==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE/SIGNALING PROTEIN 17-SEP-09 3JVZ . COMPND 2 MOLECULE: UBIQUITIN-CONJUGATING ENZYME E2 D2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.SOUPHRON,H.B.KAMADURAI,B.A.SCHULMAN . 1195 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54012.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 808 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 116 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 78 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 166 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 352 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 5 1 2 1 5 4 1 3 7 8 0 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 2 3 1 0 1 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 . 11 3 6 4 3 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 ANTIPARALLEL BRIDGES PER LADDER . 5 7 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 A A > 0 0 26 0, 0.0 4,-3.8 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -42.4 29.8 8.6 19.1 2 3 A S H > + 0 0 37 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.991 360.0 34.6 -57.5 -69.4 26.2 9.0 20.5 3 4 A K H > S+ 0 0 94 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.847 118.3 57.1 -55.7 -34.1 25.7 5.4 21.8 4 5 A R H > S+ 0 0 10 2,-0.2 4,-2.7 3,-0.2 -1,-0.2 0.981 112.8 38.1 -61.6 -54.9 29.4 5.4 22.6 5 6 A I H X S+ 0 0 1 -4,-3.8 4,-1.7 2,-0.2 -2,-0.2 0.968 118.5 48.6 -60.2 -55.3 29.0 8.5 24.9 6 7 A H H >X S+ 0 0 91 -4,-3.3 4,-2.0 -5,-0.2 3,-0.9 0.947 115.8 43.1 -48.7 -59.1 25.6 7.5 26.3 7 8 A K H 3X S+ 0 0 72 -4,-2.7 4,-2.1 1,-0.3 -1,-0.2 0.897 112.9 52.2 -56.3 -43.5 26.7 4.0 27.1 8 9 A E H 3< S+ 0 0 8 -4,-2.7 4,-0.3 -5,-0.3 -1,-0.3 0.756 109.1 54.2 -64.9 -22.3 30.1 5.2 28.5 9 10 A L H XX S+ 0 0 40 -4,-1.7 4,-1.2 -3,-0.9 3,-0.9 0.886 105.9 48.1 -78.1 -43.4 28.0 7.6 30.6 10 11 A N H 3< S+ 0 0 99 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.868 105.0 62.0 -65.2 -36.0 25.8 4.8 32.2 11 12 A D T >X S+ 0 0 49 -4,-2.1 4,-1.0 1,-0.2 3,-0.8 0.733 97.4 58.8 -62.8 -20.9 29.0 2.9 32.9 12 13 A L G X4 S+ 0 0 12 -3,-0.9 2,-0.9 -4,-0.3 3,-0.7 0.941 104.1 48.3 -72.8 -46.4 30.0 5.8 35.1 13 14 A A G 3< S+ 0 0 82 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.1 -0.187 108.5 60.7 -84.4 43.6 26.9 5.4 37.2 14 15 A R G <4 S+ 0 0 163 -2,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.463 128.1 3.1-132.9 -37.5 27.9 1.7 37.3 15 16 A D S << S- 0 0 128 -4,-1.0 -2,-0.2 -3,-0.7 3,-0.1 -0.504 83.7-147.3-152.6 66.7 31.3 1.9 38.9 16 17 A P - 0 0 91 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.159 29.0-110.9 -43.4 112.5 31.7 5.6 39.7 17 18 A P > - 0 0 13 0, 0.0 3,-1.6 0, 0.0 83,-0.0 -0.300 42.5-110.2 -52.0 116.1 35.5 6.2 39.4 18 19 A A T 3 S+ 0 0 60 1,-0.2 3,-0.1 -3,-0.1 -3,-0.0 -0.172 96.0 17.8 -51.3 138.3 36.5 6.8 43.0 19 20 A Q T 3 S+ 0 0 108 1,-0.1 18,-2.6 -3,-0.1 2,-0.3 0.417 120.2 57.7 79.9 1.6 37.6 10.4 43.8 20 21 A C E < -A 36 0A 15 -3,-1.6 2,-0.3 16,-0.2 16,-0.2 -0.979 54.1-164.4-155.8 164.7 36.0 12.0 40.8 21 22 A S E -A 35 0A 52 14,-1.4 14,-1.5 -2,-0.3 2,-0.3 -0.833 8.0-178.8-158.6 114.8 32.7 12.4 38.9 22 23 A A E +A 34 0A 9 12,-0.3 12,-0.2 -2,-0.3 30,-0.0 -0.828 14.4 155.8-112.1 153.0 32.3 13.6 35.4 23 24 A G E -A 33 0A 21 10,-1.3 10,-2.1 -2,-0.3 30,-0.1 -0.911 46.7 -88.8-173.3 146.7 28.9 14.1 33.8 24 25 A P E -A 32 0A 36 0, 0.0 2,-0.5 0, 0.0 8,-0.3 -0.407 38.2-151.8 -65.3 133.8 27.3 16.0 30.9 25 26 A V + 0 0 28 6,-1.2 3,-0.4 -2,-0.1 2,-0.3 -0.922 65.0 2.0-109.2 134.6 26.0 19.4 32.0 26 27 A G S S- 0 0 36 -2,-0.5 942,-0.0 1,-0.2 0, 0.0 -0.644 110.5 -65.5 89.0-152.2 23.1 20.9 30.2 27 28 A D S S+ 0 0 165 -2,-0.3 -1,-0.2 941,-0.0 2,-0.2 0.507 99.9 111.1-112.0 -11.3 21.6 18.7 27.4 28 29 A D - 0 0 68 -3,-0.4 3,-0.3 1,-0.1 -3,-0.1 -0.465 52.1-161.7 -64.7 131.4 24.6 18.8 25.1 29 30 A M S S+ 0 0 39 -2,-0.2 -1,-0.1 1,-0.2 3,-0.1 0.311 85.0 59.4 -98.8 7.7 26.1 15.3 25.1 30 31 A F S S+ 0 0 25 1,-0.2 25,-2.1 24,-0.1 2,-0.5 0.336 97.3 65.3-113.8 3.0 29.5 16.5 23.8 31 32 A H E + B 0 54A 72 -3,-0.3 -6,-1.2 23,-0.2 2,-0.2 -0.912 61.7 163.6-132.1 104.6 30.2 18.8 26.7 32 33 A W E -AB 24 53A 5 21,-2.9 21,-1.3 -2,-0.5 2,-0.4 -0.666 23.8-146.9-111.7 168.9 30.7 17.3 30.1 33 34 A Q E -AB 23 52A 46 -10,-2.1 -10,-1.3 19,-0.2 2,-0.3 -0.995 16.7-165.6-139.7 131.7 32.3 18.7 33.3 34 35 A A E -AB 22 51A 2 17,-1.4 17,-2.8 -2,-0.4 2,-0.3 -0.838 10.4-146.6-122.2 158.1 34.2 16.7 35.8 35 36 A T E -AB 21 50A 18 -14,-1.5 -14,-1.4 -2,-0.3 2,-0.4 -0.870 8.8-169.2-118.0 151.7 35.4 17.0 39.3 36 37 A I E -AB 20 49A 0 13,-2.0 13,-2.0 -2,-0.3 2,-0.6 -0.956 16.3-140.6-144.2 121.2 38.6 15.6 40.9 37 38 A M E - B 0 48A 79 -18,-2.6 11,-0.2 -2,-0.4 3,-0.1 -0.741 36.8-101.2 -87.2 121.8 39.3 15.6 44.6 38 39 A G - 0 0 9 9,-0.8 8,-0.4 -2,-0.6 4,-0.1 -0.110 48.8-104.9 -40.0 116.5 42.9 16.4 45.4 39 40 A P > - 0 0 22 0, 0.0 3,-0.9 0, 0.0 5,-0.1 -0.093 48.6 -89.8 -47.0 148.7 44.4 13.0 46.2 40 41 A N T 3 S+ 0 0 119 1,-0.2 4,-0.1 5,-0.1 5,-0.0 -0.246 102.6 10.2 -68.9 149.1 44.9 12.5 49.9 41 42 A D T 3 S+ 0 0 141 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.801 102.8 113.4 53.1 32.4 48.0 13.4 51.9 42 43 A S S X S- 0 0 12 -3,-0.9 3,-2.0 -4,-0.1 -1,-0.3 -0.818 89.2-101.7-120.0 159.3 49.2 15.2 48.8 43 44 A P T 3 S+ 0 0 14 0, 0.0 98,-0.1 0, 0.0 -2,-0.1 0.812 121.8 63.5 -57.4 -25.6 49.6 19.0 48.8 44 45 A Y T 3 S+ 0 0 0 -5,-0.1 3,-0.5 65,-0.1 -6,-0.3 0.243 78.3 139.3 -81.3 14.7 46.2 19.2 46.9 45 46 A Q < + 0 0 78 -3,-2.0 2,-1.5 1,-0.2 -5,-0.1 -0.182 63.1 15.8 -58.0 151.6 44.6 17.7 49.9 46 47 A G S S+ 0 0 38 -8,-0.4 -1,-0.2 1,-0.2 -2,-0.1 -0.204 103.9 96.9 80.3 -48.0 41.2 19.1 50.9 47 48 A G - 0 0 2 -2,-1.5 -9,-0.8 -3,-0.5 2,-0.3 0.045 60.8-139.2 -69.5-178.7 40.5 21.0 47.7 48 49 A V E -B 37 0A 20 97,-0.7 2,-0.4 93,-0.2 -11,-0.2 -0.985 10.9-150.9-140.3 145.7 38.3 20.1 44.7 49 50 A F E -B 36 0A 1 -13,-2.0 -13,-2.0 -2,-0.3 2,-0.3 -0.974 3.7-147.3-128.5 135.0 39.1 20.7 41.1 50 51 A F E -B 35 0A 9 -2,-0.4 19,-2.6 -15,-0.2 20,-1.3 -0.687 19.0-175.0 -97.3 149.7 36.7 21.2 38.1 51 52 A L E -BC 34 68A 3 -17,-2.8 -17,-1.4 -2,-0.3 2,-0.5 -0.923 22.6-129.4-141.2 168.2 37.3 20.1 34.6 52 53 A T E -BC 33 67A 60 15,-2.7 15,-1.4 -2,-0.3 2,-0.9 -0.926 13.6-170.1-123.9 108.4 35.9 20.2 31.0 53 54 A I E -BC 32 66A 3 -21,-1.3 -21,-2.9 -2,-0.5 2,-0.7 -0.837 11.8-178.1-100.1 103.1 35.6 17.1 29.0 54 55 A H E -BC 31 65A 71 11,-2.9 11,-2.6 -2,-0.9 -23,-0.2 -0.903 12.7-153.8-104.7 112.9 34.7 18.2 25.5 55 56 A F - 0 0 2 -25,-2.1 2,-0.1 -2,-0.7 -2,-0.0 -0.726 11.9-140.3 -87.1 127.0 34.1 15.3 23.1 56 57 A P > - 0 0 30 0, 0.0 3,-2.3 0, 0.0 6,-0.1 -0.481 27.4-107.9 -82.0 160.6 34.8 16.1 19.4 57 58 A T T 3 S+ 0 0 25 1,-0.3 422,-0.6 -2,-0.1 -2,-0.0 0.691 119.0 64.6 -59.7 -17.0 32.5 14.8 16.7 58 59 A D T >> S+ 0 0 45 5,-0.1 3,-2.4 420,-0.1 4,-0.9 0.430 83.3 159.7 -87.2 -1.1 35.4 12.4 15.8 59 60 A Y T <4 + 0 0 4 -3,-2.3 420,-0.1 1,-0.3 -54,-0.1 -0.424 58.4 22.7 -62.0 138.7 35.3 10.6 19.2 60 61 A P T 34 S+ 0 0 1 0, 0.0 -1,-0.3 0, 0.0 36,-0.1 -0.932 122.7 53.5 -96.4 16.5 36.4 7.9 19.6 61 62 A F T <4 S+ 0 0 8 -3,-2.4 399,-0.4 1,-0.1 -2,-0.2 0.768 115.8 44.4 -77.1 -22.8 38.9 8.0 16.7 62 63 A K S < S- 0 0 50 -4,-0.9 -1,-0.1 -6,-0.1 27,-0.1 -0.942 99.6-108.3-118.3 140.2 40.2 11.3 18.1 63 64 A P - 0 0 14 0, 0.0 2,-0.1 0, 0.0 -5,-0.1 -0.265 37.5-104.9 -65.4 154.7 40.9 11.7 21.8 64 65 A P - 0 0 4 0, 0.0 2,-0.7 0, 0.0 -9,-0.2 -0.447 30.5-114.8 -78.2 154.9 38.6 14.0 23.8 65 66 A K E -C 54 0A 75 -11,-2.6 -11,-2.9 -2,-0.1 2,-0.5 -0.833 38.7-177.6 -93.7 116.7 39.8 17.4 24.9 66 67 A V E +C 53 0A 14 -2,-0.7 17,-0.6 -13,-0.2 2,-0.3 -0.967 4.7 170.7-118.8 128.4 40.1 17.5 28.6 67 68 A A E -CD 52 82A 32 -15,-1.4 -15,-2.7 -2,-0.5 15,-0.2 -0.982 33.7-114.1-140.7 150.6 41.1 20.6 30.6 68 69 A F E -C 51 0A 6 13,-3.8 -17,-0.2 -2,-0.3 4,-0.1 -0.521 21.7-177.8 -77.7 146.6 41.4 21.9 34.1 69 70 A T + 0 0 61 -19,-2.6 2,-0.3 -2,-0.2 -18,-0.2 0.673 66.5 72.5-109.5 -44.1 39.0 24.8 35.0 70 71 A T S S- 0 0 3 -20,-1.3 75,-0.1 1,-0.1 -1,-0.0 -0.572 94.2-108.7 -78.0 133.4 40.2 25.3 38.5 71 72 A R + 0 0 85 -2,-0.3 2,-0.3 73,-0.1 -1,-0.1 -0.256 44.6 174.5 -60.5 151.8 43.6 26.9 39.0 72 73 A I - 0 0 7 6,-0.1 2,-1.1 5,-0.1 9,-0.1 -0.942 33.9-130.7-161.9 138.1 46.3 24.4 40.2 73 74 A Y + 0 0 27 -2,-0.3 5,-0.1 64,-0.2 68,-0.1 -0.775 54.4 135.8 -95.6 95.3 50.0 24.6 40.8 74 75 A H B > -E 77 0B 0 -2,-1.1 3,-0.7 3,-0.7 48,-0.2 -0.978 60.0-124.5-141.9 151.6 51.3 21.5 39.1 75 76 A P T 3 S+ 0 0 0 0, 0.0 43,-2.5 0, 0.0 44,-2.4 0.780 109.6 36.6 -65.3 -30.6 54.3 20.7 36.8 76 77 A N T 3 S+ 0 0 2 42,-0.2 8,-2.3 41,-0.2 2,-0.4 0.246 108.1 67.0-110.7 14.5 52.2 19.1 34.0 77 78 A I B < S-EF 74 83B 2 -3,-0.7 -3,-0.7 6,-0.2 6,-0.2 -0.983 70.0-154.5-132.6 120.8 49.1 21.3 34.1 78 79 A N > - 0 0 21 4,-1.5 3,-1.9 -2,-0.4 -6,-0.1 -0.201 37.5 -85.4 -91.3-174.0 49.3 25.0 33.0 79 80 A S T 3 S+ 0 0 83 1,-0.3 -1,-0.1 2,-0.2 -6,-0.0 0.571 127.7 56.1 -62.0 -12.8 47.4 28.2 33.8 80 81 A N T 3 S- 0 0 125 2,-0.1 -1,-0.3 -9,-0.0 3,-0.1 0.572 118.4-113.4 -93.0 -13.1 44.9 27.3 31.1 81 82 A G < + 0 0 5 -3,-1.9 -13,-3.8 1,-0.3 2,-0.2 0.669 61.9 160.0 86.7 18.7 44.3 24.0 32.7 82 83 A S B -D 67 0A 16 -15,-0.2 -4,-1.5 -13,-0.1 2,-0.5 -0.554 30.4-144.3 -73.7 140.1 45.9 22.3 29.8 83 84 A I B -F 77 0B 1 -17,-0.6 2,-1.3 -2,-0.2 -6,-0.2 -0.933 9.1-152.8-114.7 120.9 47.0 18.8 30.7 84 85 A S + 0 0 9 -8,-2.3 2,-0.4 -2,-0.5 1039,-0.1 -0.753 43.0 144.4 -88.2 94.5 50.2 17.2 29.3 85 86 A L >> - 0 0 17 -2,-1.3 3,-1.3 1,-0.1 4,-0.8 -0.996 49.3-138.5-135.5 128.1 49.1 13.6 29.5 86 87 A D G >4>S+ 0 0 89 -2,-0.4 5,-2.3 1,-0.3 3,-0.8 0.826 99.4 56.7 -57.8 -38.6 50.1 11.1 26.9 87 88 A I G 345S+ 0 0 26 1,-0.2 -1,-0.3 4,-0.2 6,-0.2 0.707 101.3 59.8 -70.0 -14.5 46.8 9.2 26.6 88 89 A L G <45S+ 0 0 11 -3,-1.3 -1,-0.2 4,-0.1 -2,-0.2 0.784 128.8 2.3 -81.2 -23.6 45.1 12.5 25.8 89 90 A R T X<5S+ 0 0 53 -3,-0.8 3,-0.9 -4,-0.8 -3,-0.1 0.598 134.0 18.8-121.8 -86.5 47.3 12.8 22.7 90 91 A S T 3 5S+ 0 0 74 1,-0.2 -3,-0.2 -5,-0.1 -4,-0.1 0.874 126.5 40.3 -64.7 -43.5 50.0 10.3 21.5 91 92 A Q T 3 - 0 0 25 -6,-0.2 3,-1.7 -2,-0.2 367,-0.1 -0.990 30.7-129.3-131.0 139.9 43.1 4.4 21.9 94 95 A P T 3 S+ 0 0 2 0, 0.0 -33,-0.1 0, 0.0 -32,-0.1 0.701 110.8 60.3 -59.7 -15.4 39.5 4.2 20.8 95 96 A A T 3 S+ 0 0 20 2,-0.1 -3,-0.0 -35,-0.0 365,-0.0 0.729 81.9 103.8 -84.5 -22.7 39.1 1.6 23.4 96 97 A L < - 0 0 23 -3,-1.7 2,-0.3 -36,-0.1 3,-0.0 -0.281 60.3-147.2 -62.9 143.4 40.0 3.9 26.3 97 98 A K >> - 0 0 80 1,-0.1 3,-2.3 -89,-0.0 4,-1.5 -0.881 21.3-118.7-120.6 147.8 37.2 5.2 28.5 98 99 A I H 3> S+ 0 0 1 -2,-0.3 4,-2.4 1,-0.3 3,-0.3 0.858 113.3 61.0 -45.8 -47.3 36.6 8.4 30.4 99 100 A S H 3> S+ 0 0 27 1,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.812 109.3 45.5 -53.4 -28.0 36.5 6.6 33.7 100 101 A K H <> S+ 0 0 117 -3,-2.3 4,-1.7 2,-0.2 -1,-0.3 0.808 110.0 52.3 -83.2 -33.2 40.1 5.6 32.9 101 102 A V H X S+ 0 0 3 -4,-1.5 4,-0.9 -3,-0.3 -2,-0.2 0.763 108.4 53.0 -73.8 -27.0 41.2 9.0 31.8 102 103 A L H >X S+ 0 0 4 -4,-2.4 4,-1.7 -5,-0.2 3,-0.6 0.954 110.5 43.2 -73.3 -52.3 39.9 10.5 35.0 103 104 A L H 3X S+ 0 0 79 -4,-1.3 4,-1.9 1,-0.3 -2,-0.2 0.894 109.5 59.3 -60.1 -40.1 41.8 8.2 37.4 104 105 A S H 3X S+ 0 0 39 -4,-1.7 4,-1.6 1,-0.2 -1,-0.3 0.852 106.9 48.3 -56.5 -33.7 44.8 8.6 35.2 105 106 A I H + 0 0 76 -5,-0.1 3,-1.4 1,-0.1 1010,-0.1 -0.672 30.2 173.4-126.9 75.4 56.0 14.0 36.2 114 115 A P T 3 S+ 0 0 18 0, 0.0 13,-0.1 0, 0.0 -1,-0.1 0.464 73.1 60.5 -61.4 -6.2 58.9 16.5 36.5 115 116 A D T 3 S+ 0 0 67 1,-0.2 -2,-0.0 8,-0.0 8,-0.0 0.555 109.0 37.9-102.2 -10.0 60.8 15.1 33.6 116 117 A D S < S+ 0 0 61 -3,-1.4 -1,-0.2 1007,-0.1 1007,-0.2 -0.471 93.1 174.1-133.8 55.6 58.2 15.7 30.8 117 118 A P - 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0 0 7 5,-0.1 2,-1.1 6,-0.1 9,-0.1 -0.948 33.7-132.7-162.0 137.9 21.8 47.2 69.3 220 74 B Y + 0 0 17 -2,-0.3 5,-0.1 64,-0.1 68,-0.1 -0.738 57.1 131.3 -93.8 89.7 21.8 43.5 70.4 221 75 B H B > -J 224 0D 0 -2,-1.1 3,-1.5 3,-0.7 45,-0.2 -1.000 59.5-132.2-145.6 138.2 18.8 42.1 68.4 222 76 B P T 3 S+ 0 0 0 0, 0.0 43,-2.3 0, 0.0 44,-1.6 0.649 108.6 43.2 -64.4 -17.7 18.3 39.0 66.2 223 77 B N T 3 S+ 0 0 0 41,-0.2 8,-2.6 42,-0.2 2,-0.4 0.246 109.0 64.0-112.5 14.5 16.7 40.9 63.4 224 78 B I B < S-JK 221 230D 2 -3,-1.5 -3,-0.7 6,-0.2 6,-0.2 -0.932 70.7-156.6-139.7 112.5 19.1 43.8 63.4 225 79 B N > - 0 0 18 4,-1.0 3,-1.3 -2,-0.4 -6,-0.1 -0.148 37.9 -88.8 -82.5-178.9 22.8 43.4 62.6 226 80 B S T 3 S+ 0 0 72 1,-0.3 -1,-0.1 2,-0.2 -7,-0.1 0.865 122.7 60.7 -55.0 -43.7 25.8 45.5 63.5 227 81 B N T 3 S- 0 0 124 1,-0.1 -1,-0.3 -9,-0.1 -2,-0.1 0.114 118.9-109.5 -75.5 24.6 25.5 47.8 60.5 228 82 B G < + 0 0 1 -3,-1.3 -13,-2.0 1,-0.2 2,-0.2 0.784 66.9 154.5 52.8 31.6 22.1 48.8 61.7 229 83 B S - 0 0 8 -15,-0.2 -4,-1.0 -4,-0.1 2,-0.5 -0.626 33.9-135.8 -88.8 152.6 20.3 46.9 58.9 230 84 B I B -K 224 0D 2 -17,-0.5 2,-1.4 -2,-0.2 -6,-0.2 -0.930 13.1-155.4-121.1 124.3 16.7 45.7 59.5 231 85 B S + 0 0 2 -8,-2.6 2,-0.4 -2,-0.5 969,-0.2 -0.709 48.1 137.1 -90.9 87.0 15.0 42.3 58.6 232 86 B L > - 0 0 16 -2,-1.4 3,-1.4 1,-0.2 4,-0.3 -0.970 50.3-142.0-138.8 120.1 11.5 43.6 58.5 233 87 B D G > >S+ 0 0 86 -2,-0.4 3,-4.4 1,-0.3 5,-1.6 0.879 96.5 58.0 -43.3 -65.1 9.0 42.6 55.7 234 88 B I G 3 5S+ 0 0 31 1,-0.3 -1,-0.3 4,-0.2 6,-0.2 0.756 102.4 61.6 -44.0 -25.5 7.2 45.9 55.0 235 89 B L G < 5S+ 0 0 12 -3,-1.4 -1,-0.3 4,-0.1 -2,-0.2 0.677 123.7 4.1 -79.8 -10.5 10.6 47.2 54.2 236 90 B R T < 5S+ 0 0 55 -3,-4.4 3,-0.3 -4,-0.3 -2,-0.1 0.651 133.1 6.4-132.3 -79.0 11.1 44.8 51.4 237 91 B S T 5S+ 0 0 51 -4,-0.4 -3,-0.2 1,-0.2 -4,-0.1 0.408 126.9 51.6 -99.4 -4.1 8.8 42.2 49.8 238 92 B Q S - 0 0 27 -2,-0.3 3,-1.7 -6,-0.2 596,-0.1 -0.960 35.2-126.5-128.9 147.4 3.0 48.8 49.7 241 95 B P T 3 S+ 0 0 3 0, 0.0 -33,-0.1 0, 0.0 -32,-0.1 0.693 111.0 66.1 -62.7 -16.2 2.7 52.3 48.3 242 96 B A T 3 S+ 0 0 20 2,-0.1 -3,-0.0 -35,-0.0 594,-0.0 0.705 79.4 102.5 -77.8 -24.6 -0.0 52.7 51.0 243 97 B L < - 0 0 29 -3,-1.7 2,-0.3 -36,-0.1 3,-0.0 -0.202 58.5-152.8 -61.8 153.4 2.4 52.3 53.9 244 98 B K > - 0 0 66 1,-0.1 4,-2.1 -89,-0.0 3,-0.3 -0.847 27.3-112.9-125.4 161.1 3.5 55.3 55.8 245 99 B I H > S+ 0 0 0 -2,-0.3 4,-3.4 1,-0.2 5,-0.3 0.910 117.0 59.2 -60.3 -42.1 6.6 56.1 57.8 246 100 B S H > S+ 0 0 35 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.873 107.4 47.1 -54.6 -38.4 4.6 56.2 61.0 247 101 B K H > S+ 0 0 77 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.923 112.7 48.6 -69.5 -44.8 3.6 52.6 60.3 248 102 B V H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.956 114.1 45.5 -58.2 -54.5 7.2 51.5 59.5 249 103 B L H X S+ 0 0 0 -4,-3.4 4,-1.3 1,-0.2 -1,-0.2 0.892 113.1 50.5 -57.4 -42.4 8.5 53.2 62.6 250 104 B L H X S+ 0 0 79 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.2 0.899 110.3 51.1 -62.1 -40.2 5.7 51.7 64.7 251 105 B S H X S+ 0 0 43 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.890 105.4 54.7 -64.0 -40.8 6.6 48.3 63.1 252 106 B I H X S+ 0 0 0 -4,-2.5 4,-0.8 1,-0.2 -1,-0.2 0.797 105.3 55.3 -65.1 -25.9 10.2 48.7 64.1 253 107 B C H >X S+ 0 0 15 -4,-1.3 3,-1.1 -3,-0.2 4,-1.1 0.948 105.5 49.5 -69.5 -50.2 9.1 49.3 67.7 254 108 B S H >X S+ 0 0 66 -4,-1.8 4,-4.5 1,-0.3 3,-0.6 0.866 103.1 62.0 -56.6 -37.5 7.2 46.0 67.9 255 109 B L H 3< S+ 0 0 5 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.840 103.4 49.9 -59.0 -31.9 10.2 44.2 66.5 256 110 B L H << S+ 0 0 2 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.744 117.1 40.7 -77.9 -23.7 12.1 45.4 69.6 257 111 B C H << S+ 0 0 54 -4,-1.1 -2,-0.2 -3,-0.6 -3,-0.2 0.889 131.3 23.0 -87.0 -45.0 9.3 44.1 71.8 258 112 B D S < S- 0 0 112 -4,-4.5 -1,-0.2 -5,-0.1 -2,-0.1 -0.792 80.2-160.5-131.2 89.7 8.7 40.9 69.8 259 113 B P - 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0 0 182 -2,-0.3 -2,-0.1 0, 0.0 -3,-0.0 -0.931 9.8-135.8-123.4 146.2 57.0 19.5 -26.7 311 590 C K - 0 0 129 -2,-0.4 36,-0.0 1,-0.1 4,-0.0 -0.827 26.4-126.9 -96.8 123.4 56.1 23.0 -27.8 312 591 C P - 0 0 31 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.010 11.5-142.6 -57.7 176.3 53.5 23.3 -30.6 313 592 C A S S+ 0 0 89 1,-0.1 2,-3.0 0, 0.0 -2,-0.0 0.812 84.9 68.5-108.4 -51.8 54.5 25.4 -33.6 314 593 C D S S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 30,-0.1 -0.126 85.0 99.7 -67.1 46.9 51.3 27.2 -34.8 315 594 C I S S- 0 0 26 -2,-3.0 4,-0.1 -3,-0.1 30,-0.0 -0.991 79.9 -90.5-138.7 144.1 51.2 29.4 -31.6 316 595 C P - 0 0 80 0, 0.0 32,-0.2 0, 0.0 -1,-0.1 0.132 37.9-112.6 -43.1 160.3 52.3 33.0 -30.7 317 596 C N S S+ 0 0 149 30,-0.1 31,-0.8 1,-0.1 2,-0.3 0.814 99.3 5.8 -69.2 -28.6 55.8 33.6 -29.4 318 597 C R E S-l 348 0E 81 29,-0.2 2,-0.6 32,-0.0 31,-0.2 -0.907 80.7-104.3-145.8 169.6 54.2 34.5 -26.1 319 598 C F E -l 349 0E 11 29,-4.5 31,-1.5 -2,-0.3 2,-0.8 -0.909 34.5-128.5-104.6 122.6 50.8 34.5 -24.3 320 599 C E E +l 350 0E 102 -2,-0.6 2,-0.4 29,-0.1 31,-0.2 -0.585 39.8 163.8 -74.7 107.5 49.2 38.0 -24.0 321 600 C M E +l 351 0E 7 29,-2.2 31,-1.5 -2,-0.8 2,-0.3 -0.974 7.0 155.0-133.3 121.6 48.2 38.5 -20.4 322 601 C K E +l 352 0E 120 -2,-0.4 2,-0.3 29,-0.2 31,-0.2 -0.940 16.5 138.5-147.1 119.5 47.4 41.8 -18.7 323 602 C L - 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0 0 24 -3,-0.9 217,-0.2 2,-0.1 -2,-0.1 0.700 67.5-157.1-112.9 -30.2 47.9 21.3 9.1 392 671 C Y < + 0 0 15 -4,-0.7 2,-0.5 1,-0.2 39,-0.5 0.630 47.2 131.8 64.3 11.8 47.7 24.0 6.4 393 672 C T - 0 0 11 -5,-0.1 -6,-1.9 37,-0.1 39,-0.3 -0.853 53.9-126.4 -98.2 131.7 47.6 21.3 3.7 394 673 C L E +Mn 386 432F 4 37,-4.0 39,-1.9 -2,-0.5 2,-0.3 -0.440 30.3 170.2 -81.6 150.8 44.8 21.8 1.1 395 674 C Q E -M 385 0F 19 -10,-1.6 -10,-2.4 37,-0.2 122,-0.0 -0.974 45.6 -82.5-155.0 145.7 42.2 19.4 0.0 396 675 C I E -M 384 0F 8 -2,-0.3 -12,-0.2 -12,-0.2 -13,-0.1 -0.210 43.9-123.7 -51.1 129.5 39.0 19.7 -2.1 397 676 C N > - 0 0 22 -14,-2.0 3,-1.7 1,-0.2 4,-0.2 -0.716 13.3-151.3 -80.9 113.0 36.1 21.1 -0.1 398 677 C P T 3 S+ 0 0 22 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.809 97.5 52.6 -54.1 -29.7 33.3 18.5 -0.6 399 678 C N T 3 S+ 0 0 90 1,-0.2 3,-0.4 2,-0.1 122,-0.1 -0.107 75.2 113.5 -98.8 36.3 30.8 21.3 -0.1 400 679 C S X> + 0 0 0 -3,-1.7 3,-2.7 1,-0.2 4,-1.5 0.874 65.0 64.7 -73.6 -40.5 32.4 23.4 -2.8 401 680 C G T 34 S+ 0 0 25 -3,-0.5 -1,-0.2 1,-0.3 6,-0.2 0.743 98.6 56.6 -55.9 -21.1 29.4 23.2 -5.1 402 681 C L T 34 S+ 0 0 148 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.435 108.2 47.2 -92.7 4.8 27.4 25.1 -2.5 403 682 C C T <4 S+ 0 0 65 -3,-2.7 2,-0.4 1,-0.4 -2,-0.2 0.679 120.5 29.4-110.4 -35.4 29.9 28.0 -2.5 404 683 C N S >< S- 0 0 22 -4,-1.5 3,-1.6 -22,-0.1 -1,-0.4 -0.990 76.1-142.5-129.3 118.1 30.4 28.7 -6.2 405 684 C E T 3 S+ 0 0 195 -2,-0.4 -4,-0.1 1,-0.3 -3,-0.1 0.245 103.6 32.3 -70.6 18.1 27.3 27.8 -8.2 406 685 C D T >> S+ 0 0 83 2,-0.0 4,-1.1 0, 0.0 3,-0.8 -0.111 72.2 150.5-166.8 44.6 29.6 26.5 -10.9 407 686 C H H <> + 0 0 29 -3,-1.6 4,-2.7 1,-0.2 5,-0.2 0.836 64.5 68.5 -52.6 -41.0 32.6 25.2 -9.0 408 687 C L H 3> S+ 0 0 60 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.871 98.3 49.6 -50.5 -45.2 33.4 22.6 -11.7 409 688 C S H <> S+ 0 0 44 -3,-0.8 4,-1.8 1,-0.2 -1,-0.2 0.925 111.8 50.4 -62.2 -42.2 34.4 25.2 -14.2 410 689 C Y H X S+ 0 0 27 -4,-1.1 4,-2.9 2,-0.2 5,-0.2 0.901 109.8 49.1 -62.3 -43.9 36.6 26.8 -11.6 411 690 C F H X S+ 0 0 1 -4,-2.7 4,-2.3 2,-0.2 5,-0.3 0.981 106.9 54.7 -59.8 -54.2 38.3 23.6 -10.7 412 691 C T H X S+ 0 0 9 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.866 111.5 48.8 -43.9 -41.2 38.9 22.8 -14.4 413 692 C F H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 5,-0.3 0.988 105.2 52.5 -64.9 -61.6 40.6 26.2 -14.4 414 693 C I H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.3 -1,-0.2 0.800 115.4 46.1 -47.5 -26.4 42.8 25.7 -11.3 415 694 C G H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.2 5,-0.4 0.939 106.2 56.2 -78.6 -49.8 43.8 22.5 -13.1 416 695 C R H X S+ 0 0 20 -4,-3.0 4,-1.3 -5,-0.3 -2,-0.2 0.891 117.0 38.3 -45.2 -45.3 44.4 24.4 -16.4 417 696 C V H X S+ 0 0 0 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.960 109.6 58.9 -71.2 -56.2 46.8 26.6 -14.4 418 697 C A H X S+ 0 0 0 -4,-2.3 4,-1.5 -5,-0.3 3,-0.5 0.877 111.1 42.4 -40.6 -53.6 48.3 24.0 -12.2 419 698 C G H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 -1,-0.3 0.908 107.4 61.3 -62.9 -41.9 49.5 22.1 -15.3 420 699 C L H X S+ 0 0 2 -4,-1.3 4,-1.3 -5,-0.4 -1,-0.2 0.815 104.6 50.5 -53.9 -32.1 50.6 25.4 -17.0 421 700 C A H <>S+ 0 0 0 -4,-1.8 5,-3.1 -3,-0.5 -1,-0.2 0.905 109.0 48.3 -74.2 -44.1 53.0 25.8 -14.1 422 701 C V H ><5S+ 0 0 4 -4,-1.5 3,-1.5 1,-0.2 -2,-0.2 0.925 110.8 53.8 -61.1 -43.4 54.5 22.4 -14.3 423 702 C F H 3<5S+ 0 0 15 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.830 114.1 39.2 -59.5 -39.3 54.9 23.0 -18.0 424 703 C H T 3<5S- 0 0 25 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.050 114.9-112.0-100.5 22.6 56.8 26.3 -17.6 425 704 C G T < 5S+ 0 0 24 -3,-1.5 -3,-0.2 1,-0.2 2,-0.2 0.766 73.8 132.7 54.7 30.0 58.8 25.0 -14.6 426 705 C K < - 0 0 27 -5,-3.1 2,-0.3 -6,-0.2 -1,-0.2 -0.607 50.2-121.9-104.7 170.0 57.1 27.3 -12.1 427 706 C L - 0 0 89 -2,-0.2 2,-0.2 -61,-0.1 127,-0.2 -0.868 8.6-135.6-117.9 149.5 55.6 26.4 -8.7 428 707 C L - 0 0 4 125,-3.0 2,-0.7 -2,-0.3 -58,-0.1 -0.637 28.4-117.9 -92.7 155.3 52.2 26.7 -7.2 429 708 C D S S+ 0 0 60 -60,-0.4 2,-0.2 -2,-0.2 -52,-0.2 -0.865 75.1 34.5-105.1 118.5 51.8 28.1 -3.7 430 709 C G S S- 0 0 18 -2,-0.7 2,-0.4 124,-0.3 -2,-0.1 -0.639 71.4-112.2 130.8 171.5 50.3 25.7 -1.2 431 710 C F - 0 0 22 -39,-0.5 -37,-4.0 -2,-0.2 2,-0.3 -0.997 17.6-142.9-143.2 146.8 50.4 22.0 -0.5 432 711 C F B -n 394 0F 3 -2,-0.4 -37,-0.2 -39,-0.3 5,-0.1 -0.748 31.1 -96.6-109.4 156.6 47.8 19.3 -0.7 433 712 C I >> - 0 0 10 -39,-1.9 3,-2.2 -2,-0.3 4,-0.8 -0.333 48.1-102.0 -64.1 150.7 47.2 16.2 1.5 434 713 C R H >> S+ 0 0 81 1,-0.3 4,-2.2 2,-0.2 3,-0.7 0.887 117.9 65.0 -43.2 -53.6 48.8 13.1 -0.1 435 714 C P H 3> S+ 0 0 1 0, 0.0 4,-2.2 0, 0.0 -1,-0.3 0.748 94.8 60.8 -43.9 -29.0 45.5 11.7 -1.4 436 715 C F H <> S+ 0 0 1 -3,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.989 109.5 40.7 -63.7 -53.7 45.3 14.7 -3.8 437 716 C Y H S+ 0 0 18 -4,-2.2 5,-2.4 1,-0.3 4,-0.6 0.922 104.0 57.5 -59.5 -41.1 47.7 10.0 -5.4 439 718 C M H <5S+ 0 0 25 -4,-2.2 3,-0.4 -5,-0.3 -1,-0.3 0.840 107.8 46.2 -59.3 -33.3 44.5 10.8 -7.1 440 719 C M H <5S+ 0 0 2 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.951 110.2 53.2 -71.2 -49.0 46.4 12.4 -9.9 441 720 C L H <5S- 0 0 10 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.475 115.1-117.9 -63.8 -4.1 48.8 9.5 -10.1 442 721 C G T <5 + 0 0 58 -4,-0.6 2,-0.2 -3,-0.4 -3,-0.2 0.909 65.8 145.7 64.4 41.4 45.8 7.2 -10.4 443 722 C K < - 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0 0 70 -2,-0.2 3,-0.5 1,-0.1 4,-0.1 -0.791 35.2-166.6 -87.8 120.5 37.6 -6.7 18.0 469 748 C P T 3 > + 0 0 0 0, 0.0 5,-0.5 0, 0.0 4,-0.2 -0.010 60.4 100.1 -97.1 30.9 35.5 -3.5 17.8 470 749 C T T 3 5S+ 0 0 64 1,-0.2 3,-0.5 2,-0.2 30,-0.1 0.757 80.4 54.7 -85.0 -22.5 32.3 -4.7 19.4 471 750 C E T < 5S+ 0 0 111 -3,-0.5 -1,-0.2 1,-0.2 -3,-0.0 0.722 96.7 65.3 -79.2 -24.0 33.1 -3.1 22.8 472 751 C L T 5S- 0 0 1 28,-0.1 -1,-0.2 -4,-0.1 -2,-0.2 0.666 97.1-142.2 -71.0 -16.8 33.6 0.3 21.2 473 752 C D T 5 + 0 0 30 -3,-0.5 2,-0.2 -4,-0.2 -469,-0.2 0.975 36.6 168.9 49.4 72.6 29.9 0.3 20.3 474 753 C L < - 0 0 6 -5,-0.5 26,-1.1 26,-0.3 2,-0.3 -0.625 20.3-157.2-107.6 169.7 30.3 1.9 16.9 475 754 C M B -O 499 0G 21 24,-0.2 2,-2.9 -2,-0.2 24,-0.2 -0.972 36.8 -93.1-145.9 154.8 27.8 2.3 14.2 476 755 C F S S+ 0 0 0 22,-1.7 15,-1.6 19,-1.1 16,-0.6 -0.318 97.3 74.4 -70.1 65.2 28.1 2.8 10.4 477 756 C C E -P 490 0H 10 -2,-2.9 13,-0.2 13,-0.3 -2,-0.2 -0.725 63.0-146.9-176.4 122.9 27.8 6.6 10.6 478 757 C I E -P 489 0H 8 11,-0.8 11,-2.3 -2,-0.2 2,-0.3 -0.346 27.2-109.1 -87.6 173.4 30.1 9.5 11.6 479 758 C D E -P 488 0H 3 -422,-0.6 2,-0.3 9,-0.2 9,-0.2 -0.739 28.6-165.1-108.0 155.3 29.1 12.8 13.2 480 759 C E - 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0 0 72 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.664 32.7-135.6 -75.0 115.5 49.8 14.1 -21.0 538 817 C I G >4 S+ 0 0 42 -2,-0.6 3,-0.5 1,-0.3 4,-0.4 0.765 101.9 53.9 -49.6 -26.5 48.6 12.8 -17.6 539 818 C D G >4 S+ 0 0 105 1,-0.2 3,-0.7 2,-0.2 4,-0.4 0.729 89.4 72.1 -79.8 -27.5 50.9 9.7 -18.0 540 819 C L G <4 S+ 0 0 25 -3,-1.8 3,-0.2 1,-0.2 -1,-0.2 0.726 102.0 50.1 -59.8 -19.1 54.0 11.7 -18.6 541 820 C I G X< S+ 0 0 4 -4,-0.6 3,-2.0 -3,-0.5 -1,-0.2 0.676 84.7 81.6 -94.1 -22.9 53.6 12.4 -14.9 542 821 C K T < S+ 0 0 94 -3,-0.7 -1,-0.2 -4,-0.4 -2,-0.1 0.668 76.0 78.4 -60.2 -15.6 53.1 8.9 -13.5 543 822 C I T 3 S+ 0 0 57 -4,-0.4 -1,-0.3 -3,-0.2 2,-0.2 0.767 87.8 67.2 -63.4 -27.1 56.9 8.5 -13.6 544 823 C F S < S- 0 0 5 -3,-2.0 2,-0.2 -243,-0.1 -3,-0.0 -0.576 82.1-130.3 -91.9 159.3 57.2 10.6 -10.4 545 824 C D >> - 0 0 60 -2,-0.2 4,-3.2 1,-0.0 3,-1.0 -0.677 38.1 -87.9-105.7 163.3 55.8 9.5 -7.0 546 825 C E H 3> S+ 0 0 21 1,-0.3 4,-1.8 -2,-0.2 5,-0.1 0.822 129.3 46.9 -34.4 -50.6 53.6 11.4 -4.6 547 826 C N H 3> S+ 0 0 100 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.868 115.8 43.1 -63.7 -40.6 56.6 13.1 -3.0 548 827 C E H <> S+ 0 0 31 -3,-1.0 4,-2.8 2,-0.2 -2,-0.2 0.898 112.5 53.4 -72.7 -40.9 58.3 13.9 -6.3 549 828 C L H X S+ 0 0 0 -4,-3.2 4,-1.8 2,-0.2 5,-0.3 0.840 110.2 48.8 -62.3 -34.3 55.1 15.1 -7.8 550 829 C E H X>S+ 0 0 37 -4,-1.8 4,-3.0 -5,-0.4 5,-0.6 0.948 113.2 45.3 -69.4 -48.5 54.6 17.4 -4.8 551 830 C L H X5S+ 0 0 72 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.852 110.9 58.6 -61.5 -34.2 58.1 18.7 -5.1 552 831 C L H <5S+ 0 0 9 -4,-2.8 -1,-0.2 1,-0.1 -2,-0.2 0.923 124.6 12.0 -62.6 -49.9 57.5 19.1 -8.9 553 832 C M H <5S+ 0 0 0 -4,-1.8 -125,-3.0 2,-0.1 -2,-0.2 0.683 136.0 37.2-107.6 -21.8 54.6 21.4 -8.7 554 833 C C H <5S- 0 0 5 -4,-3.0 -124,-0.3 -5,-0.3 -3,-0.2 0.419 99.2-143.4-108.9 1.5 54.3 22.7 -5.2 555 834 C G << - 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0 0 25 -3,-2.2 217,-0.4 2,-0.1 -2,-0.1 0.756 66.6-157.2-113.2 -34.5 20.7 43.8 38.9 768 671 D Y < + 0 0 20 -4,-1.0 2,-0.5 1,-0.3 39,-0.4 0.845 48.9 127.1 67.0 23.7 23.5 43.6 36.2 769 672 D T - 0 0 16 -5,-0.2 -6,-2.1 37,-0.1 -1,-0.3 -0.965 56.8-125.9-113.5 141.3 21.1 43.6 33.4 770 673 D L E +Xy 762 808M 4 37,-3.5 39,-2.6 -2,-0.5 2,-0.3 -0.574 31.0 168.2 -90.5 150.2 21.7 46.3 30.8 771 674 D Q E -X 761 0M 25 -10,-2.0 -10,-1.8 -2,-0.2 2,-0.1 -0.971 45.2 -79.9-150.6 157.4 19.4 48.9 29.4 772 675 D I E -X 760 0M 6 -2,-0.3 -12,-0.2 -12,-0.2 -13,-0.1 -0.373 44.8-119.8 -63.8 133.6 19.9 52.1 27.2 773 676 D N > - 0 0 13 -14,-1.7 3,-1.5 1,-0.2 -1,-0.1 -0.574 14.7-147.3 -72.8 127.2 21.1 55.1 29.1 774 677 D P T 3 S+ 0 0 18 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.911 98.2 49.6 -63.9 -35.6 18.5 57.8 28.7 775 678 D N T >> + 0 0 29 1,-0.2 3,-2.1 2,-0.1 4,-1.3 0.089 69.3 126.2 -89.7 25.4 21.1 60.5 28.7 776 679 D S H <> S+ 0 0 0 -3,-1.5 4,-0.7 1,-0.3 7,-0.2 0.693 71.6 57.8 -56.1 -16.3 23.3 58.8 26.1 777 680 D G H 34 S+ 0 0 25 -3,-0.5 -1,-0.3 2,-0.2 -2,-0.1 0.627 103.4 47.9 -91.3 -13.2 23.2 62.0 24.2 778 681 D L H <4 S+ 0 0 125 -3,-2.1 -2,-0.2 -20,-0.1 3,-0.2 0.638 114.5 46.9 -97.7 -18.5 24.6 64.3 26.9 779 682 D C H < S+ 0 0 63 -4,-1.3 2,-0.4 1,-0.3 -2,-0.2 0.707 124.0 31.6 -90.2 -26.2 27.5 61.9 27.6 780 683 D N >< - 0 0 35 -4,-0.7 3,-2.2 -5,-0.3 -1,-0.3 -0.899 60.3-158.1-141.6 109.9 28.2 61.5 23.9 781 684 D E T 3 S+ 0 0 188 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.655 103.0 38.6 -59.1 -14.2 27.7 64.1 21.1 782 685 D D T >> S+ 0 0 101 -6,-0.1 4,-1.8 1,-0.1 3,-1.2 0.008 73.4 132.8-126.0 28.9 27.6 61.2 18.7 783 686 D H H <> + 0 0 32 -3,-2.2 4,-3.2 1,-0.3 5,-0.3 0.887 68.1 58.7 -49.6 -49.6 25.7 58.6 20.5 784 687 D L H 3> S+ 0 0 56 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.830 107.0 49.1 -54.5 -30.7 23.3 57.7 17.7 785 688 D S H <> S+ 0 0 42 -3,-1.2 4,-1.0 2,-0.2 3,-0.4 0.971 112.6 47.2 -71.0 -49.6 26.3 56.8 15.5 786 689 D Y H >X S+ 0 0 22 -4,-1.8 4,-2.9 1,-0.2 3,-0.5 0.881 109.9 54.5 -55.0 -40.3 27.7 54.7 18.3 787 690 D F H 3X S+ 0 0 0 -4,-3.2 4,-1.3 1,-0.3 -1,-0.2 0.854 104.6 50.9 -66.4 -35.8 24.4 53.0 18.9 788 691 D T H 3X S+ 0 0 12 -4,-1.5 4,-1.5 -3,-0.4 -1,-0.3 0.686 111.4 52.3 -74.7 -12.4 24.0 51.9 15.3 789 692 D F H S+ 0 0 0 -4,-2.5 5,-2.5 2,-0.2 4,-0.5 0.961 111.6 42.4 -69.6 -52.7 27.2 38.4 16.2 798 701 D V H ><5S+ 0 0 0 -4,-1.6 3,-0.9 1,-0.2 -2,-0.2 0.889 111.8 57.1 -60.6 -40.0 23.8 36.8 15.5 799 702 D F H 3<5S+ 0 0 14 -4,-3.5 -1,-0.2 1,-0.2 -2,-0.2 0.890 114.4 36.6 -57.9 -44.1 24.7 36.5 11.9 800 703 D H H 3<5S- 0 0 29 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.293 114.2-109.7 -94.7 7.5 27.9 34.5 12.6 801 704 D G T <<5S+ 0 0 26 -3,-0.9 2,-0.2 -4,-0.5 -3,-0.2 0.818 76.7 122.4 71.1 30.7 26.6 32.5 15.6 802 705 D K < - 0 0 52 -5,-2.5 2,-0.3 -6,-0.2 -1,-0.2 -0.658 55.3-113.2-115.2 176.2 28.6 34.2 18.3 803 706 D L - 0 0 85 -2,-0.2 2,-0.2 -61,-0.1 127,-0.2 -0.846 5.0-135.2-118.9 150.2 27.4 36.0 21.4 804 707 D L - 0 0 3 125,-2.6 2,-0.7 -2,-0.3 -58,-0.1 -0.606 35.7-119.3 -86.7 161.4 27.4 39.5 22.8 805 708 D D S S+ 0 0 62 -60,-0.3 2,-0.3 -2,-0.2 -52,-0.1 -0.587 75.5 42.7-111.1 76.8 28.4 39.6 26.5 806 709 D G S S- 0 0 18 -2,-0.7 2,-0.5 124,-0.1 -2,-0.1 -0.891 72.7-108.8 168.4 164.4 25.6 40.9 28.7 807 710 D F - 0 0 29 -39,-0.4 -37,-3.5 -2,-0.3 2,-0.2 -0.967 22.7-145.8-122.1 128.5 21.9 40.7 29.2 808 711 D F B -y 770 0M 4 -2,-0.5 -37,-0.2 -39,-0.2 5,-0.1 -0.607 33.0 -97.0 -87.9 150.6 19.5 43.5 28.4 809 712 D I >> - 0 0 11 -39,-2.6 3,-1.5 -2,-0.2 4,-0.9 -0.243 44.2-101.2 -59.5 153.4 16.4 44.1 30.4 810 713 D R H >> S+ 0 0 75 1,-0.3 3,-2.3 2,-0.2 4,-1.4 0.918 118.5 61.2 -42.8 -63.8 13.2 42.5 29.0 811 714 D P H 3> S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.763 98.3 60.8 -36.1 -37.0 11.8 45.7 27.5 812 715 D F H <> S+ 0 0 5 -3,-1.5 4,-0.6 1,-0.2 -2,-0.2 0.912 105.2 46.2 -62.1 -42.2 14.9 46.0 25.3 813 716 D Y H S+ 0 0 18 -4,-1.4 5,-1.8 1,-0.2 4,-1.1 0.922 100.6 61.0 -73.7 -39.5 10.5 43.4 23.0 815 718 D M H <5S+ 0 0 27 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.761 107.5 47.2 -58.6 -20.5 11.3 46.7 21.4 816 719 D M H <5S+ 0 0 6 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.2 0.918 110.6 49.0 -81.3 -49.2 13.2 44.7 18.8 817 720 D L H <5S- 0 0 10 -4,-1.8 -2,-0.2 1,-0.1 -1,-0.2 0.531 118.7-118.5 -65.9 -6.0 10.4 42.2 18.3 818 721 D G T <5 + 0 0 64 -4,-1.1 -3,-0.2 1,-0.2 2,-0.2 0.873 64.5 139.5 69.9 41.5 8.3 45.2 18.0 819 722 D K < - 0 0 105 -5,-1.8 -1,-0.2 -8,-0.1 2,-0.2 -0.638 54.0 -97.0-110.3 168.0 6.0 44.7 20.9 820 723 D Q - 0 0 163 -2,-0.2 2,-0.8 1,-0.0 -1,-0.1 -0.496 27.3-125.0 -83.0 157.4 4.5 47.1 23.5 821 724 D I - 0 0 23 -2,-0.2 2,-0.2 -7,-0.0 72,-0.1 -0.895 39.0-177.1-104.7 106.0 6.0 47.7 26.9 822 725 D T > - 0 0 59 -2,-0.8 3,-1.6 1,-0.1 4,-0.3 -0.563 44.1 -99.4-102.5 166.1 3.2 47.1 29.4 823 726 D L G > S+ 0 0 23 1,-0.3 3,-1.4 -2,-0.2 4,-0.3 0.818 123.2 61.3 -49.7 -34.9 3.0 47.3 33.2 824 727 D N G > S+ 0 0 89 1,-0.3 3,-1.7 2,-0.2 4,-0.3 0.862 91.2 67.0 -62.0 -35.9 3.5 43.6 33.2 825 728 D D G <> S+ 0 0 8 -3,-1.6 4,-0.5 1,-0.3 -1,-0.3 0.521 91.8 62.1 -65.9 -4.7 6.9 43.9 31.6 826 729 D M H <> S+ 0 0 0 -3,-1.4 4,-2.3 -4,-0.3 8,-0.4 0.591 75.3 88.2 -96.6 -9.6 8.3 45.6 34.6 827 730 D E H <4 S+ 0 0 100 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.1 0.880 96.4 41.1 -53.1 -38.9 7.8 42.7 37.0 828 731 D S H 4 S+ 0 0 72 -4,-0.3 3,-0.4 -3,-0.2 -1,-0.2 0.920 112.0 51.8 -76.1 -48.0 11.2 41.3 35.9 829 732 D V H < S- 0 0 13 -4,-0.5 2,-0.2 1,-0.3 -2,-0.2 0.906 134.9 -1.1 -55.7 -45.6 13.2 44.6 35.8 830 733 D D X - 0 0 31 -4,-2.3 4,-2.1 1,-0.1 -1,-0.3 -0.730 63.5-165.1-154.1 93.5 12.2 45.6 39.3 831 734 D S H > S+ 0 0 66 -3,-0.4 4,-1.8 -2,-0.2 5,-0.2 0.871 90.1 47.0 -44.9 -53.4 9.8 43.4 41.3 832 735 D E H > S+ 0 0 44 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.908 108.3 52.6 -61.7 -47.5 8.9 46.0 43.9 833 736 D Y H >> S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 3,-0.7 0.972 109.4 53.8 -52.4 -53.8 8.2 48.9 41.5 834 737 D Y H 3X S+ 0 0 19 -4,-2.1 4,-3.3 -8,-0.4 -1,-0.2 0.847 106.3 48.2 -46.4 -53.0 5.9 46.6 39.7 835 738 D N H 3X S+ 0 0 71 -4,-1.8 4,-2.4 2,-0.2 -1,-0.3 0.812 108.9 55.4 -63.8 -31.0 3.7 45.6 42.7 836 739 D S H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 3,-0.7 0.968 115.2 52.0 -62.1 -50.1 2.0 50.1 40.3 838 741 D K H 3X S+ 0 0 57 -4,-3.3 4,-1.5 1,-0.3 -1,-0.2 0.892 106.7 55.5 -53.0 -37.6 -0.1 47.0 40.2 839 742 D W H 3X S+ 0 0 61 -4,-2.4 4,-1.8 1,-0.2 -1,-0.3 0.878 106.8 49.6 -63.7 -36.4 -1.4 48.0 43.6 840 743 D I H << S+ 0 0 2 -4,-1.7 -1,-0.2 -3,-0.7 -2,-0.2 0.906 107.0 54.8 -66.9 -43.1 -2.5 51.3 42.2 841 744 D L H < S+ 0 0 39 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.817 114.8 39.3 -60.4 -32.1 -4.2 49.6 39.3 842 745 D E H < S+ 0 0 118 -4,-1.5 -1,-0.2 -5,-0.2 2,-0.2 0.746 118.3 41.9 -91.2 -26.5 -6.3 47.4 41.6 843 746 D N S < S- 0 0 73 -4,-1.8 0, 0.0 -5,-0.2 0, 0.0 -0.649 90.4 -88.6-119.7 174.4 -7.1 49.9 44.4 844 747 D D - 0 0 73 -2,-0.2 3,-0.3 1,-0.1 34,-0.1 -0.744 30.8-164.7 -86.1 122.6 -8.1 53.5 45.0 845 748 D P >> + 0 0 0 0, 0.0 3,-4.1 0, 0.0 4,-0.6 0.577 53.3 113.8 -80.3 -14.5 -5.0 55.7 45.2 846 749 D T G >4 S+ 0 0 79 1,-0.3 3,-1.1 2,-0.2 4,-0.2 0.757 80.2 44.8 -26.6 -57.9 -6.6 58.8 46.7 847 750 D E G 34 S+ 0 0 100 -3,-0.3 -1,-0.3 1,-0.2 -3,-0.0 0.475 95.2 77.5 -75.1 -0.2 -4.8 58.6 50.1 848 751 D L G <4 S- 0 0 1 -3,-4.1 -1,-0.2 28,-0.2 -2,-0.2 0.811 91.0-141.5 -75.5 -28.9 -1.4 57.9 48.4 849 752 D D << + 0 0 16 -3,-1.1 2,-0.3 -4,-0.6 -695,-0.1 0.978 38.3 161.2 66.1 60.8 -1.1 61.6 47.6 850 753 D L - 0 0 12 26,-0.2 26,-1.7 -5,-0.2 2,-0.2 -0.818 20.6-166.3-112.2 152.4 0.5 61.3 44.1 851 754 D M B -Z 875 0N 25 -2,-0.3 2,-1.2 2,-0.3 21,-0.2 -0.694 43.7 -88.7-124.6 177.7 0.6 63.9 41.4 852 755 D F S S+ 0 0 0 19,-2.1 15,-2.0 22,-1.1 16,-0.6 -0.228 96.4 95.5 -88.1 50.3 1.5 63.6 37.7 853 756 D C E -A 866 0O 22 -2,-1.2 2,-0.3 18,-0.3 -2,-0.3 -0.910 52.8-165.3-133.6 159.6 5.2 64.2 38.4 854 757 D I E -A 865 0O 10 11,-2.2 11,-2.8 -2,-0.3 2,-0.5 -0.990 24.7-118.3-147.3 140.7 8.1 61.8 38.9 855 758 D D E -A 864 0O 18 -651,-0.5 2,-0.5 -2,-0.3 9,-0.2 -0.740 31.6-173.4 -85.4 126.4 11.5 62.4 40.4 856 759 D E E -A 863 0O 28 7,-1.6 7,-1.9 -2,-0.5 2,-0.7 -0.973 9.5-155.7-126.4 121.8 14.3 61.7 37.9 857 760 D E E +A 862 0O 115 -2,-0.5 2,-0.5 5,-0.3 5,-0.2 -0.827 19.9 164.1-104.0 108.9 18.0 61.8 38.8 858 761 D N E > S+A 861 0O 19 3,-1.0 3,-0.6 -2,-0.7 5,-0.1 -0.978 70.0 0.4-125.0 124.8 20.6 62.5 36.1 859 762 D F T 3 S- 0 0 149 -2,-0.5 -1,-0.1 1,-0.2 3,-0.1 0.780 121.9 -65.6 72.7 33.7 24.2 63.4 37.0 860 763 D G T 3 S+ 0 0 68 1,-0.3 2,-0.4 -3,-0.1 -1,-0.2 0.734 118.6 102.3 64.5 16.8 23.8 63.4 40.8 861 764 D Q E < -A 858 0O 118 -3,-0.6 -3,-1.0 -5,-0.0 2,-0.6 -0.961 68.6-142.3-124.6 139.1 21.4 66.3 40.5 862 765 D T E -A 857 0O 49 -2,-0.4 -5,-0.3 -5,-0.2 -3,-0.0 -0.895 17.4-169.7-116.8 106.0 17.8 65.2 40.9 863 766 D Y E -A 856 0O 128 -7,-1.9 -7,-1.6 -2,-0.6 2,-0.4 -0.223 17.0-135.4 -81.3 174.1 15.2 66.9 38.8 864 767 D Q E -A 855 0O 73 -9,-0.2 2,-0.4 -2,-0.0 -9,-0.2 -0.984 26.2-165.4-133.1 119.4 11.4 66.6 39.1 865 768 D V E -A 854 0O 38 -11,-2.8 -11,-2.2 -2,-0.4 2,-0.5 -0.854 19.5-127.6-117.0 149.0 9.5 66.1 35.9 866 769 D D E -A 853 0O 65 -2,-0.4 -13,-0.2 -13,-0.2 4,-0.1 -0.771 8.8-152.2 -90.6 124.1 5.9 66.4 34.8 867 770 D L S S+ 0 0 29 -15,-2.0 -14,-0.1 -2,-0.5 -1,-0.1 0.631 85.2 1.0 -68.1 -15.1 4.6 63.4 33.0 868 771 D K S > S- 0 0 54 -16,-0.6 3,-2.0 -3,-0.0 4,-0.2 -0.926 113.1 -47.3-160.2 169.0 2.2 65.7 31.2 869 772 D P T 3 S- 0 0 116 0, 0.0 -2,-0.1 0, 0.0 -17,-0.0 -0.342 125.1 -6.3 -49.5 120.2 1.4 69.5 31.2 870 773 D N T >> S+ 0 0 111 -2,-0.1 3,-1.7 -4,-0.1 4,-1.0 0.747 83.0 152.9 63.7 28.3 1.2 70.7 34.8 871 774 D G G X4 + 0 0 0 -3,-2.0 -19,-2.1 1,-0.3 3,-0.9 0.889 61.9 69.1 -53.5 -44.5 1.5 67.2 36.2 872 775 D S G 34 S+ 0 0 35 -20,-0.3 -1,-0.3 1,-0.3 -19,-0.1 0.749 106.0 42.5 -46.7 -26.8 3.0 68.6 39.5 873 776 D E G <4 S+ 0 0 128 -3,-1.7 2,-0.4 -21,-0.1 -1,-0.3 0.730 94.7 89.8 -95.2 -25.7 -0.5 70.1 40.2 874 777 D I << - 0 0 59 -4,-1.0 -22,-1.1 -3,-0.9 -21,-0.1 -0.616 66.5-143.2 -81.5 125.0 -2.8 67.2 39.1 875 778 D M B -Z 851 0N 87 -2,-0.4 2,-1.0 -24,-0.2 -24,-0.2 -0.397 21.7-113.3 -79.1 159.6 -3.7 64.7 41.8 876 779 D V + 0 0 5 -26,-1.7 -26,-0.2 -30,-0.1 -27,-0.2 -0.843 42.9 179.2 -96.3 101.8 -4.1 61.0 40.9 877 780 D T - 0 0 48 -2,-1.0 3,-0.3 -32,-0.1 4,-0.1 -0.172 44.7-100.6 -84.4-171.6 -7.8 60.5 41.5 878 781 D N S S+ 0 0 69 1,-0.2 4,-0.1 2,-0.1 -1,-0.0 0.294 118.3 62.9 -95.2 8.2 -9.3 57.0 40.8 879 782 D E S S+ 0 0 183 1,-0.1 -1,-0.2 2,-0.1 4,-0.1 0.598 110.6 33.5-107.8 -5.7 -10.6 58.1 37.5 880 783 D N S > S+ 0 0 31 -3,-0.3 4,-0.9 2,-0.1 -2,-0.1 0.143 83.8 101.4-132.5 16.6 -7.2 58.8 35.9 881 784 D K H > S+ 0 0 12 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.823 77.2 62.1 -73.7 -29.8 -4.8 56.3 37.5 882 785 D R H > S+ 0 0 169 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.910 107.0 45.2 -61.1 -39.4 -4.9 54.1 34.4 883 786 D E H > S+ 0 0 87 2,-0.2 4,-1.0 3,-0.1 -1,-0.2 0.703 109.0 56.9 -76.2 -24.0 -3.3 57.0 32.5 884 787 D Y H >X S+ 0 0 4 -4,-0.9 4,-2.5 2,-0.2 3,-2.4 0.991 108.0 45.3 -66.6 -67.6 -0.8 57.7 35.2 885 788 D I H 3X S+ 0 0 9 -4,-2.1 4,-2.5 1,-0.3 5,-0.4 0.866 109.1 58.0 -41.5 -46.5 0.6 54.2 35.1 886 789 D D H 3X S+ 0 0 108 -4,-1.7 4,-1.1 -5,-0.3 -1,-0.3 0.853 112.4 41.3 -54.3 -35.9 0.6 54.4 31.3 887 790 D L H S+ 0 0 85 -4,-1.1 4,-2.6 -5,-0.4 5,-1.7 0.938 110.2 48.9 -65.3 -44.4 6.3 54.8 29.3 891 794 D W H <5S+ 0 0 23 -4,-2.7 5,-0.5 3,-0.2 -2,-0.2 0.874 111.8 50.1 -62.4 -39.4 8.7 57.3 30.8 892 795 D R H <5S+ 0 0 47 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.946 127.0 16.0 -68.1 -47.3 10.8 54.6 32.4 893 796 D F H <5S+ 0 0 8 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.648 131.3 18.4-106.3 -14.3 11.3 52.3 29.4 894 797 D V T ><5S+ 0 0 34 -4,-2.6 3,-1.6 -5,-0.3 4,-0.5 0.805 98.4 64.4-125.7 -52.1 10.5 54.1 26.2 895 798 D N G > S+ 0 0 9 -3,-1.6 4,-3.1 2,-0.1 -1,-0.2 0.221 78.0 100.7-128.2 16.2 15.5 55.8 24.5 898 801 D Q H <> S+ 0 0 61 -3,-0.7 4,-2.5 -4,-0.5 5,-0.3 0.923 82.1 49.3 -71.4 -42.7 13.7 55.9 21.2 899 802 D K H > S+ 0 0 147 -4,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.955 118.3 43.3 -59.2 -46.8 16.3 57.7 19.2 900 803 D Q H >> S+ 0 0 7 1,-0.2 4,-2.6 2,-0.2 3,-0.5 0.968 112.4 50.3 -60.6 -58.7 18.9 55.4 20.5 901 804 D M H 3X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.3 -1,-0.2 0.824 113.2 46.6 -52.2 -36.9 16.9 52.2 20.2 902 805 D N H 3X S+ 0 0 83 -4,-2.5 4,-2.0 2,-0.2 -1,-0.3 0.821 109.9 53.6 -76.4 -29.4 16.0 53.0 16.6 903 806 D A H < S+ 0 0 118 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.988 111.0 40.2 -55.8 -59.4 19.1 50.4 12.1 907 810 D G H 3< S+ 0 0 0 -4,-1.7 3,-0.4 1,-0.2 -1,-0.2 0.689 114.4 54.2 -64.4 -18.6 22.5 48.9 12.5 908 811 D F H >X S+ 0 0 0 -4,-1.4 4,-1.2 1,-0.2 3,-0.9 0.814 105.7 51.0 -84.6 -31.1 21.2 45.6 13.6 909 812 D T T << S+ 0 0 56 -4,-2.3 -1,-0.2 -3,-0.5 -2,-0.2 0.203 88.1 88.6 -89.2 16.3 18.9 45.2 10.6 910 813 D E T 34 S+ 0 0 59 -3,-0.4 -1,-0.2 -5,-0.1 -2,-0.2 0.760 107.1 16.5 -81.4 -26.8 22.0 46.0 8.5 911 814 D L T <4 S+ 0 0 4 -3,-0.9 -2,-0.2 1,-0.2 -3,-0.1 0.637 127.3 53.0-117.0 -28.6 22.9 42.3 8.4 912 815 D L S < S- 0 0 1 -4,-1.2 2,-0.7 -227,-0.1 -1,-0.2 -0.920 80.4-127.5-113.0 134.2 19.6 40.6 9.5 913 816 D P >> - 0 0 75 0, 0.0 3,-2.9 0, 0.0 4,-0.6 -0.736 26.4-135.2 -79.5 119.3 16.3 41.3 7.8 914 817 D I H >> S+ 0 0 47 -2,-0.7 3,-1.6 1,-0.3 4,-1.2 0.820 100.5 62.3 -44.2 -46.6 14.1 42.2 10.8 915 818 D D H 34 S+ 0 0 122 1,-0.3 -1,-0.3 2,-0.2 -98,-0.0 0.583 99.9 61.7 -59.7 -4.3 11.1 40.1 9.9 916 819 D L H X4 S+ 0 0 16 -3,-2.9 3,-0.8 1,-0.1 -1,-0.3 0.785 98.6 50.3 -92.3 -28.5 13.5 37.2 10.2 917 820 D I H X< S+ 0 0 0 -3,-1.6 3,-1.5 -4,-0.6 -2,-0.2 0.728 95.5 75.2 -79.7 -20.0 14.3 37.6 13.9 918 821 D K T 3< S+ 0 0 98 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.460 72.2 78.9 -74.6 1.6 10.6 37.8 14.7 919 822 D I T < S+ 0 0 53 -3,-0.8 -1,-0.3 2,-0.1 2,-0.2 0.670 92.0 67.8 -78.1 -16.7 10.1 34.0 14.3 920 823 D F S < S- 0 0 6 -3,-1.5 2,-0.2 -4,-0.1 -3,-0.0 -0.605 84.3-126.0 -97.8 161.6 11.7 33.8 17.8 921 824 D D >> - 0 0 53 -2,-0.2 4,-2.5 1,-0.0 3,-0.6 -0.600 37.1 -86.8-107.1 169.0 10.2 35.1 21.0 922 825 D E T 34 S+ 0 0 30 1,-0.2 -109,-0.1 -2,-0.2 -108,-0.1 0.395 128.0 45.2 -55.2 4.7 11.4 37.4 23.7 923 826 D N T 3> S+ 0 0 106 3,-0.1 4,-1.2 2,-0.1 -1,-0.2 0.664 113.6 44.1-114.1 -40.5 13.1 34.5 25.4 924 827 D E H X> S+ 0 0 23 -3,-0.6 4,-2.1 2,-0.2 3,-0.8 0.961 109.4 56.6 -70.8 -49.5 14.8 32.7 22.5 925 828 D L H 3X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.3 5,-0.2 0.827 107.6 50.9 -48.5 -36.6 16.0 36.0 21.0 926 829 D E H 3> S+ 0 0 30 -5,-0.4 4,-2.5 1,-0.2 -1,-0.3 0.861 111.6 45.7 -70.1 -37.6 17.8 36.6 24.3 927 830 D L H << S+ 0 0 68 -4,-1.2 -2,-0.2 -3,-0.8 -1,-0.2 0.677 114.1 50.9 -77.8 -19.2 19.3 33.1 24.1 928 831 D L H < S+ 0 0 11 -4,-2.1 -2,-0.2 3,-0.1 -1,-0.2 0.626 119.9 33.5 -91.4 -17.3 20.2 33.7 20.5 929 832 D M H < S+ 0 0 1 -4,-1.0 -125,-2.6 -5,-0.3 -2,-0.2 0.790 138.2 17.4-105.0 -41.5 21.9 37.1 21.2 930 833 D C S < S- 0 0 7 -4,-2.5 -3,-0.2 1,-0.2 -2,-0.1 0.319 100.2-141.2-114.4 4.5 23.4 36.6 24.7 931 834 D G - 0 0 8 -5,-0.3 -1,-0.2 -6,-0.2 -2,-0.2 -0.057 50.2 -26.8 63.6-170.7 23.3 32.8 24.7 932 835 D L - 0 0 99 -5,-0.2 2,-1.1 1,-0.1 38,-0.0 -0.349 67.3-119.6 -68.0 156.1 22.4 30.8 27.7 933 836 D G - 0 0 11 2,-0.0 2,-0.3 36,-0.0 -1,-0.1 -0.624 41.2-176.4-100.3 77.6 23.3 32.6 31.0 934 837 D D - 0 0 97 -2,-1.1 2,-0.4 1,-0.1 36,-0.1 -0.576 19.6-134.1 -84.9 133.0 25.7 30.1 32.4 935 838 D V - 0 0 14 -2,-0.3 2,-1.5 34,-0.3 3,-0.1 -0.686 13.4-130.9 -84.7 126.9 27.2 30.7 35.9 936 839 D D >> - 0 0 88 -2,-0.4 4,-2.0 1,-0.2 3,-0.7 -0.596 21.0-167.5 -77.1 90.6 31.0 30.2 36.3 937 840 D V H 3> S+ 0 0 6 -2,-1.5 4,-1.6 1,-0.2 5,-0.2 0.697 82.3 59.9 -54.3 -21.3 30.9 27.9 39.4 938 841 D N H 3> S+ 0 0 13 2,-0.2 4,-2.3 1,-0.1 -1,-0.2 0.943 107.4 42.4 -73.1 -46.5 34.6 28.4 39.9 939 842 D D H <> S+ 0 0 30 -3,-0.7 4,-2.6 2,-0.2 -2,-0.2 0.900 111.6 57.7 -63.2 -45.1 34.4 32.2 40.3 940 843 D W H < S+ 0 0 0 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.967 111.9 38.2 -49.9 -67.2 31.4 31.9 42.5 941 844 D R H >< S+ 0 0 6 -4,-1.6 3,-2.3 1,-0.2 -1,-0.2 0.934 112.1 57.6 -53.6 -52.5 33.0 29.7 45.1 942 845 D Q H 3< S+ 0 0 62 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.925 116.2 36.5 -43.9 -53.9 36.3 31.5 44.9 943 846 D H T 3< S+ 0 0 55 -4,-2.6 59,-0.4 -5,-0.1 -1,-0.3 0.019 93.1 107.9 -92.3 24.5 34.6 34.8 45.8 944 847 D S < - 0 0 10 -3,-2.3 2,-0.3 57,-0.1 59,-0.2 -0.536 54.4-151.1 -91.9 167.2 32.0 33.5 48.2 945 848 D I E -b 1003 0P 55 57,-2.5 59,-2.4 -2,-0.2 2,-0.4 -0.965 1.6-143.0-137.7 155.5 32.4 34.2 51.9 946 849 D Y E -b 1004 0P 43 -2,-0.3 2,-0.3 57,-0.2 59,-0.2 -0.928 13.0-174.8-125.5 148.5 31.2 32.3 55.0 947 850 D K E +b 1005 0P 94 57,-1.4 59,-1.3 -2,-0.4 4,-0.1 -0.979 58.0 25.1-138.5 147.6 29.9 33.4 58.3 948 851 D N S S- 0 0 58 -2,-0.3 58,-0.6 57,-0.2 -1,-0.2 0.992 130.4 -25.5 64.7 68.9 28.9 31.6 61.6 949 852 D G S S+ 0 0 55 1,-0.2 2,-0.3 -3,-0.1 -1,-0.2 0.424 107.6 107.7 83.1 -0.5 30.9 28.4 61.7 950 853 D Y + 0 0 15 54,-0.1 -1,-0.2 56,-0.1 -4,-0.1 -0.715 36.5 168.9-108.8 163.5 31.6 27.7 58.0 951 854 D C > - 0 0 49 -2,-0.3 3,-1.7 -3,-0.1 6,-0.2 -0.975 52.4 -81.8-163.7 161.7 34.8 28.0 55.9 952 855 D P T 3 S+ 0 0 48 0, 0.0 2,-0.1 0, 0.0 -1,-0.0 0.776 127.9 36.0 -36.0 -40.2 36.3 27.1 52.5 953 856 D N T 3 S+ 0 0 83 4,-0.1 -807,-0.0 5,-0.0 -906,-0.0 -0.333 82.7 128.4-117.6 51.5 37.0 23.6 53.8 954 857 D H X> - 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