 43.9 4.6 1070 774 C I H 3< S+ 0 0 0 -4,-2.6 3,-0.5 1,-0.2 -2,-0.2 0.879 106.5 58.9 -61.5 -35.9 -28.2 40.1 4.0 1071 775 C S H 3< S+ 0 0 38 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.797 118.9 30.7 -62.3 -27.5 -27.7 39.5 7.7 1072 776 C K H << S+ 0 0 92 -3,-0.9 -61,-0.6 -4,-0.9 -1,-0.2 0.393 90.0 127.2-110.4 -1.1 -31.2 40.9 8.4 1073 777 C A < - 0 0 13 -4,-1.0 3,-0.1 -3,-0.5 -62,-0.1 -0.259 34.4-174.8 -63.5 143.1 -33.0 40.0 5.2 1074 778 C R S S+ 0 0 223 1,-0.2 2,-1.1 -63,-0.1 3,-0.2 0.653 75.0 67.3-107.2 -26.2 -36.3 38.1 5.4 1075 779 C N > + 0 0 73 1,-0.2 4,-1.5 -64,-0.1 3,-0.4 -0.724 57.7 169.5 -94.9 89.3 -36.8 37.4 1.7 1076 780 C L H > S+ 0 0 48 -2,-1.1 4,-2.4 1,-0.2 5,-0.2 0.766 70.6 66.5 -73.8 -24.6 -33.9 35.1 1.0 1077 781 C D H > S+ 0 0 113 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.884 104.3 45.5 -62.0 -39.8 -35.3 34.2 -2.5 1078 782 C D H >>S+ 0 0 48 -3,-0.4 4,-2.6 2,-0.2 5,-1.4 0.882 108.5 56.3 -68.9 -41.2 -34.6 37.9 -3.5 1079 783 C V H X>S+ 0 0 0 -4,-1.5 5,-2.5 3,-0.2 4,-0.8 0.961 117.5 35.8 -50.4 -49.8 -31.1 37.7 -1.9 1080 784 C V H <>S+ 0 0 36 -4,-2.4 5,-0.6 3,-0.2 -2,-0.2 0.918 123.5 40.4 -75.1 -45.5 -30.3 34.7 -4.1 1081 785 C K H <5S+ 0 0 170 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.807 133.9 16.5 -74.2 -33.3 -32.2 35.7 -7.3 1082 786 C V H <5S+ 0 0 33 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.798 128.1 34.7-112.8 -41.9 -31.2 39.4 -7.3 1083 787 C L T X S+ 0 0 38 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.876 113.7 53.3 -65.2 -34.9 -23.8 40.3 -9.2 1087 791 C L H X S+ 0 0 1 -4,-1.7 4,-2.1 2,-0.2 5,-0.2 0.959 111.7 43.7 -58.9 -53.4 -22.1 40.5 -5.8 1088 792 C L H X S+ 0 0 9 -4,-2.9 4,-2.0 1,-0.2 5,-0.5 0.886 113.5 51.9 -61.4 -42.5 -19.9 37.5 -6.4 1089 793 C N H < S+ 0 0 85 -4,-2.4 4,-0.3 -5,-0.3 5,-0.2 0.887 113.5 45.0 -57.8 -42.9 -19.2 38.8 -10.0 1090 794 C A H < S+ 0 0 2 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.823 125.0 25.8 -73.7 -33.4 -18.1 42.2 -8.6 1091 795 C V H X S+ 0 0 1 -4,-2.1 4,-1.8 -5,-0.1 -2,-0.2 0.766 106.1 61.5-108.2 -28.7 -16.0 41.1 -5.6 1092 796 C L H X S+ 0 0 5 -4,-2.0 4,-3.1 -5,-0.2 5,-0.2 0.940 106.9 40.0 -75.8 -51.2 -14.4 37.6 -6.0 1093 797 C E H > S+ 0 0 122 -5,-0.5 4,-3.2 -4,-0.3 -1,-0.2 0.893 115.6 55.0 -64.9 -40.3 -12.1 37.9 -9.0 1094 798 C D H > S+ 0 0 32 -5,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.916 111.7 43.4 -58.1 -44.4 -11.1 41.3 -7.9 1095 799 C Y H >< S+ 0 0 2 -4,-1.8 3,-1.0 1,-0.2 -2,-0.2 0.971 116.5 47.2 -65.9 -51.6 -10.1 39.9 -4.5 1096 800 C M H 3< S+ 0 0 64 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.888 114.0 46.7 -54.7 -46.0 -8.3 36.9 -6.1 1097 801 C N H 3< S+ 0 0 112 -4,-3.2 2,-0.2 -5,-0.2 -1,-0.2 0.388 93.5 92.6 -90.4 4.9 -6.4 39.0 -8.7 1098 802 C N S << S- 0 0 14 -3,-1.0 5,-0.1 -4,-0.6 -62,-0.0 -0.629 86.8-100.2 -87.6 153.1 -5.1 41.7 -6.4 1099 803 C V >> - 0 0 64 -2,-0.2 3,-2.0 1,-0.1 4,-0.5 -0.404 44.0-102.4 -64.5 150.9 -1.8 41.6 -4.7 1100 804 C P G >4 S+ 0 0 53 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.862 120.1 53.9 -45.6 -48.8 -2.1 40.5 -1.1 1101 805 C D G 34 S+ 0 0 48 1,-0.3 -2,-0.0 3,-0.0 47,-0.0 0.635 107.8 52.8 -63.9 -14.8 -1.7 44.0 0.4 1102 806 C A G <4 S+ 0 0 1 -3,-2.0 2,-0.4 -7,-0.1 -1,-0.3 0.487 85.8 106.0 -98.4 -6.2 -4.5 45.3 -1.8 1103 807 C R << - 0 0 24 -3,-1.7 2,-0.6 -4,-0.5 48,-0.1 -0.614 66.7-134.4 -81.6 132.2 -7.0 42.6 -0.7 1104 808 C D >> - 0 0 5 -2,-0.4 3,-1.9 1,-0.1 4,-0.5 -0.751 4.0-153.3 -92.3 120.0 -9.8 43.6 1.7 1105 809 C A H >> S+ 0 0 6 -2,-0.6 4,-1.5 1,-0.3 3,-0.7 0.794 92.8 72.9 -54.1 -31.4 -10.5 41.3 4.7 1106 810 C E H 3> S+ 0 0 69 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.689 83.7 67.4 -61.6 -19.8 -14.1 42.6 4.6 1107 811 C V H <> S+ 0 0 1 -3,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.953 102.7 45.7 -63.9 -44.7 -14.7 40.5 1.4 1108 812 C L H X S+ 0 0 0 -4,-2.7 3,-1.7 -5,-0.3 4,-0.8 0.267 86.8 115.1-134.3 11.8 -28.3 31.5 1.9 1119 823 C G G >< S+ 0 0 0 -4,-1.8 3,-1.3 -5,-0.5 7,-0.2 0.886 77.3 59.2 -50.1 -44.3 -25.4 29.2 1.4 1120 824 C H G 34 S+ 0 0 121 -5,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.752 107.3 47.9 -57.1 -26.0 -27.8 26.2 1.4 1121 825 C M G <4 S+ 0 0 66 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.583 112.8 47.9 -91.0 -12.2 -29.5 27.7 -1.6 1122 826 C I S+ 0 0 64 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.865 81.4 46.7 -56.2 -38.4 -24.1 25.4 -3.6 1124 828 C Q H > S+ 0 0 139 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.856 110.0 53.6 -74.4 -34.0 -22.3 26.5 -6.8 1125 829 C G H > S+ 0 0 14 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.861 107.0 51.8 -64.2 -37.7 -21.8 30.0 -5.5 1126 830 C V H X S+ 0 0 0 -4,-2.3 4,-2.5 -7,-0.2 5,-0.2 0.917 108.5 51.3 -66.0 -42.1 -20.2 28.6 -2.4 1127 831 C I H X S+ 0 0 26 -4,-1.8 4,-2.7 -5,-0.2 -2,-0.2 0.940 109.9 50.1 -56.2 -46.0 -17.8 26.6 -4.7 1128 832 C L H X S+ 0 0 73 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.901 108.5 52.7 -60.6 -41.9 -17.0 29.8 -6.5 1129 833 C I H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 5,-0.3 0.941 111.8 44.8 -59.5 -50.7 -16.3 31.6 -3.2 1130 834 C L H X S+ 0 0 3 -4,-2.5 4,-2.3 1,-0.2 5,-0.4 0.920 110.9 54.3 -57.6 -46.2 -13.9 28.9 -2.1 1131 835 C Q H < S+ 0 0 128 -4,-2.7 4,-0.2 -5,-0.2 -1,-0.2 0.907 114.3 41.6 -56.6 -39.7 -12.2 28.8 -5.5 1132 836 C S H < S+ 0 0 10 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.815 128.5 21.1 -83.1 -30.6 -11.6 32.6 -5.3 1133 837 C V H X S+ 0 0 2 -4,-2.1 4,-1.7 -5,-0.1 5,-0.2 0.649 103.1 76.9-111.5 -16.9 -10.5 33.1 -1.7 1134 838 C F H X S+ 0 0 5 -4,-2.3 4,-2.5 -5,-0.3 5,-0.2 0.984 99.6 29.4 -72.5 -68.1 -9.2 29.9 -0.3 1135 839 C E H > S+ 0 0 107 -5,-0.4 4,-2.1 -4,-0.2 -1,-0.2 0.878 122.5 50.1 -62.4 -39.6 -5.7 29.1 -1.6 1136 840 C C H > S+ 0 0 27 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.888 113.4 45.3 -72.9 -33.4 -4.7 32.7 -2.1 1137 841 C T H X S+ 0 0 0 -4,-1.7 4,-1.2 2,-0.2 3,-0.4 0.906 111.3 53.4 -73.4 -36.9 -5.8 33.7 1.5 1138 842 C L H >X S+ 0 0 9 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1,-0.1 -1,-0.2 0.920 72.6 179.8 50.3 58.4 -2.5 39.9 7.9 1149 853 C P H > S+ 0 0 60 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.852 76.4 48.3 -58.3 -41.0 -4.3 39.5 11.3 1150 854 C E H > S+ 0 0 124 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.880 112.1 49.2 -68.6 -38.6 -7.8 40.5 10.0 1151 855 C H H > S+ 0 0 14 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.936 108.6 54.3 -64.2 -47.6 -7.6 38.1 7.0 1152 856 C R H X S+ 0 0 1 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.914 112.8 42.9 -46.1 -54.4 -6.5 35.3 9.3 1153 857 C V H X S+ 0 0 18 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.937 116.8 43.7 -66.7 -48.5 -9.5 35.8 11.5 1154 858 C E H X S+ 0 0 30 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.875 109.0 61.2 -67.7 -34.6 -12.2 36.3 8.7 1155 859 C F H X S+ 0 0 3 -4,-3.1 4,-2.2 -5,-0.2 -1,-0.2 0.910 106.9 42.2 -56.7 -47.2 -10.7 33.4 6.8 1156 860 C Y H X S+ 0 0 0 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.817 111.3 55.9 -77.2 -27.9 -11.3 30.8 9.5 1157 861 C K H X S+ 0 0 68 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.902 109.9 46.9 -61.8 -43.2 -14.8 32.2 10.2 1158 862 C L H X S+ 0 0 2 -4,-2.3 4,-2.4 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