==== 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 4HB0 . COMPND 2 MOLECULE: GTP-BINDING NUCLEAR PROTEIN RAN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Q.SUN,Y.M.CHOOK . 1342 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 57013.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1035 77.1 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 . 68 5.1 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 . 62 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 156 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 695 51.8 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 3 3 4 4 0 0 2 3 1 5 6 2 5 3 3 4 3 3 0 2 0 0 0 1 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 . 3 0 1 0 2 0 2 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 1 1 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 0 122 0, 0.0 51,-2.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 73.1 15.2 57.6 45.8 2 10 A Q E -a 52 0A 108 49,-0.2 2,-0.4 51,-0.0 51,-0.2 -0.949 360.0-167.5-125.8 135.6 15.0 54.3 43.8 3 11 A F E -a 53 0A 32 49,-3.2 51,-2.9 -2,-0.4 2,-0.5 -0.931 22.3-124.4-123.3 137.0 12.7 51.3 44.2 4 12 A K E -a 54 0A 22 -2,-0.4 72,-2.1 70,-0.3 73,-1.1 -0.681 27.9-170.9 -77.0 123.9 12.8 47.8 42.7 5 13 A L E -ab 55 77A 0 49,-2.1 51,-3.5 -2,-0.5 2,-0.5 -0.977 7.0-157.5-117.9 118.8 9.7 46.9 40.9 6 14 A V E -ab 56 78A 0 71,-2.1 73,-2.1 -2,-0.5 2,-0.6 -0.860 4.4-157.2 -95.1 137.0 9.1 43.3 39.7 7 15 A L E +ab 57 79A 1 49,-2.5 51,-2.0 -2,-0.5 2,-0.3 -0.957 20.9 169.4-118.5 115.3 6.7 42.8 36.9 8 16 A V E + b 0 80A 0 71,-2.1 73,-2.8 -2,-0.6 2,-0.2 -0.827 12.1 106.0-126.5 159.4 5.2 39.4 36.6 9 17 A G E - b 0 81A 0 -2,-0.3 73,-0.1 71,-0.2 3,-0.1 -0.643 62.6 -44.0 146.3 162.4 2.4 37.7 34.7 10 18 A D > - 0 0 21 71,-0.6 3,-1.6 79,-0.3 5,-0.3 0.105 68.4 -86.0 -51.9 155.4 1.6 35.3 31.9 11 19 A G T 3 S+ 0 0 21 49,-0.8 -1,-0.1 1,-0.2 48,-0.1 -0.318 113.0 19.0 -60.6 138.7 3.3 35.3 28.5 12 20 A G T 3 S+ 0 0 22 -3,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.437 83.3 120.8 82.6 0.4 1.7 37.8 26.0 13 21 A T S < S- 0 0 0 -3,-1.6 69,-0.2 -4,-0.1 71,-0.1 0.682 88.2-102.7 -69.6 -19.0 -0.2 39.8 28.7 14 22 A G S > S+ 0 0 11 -4,-0.2 4,-3.0 -5,-0.1 5,-0.2 0.590 74.2 139.9 108.2 17.5 1.6 43.0 27.6 15 23 A K H > S+ 0 0 12 -5,-0.3 4,-2.2 2,-0.2 5,-0.2 0.967 78.3 37.4 -55.2 -59.3 4.2 43.4 30.4 16 24 A T H > S+ 0 0 26 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.916 116.5 52.0 -63.6 -44.7 7.1 44.6 28.1 17 25 A T H > S+ 0 0 29 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.946 109.6 51.5 -55.0 -47.0 4.9 46.6 25.8 18 26 A F H X S+ 0 0 0 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.931 112.8 44.6 -55.4 -50.0 3.5 48.4 28.9 19 27 A V H X S+ 0 0 2 -4,-2.2 4,-2.3 -5,-0.2 3,-0.5 0.961 111.3 52.4 -60.6 -49.1 7.0 49.2 30.2 20 28 A K H X>S+ 0 0 58 -4,-3.3 4,-3.1 1,-0.3 5,-0.8 0.872 104.5 57.6 -56.9 -42.5 8.2 50.3 26.8 21 29 A R H X5S+ 0 0 8 -4,-2.5 4,-1.0 -5,-0.2 -1,-0.3 0.893 110.6 42.7 -52.8 -46.8 5.3 52.7 26.5 22 30 A H H <5S+ 0 0 4 -4,-1.5 -2,-0.2 -3,-0.5 -1,-0.2 0.846 117.1 48.9 -69.1 -35.9 6.4 54.3 29.7 23 31 A L H <5S+ 0 0 48 -4,-2.3 -2,-0.2 -5,-0.1 -3,-0.2 0.933 134.3 2.2 -67.9 -54.4 10.1 54.3 28.7 24 32 A T H <5S- 0 0 37 -4,-3.1 -3,-0.2 2,-0.2 -2,-0.1 0.506 92.5-114.3-118.9 -11.0 10.0 55.7 25.2 25 33 A G S < -CD 49 168A 9 3,-1.0 3,-2.0 -2,-0.6 122,-0.2 -0.838 50.8-103.6-129.7 164.9 6.3 64.3 41.4 47 55 A N T 3 S+ 0 0 82 120,-2.2 121,-0.1 -2,-0.3 119,-0.0 0.653 124.9 53.2 -60.6 -15.0 5.4 67.1 43.7 48 56 A R T 3 S- 0 0 137 1,-0.5 -1,-0.3 119,-0.3 120,-0.1 0.173 127.1 -92.3-103.9 14.4 7.6 65.2 46.3 49 57 A G E < - C 0 46A 27 -3,-2.0 -3,-1.0 2,-0.1 -1,-0.5 -0.429 64.8 -34.7 100.8-179.5 10.5 65.0 43.9 50 58 A P E - C 0 45A 78 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.468 51.6-158.9 -76.9 150.0 11.6 62.5 41.4 51 59 A I E - C 0 44A 3 -7,-2.6 -7,-2.6 -2,-0.1 2,-0.6 -0.992 4.0-151.9-128.8 136.6 11.1 58.8 42.0 52 60 A K E -aC 2 43A 79 -51,-2.4 -49,-3.2 -2,-0.4 2,-0.5 -0.936 5.9-166.8-117.8 120.3 13.0 56.1 40.3 53 61 A F E -aC 3 42A 0 -11,-3.2 -11,-2.4 -2,-0.6 2,-0.9 -0.868 12.8-152.4 -96.4 133.3 11.8 52.6 39.6 54 62 A N E -aC 4 41A 33 -51,-2.9 -49,-2.1 -2,-0.5 2,-0.5 -0.884 26.1-150.4 -98.2 96.2 14.2 49.9 38.5 55 63 A V E -aC 5 40A 1 -15,-2.8 -15,-2.6 -2,-0.9 2,-1.0 -0.590 13.2-163.7 -80.6 117.9 11.7 47.9 36.5 56 64 A W E -aC 6 39A 8 -51,-3.5 -49,-2.5 -2,-0.5 2,-0.9 -0.818 10.6-166.6-102.8 93.3 12.5 44.1 36.5 57 65 A D E -aC 7 38A 1 -19,-2.8 -19,-2.2 -2,-1.0 2,-0.1 -0.753 13.9-160.9 -94.3 102.6 10.4 43.0 33.6 58 66 A T E - C 0 37A 4 -51,-2.0 2,-0.3 -2,-0.9 -21,-0.2 -0.425 20.8 -97.8 -92.2 160.5 10.3 39.3 33.8 59 67 A A - 0 0 7 -23,-2.7 -50,-0.2 6,-0.2 -48,-0.1 -0.565 23.5-169.0 -79.5 130.2 9.5 36.5 31.4 60 68 A G + 0 0 13 -2,-0.3 -49,-0.8 -50,-0.2 2,-0.5 0.630 63.6 93.2 -90.4 -23.7 5.9 35.1 31.5 61 69 A Q S > S- 0 0 50 -27,-0.2 3,-1.8 -51,-0.2 4,-0.2 -0.642 73.8-141.7 -76.4 121.4 6.6 32.1 29.3 62 70 A E G > S+ 0 0 115 -2,-0.5 3,-1.6 1,-0.3 4,-0.2 0.876 101.0 55.3 -48.8 -43.4 7.6 29.1 31.4 63 71 A K G 3 S+ 0 0 134 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.663 113.7 40.5 -72.8 -15.5 10.2 28.0 28.9 64 72 A F G < S+ 0 0 73 -3,-1.8 -28,-2.1 1,-0.1 -1,-0.3 0.164 83.1 117.5-110.9 18.5 11.9 31.5 29.1 65 73 A G X + 0 0 12 -3,-1.6 3,-1.8 -4,-0.2 -6,-0.2 0.735 42.8 175.9 -58.4 -33.6 11.5 31.7 32.9 66 74 A G T 3 S- 0 0 11 1,-0.3 -1,-0.2 -4,-0.2 3,-0.1 -0.316 70.4 -4.4 60.6-130.5 15.1 31.9 33.7 67 75 A L T > S- 0 0 0 1,-0.2 3,-2.1 299,-0.1 -1,-0.3 0.589 88.5-173.6 -71.1 -8.0 15.8 32.4 37.4 68 76 A R G X S+ 0 0 64 -3,-1.8 3,-1.8 1,-0.3 4,-0.3 -0.287 71.3 14.6 52.4-113.2 12.0 32.8 38.0 69 77 A D G > S+ 0 0 22 1,-0.3 3,-1.6 -2,-0.2 4,-0.3 0.699 112.8 79.5 -68.3 -20.6 11.4 33.8 41.6 70 78 A G G X S+ 0 0 0 -3,-2.1 3,-0.8 1,-0.3 -1,-0.3 0.751 84.7 62.9 -52.2 -27.2 15.0 34.6 42.0 71 79 A Y G < S+ 0 0 0 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.768 93.9 63.6 -69.6 -24.1 14.2 37.9 40.2 72 80 A Y G X + 0 0 4 -3,-1.6 3,-2.3 -4,-0.3 -1,-0.2 0.573 69.4 126.6 -79.0 -14.3 11.9 38.8 43.1 73 81 A I T < S- 0 0 2 -3,-0.8 3,-0.1 -4,-0.3 31,-0.1 -0.271 87.1 -4.9 -58.7 126.1 14.6 39.0 45.7 74 82 A Q T 3 S+ 0 0 99 29,-0.3 -70,-0.3 1,-0.2 -1,-0.3 0.629 87.1 162.0 61.6 18.6 14.4 42.4 47.5 75 83 A A < - 0 0 8 -3,-2.3 -1,-0.2 1,-0.1 -70,-0.2 -0.415 26.8-161.5 -56.9 139.3 11.7 43.7 45.3 76 84 A Q - 0 0 80 -72,-2.1 2,-0.3 1,-0.3 -71,-0.2 0.486 69.9 -1.4-105.4 -6.6 10.1 46.7 47.0 77 85 A C E -b 5 0A 0 -73,-1.1 -71,-2.1 30,-0.2 2,-0.3 -0.963 66.8-157.9-170.6 170.2 7.0 46.6 44.9 78 86 A A E -be 6 109A 0 30,-1.7 32,-2.2 -2,-0.3 2,-0.4 -0.987 15.1-143.7-160.5 157.8 5.3 44.8 42.0 79 87 A I E -be 7 110A 1 -73,-2.1 -71,-2.1 -2,-0.3 2,-0.6 -0.994 14.3-157.8-126.0 121.7 2.8 44.7 39.2 80 88 A I E -be 8 111A 0 30,-3.0 32,-3.3 -2,-0.4 2,-0.3 -0.931 18.9-157.8-100.3 123.4 0.9 41.5 38.4 81 89 A M E +be 9 112A 1 -73,-2.8 -71,-0.6 -2,-0.6 2,-0.3 -0.768 18.3 166.4-104.1 140.6 -0.4 41.6 34.8 82 90 A F E - e 0 113A 0 30,-2.4 32,-3.2 -2,-0.3 2,-0.5 -0.907 32.9-117.9-139.7 178.4 -3.2 39.8 33.0 83 91 A D E > -Fe 86 114A 13 3,-0.5 3,-2.4 -2,-0.3 7,-0.3 -0.956 9.7-152.9-125.4 114.4 -5.0 40.1 29.7 84 92 A V T 3 S+ 0 0 0 30,-2.3 39,-2.7 -2,-0.5 38,-2.6 0.599 98.4 56.4 -68.2 -10.7 -8.8 40.7 29.9 85 93 A T T 3 S+ 0 0 27 29,-0.3 2,-0.4 36,-0.2 -1,-0.3 0.463 104.0 61.2 -93.4 -3.4 -9.2 39.0 26.5 86 94 A S B X> -F 83 0A 22 -3,-2.4 3,-1.1 1,-0.1 4,-0.8 -0.872 61.1-170.5-132.2 103.1 -7.6 35.8 27.9 87 95 A R H >> S+ 0 0 149 -2,-0.4 4,-2.7 1,-0.3 3,-0.8 0.854 85.1 62.7 -63.4 -38.4 -9.2 34.1 30.8 88 96 A V H 3> S+ 0 0 34 1,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.865 98.0 58.8 -54.7 -33.1 -6.4 31.7 31.4 89 97 A T H <4 S+ 0 0 6 -3,-1.1 -79,-0.3 -6,-0.2 -1,-0.3 0.852 108.3 44.3 -70.5 -34.2 -4.2 34.7 32.2 90 98 A Y H X< S+ 0 0 42 -4,-0.8 3,-1.4 -3,-0.8 -1,-0.2 0.880 108.4 57.5 -72.3 -40.0 -6.6 35.7 35.0 91 99 A K H 3< S+ 0 0 95 -4,-2.7 -2,-0.2 1,-0.3 4,-0.2 0.835 105.9 51.8 -55.3 -33.8 -6.8 32.1 36.2 92 100 A N T >X S+ 0 0 28 -4,-1.6 4,-2.3 -5,-0.2 3,-0.8 0.505 82.0 94.6 -84.2 -8.0 -2.9 32.2 36.7 93 101 A V H <> S+ 0 0 0 -3,-1.4 4,-2.8 1,-0.2 5,-0.2 0.920 82.3 51.4 -53.1 -47.6 -2.9 35.4 38.7 94 102 A P H 3> S+ 0 0 38 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.765 107.9 54.1 -66.3 -21.9 -3.0 33.5 42.1 95 103 A N H <> S+ 0 0 24 -3,-0.8 4,-2.3 -4,-0.2 5,-0.3 0.943 110.8 44.4 -72.0 -50.3 0.0 31.4 40.9 96 104 A W H X S+ 0 0 42 -4,-2.3 4,-2.1 1,-0.2 5,-0.1 0.949 115.4 49.4 -56.9 -46.0 2.0 34.5 40.1 97 105 A H H X S+ 0 0 18 -4,-2.8 4,-2.8 -5,-0.2 5,-0.3 0.923 109.0 52.5 -59.2 -45.4 0.9 36.1 43.4 98 106 A R H X S+ 0 0 23 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.967 112.4 43.1 -53.3 -60.8 1.9 33.0 45.4 99 107 A D H X S+ 0 0 49 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.859 116.3 50.7 -57.0 -38.6 5.4 32.8 44.0 100 108 A L H >X S+ 0 0 0 -4,-2.1 4,-2.9 -5,-0.3 3,-1.0 0.951 110.3 44.2 -65.1 -56.7 5.8 36.5 44.4 101 109 A V H 3< S+ 0 0 41 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.713 101.7 68.6 -72.2 -19.4 4.7 37.0 48.1 102 110 A R H 3< S+ 0 0 35 -4,-1.8 -1,-0.3 -5,-0.3 3,-0.2 0.845 115.7 27.0 -63.5 -32.5 6.7 34.0 49.2 103 111 A V H << S+ 0 0 11 -3,-1.0 2,-0.8 -4,-0.7 -29,-0.3 0.777 128.9 44.0 -92.1 -39.9 9.8 36.1 48.4 104 112 A C >< + 0 0 6 -4,-2.9 3,-0.5 1,-0.2 -1,-0.2 -0.811 67.6 173.6-114.2 90.3 8.3 39.5 48.9 105 113 A E T 3 S+ 0 0 110 -2,-0.8 -1,-0.2 1,-0.2 2,-0.2 0.860 71.2 23.9 -75.0 -36.5 6.3 39.2 52.1 106 114 A N T 3 S+ 0 0 144 2,-0.1 -1,-0.2 -29,-0.0 -5,-0.0 -0.478 84.3 122.7-136.1 71.8 5.3 42.9 52.6 107 115 A I < - 0 0 32 -3,-0.5 2,-0.3 -2,-0.2 -30,-0.2 -0.868 62.4-103.8-124.1 151.8 5.3 45.0 49.4 108 116 A P - 0 0 26 0, 0.0 -30,-1.7 0, 0.0 2,-0.4 -0.658 41.5-169.3 -77.5 137.0 2.7 47.1 47.6 109 117 A I E -e 78 0A 7 -2,-0.3 28,-2.0 26,-0.3 2,-0.5 -0.993 14.6-153.6-132.5 130.8 1.4 45.3 44.6 110 118 A V E -eg 79 137A 0 -32,-2.2 -30,-3.0 -2,-0.4 2,-0.6 -0.910 9.5-150.3-101.8 128.9 -0.9 46.5 41.7 111 119 A L E -eg 80 138A 0 26,-3.7 28,-2.4 -2,-0.5 2,-0.5 -0.899 18.9-165.9 -93.1 127.0 -3.0 44.0 39.8 112 120 A C E -eg 81 139A 0 -32,-3.3 -30,-2.4 -2,-0.6 2,-0.8 -0.958 19.4-159.4-125.4 124.8 -3.5 45.1 36.2 113 121 A G E -eg 82 140A 0 26,-2.2 28,-2.9 -2,-0.5 3,-0.3 -0.859 30.5-165.8 -99.2 101.1 -6.0 43.8 33.6 114 122 A N E +e 83 0A 4 -32,-3.2 -30,-2.3 -2,-0.8 -29,-0.3 -0.298 54.0 40.9 -87.5 169.3 -4.5 44.8 30.3 115 123 A K > + 0 0 55 -32,-0.2 3,-1.8 -31,-0.1 27,-0.2 0.724 57.7 147.4 69.9 25.7 -5.7 45.1 26.7 116 124 A V T 3 + 0 0 21 25,-1.6 26,-0.2 -3,-0.3 -1,-0.1 0.641 59.1 78.9 -64.9 -16.9 -9.1 46.5 27.6 117 125 A D T 3 S+ 0 0 59 24,-0.2 2,-0.4 30,-0.1 -1,-0.3 0.707 73.4 99.1 -59.1 -22.7 -9.0 48.4 24.3 118 126 A I S < S- 0 0 71 -3,-1.8 3,-0.0 1,-0.1 0, 0.0 -0.556 73.5-142.1 -75.4 128.3 -10.0 45.1 22.7 119 127 A K S S+ 0 0 206 -2,-0.4 2,-1.8 1,-0.2 -1,-0.1 0.924 88.5 63.4 -57.7 -52.3 -13.8 45.0 21.9 120 128 A D S S- 0 0 92 2,-0.0 2,-0.3 -35,-0.0 -1,-0.2 -0.546 74.1-172.1 -85.2 81.6 -14.4 41.3 22.8 121 129 A R + 0 0 65 -2,-1.8 -36,-0.2 1,-0.1 3,-0.1 -0.568 11.9 180.0 -71.1 133.6 -13.5 41.3 26.5 122 130 A K + 0 0 77 -38,-2.6 2,-1.0 -2,-0.3 -37,-0.2 0.712 66.8 64.8-109.6 -33.8 -13.5 37.8 28.1 123 131 A V S S- 0 0 1 -39,-2.7 -1,-0.2 3,-0.0 5,-0.1 -0.829 87.8-138.8 -95.5 94.2 -12.6 38.4 31.8 124 132 A K >> - 0 0 118 -2,-1.0 3,-1.6 -3,-0.1 4,-0.7 -0.267 11.8-121.8 -58.3 137.5 -15.6 40.4 33.0 125 133 A A G >4 S+ 0 0 38 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.878 112.7 58.3 -39.4 -50.4 -15.2 43.3 35.3 126 134 A K G 34 S+ 0 0 99 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.783 99.8 55.8 -57.9 -35.7 -17.4 41.6 37.7 127 135 A S G <4 S+ 0 0 49 -3,-1.6 2,-1.3 1,-0.1 3,-0.3 0.594 79.3 100.3 -71.9 -17.6 -15.2 38.5 38.0 128 136 A I << + 0 0 6 -3,-1.6 -1,-0.1 -4,-0.7 10,-0.0 -0.611 39.8 119.2 -83.7 93.0 -12.1 40.5 39.0 129 137 A V >> + 0 0 60 -2,-1.3 3,-2.0 2,-0.1 4,-0.5 0.423 33.6 101.7-133.0 -6.3 -12.0 40.0 42.8 130 138 A F H 3> S+ 0 0 42 -3,-0.3 4,-0.5 1,-0.3 3,-0.2 0.802 79.0 61.2 -55.6 -33.3 -8.8 38.2 43.5 131 139 A H H 3>>S+ 0 0 3 1,-0.2 5,-1.8 2,-0.1 4,-0.7 0.668 87.4 74.3 -67.9 -20.2 -7.2 41.5 44.7 132 140 A R H X45S+ 0 0 45 -3,-2.0 3,-0.9 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49.4 -53.8 -40.0 29.3 35.5 44.4 349 18 C Q H X S+ 0 0 107 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.928 110.2 49.9 -65.8 -46.1 30.7 38.2 42.2 350 19 C V H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.951 114.0 46.3 -54.8 -47.1 28.5 37.2 39.3 351 20 C V H X S+ 0 0 0 -4,-2.9 4,-3.1 1,-0.2 5,-0.3 0.942 111.8 49.0 -66.0 -50.8 25.5 37.2 41.6 352 21 C S H X>S+ 0 0 46 -4,-2.7 4,-2.9 1,-0.2 5,-0.6 0.898 109.8 54.1 -52.8 -44.3 26.3 40.6 43.2 353 22 C T H X5S+ 0 0 24 -4,-2.6 4,-0.7 -5,-0.2 -1,-0.2 0.880 111.8 44.6 -58.5 -41.8 26.8 42.0 39.7 354 23 C F H <5S+ 0 0 1 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.963 122.7 33.5 -68.0 -53.4 23.4 40.8 38.7 355 24 C Y H <5S+ 0 0 16 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.930 134.7 22.6 -72.9 -45.0 21.4 41.9 41.8 356 25 C Q H <5S+ 0 0 122 -4,-2.9 -3,-0.2 -5,-0.3 -1,-0.2 0.503 111.2 80.2-101.0 -10.4 23.3 45.1 42.8 357 26 C G << - 0 0 29 -4,-0.7 2,-0.3 -5,-0.6 -3,-0.1 0.024 61.6-148.4 -89.2-165.1 24.9 46.0 39.4 358 27 C S >> + 0 0 87 -319,-0.0 4,-1.4 -2,-0.0 3,-0.6 -0.971 42.6 4.7-160.2 169.6 23.5 47.7 36.3 359 28 C G H 3> S- 0 0 54 -2,-0.3 4,-1.7 1,-0.2 -320,-0.1 -0.152 118.0 -6.8 56.0-130.5 23.5 48.2 32.6 360 29 C V H 3> S+ 0 0 100 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.889 135.0 53.1 -69.0 -41.6 25.6 45.9 30.4 361 30 C Q H <> S+ 0 0 97 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.887 110.4 45.4 -57.8 -49.9 27.4 44.2 33.4 362 31 C Q H X S+ 0 0 16 -4,-1.4 4,-3.0 2,-0.2 -1,-0.2 0.917 113.6 52.3 -59.2 -45.7 24.2 43.2 35.1 363 32 C K H X S+ 0 0 124 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.895 110.2 45.8 -62.7 -47.6 22.8 42.0 31.8 364 33 C Q H X S+ 0 0 85 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.933 113.3 50.9 -59.6 -44.9 25.8 39.8 31.1 365 34 C A H X S+ 0 0 0 -4,-2.2 4,-3.0 1,-0.2 5,-0.2 0.917 106.2 55.3 -61.7 -47.1 25.8 38.4 34.6 366 35 C Q H X S+ 0 0 11 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.898 110.6 44.8 -48.8 -48.7 22.0 37.6 34.3 367 36 C E H X S+ 0 0 87 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.891 112.8 51.3 -67.4 -40.4 22.7 35.5 31.2 368 37 C I H X S+ 0 0 8 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.934 111.5 47.0 -59.2 -48.8 25.6 33.8 32.7 369 38 C L H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.860 110.5 51.7 -64.7 -38.6 23.6 32.9 35.9 370 39 C T H X S+ 0 0 20 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.2 0.887 110.1 49.9 -66.4 -38.8 20.7 31.6 33.9 371 40 C K H X S+ 0 0 114 -4,-1.8 4,-0.7 2,-0.2 -2,-0.2 0.957 112.2 47.5 -64.9 -50.3 23.0 29.4 31.9 372 41 C F H >< S+ 0 0 1 -4,-2.4 3,-1.0 2,-0.2 -2,-0.2 0.930 113.1 48.1 -49.1 -54.6 24.6 28.1 35.1 373 42 C Q H 3< S+ 0 0 9 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.932 109.9 50.8 -59.9 -48.1 21.2 27.4 36.6 374 43 C D H 3< S+ 0 0 103 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.576 82.7 112.9 -65.7 -14.1 19.8 25.6 33.6 375 44 C N X< - 0 0 49 -3,-1.0 3,-1.9 -4,-0.7 4,-0.4 -0.514 69.9-137.8 -65.9 124.2 22.9 23.3 33.5 376 45 C P T 3 S+ 0 0 78 0, 0.0 -1,-0.2 0, 0.0 3,-0.2 0.619 102.5 44.5 -67.5 -11.9 21.6 19.8 34.4 377 46 C D T > S+ 0 0 80 1,-0.1 3,-2.6 2,-0.1 4,-0.5 0.512 83.4 101.4 -99.3 -7.3 24.6 19.0 36.6 378 47 C A G X S+ 0 0 0 -3,-1.9 3,-1.8 1,-0.3 4,-0.3 0.804 71.4 66.2 -46.1 -36.5 24.4 22.5 38.3 379 48 C W G > S+ 0 0 39 -4,-0.4 3,-1.8 1,-0.3 4,-0.4 0.777 86.2 68.3 -58.3 -31.4 22.6 20.8 41.2 380 49 C Q G < S+ 0 0 98 -3,-2.6 4,-0.4 1,-0.3 -1,-0.3 0.740 96.7 54.9 -63.7 -22.1 25.7 18.9 42.2 381 50 C K G <> S+ 0 0 43 -3,-1.8 4,-2.4 -4,-0.5 -1,-0.3 0.556 82.7 93.3 -84.5 -9.3 27.3 22.2 43.1 382 51 C A H <> S+ 0 0 1 -3,-1.8 4,-3.1 -4,-0.3 5,-0.3 0.899 83.6 47.9 -56.5 -48.6 24.5 23.1 45.5 383 52 C D H > S+ 0 0 58 -4,-0.4 4,-2.7 -3,-0.3 -1,-0.2 0.943 112.2 50.3 -57.8 -50.1 26.1 21.7 48.6 384 53 C Q H > S+ 0 0 60 -4,-0.4 4,-2.4 2,-0.2 5,-0.2 0.874 113.1 47.1 -52.6 -45.1 29.4 23.5 47.9 385 54 C I H X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 -2,-0.2 0.967 111.6 48.8 -63.5 -54.1 27.5 26.8 47.3 386 55 C L H < S+ 0 0 16 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.895 117.8 42.2 -53.9 -44.6 25.4 26.5 50.5 387 56 C Q H < S+ 0 0 114 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.955 126.8 26.6 -66.7 -52.1 28.5 25.7 52.5 388 57 C F H < S+ 0 0 131 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.575 92.1 103.0 -99.0 -15.5 31.0 28.2 51.1 389 58 C S < - 0 0 7 -4,-3.1 -44,-0.1 -5,-0.2 -45,-0.0 -0.376 44.5-167.2 -70.5 150.5 29.0 31.1 49.7 390 59 C T S S+ 0 0 128 -46,-0.1 -1,-0.1 -2,-0.1 -4,-0.1 0.130 70.4 83.1-117.4 14.0 28.9 34.4 51.7 391 60 C N > - 0 0 12 1,-0.1 4,-1.3 0, 0.0 3,-0.5 -0.990 65.7-154.7-126.3 115.2 26.0 35.7 49.5 392 61 C P H > S+ 0 0 32 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.772 96.0 58.8 -62.5 -31.5 22.5 34.7 50.4 393 62 C Q H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.833 101.8 55.5 -64.7 -35.5 21.3 35.2 46.8 394 63 C S H > S+ 0 0 0 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.927 111.2 43.5 -59.9 -45.7 23.9 32.7 45.7 395 64 C K H X S+ 0 0 45 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.870 109.8 55.6 -69.9 -38.8 22.4 30.2 48.1 396 65 C F H X S+ 0 0 4 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.952 109.8 46.7 -56.1 -50.9 18.9 31.1 47.0 397 66 C I H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.907 107.9 56.4 -57.3 -46.6 19.9 30.3 43.4 398 67 C A H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.912 108.9 48.2 -45.3 -46.5 21.4 27.1 44.7 399 68 C L H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.844 106.2 54.6 -72.2 -36.7 18.0 26.3 46.1 400 69 C S H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.891 108.1 51.8 -60.4 -39.0 16.1 27.2 42.9 401 70 C I H X S+ 0 0 8 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.914 112.2 44.7 -63.9 -45.3 18.4 24.6 41.2 402 71 C L H X S+ 0 0 0 -4,-1.8 4,-3.3 2,-0.2 5,-0.3 0.941 110.2 54.9 -61.6 -50.1 17.6 22.0 43.7 403 72 C D H X S+ 0 0 26 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.875 108.6 48.5 -52.1 -43.3 13.9 22.8 43.5 404 73 C K H X S+ 0 0 74 -4,-2.1 4,-1.5 2,-0.2 5,-0.4 0.929 114.1 46.5 -62.4 -46.8 14.0 22.3 39.7 405 74 C L H X S+ 0 0 12 -4,-1.9 4,-2.4 2,-0.2 5,-0.5 0.908 115.3 46.1 -61.1 -45.2 15.8 19.0 40.2 406 75 C I H X S+ 0 0 0 -4,-3.3 4,-0.6 1,-0.2 -2,-0.2 0.902 115.4 44.8 -69.0 -44.2 13.4 17.8 42.9 407 76 C T H < S+ 0 0 36 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.770 129.0 23.5 -73.4 -23.6 10.2 18.8 41.2 408 77 C R H < S+ 0 0 101 -4,-1.5 928,-0.8 -5,-0.2 -2,-0.2 0.771 134.7 17.3-113.8 -33.6 11.2 17.4 37.8 409 78 C K H >X S+ 0 0 87 -4,-2.4 3,-2.3 -5,-0.4 4,-0.8 0.247 75.2 124.2-133.1 7.1 13.9 14.6 38.1 410 79 C W G >< S+ 0 0 3 -4,-0.6 3,-1.2 -5,-0.5 -4,-0.1 0.854 80.5 45.6 -43.4 -49.5 13.8 13.5 41.7 411 80 C K G 34 S+ 0 0 87 925,-0.5 -1,-0.3 1,-0.3 926,-0.1 0.493 100.6 68.3 -82.8 -4.6 13.2 9.8 40.9 412 81 C L G <4 S+ 0 0 117 -3,-2.3 -1,-0.3 924,-0.1 -2,-0.2 0.708 87.3 93.7 -74.1 -25.5 15.9 9.8 38.1 413 82 C L S << S- 0 0 15 -3,-1.2 5,-0.1 -4,-0.8 -3,-0.0 -0.374 88.1-105.1 -73.6 143.7 18.4 10.2 41.0 414 83 C P > - 0 0 72 0, 0.0 4,-1.1 0, 0.0 3,-0.3 -0.279 36.9-110.8 -56.7 154.5 20.3 7.4 42.6 415 84 C N H >> S+ 0 0 86 1,-0.2 4,-2.0 2,-0.2 3,-0.9 0.926 116.6 55.8 -57.1 -50.1 18.9 6.7 46.1 416 85 C D H 3> S+ 0 0 129 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.863 103.6 54.6 -46.3 -46.5 22.1 8.0 47.8 417 86 C H H 3> S+ 0 0 80 -3,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.814 107.1 51.7 -62.0 -30.6 21.8 11.3 46.1 418 87 C R H S+ 0 0 105 -2,-1.0 4,-2.1 1,-0.2 5,-0.2 0.851 86.7 53.9 -54.3 -43.1 19.8 33.8 65.9 437 106 C E H > S+ 0 0 108 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.948 112.7 43.7 -61.5 -49.2 21.5 36.5 63.8 438 107 C V H > S+ 0 0 38 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.935 113.1 52.9 -57.3 -47.7 21.0 34.4 60.7 439 108 C F H < S+ 0 0 11 -4,-2.8 -1,-0.2 -7,-0.3 -2,-0.2 0.845 114.2 42.3 -58.5 -36.5 17.5 33.6 61.7 440 109 C K H < S+ 0 0 132 -4,-2.1 3,-0.3 -5,-0.2 -1,-0.2 0.863 125.9 30.4 -78.8 -38.1 16.6 37.3 62.1 441 110 C T H < S+ 0 0 73 -4,-2.2 3,-0.2 -5,-0.2 -2,-0.2 0.533 113.0 56.9-106.8 -10.1 18.4 38.6 59.1 442 111 C Q X + 0 0 58 -4,-2.5 4,-2.0 -5,-0.2 3,-0.4 -0.113 59.2 134.3-115.8 37.3 18.2 35.8 56.5 443 112 C K H > + 0 0 62 -3,-0.3 4,-2.8 1,-0.2 5,-0.2 0.815 69.1 56.5 -59.2 -38.7 14.4 35.3 56.3 444 113 C N H > S+ 0 0 42 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.941 111.0 44.2 -56.4 -47.1 14.3 35.2 52.4 445 114 C L H > S+ 0 0 4 -3,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.849 113.5 50.3 -70.4 -35.8 16.8 32.4 52.4 446 115 C I H X S+ 0 0 3 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.926 110.0 50.3 -68.4 -44.3 15.1 30.5 55.2 447 116 C N H X S+ 0 0 16 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.906 111.3 48.3 -57.8 -46.4 11.7 30.8 53.5 448 117 C K H X S+ 0 0 10 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.911 111.4 51.0 -58.3 -43.2 13.2 29.5 50.2 449 118 C S H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.914 108.7 51.3 -62.5 -47.2 14.9 26.6 52.1 450 119 C D H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.933 111.0 47.0 -56.0 -49.6 11.6 25.7 53.8 451 120 C L H X S+ 0 0 18 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.899 109.7 54.5 -59.7 -41.2 9.8 25.6 50.4 452 121 C T H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 3,-0.3 0.961 109.3 48.0 -59.5 -46.3 12.7 23.5 49.0 453 122 C L H X S+ 0 0 10 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.916 107.3 55.5 -55.8 -47.2 12.1 21.0 51.9 454 123 C V H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.853 102.8 56.0 -58.1 -36.4 8.4 21.0 51.2 455 124 C Q H X S+ 0 0 19 -4,-2.0 4,-1.1 -3,-0.3 -1,-0.2 0.900 107.8 49.4 -61.7 -39.0 9.2 20.0 47.6 456 125 C I H X S+ 0 0 0 -4,-1.6 4,-2.3 1,-0.2 3,-0.5 0.924 108.6 52.3 -65.7 -43.4 11.1 17.0 49.0 457 126 C L H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 -1,-0.2 0.926 102.7 58.7 -56.7 -44.7 8.2 16.1 51.3 458 127 C K H < S+ 0 0 17 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.842 115.2 37.5 -56.7 -31.4 5.8 16.2 48.2 459 128 C Q H < S+ 0 0 16 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.843 131.9 23.2 -85.2 -36.9 8.0 13.5 46.7 460 129 C E H X S+ 0 0 19 -4,-2.3 4,-2.3 -5,-0.1 -3,-0.2 0.550 88.6 134.2-114.4 -12.9 8.9 11.4 49.8 461 130 C W T < S- 0 0 1 -4,-3.1 55,-0.1 -5,-0.2 0, 0.0 -0.834 73.6 -13.9-116.1 139.3 6.3 11.9 52.5 462 131 C P T >4 S+ 0 0 26 0, 0.0 3,-2.3 0, 0.0 -1,-0.2 -0.988 128.4 57.2 -88.2 -12.7 4.8 10.1 54.3 463 132 C Q T 34 S+ 0 0 108 1,-0.3 -2,-0.2 2,-0.2 -3,-0.1 0.816 126.4 22.2 -45.9 -43.2 5.6 6.8 52.5 464 133 C N T 3< S+ 0 0 84 -4,-2.3 -1,-0.3 1,-0.2 -3,-0.2 0.017 135.6 37.8-115.1 22.9 9.4 7.3 52.8 465 134 C W X + 0 0 28 -3,-2.3 3,-2.0 -8,-0.0 4,-0.3 -0.010 62.1 155.2-163.3 47.9 9.3 9.7 55.7 466 135 C P T 3 S+ 0 0 72 0, 0.0 3,-0.2 0, 0.0 -3,-0.1 0.648 73.1 54.3 -60.9 -20.8 6.6 8.7 58.2 467 136 C E T 3> S+ 0 0 99 1,-0.2 4,-2.3 2,-0.1 5,-0.3 0.423 74.6 102.8 -96.4 2.6 8.2 10.4 61.2 468 137 C F H <> S+ 0 0 19 -3,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.920 85.1 41.6 -51.1 -54.6 8.5 13.8 59.7 469 138 C I H > S+ 0 0 2 -4,-0.3 4,-3.4 -3,-0.2 5,-0.2 0.938 113.1 49.1 -65.8 -53.8 5.5 15.3 61.6 470 139 C P H > S+ 0 0 57 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.871 117.2 44.3 -56.7 -33.6 6.0 13.7 65.0 471 140 C E H X S+ 0 0 125 -4,-2.3 4,-3.2 2,-0.2 -2,-0.2 0.874 111.0 52.3 -77.7 -41.6 9.7 14.8 64.9 472 141 C L H X S+ 0 0 8 -4,-2.8 4,-1.4 -5,-0.3 -3,-0.2 0.962 112.6 48.1 -49.4 -52.8 8.8 18.3 63.6 473 142 C I H X S+ 0 0 41 -4,-3.4 4,-0.6 1,-0.2 3,-0.5 0.938 113.1 46.2 -54.2 -53.0 6.4 18.4 66.5 474 143 C G H >X S+ 0 0 40 -4,-2.2 3,-1.6 1,-0.2 4,-0.6 0.956 109.3 54.1 -55.3 -53.3 9.0 17.3 69.0 475 144 C S H >< S+ 0 0 41 -4,-3.2 3,-0.8 1,-0.3 4,-0.5 0.756 94.5 72.8 -54.8 -29.7 11.7 19.7 67.7 476 145 C S H >< S+ 0 0 7 -4,-1.4 3,-0.5 -3,-0.5 7,-0.4 0.781 93.0 51.9 -61.3 -33.2 9.3 22.6 68.2 477 146 C S H << S+ 0 0 114 -3,-1.6 -1,-0.2 -4,-0.6 -2,-0.2 0.764 100.1 64.7 -74.7 -24.8 9.6 22.6 72.0 478 147 C S T << S+ 0 0 94 -3,-0.8 2,-0.3 -4,-0.6 -1,-0.2 0.655 113.4 14.9 -75.1 -16.6 13.4 22.7 71.9 479 148 C S <> - 0 0 34 -3,-0.5 4,-2.3 -4,-0.5 -1,-0.2 -0.935 55.7-142.2-166.3 133.4 13.7 26.2 70.3 480 149 C V H > S+ 0 0 94 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.902 107.0 49.2 -67.8 -39.5 11.5 29.2 69.6 481 150 C N H > S+ 0 0 23 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.925 112.9 46.2 -64.1 -48.6 13.2 29.8 66.2 482 151 C V H > S+ 0 0 18 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.903 113.5 50.3 -57.8 -45.5 12.8 26.2 65.1 483 152 C C H X S+ 0 0 7 -4,-2.3 4,-1.8 -7,-0.4 -2,-0.2 0.916 112.0 45.8 -63.0 -46.0 9.2 26.2 66.3 484 153 C E H X S+ 0 0 15 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.927 113.4 50.9 -63.9 -42.3 8.4 29.4 64.5 485 154 C N H X S+ 0 0 2 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.824 103.6 58.6 -66.5 -31.4 10.1 28.0 61.4 486 155 C N H X S+ 0 0 18 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.920 101.5 55.8 -64.5 -40.8 8.1 24.8 61.6 487 156 C M H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.868 106.8 49.0 -55.6 -44.8 5.0 26.9 61.4 488 157 C I H X S+ 0 0 17 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.931 111.3 51.1 -58.7 -47.8 6.2 28.4 58.0 489 158 C V H X S+ 0 0 3 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.927 112.2 45.6 -58.3 -45.9 7.0 24.9 56.8 490 159 C L H X S+ 0 0 1 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.882 109.9 53.5 -68.5 -41.6 3.5 23.6 57.7 491 160 C K H X S+ 0 0 23 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.926 112.2 46.3 -56.4 -44.5 1.9 26.7 56.1 492 161 C L H X S+ 0 0 8 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.921 111.7 50.8 -68.0 -43.1 3.8 26.0 52.9 493 162 C L H X S+ 0 0 1 -4,-2.5 4,-2.2 2,-0.2 5,-0.2 0.949 110.1 48.6 -59.1 -51.8 2.9 22.3 53.0 494 163 C S H X>S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 5,-0.8 0.907 113.0 49.8 -55.2 -43.2 -0.8 23.0 53.5 495 164 C E H X>S+ 0 0 15 -4,-2.1 5,-1.9 -5,-0.2 4,-1.4 0.950 112.3 45.6 -57.0 -51.2 -0.6 25.4 50.6 496 165 C E H <5S+ 0 0 3 -4,-2.7 -1,-0.2 3,-0.2 -2,-0.2 0.807 120.7 40.8 -68.7 -27.9 1.1 23.0 48.3 497 166 C V H <5S+ 0 0 0 -4,-2.2 -2,-0.2 -5,-0.2 4,-0.2 0.939 130.9 16.0 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33.8 -54.9 -23.9 -4.5 11.7 59.2 520 189 C E H XX S+ 0 0 40 -4,-0.8 4,-1.6 -3,-0.8 3,-0.7 0.336 85.7 100.1-114.0 4.4 -2.0 13.7 61.2 521 190 C F H S+ 0 0 87 -4,-0.5 4,-1.5 1,-0.2 -1,-0.2 0.905 105.8 38.0 -41.6 -51.0 -4.8 16.1 65.2 523 192 C Q H <> S+ 0 0 91 -3,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.881 113.0 55.8 -73.9 -40.7 -1.2 16.5 66.3 524 193 C I H X S+ 0 0 2 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.938 110.9 46.2 -56.1 -45.1 -0.5 19.5 64.1 525 194 C F H X S+ 0 0 13 -4,-3.5 4,-3.5 2,-0.2 5,-0.2 0.850 105.5 58.4 -69.3 -39.0 -3.4 21.3 65.6 526 195 C K H X S+ 0 0 112 -4,-1.5 4,-2.5 -5,-0.3 -1,-0.2 0.947 109.5 45.0 -57.3 -50.0 -2.5 20.5 69.2 527 196 C L H X S+ 0 0 15 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.955 113.4 51.1 -56.3 -49.8 0.9 22.2 68.7 528 197 C C H X S+ 0 0 4 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.937 111.7 46.7 -57.0 -48.0 -0.8 25.1 67.0 529 198 C F H X S+ 0 0 33 -4,-3.5 4,-1.8 2,-0.2 -1,-0.2 0.917 111.7 50.9 -62.8 -41.8 -3.3 25.5 69.9 530 199 C Q H X S+ 0 0 73 -4,-2.5 4,-2.8 -5,-0.2 3,-0.5 0.974 110.0 47.9 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28.0 55.4 551 220 C Y H >X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.3 3,-2.3 0.871 97.0 68.0 -63.2 -37.1 -5.6 25.1 57.5 552 221 C L T 3< S+ 0 0 8 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.747 85.4 71.3 -57.3 -23.1 -9.0 26.9 57.7 553 222 C H T <4 S+ 0 0 86 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.738 123.7 1.6 -62.2 -21.7 -9.4 26.2 53.9 554 223 C W T <4 S+ 0 0 44 -3,-2.3 -2,-0.2 -4,-0.3 -1,-0.1 0.568 92.3 115.6-146.0 -18.7 -9.9 22.5 54.6 555 224 C I S < S- 0 0 5 -4,-2.7 5,-0.1 1,-0.1 2,-0.0 -0.309 73.0 -95.4 -66.4 148.6 -9.9 21.3 58.2 556 225 C P > - 0 0 53 0, 0.0 3,-1.4 0, 0.0 4,-0.4 -0.368 33.5-118.6 -64.2 148.1 -13.0 19.9 59.7 557 226 C Y T >> S+ 0 0 62 37,-0.3 4,-2.5 1,-0.3 3,-1.9 0.775 103.5 75.2 -65.7 -30.7 -15.1 22.4 61.6 558 227 C R H 3> S+ 0 0 105 1,-0.3 4,-2.8 2,-0.2 -1,-0.3 0.839 89.4 60.9 -48.6 -36.2 -14.9 20.6 65.0 559 228 C Y H <4 S+ 0 0 12 -3,-1.4 -1,-0.3 1,-0.2 6,-0.3 0.816 112.7 38.3 -63.3 -28.7 -11.3 21.9 65.4 560 229 C I H <4 S+ 0 0 0 -3,-1.9 6,-0.6 -4,-0.4 3,-0.2 0.876 126.4 32.8 -86.1 -42.6 -12.7 25.4 65.2 561 230 C Y H < S+ 0 0 8 -4,-2.5 -3,-0.2 1,-0.2 -2,-0.2 0.688 114.7 53.3 -93.7 -20.2 -15.9 25.0 67.2 562 231 C E S < S+ 0 0 139 -4,-2.8 2,-0.2 -5,-0.3 -1,-0.2 0.316 103.3 60.5-106.4 10.4 -15.0 22.4 69.8 563 232 C T S > S- 0 0 48 -3,-0.2 3,-0.5 -5,-0.2 4,-0.2 -0.717 94.7-104.4-120.0 177.1 -11.9 24.1 71.1 564 233 C N T 3> S+ 0 0 71 -2,-0.2 4,-1.7 1,-0.2 3,-0.5 0.331 88.0 110.5 -81.5 11.5 -11.4 27.5 72.8 565 234 C I H 3> + 0 0 2 -6,-0.3 4,-2.6 1,-0.2 5,-0.3 0.844 67.5 56.2 -65.9 -33.7 -9.9 28.8 69.6 566 235 C L H <> S+ 0 0 12 -6,-0.6 4,-2.6 -3,-0.5 -1,-0.2 0.919 107.1 50.9 -64.3 -41.8 -12.7 31.2 68.6 567 236 C E H > S+ 0 0 96 -3,-0.5 4,-1.2 2,-0.2 5,-0.5 0.926 111.6 48.0 -57.0 -50.2 -12.4 33.1 71.9 568 237 C L H ><>S+ 0 0 15 -4,-1.7 5,-2.6 2,-0.2 3,-0.5 0.955 115.6 42.9 -55.7 -54.3 -8.7 33.5 71.4 569 238 C L H 3<5S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.917 117.9 45.1 -59.8 -46.1 -8.9 34.8 67.9 570 239 C S H 3<5S+ 0 0 0 -4,-2.6 46,-0.3 -5,-0.3 -1,-0.2 0.517 130.8 14.8 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4,-0.4 -0.404 52.9 -44.5 -64.9 144.5 -1.1 55.7 58.1 637 306 C G T 3 S- 0 0 72 1,-0.3 3,-0.3 2,-0.1 4,-0.1 0.018 122.0 -23.1 41.8-123.3 0.7 52.5 58.7 638 307 C N T 3> S+ 0 0 112 1,-0.2 4,-2.5 2,-0.1 -1,-0.3 0.074 98.8 121.3-107.9 20.8 -1.5 49.7 57.7 639 308 C D H <> S+ 0 0 53 -3,-3.1 4,-2.8 1,-0.2 5,-0.3 0.889 72.4 51.3 -51.1 -46.0 -4.7 51.5 58.1 640 309 C Q H > S+ 0 0 19 -4,-0.4 4,-2.4 -3,-0.3 -1,-0.2 0.930 113.1 46.0 -61.1 -45.5 -5.8 51.0 54.4 641 310 C S H > S+ 0 0 33 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.915 112.2 50.0 -61.8 -46.5 -5.2 47.3 54.6 642 311 C F H X S+ 0 0 28 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.959 111.1 48.6 -59.9 -50.2 -6.9 46.9 58.0 643 312 C L H X S+ 0 0 3 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.920 112.2 50.4 -56.9 -44.4 -10.0 48.8 56.7 644 313 C Q H X S+ 0 0 34 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.928 111.9 46.3 -57.2 -48.3 -10.0 46.6 53.6 645 314 C D H X S+ 0 0 8 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.837 110.7 53.6 -68.0 -30.9 -9.8 43.5 55.7 646 315 C L H X S+ 0 0 0 -4,-2.5 4,-3.4 -5,-0.2 5,-0.3 0.951 107.8 50.0 -66.3 -49.0 -12.5 44.7 58.0 647 316 C A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.920 112.3 48.5 -51.0 -46.5 -14.8 45.3 55.0 648 317 C M H X S+ 0 0 23 -4,-2.3 4,-2.0 1,-0.2 5,-0.3 0.888 113.8 47.0 -65.4 -40.0 -14.1 41.8 53.9 649 318 C F H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 5,-0.3 0.959 115.2 42.9 -67.5 -52.2 -14.7 40.4 57.4 650 319 C L H X S+ 0 0 0 -4,-3.4 4,-2.6 1,-0.2 5,-0.3 0.925 117.2 46.8 -59.5 -46.2 -18.0 42.3 58.0 651 320 C T H X S+ 0 0 13 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.911 114.4 46.1 -66.8 -41.7 -19.4 41.6 54.5 652 321 C T H X S+ 0 0 22 -4,-2.0 4,-1.4 -5,-0.3 -1,-0.2 0.929 116.8 44.3 -66.0 -49.6 -18.5 37.9 54.5 653 322 C Y H X S+ 0 0 0 -4,-2.4 4,-3.6 -5,-0.3 5,-0.3 0.934 116.4 43.9 -62.4 -51.2 -19.9 37.3 57.9 654 323 C L H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.3 5,-0.3 0.906 107.4 58.9 -65.7 -43.5 -23.1 39.2 57.5 655 324 C A H < S+ 0 0 43 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.866 120.5 29.5 -50.5 -42.7 -23.8 37.8 54.1 656 325 C R H < S+ 0 0 92 -4,-1.4 -2,-0.2 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> - 0 0 39 -2,-1.1 4,-2.9 1,-0.1 3,-0.2 -0.606 56.4-151.0-171.0 107.5 -11.4 53.8 46.9 687 356 C R H > S+ 0 0 122 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.882 95.3 46.1 -54.8 -47.4 -13.1 52.4 43.9 688 357 C E H > S+ 0 0 23 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.866 114.3 47.6 -69.3 -36.4 -12.3 48.8 44.5 689 358 C L H >> S+ 0 0 10 -3,-0.2 4,-2.1 2,-0.2 3,-0.6 0.920 110.0 54.4 -67.6 -44.7 -13.1 48.9 48.2 690 359 C F H 3X S+ 0 0 6 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.893 104.9 53.8 -54.3 -40.5 -16.4 50.6 47.3 691 360 C K H 3X S+ 0 0 43 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.821 106.5 53.1 -65.2 -30.1 -17.2 47.8 44.9 692 361 C T H X S+ 0 0 64 -4,-1.6 4,-2.8 -5,-0.3 3,-0.8 0.881 111.0 51.1 -66.4 -44.0 -32.8 39.9 50.4 704 373 C L H 3< S+ 0 0 8 -4,-2.4 7,-0.4 1,-0.2 -1,-0.2 0.719 102.4 62.1 -66.5 -23.5 -34.8 42.7 52.0 705 374 C F H 3< S+ 0 0 65 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.728 121.4 20.1 -75.0 -27.0 -36.8 43.1 48.8 706 375 C Y H << S+ 0 0 176 -3,-0.8 -2,-0.2 -4,-0.6 -3,-0.1 0.753 99.2 91.3-108.9 -45.5 -38.1 39.5 49.2 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H X S+ 0 0 20 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.919 112.4 49.6 -63.7 -38.1 -0.8 49.7 -6.9 1038 744 C A H < S+ 0 0 89 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.942 117.1 39.8 -67.9 -45.8 0.7 49.0 -10.3 1039 745 C A H < S+ 0 0 84 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.829 132.3 22.1 -74.6 -34.4 1.8 52.6 -10.9 1040 746 C E H < S- 0 0 95 -4,-2.7 3,-0.3 1,-0.2 -3,-0.2 0.518 102.9-118.6-113.2 -10.1 3.0 53.4 -7.3 1041 747 C G >< - 0 0 29 -4,-2.3 3,-2.1 -5,-0.3 4,-0.3 -0.236 50.7 -51.5 91.5 174.7 3.8 50.1 -5.6 1042 748 C L G > S+ 0 0 86 1,-0.3 3,-2.2 2,-0.2 4,-0.3 0.782 127.0 74.6 -55.5 -29.2 2.3 48.4 -2.5 1043 749 C I G >> S+ 0 0 62 1,-0.3 3,-2.6 -3,-0.3 4,-0.7 0.818 77.0 77.9 -59.2 -28.5 2.9 51.7 -0.7 1044 750 C A G X4 S+ 0 0 0 -3,-2.1 3,-1.1 1,-0.3 6,-0.5 0.827 81.8 67.1 -45.3 -37.6 -0.2 53.0 -2.7 1045 751 C T G <4 S+ 0 0 10 -3,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.697 97.0 53.2 -64.5 -17.9 -2.3 51.0 -0.2 1046 752 C K G <4 S+ 0 0 92 -3,-2.6 -1,-0.3 -4,-0.3 -2,-0.2 0.696 87.0 106.2 -86.8 -21.2 -1.3 53.4 2.6 1047 753 C T S S+ 0 0 41 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.909 111.8 55.6 -53.3 -43.2 -5.3 58.5 1.7 1049 755 C K H > S+ 0 0 47 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.945 112.6 38.6 -54.3 -54.5 -6.6 58.1 -1.9 1050 756 C V H > S+ 0 0 0 -6,-0.5 4,-2.5 2,-0.2 5,-0.2 0.901 114.0 53.8 -68.9 -40.6 -6.4 54.3 -1.9 1051 757 C R H X S+ 0 0 57 -4,-2.7 4,-2.3 -7,-0.2 -1,-0.2 0.936 110.3 50.8 -59.1 -42.8 -7.6 53.9 1.7 1052 758 C G H X S+ 0 0 18 -4,-2.5 4,-1.7 -5,-0.3 -2,-0.2 0.925 108.4 49.5 -58.7 -48.1 -10.6 56.0 0.6 1053 759 C L H X S+ 0 0 1 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.903 111.9 49.8 -61.7 -36.4 -11.3 53.9 -2.4 1054 760 C R H X S+ 0 0 38 -4,-2.5 4,-3.0 1,-0.2 5,-0.3 0.864 101.7 61.0 -71.9 -35.8 -11.2 50.8 -0.2 1055 761 C T H X S+ 0 0 38 -4,-2.3 4,-2.9 -5,-0.2 5,-0.3 0.932 103.4 52.8 -55.2 -41.2 -13.6 52.4 2.3 1056 762 C I H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.961 111.0 45.3 -56.8 -50.2 -16.1 52.5 -0.6 1057 763 C K H X S+ 0 0 0 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.889 114.9 48.5 -60.6 -41.9 -15.6 48.8 -1.3 1058 764 C K H X S+ 0 0 58 -4,-3.0 4,-2.9 2,-0.2 -1,-0.2 0.917 111.2 48.2 -69.7 -41.2 -15.8 47.9 2.4 1059 765 C E H X S+ 0 0 19 -4,-2.9 4,-2.7 -5,-0.3 -1,-0.2 0.893 110.9 52.0 -68.3 -37.4 -18.9 50.0 3.0 1060 766 C I H X S+ 0 0 1 -4,-2.4 4,-2.2 -5,-0.3 5,-0.2 0.950 112.1 46.3 -58.3 -48.4 -20.5 48.3 -0.1 1061 767 C L H X S+ 0 0 3 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.936 112.7 50.9 -62.8 -41.8 -19.6 44.9 1.4 1062 768 C K H X S+ 0 0 108 -4,-2.9 4,-3.1 1,-0.2 5,-0.2 0.907 108.0 52.1 -63.9 -42.6 -21.0 46.0 4.8 1063 769 C L H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.942 112.7 43.5 -59.6 -49.3 -24.2 47.2 3.3 1064 770 C V H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.918 115.1 50.1 -66.1 -41.0 -24.9 43.9 1.5 1065 771 C E H X S+ 0 0 37 -4,-2.7 4,-2.7 -5,-0.2 -2,-0.2 0.933 110.9 49.2 -59.7 -49.3 -23.8 41.9 4.5 1066 772 C T H X S+ 0 0 11 -4,-3.1 4,-1.1 -5,-0.2 -2,-0.2 0.951 114.3 45.1 -56.0 -51.0 -26.1 43.9 6.8 1067 773 C Y H >X S+ 0 0 5 -4,-2.5 3,-1.0 -5,-0.2 4,-0.9 0.960 113.7 47.7 -63.2 -52.0 -29.1 43.5 4.5 1068 774 C I H >< S+ 0 0 0 -4,-2.9 3,-0.7 1,-0.2 -1,-0.2 0.884 106.4 58.7 -57.9 -39.0 -28.5 39.7 3.9 1069 775 C S H 3< S+ 0 0 38 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.793 118.5 31.2 -60.4 -30.5 -28.1 39.1 7.7 1070 776 C K H << S+ 0 0 90 -4,-1.1 -61,-0.5 -3,-1.0 -1,-0.2 0.391 89.3 131.8-104.8 -3.1 -31.6 40.5 8.3 1071 777 C A << - 0 0 14 -4,-0.9 3,-0.1 -3,-0.7 -62,-0.1 -0.252 32.7-175.4 -63.1 141.3 -33.3 39.6 5.0 1072 778 C R S S+ 0 0 219 1,-0.2 2,-1.0 -63,-0.1 -1,-0.1 0.694 74.8 64.7-105.7 -30.5 -36.7 37.9 5.3 1073 779 C N > + 0 0 74 1,-0.2 4,-1.4 -64,-0.1 3,-0.3 -0.764 59.3 173.9 -98.5 90.6 -37.2 37.2 1.6 1074 780 C L H > S+ 0 0 55 -2,-1.0 4,-2.1 1,-0.2 5,-0.2 0.735 71.6 66.1 -69.1 -24.4 -34.4 34.7 0.9 1075 781 C D H > S+ 0 0 96 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.916 102.8 45.3 -68.4 -43.2 -35.6 34.1 -2.7 1076 782 C D H >>S+ 0 0 52 -3,-0.3 4,-2.8 2,-0.2 5,-1.5 0.884 108.9 58.0 -65.0 -38.6 -34.9 37.6 -3.8 1077 783 C V H X>S+ 0 0 0 -4,-1.4 5,-2.8 3,-0.2 4,-0.8 0.971 116.1 34.8 -52.0 -52.3 -31.5 37.4 -2.0 1078 784 C V H <>S+ 0 0 31 -4,-2.1 5,-0.6 3,-0.2 -2,-0.2 0.931 125.5 39.2 -70.6 -50.3 -30.6 34.4 -4.2 1079 785 C K H <5S+ 0 0 171 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.829 132.9 18.8 -72.9 -33.5 -32.4 35.3 -7.4 1080 786 C V H <5S+ 0 0 43 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.812 129.9 31.6-108.4 -43.5 -31.6 39.1 -7.4 1081 787 C L T X S+ 0 0 32 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.914 114.9 53.3 -63.0 -38.0 -24.2 39.9 -9.3 1085 791 C L H X S+ 0 0 1 -4,-1.9 4,-2.3 2,-0.2 5,-0.3 0.977 112.2 43.3 -54.3 -56.5 -22.5 40.1 -5.9 1086 792 C L H X S+ 0 0 7 -4,-3.0 4,-2.1 1,-0.2 5,-0.5 0.917 114.4 50.8 -57.3 -45.0 -20.4 37.0 -6.5 1087 793 C N H < S+ 0 0 77 -4,-2.5 4,-0.3 -5,-0.2 5,-0.2 0.911 114.0 45.3 -62.2 -42.2 -19.6 38.3 -10.0 1088 794 C A H < S+ 0 0 2 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.846 124.9 25.2 -69.2 -36.8 -18.5 41.7 -8.7 1089 795 C V H X S+ 0 0 0 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.765 106.5 63.0-107.6 -30.0 -16.4 40.6 -5.7 1090 796 C L H X S+ 0 0 5 -4,-2.1 4,-2.9 -5,-0.3 5,-0.2 0.954 105.5 41.0 -70.9 -53.9 -14.8 37.1 -6.0 1091 797 C E H > S+ 0 0 125 -5,-0.5 4,-2.9 -4,-0.3 -1,-0.2 0.907 114.1 55.6 -64.0 -43.4 -12.6 37.4 -9.0 1092 798 C D H > S+ 0 0 28 -5,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.890 110.8 44.2 -53.1 -45.1 -11.5 40.8 -7.8 1093 799 C Y H >< S+ 0 0 2 -4,-1.7 3,-1.2 2,-0.2 -2,-0.2 0.980 116.1 47.0 -64.7 -55.2 -10.4 39.4 -4.4 1094 800 C M H 3< S+ 0 0 70 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.871 115.2 45.7 -49.6 -45.9 -8.7 36.3 -6.0 1095 801 C N H 3< S+ 0 0 104 -4,-2.9 2,-0.3 -5,-0.2 -1,-0.2 0.354 93.5 93.6 -94.2 4.7 -6.9 38.4 -8.6 1096 802 C N S << S- 0 0 13 -3,-1.2 5,-0.1 -4,-0.5 -62,-0.0 -0.661 86.2 -99.1 -86.0 152.3 -5.6 41.2 -6.4 1097 803 C V >> - 0 0 66 -2,-0.3 3,-2.5 1,-0.1 4,-0.6 -0.399 45.2-103.4 -62.3 147.5 -2.2 41.2 -4.7 1098 804 C P G >4 S+ 0 0 50 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.854 120.1 55.2 -43.5 -44.3 -2.5 40.0 -1.0 1099 805 C D G 34 S+ 0 0 50 1,-0.3 -2,-0.1 3,-0.0 47,-0.0 0.550 106.0 52.8 -70.7 -8.8 -2.1 43.6 0.4 1100 806 C A G <4 S+ 0 0 1 -3,-2.5 2,-0.4 -7,-0.1 -1,-0.3 0.467 84.7 107.5-103.4 -7.8 -5.0 44.8 -1.7 1101 807 C R << - 0 0 23 -3,-1.4 2,-0.5 -4,-0.6 48,-0.1 -0.606 64.4-138.3 -79.4 124.7 -7.5 42.1 -0.6 1102 808 C D >> - 0 0 5 -2,-0.4 3,-1.3 1,-0.1 4,-0.6 -0.717 3.5-153.4 -85.2 125.0 -10.3 43.2 1.7 1103 809 C A H 3> S+ 0 0 6 -2,-0.5 4,-1.8 1,-0.3 3,-0.5 0.778 92.7 75.2 -64.2 -25.3 -11.0 40.7 4.6 1104 810 C E H 3> S+ 0 0 71 1,-0.3 4,-2.8 2,-0.2 -1,-0.3 0.755 84.5 62.6 -59.6 -29.8 -14.5 42.2 4.5 1105 811 C V H <> S+ 0 0 0 -3,-1.3 4,-2.3 2,-0.2 -1,-0.3 0.960 104.6 47.4 -57.7 -48.6 -15.1 40.1 1.3 1106 812 C L H X S+ 0 0 0 -4,-0.6 4,-2.0 -3,-0.5 -2,-0.2 0.913 111.9 50.7 -58.1 -44.4 -14.6 37.0 3.5 1107 813 C N H X S+ 0 0 51 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.916 109.3 50.1 -62.9 -44.2 -16.9 38.4 6.1 1108 814 C C H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.920 108.4 52.7 -58.7 -44.6 -19.6 39.2 3.6 1109 815 C M H X S+ 0 0 0 -4,-2.3 4,-3.4 1,-0.2 5,-0.3 0.868 102.6 58.9 -65.0 -36.9 -19.4 35.7 2.1 1110 816 C T H X S+ 0 0 21 -4,-2.0 4,-3.7 2,-0.2 -1,-0.2 0.967 108.4 44.7 -54.6 -52.9 -19.9 34.1 5.6 1111 817 C T H X S+ 0 0 16 -4,-1.6 4,-2.6 1,-0.2 5,-0.3 0.932 112.8 52.4 -60.5 -42.6 -23.2 35.9 6.0 1112 818 C V H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.5 0.966 114.3 41.3 -58.5 -51.7 -24.2 34.9 2.5 1113 819 C V H X S+ 0 0 0 -4,-3.4 4,-2.0 1,-0.2 5,-0.4 0.951 113.7 54.5 -59.4 -48.9 -23.4 31.2 3.2 1114 820 C E H < S+ 0 0 66 -4,-3.7 -1,-0.2 -5,-0.3 -2,-0.2 0.902 119.3 31.7 -47.5 -48.0 -25.0 31.4 6.6 1115 821 C K H < S+ 0 0 82 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.856 140.8 7.5 -88.9 -43.0 -28.3 32.7 5.2 1116 822 C V H >X S+ 0 0 0 -4,-2.9 3,-1.7 -5,-0.3 4,-0.7 0.265 88.0 114.3-126.1 13.2 -28.7 31.2 1.8 1117 823 C G G >< S+ 0 0 1 -4,-2.0 3,-1.0 -5,-0.5 7,-0.2 0.851 77.7 56.9 -52.9 -41.0 -25.9 28.7 1.5 1118 824 C H G 34 S+ 0 0 122 -5,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.751 108.2 48.9 -62.7 -25.1 -28.3 25.8 1.4 1119 825 C M G <4 S+ 0 0 64 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.519 110.8 49.8 -94.4 -8.0 -29.9 27.4 -1.6 1120 826 C I S+ 0 0 70 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.897 82.9 45.5 -46.5 -45.7 -24.5 24.9 -3.8 1122 828 C Q H > S+ 0 0 141 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.908 111.5 52.9 -69.0 -42.1 -22.7 26.1 -7.0 1123 829 C G H > S+ 0 0 15 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.899 106.6 52.5 -52.8 -44.8 -22.2 29.6 -5.5 1124 830 C V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.951 108.8 50.4 -62.2 -45.8 -20.6 28.1 -2.4 1125 831 C I H X S+ 0 0 27 -4,-2.0 4,-2.7 -5,-0.3 -1,-0.2 0.917 110.1 50.7 -53.8 -47.3 -18.2 26.2 -4.7 1126 832 C L H X S+ 0 0 69 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.923 108.5 51.6 -57.7 -49.0 -17.5 29.5 -6.5 1127 833 C I H X S+ 0 0 0 -4,-2.9 4,-1.5 1,-0.2 5,-0.3 0.929 112.3 46.4 -54.2 -49.1 -16.8 31.3 -3.2 1128 834 C L H >X S+ 0 0 2 -4,-2.5 4,-2.8 1,-0.2 3,-0.5 0.948 110.6 51.4 -60.7 -50.8 -14.3 28.6 -2.1 1129 835 C Q H 3< S+ 0 0 128 -4,-2.7 4,-0.2 1,-0.2 5,-0.2 0.876 113.9 46.0 -54.3 -40.5 -12.5 28.4 -5.5 1130 836 C S H 3< S+ 0 0 16 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.726 129.3 15.8 -79.6 -26.6 -12.0 32.1 -5.4 1131 837 C V H S+ 0 0 106 -5,-0.4 4,-2.2 -4,-0.2 -1,-0.2 0.883 121.3 50.8 -66.4 -41.5 -6.2 28.8 -1.6 1134 840 C C H > S+ 0 0 27 -5,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.920 115.7 43.4 -66.6 -37.5 -5.2 32.4 -2.1 1135 841 C T H >X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 3,-1.0 0.947 110.6 55.0 -70.2 -46.1 -6.3 33.3 1.5 1136 842 C L H 3X S+ 0 0 8 -4,-2.8 4,-0.8 -5,-0.4 3,-0.4 0.910 105.1 53.8 -50.9 -47.3 -4.7 30.2 3.0 1137 843 C D H 3< S+ 0 0 90 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.738 105.7 53.9 -62.0 -27.7 -1.4 31.1 1.3 1138 844 C M H << S+ 0 0 7 -3,-1.0 3,-0.3 -4,-0.8 -1,-0.2 0.870 117.1 35.5 -66.9 -40.2 -1.5 34.6 3.0 1139 845 C I H < S+ 0 0 0 -4,-1.6 -2,-0.2 -3,-0.4 -1,-0.1 0.353 98.9 77.7-103.9 2.3 -1.9 33.2 6.5 1140 846 C N S < S+ 0 0 60 -4,-0.8 -1,-0.2 -5,-0.2 3,-0.1 0.162 78.7 68.4-106.2 19.3 0.2 30.0 6.5 1141 847 C K S S- 0 0 124 1,-0.4 2,-0.3 -3,-0.3 -1,-0.2 0.721 117.1 -15.1-101.9 -31.6 3.7 31.5 6.8 1142 848 C D - 0 0 53 -4,-0.2 -1,-0.4 3,-0.1 0, 0.0 -0.920 65.1-106.2-158.5 179.7 3.2 32.7 10.4 1143 849 C F S S+ 0 0 84 -2,-0.3 48,-0.1 -3,-0.1 47,-0.1 0.467 106.4 50.1 -93.2 -3.0 0.5 33.3 13.0 1144 850 C T S S+ 0 0 109 6,-0.0 -1,-0.1 2,-0.0 6,-0.1 0.797 77.5 95.3-112.6 -37.4 0.6 37.1 12.9 1145 851 C E S S+ 0 0 88 1,-0.2 5,-0.2 2,-0.1 -3,-0.1 -0.253 95.3 8.4 -66.0 147.4 0.4 38.5 9.3 1146 852 C Y S > S- 0 0 39 1,-0.1 4,-2.2 3,-0.1 -1,-0.2 0.934 74.8-179.2 48.3 59.7 -3.1 39.5 7.9 1147 853 C P H > S+ 0 0 60 0, 0.0 4,-1.6 0, 0.0 5,-0.2 0.822 75.8 48.5 -59.6 -36.6 -4.9 39.1 11.3 1148 854 C E H > S+ 0 0 120 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.907 110.7 50.5 -71.9 -40.0 -8.3 40.1 10.0 1149 855 C H H > S+ 0 0 17 1,-0.2 4,-3.5 2,-0.2 5,-0.2 0.949 109.3 53.5 -58.0 -48.1 -8.1 37.7 7.0 1150 856 C R H X S+ 0 0 1 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.911 112.3 42.0 -50.4 -52.8 -7.1 34.9 9.3 1151 857 C V H X S+ 0 0 17 -4,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.941 118.7 43.7 -67.5 -49.1 -10.1 35.4 11.6 1152 858 C E H X S+ 0 0 29 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.914 108.5 61.4 -64.9 -37.1 -12.6 35.9 8.8 1153 859 C F H X S+ 0 0 1 -4,-3.5 4,-2.2 -5,-0.3 -1,-0.2 0.937 107.0 42.5 -54.4 -50.9 -11.1 33.0 6.8 1154 860 C Y H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.820 110.7 55.8 -72.9 -29.3 -11.8 30.4 9.5 1155 861 C K H X S+ 0 0 68 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.905 109.2 48.4 -62.2 -39.8 -15.3 31.8 10.1 1156 862 C L H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.977 112.0 47.0 -65.8 -55.2 -16.1 31.3 6.4 1157 863 C L H X S+ 0 0 2 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.896 110.3 56.6 -52.5 -42.4 -14.8 27.8 6.4 1158 864 C K H X S+ 0 0 54 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.945 110.3 40.6 -55.1 -52.9 -16.8 27.1 9.6 1159 865 C V H X S+ 0 0 4 -4,-2.1 4,-3.1 2,-0.2 5,-0.4 0.879 114.8 52.4 -70.9 -34.5 -20.1 28.1 8.1 1160 866 C I H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 7,-0.2 0.931 110.5 48.6 -61.5 -45.9 -19.4 26.4 4.8 1161 867 C N H < S+ 0 0 0 -4,-2.7 4,-0.3 -5,-0.2 -2,-0.2 0.885 117.1 43.3 -62.9 -40.1 -18.5 23.2 6.6 1162 868 C E H < S+ 0 0 80 -4,-2.1 3,-0.2 -5,-0.2 -2,-0.2 0.927 129.8 20.5 -64.6 -53.2 -21.8 23.5 8.7 1163 869 C K H < S+ 0 0 95 -4,-3.1 -3,-0.2 1,-0.2 -2,-0.2 0.732 134.0 28.2-100.0 -26.8 -24.2 24.5 6.0 1164 870 C S >X + 0 0 12 -4,-2.5 3,-2.4 -5,-0.4 4,-0.5 -0.269 60.6 152.6-137.1 46.9 -22.7 23.4 2.7 1165 871 C F H >> + 0 0 26 -4,-0.3 3,-1.6 1,-0.3 4,-1.4 0.809 67.6 73.8 -49.2 -32.5 -20.5 20.5 3.4 1166 872 C A H 3> S+ 0 0 54 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.834 84.7 66.1 -54.1 -33.6 -21.1 19.3 -0.2 1167 873 C A H <> S+ 0 0 3 -3,-2.4 4,-0.6 1,-0.2 -1,-0.3 0.872 101.8 47.1 -58.4 -37.4 -18.8 22.1 -1.4 1168 874 C F H X< S+ 0 0 0 -3,-1.6 3,-0.7 -4,-0.5 -1,-0.2 0.874 105.3 59.7 -75.2 -34.1 -15.8 20.4 0.3 1169 875 C L H 3< S+ 0 0 52 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.801 104.4 52.2 -57.6 -29.3 -16.8 17.0 -1.2 1170 876 C E H 3< S+ 0 0 133 -4,-1.5 -1,-0.2 -3,-0.1 -2,-0.2 0.694 85.6 108.5 -83.7 -20.1 -16.4 18.6 -4.6 1171 877 C L S << S- 0 0 27 -3,-0.7 -3,-0.0 -4,-0.6 -46,-0.0 -0.231 80.7-104.6 -55.6 143.7 -12.9 19.9 -4.0 1172 878 C P >> - 0 0 82 0, 0.0 4,-2.3 0, 0.0 3,-0.7 -0.416 36.4-106.1 -59.5 149.7 -10.1 18.1 -5.8 1173 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1193 899 C D H > S+ 0 0 69 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.951 115.2 34.9 -58.2 -48.6 -10.7 33.7 17.6 1194 900 C V H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.950 117.5 51.6 -67.1 -51.8 -8.8 31.4 15.2 1195 901 C E H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.879 107.8 50.5 -56.5 -45.6 -8.2 28.4 17.6 1196 902 C V H X S+ 0 0 41 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.944 112.8 46.3 -65.3 -47.3 -11.7 28.0 18.7 1197 903 C N H X S+ 0 0 18 -4,-1.1 4,-3.0 -5,-0.3 5,-0.2 0.893 109.6 55.8 -61.0 -44.0 -13.0 27.9 15.1 1198 904 C G H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.951 110.0 44.6 -47.8 -54.3 -10.3 25.5 14.1 1199 905 C L H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.904 114.7 49.1 -64.2 -41.0 -11.3 23.0 16.8 1200 906 C Q H X S+ 0 0 55 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.909 109.9 50.2 -65.1 -44.3 -15.0 23.4 16.0 1201 907 C I H X S+ 0 0 0 -4,-3.0 4,-3.0 2,-0.2 -1,-0.2 0.921 110.3 51.5 -61.8 -42.8 -14.4 22.9 12.3 1202 908 C A H X S+ 0 0 0 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.938 112.5 45.5 -58.6 -48.0 -12.4 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