==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN/ISOMERASE 28-MAY-97 1AK4 . COMPND 2 MOLECULE: CYCLOPHILIN A; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.P.HILL,T.R.GAMBLE,F.F.VAJDOS,D.K.WORTHYLAKE,W.I.SUNDQUIST . 618 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29422.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 417 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 104 16.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 49 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 173 28.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.0 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 2 0 0 2 3 3 0 0 2 2 0 0 1 0 0 1 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 0 7 5 0 0 2 2 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 . 2 0 0 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 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 1 A M 0 0 230 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.1 13.5 75.4 58.4 2 2 A V + 0 0 108 2,-0.1 24,-0.1 1,-0.1 23,-0.0 0.965 360.0 63.9 -66.9 -53.8 14.9 74.9 54.8 3 3 A N S S- 0 0 27 22,-0.1 22,-0.1 23,-0.1 2,-0.1 -0.599 80.4-142.9 -78.0 121.6 16.7 71.5 55.4 4 4 A P - 0 0 19 0, 0.0 20,-2.6 0, 0.0 2,-0.4 -0.426 4.3-138.6 -79.3 156.8 14.3 68.6 56.3 5 5 A T E -A 23 0A 19 159,-0.5 159,-2.8 18,-0.2 2,-0.3 -0.955 20.3-176.8-119.2 134.0 15.0 65.8 58.8 6 6 A V E -AB 22 163A 0 16,-1.9 16,-2.7 -2,-0.4 2,-0.3 -0.896 9.7-147.1-126.4 159.7 14.1 62.2 58.2 7 7 A F E -AB 21 162A 20 155,-2.4 155,-1.4 -2,-0.3 2,-0.4 -0.942 4.5-157.8-127.6 151.3 14.3 59.0 60.3 8 8 A F E -AB 20 161A 1 12,-2.9 12,-2.2 -2,-0.3 2,-0.7 -0.993 9.9-151.2-119.6 135.9 14.9 55.3 59.7 9 9 A D E -AB 19 160A 40 151,-3.2 150,-1.8 -2,-0.4 151,-0.9 -0.906 24.4-153.2-103.1 103.3 13.9 52.6 62.2 10 10 A I E -AB 18 158A 4 8,-2.5 7,-2.6 -2,-0.7 8,-1.1 -0.548 12.4-170.4 -84.7 138.4 16.4 49.9 61.6 11 11 A A E -AB 16 157A 3 146,-2.2 146,-2.4 5,-0.3 2,-0.5 -0.963 15.3-149.2-127.5 145.4 15.6 46.2 62.3 12 12 A V E > S-AB 15 156A 7 3,-3.1 3,-2.1 -2,-0.4 144,-0.2 -0.974 86.0 -26.1-115.3 111.2 17.9 43.1 62.4 13 13 A D T 3 S- 0 0 90 142,-2.8 -1,-0.1 -2,-0.5 143,-0.1 0.850 128.0 -50.6 50.5 37.1 16.0 40.0 61.4 14 14 A G T 3 S+ 0 0 59 141,-0.4 -1,-0.3 1,-0.2 142,-0.0 -0.023 115.7 116.5 93.8 -29.5 12.8 41.7 62.6 15 15 A E E < S-A 12 0A 118 -3,-2.1 -3,-3.1 1,-0.1 -1,-0.2 -0.577 73.4-110.5 -78.5 125.5 14.3 42.7 66.0 16 16 A P E +A 11 0A 122 0, 0.0 -5,-0.3 0, 0.0 -1,-0.1 -0.298 36.7 173.9 -57.1 129.0 14.5 46.5 66.5 17 17 A L E - 0 0 57 -7,-2.6 2,-0.3 1,-0.3 -6,-0.2 0.843 49.7 -85.8 -97.8 -57.7 18.0 47.9 66.6 18 18 A G E -A 10 0A 25 -8,-1.1 -8,-2.5 120,-0.0 2,-0.4 -0.974 40.6 -67.3 168.2-175.2 17.4 51.6 66.8 19 19 A R E -A 9 0A 111 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.847 28.2-168.8-108.1 132.9 16.7 54.9 65.0 20 20 A V E -A 8 0A 1 -12,-2.2 -12,-2.9 -2,-0.4 2,-0.3 -0.970 10.4-164.4-111.3 131.2 19.0 56.9 62.7 21 21 A S E -AC 7 134A 9 113,-3.0 112,-3.0 -2,-0.4 113,-0.9 -0.862 3.1-158.6-113.9 153.5 18.0 60.4 61.7 22 22 A F E -AC 6 132A 0 -16,-2.7 -16,-1.9 -2,-0.3 2,-0.5 -0.975 14.6-141.0-130.7 142.4 19.4 62.5 58.9 23 23 A E E -AC 5 131A 45 108,-3.0 108,-1.9 -2,-0.4 2,-0.5 -0.894 23.0-148.0 -96.2 133.8 19.6 66.2 58.0 24 24 A L E - C 0 130A 0 -20,-2.6 2,-2.4 -2,-0.5 106,-0.3 -0.906 9.0-138.1-108.6 123.1 19.1 66.8 54.3 25 25 A F >> + 0 0 27 104,-1.9 4,-3.1 -2,-0.5 3,-2.3 -0.329 40.5 155.3 -81.6 67.6 20.9 69.7 52.7 26 26 A A T 34 + 0 0 21 -2,-2.4 -1,-0.2 1,-0.3 5,-0.1 0.717 69.5 67.8 -66.4 -17.6 18.1 71.0 50.5 27 27 A D T 34 S+ 0 0 80 -3,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.675 116.1 24.3 -73.2 -17.4 19.8 74.4 50.7 28 28 A K T <4 S+ 0 0 88 -3,-2.3 -2,-0.2 101,-0.1 -1,-0.1 0.724 141.2 19.4-111.8 -43.6 22.6 72.9 48.6 29 29 A V X + 0 0 0 -4,-3.1 4,-2.8 100,-0.1 3,-0.3 -0.571 67.0 164.8-131.4 72.1 21.0 70.0 46.7 30 30 A P H > S+ 0 0 64 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.912 76.0 48.9 -59.2 -47.8 17.2 70.5 46.7 31 31 A K H > S+ 0 0 64 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.847 116.4 43.4 -63.3 -32.7 16.3 68.0 44.0 32 32 A T H > S+ 0 0 0 -3,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.886 115.0 47.9 -83.1 -38.4 18.4 65.2 45.6 33 33 A A H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.934 111.4 52.4 -63.2 -44.6 17.2 66.0 49.2 34 34 A E H X S+ 0 0 71 -4,-3.1 4,-2.6 -5,-0.3 5,-0.3 0.919 106.1 53.1 -59.8 -45.1 13.6 66.1 48.0 35 35 A N H X S+ 0 0 0 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.944 113.8 42.3 -54.1 -50.9 13.9 62.7 46.3 36 36 A F H X S+ 0 0 0 -4,-1.8 4,-1.0 2,-0.2 -2,-0.2 0.897 114.0 51.8 -65.9 -42.9 15.2 61.1 49.5 37 37 A R H >X S+ 0 0 28 -4,-2.8 4,-2.0 2,-0.2 3,-1.0 0.966 111.2 45.4 -57.9 -54.0 12.7 62.9 51.8 38 38 A A H 3X>S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.3 5,-0.7 0.839 111.8 52.8 -62.5 -34.2 9.6 61.9 49.7 39 39 A L H 3<5S+ 0 0 1 -4,-1.8 9,-2.1 -5,-0.3 10,-0.5 0.705 108.8 51.5 -73.4 -21.0 10.8 58.3 49.5 40 40 A S H <<5S+ 0 0 3 -4,-1.0 -2,-0.2 -3,-1.0 -1,-0.2 0.828 113.4 42.3 -82.7 -35.6 11.2 58.3 53.3 41 41 A T H <5S- 0 0 46 -4,-2.0 -2,-0.2 121,-0.2 -3,-0.2 0.689 99.4-137.9 -80.3 -26.1 7.7 59.5 54.0 42 42 A G T ><5 + 0 0 31 -4,-1.5 3,-2.3 -5,-0.2 -3,-0.2 0.591 52.6 145.3 79.0 16.5 6.2 57.2 51.3 43 43 A E T 3 < + 0 0 107 -5,-0.7 -4,-0.1 1,-0.3 -1,-0.1 0.549 66.0 58.6 -67.2 -7.6 3.9 59.9 50.0 44 44 A K T 3 S- 0 0 98 2,-0.5 -1,-0.3 -6,-0.5 3,-0.1 0.456 120.7-103.3 -97.2 -5.4 4.2 58.7 46.4 45 45 A G S < S+ 0 0 74 -3,-2.3 2,-0.3 1,-0.3 -2,-0.1 0.303 98.9 57.9 99.1 -9.9 2.9 55.2 47.3 46 46 A F + 0 0 67 0, 0.0 -2,-0.5 0, 0.0 2,-0.3 -0.941 61.5 105.8-143.3 163.8 6.4 53.6 47.2 47 47 A G S S- 0 0 15 -2,-0.3 -7,-0.2 2,-0.2 4,-0.1 -0.990 70.8 -34.4 158.5-158.7 9.7 54.1 49.0 48 48 A Y S > S+ 0 0 0 -9,-2.1 3,-2.8 -2,-0.3 110,-0.3 0.716 84.1 111.7 -71.4 -28.4 12.2 53.0 51.6 49 49 A K T 3 S+ 0 0 134 -10,-0.5 110,-0.2 1,-0.3 -2,-0.2 -0.290 90.9 11.6 -57.5 119.9 9.9 51.5 54.3 50 50 A G T 3 S+ 0 0 57 108,-3.2 -1,-0.3 1,-0.4 109,-0.1 0.180 101.0 124.9 97.6 -15.7 10.4 47.8 54.4 51 51 A S < - 0 0 5 -3,-2.8 107,-3.2 107,-0.3 -1,-0.4 -0.277 51.3-132.1 -76.3 162.0 13.5 47.9 52.2 52 52 A C B -D 157 0A 28 14,-0.3 2,-0.9 105,-0.3 13,-0.5 -0.719 16.2-113.2-115.1 159.7 16.8 46.4 53.3 53 53 A F + 0 0 1 103,-3.2 103,-0.5 -2,-0.2 11,-0.2 -0.878 38.5 176.1 -86.0 103.8 20.5 47.3 53.4 54 54 A H + 0 0 33 -2,-0.9 98,-0.5 9,-0.6 2,-0.4 0.630 63.3 42.2 -89.1 -18.7 21.8 44.9 50.8 55 55 A R E +E 63 0A 46 8,-1.5 8,-2.7 96,-0.1 2,-0.4 -0.943 61.4 165.0-137.5 106.3 25.5 45.9 50.8 56 56 A I E -E 62 0A 0 94,-2.6 91,-2.4 -2,-0.4 94,-0.4 -0.965 10.7-173.6-126.0 116.5 27.4 46.8 53.9 57 57 A I E >> -E 61 0A 3 4,-2.4 3,-2.5 -2,-0.4 4,-1.1 -0.926 28.0-123.3-114.6 110.4 31.2 47.0 54.0 58 58 A P T 34 S+ 0 0 50 0, 0.0 86,-0.0 0, 0.0 82,-0.0 -0.253 96.9 11.9 -52.1 124.6 32.9 47.5 57.4 59 59 A G T 34 S+ 0 0 49 1,-0.1 56,-0.0 57,-0.1 84,-0.0 0.351 128.4 59.4 88.3 -6.2 35.1 50.7 57.4 60 60 A F T <4 S- 0 0 8 -3,-2.5 56,-2.2 1,-0.2 57,-0.4 0.693 103.6 -57.5-115.5 -77.5 33.6 51.9 54.1 61 61 A M E < -EF 57 115A 0 -4,-1.1 -4,-2.4 54,-0.3 2,-0.5 -0.989 30.2-114.0-166.4 164.3 29.8 52.4 54.0 62 62 A C E -EF 56 114A 0 52,-2.5 52,-2.5 -2,-0.3 2,-0.5 -0.971 35.0-160.8-107.5 127.2 26.3 51.1 54.5 63 63 A Q E +EF 55 113A 0 -8,-2.7 -8,-1.5 -2,-0.5 -9,-0.6 -0.922 24.6 131.9-117.9 132.2 24.2 50.9 51.3 64 64 A G E + F 0 112A 0 48,-2.1 48,-2.2 -2,-0.5 -11,-0.2 -0.679 20.9 104.3-147.4-164.4 20.4 50.7 50.8 65 65 A G + 0 0 0 -13,-0.5 2,-1.6 46,-0.3 11,-0.3 0.352 44.7 125.9 103.0 -5.7 17.5 52.2 48.9 66 66 A D > + 0 0 2 -14,-0.4 4,-0.8 1,-0.2 -14,-0.3 -0.583 22.1 158.6 -87.0 81.7 16.8 49.5 46.4 67 67 A F T 4 + 0 0 28 -2,-1.6 -1,-0.2 2,-0.1 -20,-0.0 0.704 68.8 45.1 -83.1 -13.2 13.1 48.9 47.1 68 68 A T T 4 S+ 0 0 59 -3,-0.2 -1,-0.1 1,-0.0 -2,-0.1 0.952 129.5 13.7 -90.8 -66.3 12.3 47.4 43.7 69 69 A R T 4 S- 0 0 121 1,-0.1 -2,-0.1 3,-0.0 4,-0.1 0.601 80.8-152.8 -89.5 -16.1 15.1 44.8 42.9 70 70 A H S < S+ 0 0 106 -4,-0.8 -4,-0.1 1,-0.1 -3,-0.1 0.418 74.4 80.8 65.5 2.2 16.6 44.6 46.4 71 71 A N S S- 0 0 68 -16,-0.0 -1,-0.1 -17,-0.0 -4,-0.0 0.299 112.1 -88.7-127.4 6.3 20.1 43.6 45.0 72 72 A G S S+ 0 0 1 491,-0.1 492,-2.8 -6,-0.1 -2,-0.1 0.054 111.8 86.9 103.8 -21.7 21.9 46.7 43.8 73 73 A T S S+ 0 0 20 490,-0.2 2,-0.2 -4,-0.1 490,-0.1 -0.176 88.4 40.5-105.9 38.8 20.4 46.6 40.3 74 74 A G + 0 0 16 -6,-0.1 36,-0.3 490,-0.0 37,-0.3 -0.816 49.3 112.6-156.6-157.9 17.2 48.5 41.0 75 75 A G - 0 0 5 -2,-0.2 2,-0.3 -9,-0.1 -9,-0.1 -0.166 37.7-140.2 95.3 158.6 15.5 51.4 42.7 76 76 A K - 0 0 59 -11,-0.3 33,-0.2 33,-0.1 6,-0.1 -0.983 8.3-123.6-158.1 149.8 13.8 54.5 41.3 77 77 A S > - 0 0 0 4,-1.8 3,-0.7 -2,-0.3 33,-0.1 -0.161 33.6-104.9 -80.9-177.5 13.4 58.2 42.1 78 78 A I T 3 S+ 0 0 30 31,-0.2 -1,-0.1 1,-0.2 32,-0.0 0.379 115.6 69.8 -88.1 4.9 10.3 60.3 42.6 79 79 A Y T 3 S- 0 0 96 2,-0.3 -1,-0.2 30,-0.1 2,-0.1 0.256 123.0 -95.9-102.8 9.3 11.0 61.7 39.1 80 80 A G S < S- 0 0 49 -3,-0.7 2,-0.1 1,-0.2 -2,-0.0 -0.289 88.8 -17.7 110.4 -49.8 10.1 58.5 37.3 81 81 A E S S- 0 0 115 -2,-0.1 -4,-1.8 -5,-0.1 2,-0.5 -0.128 110.6 -3.6-149.3-106.7 13.5 56.9 36.9 82 82 A K - 0 0 95 -6,-0.1 27,-0.2 -3,-0.1 2,-0.2 -0.890 57.2-166.2-116.3 126.9 17.1 58.2 37.0 83 83 A F B -I 108 0B 9 25,-2.7 25,-2.0 -2,-0.5 3,-0.1 -0.673 25.3 -85.0-114.9 168.9 18.0 61.8 37.5 84 84 A E - 0 0 79 -2,-0.2 2,-0.9 23,-0.1 -1,-0.1 -0.117 42.5 -96.2 -74.9 159.0 21.2 63.9 37.1 85 85 A D - 0 0 24 1,-0.2 -1,-0.1 41,-0.0 3,-0.1 -0.688 38.7-157.3 -69.3 107.4 24.1 64.6 39.4 86 86 A E - 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0 0 52 0, 0.0 2,-0.5 0, 0.0 -3,-0.1 -0.244 32.2-103.6 -61.9 140.4 42.6 20.4 31.7 416 486 C V - 0 0 55 -179,-0.1 2,-0.4 -5,-0.0 -180,-0.0 -0.520 27.0-145.4 -70.6 117.2 40.6 17.9 33.8 417 487 C H - 0 0 85 -2,-0.5 -180,-0.2 -3,-0.1 11,-0.2 -0.699 20.3-133.7 -77.9 127.0 40.7 18.4 37.5 418 488 C A + 0 0 10 -182,-2.6 -151,-0.2 -2,-0.4 -152,-0.1 -0.317 49.0 98.1 -71.8 163.3 40.6 15.1 39.3 419 489 C G S S- 0 0 17 -153,-2.8 2,-0.1 -144,-0.1 -154,-0.1 -0.425 70.1 -66.0 137.6 152.5 38.4 14.4 42.3 420 490 C P - 0 0 0 0, 0.0 2,-0.5 0, 0.0 -195,-0.1 -0.401 54.2-114.5 -61.8 139.4 35.1 13.0 43.7 421 491 C I - 0 0 71 -2,-0.1 3,-0.1 4,-0.1 6,-0.1 -0.694 28.8-132.4 -81.2 119.8 32.0 14.8 42.5 422 492 C A > - 0 0 7 -2,-0.5 3,-2.2 1,-0.1 -198,-0.0 -0.452 32.5 -92.2 -65.2 146.2 30.2 16.5 45.3 423 493 C P T 3 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.351 117.4 22.9 -57.2 132.4 26.4 16.0 45.7 424 494 C G T 3 S+ 0 0 70 1,-0.3 2,-0.3 -3,-0.1 -2,-0.1 0.426 110.0 97.7 85.6 -5.9 24.6 18.8 43.8 425 495 C Q < - 0 0 43 -3,-2.2 2,-0.3 25,-0.1 -1,-0.3 -0.753 61.7-143.6-108.7 162.8 27.7 19.3 41.7 426 496 C M - 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0 0 80 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.503 27.9-109.5 -82.0 165.0 22.7 13.7 28.1 441 511 C L H > S+ 0 0 31 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.902 119.5 54.5 -63.7 -38.5 20.0 16.3 28.1 442 512 C Q H > S+ 0 0 136 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.930 109.2 48.9 -63.3 -38.6 19.6 16.1 31.9 443 513 C E H > S+ 0 0 53 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.900 108.7 52.2 -62.0 -47.6 23.4 16.8 32.2 444 514 C Q H X S+ 0 0 5 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.930 110.6 48.5 -59.3 -41.5 23.1 19.8 29.8 445 515 C I H X S+ 0 0 23 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.952 107.7 56.9 -61.5 -44.8 20.3 21.2 32.0 446 516 C G H X S+ 0 0 19 -4,-2.6 4,-1.0 1,-0.2 -2,-0.2 0.894 111.2 40.9 -53.7 -47.0 22.4 20.6 35.1 447 517 C W H >< S+ 0 0 1 -4,-2.3 7,-2.6 1,-0.2 3,-0.5 0.955 118.1 46.4 -66.0 -47.9 25.3 22.8 33.7 448 518 C M H 3< S+ 0 0 31 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.766 118.4 41.2 -67.6 -30.3 23.1 25.5 32.3 449 519 C T H 3< S+ 0 0 49 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.542 91.7 111.5 -96.6 -9.1 20.8 25.7 35.4 450 520 C H S << S- 0 0 43 -4,-1.0 -25,-0.1 -3,-0.5 -3,-0.1 -0.105 77.7 -90.3 -62.2 159.1 23.6 25.5 38.0 451 521 C N S S+ 0 0 128 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 -0.975 126.1 19.0-114.2 118.6 24.7 28.4 40.3 452 522 C P S S- 0 0 91 0, 0.0 -1,-0.3 0, 0.0 2,-0.1 0.811 112.2-129.6 -72.9 151.4 26.8 29.7 38.8 453 523 C P - 0 0 71 0, 0.0 -5,-0.2 0, 0.0 -6,-0.1 -0.434 4.5-142.4 -73.8 138.8 25.8 28.2 35.4 454 524 C I - 0 0 52 -7,-2.6 2,-2.7 -8,-0.2 3,-0.2 -0.876 25.4-144.5 -94.2 102.4 28.2 26.6 33.1 455 525 C P > + 0 0 50 0, 0.0 4,-2.5 0, 0.0 3,-0.3 -0.267 38.8 156.6 -83.6 64.9 26.7 27.9 29.8 456 526 C V H > S+ 0 0 0 -2,-2.7 4,-2.3 1,-0.2 5,-0.2 0.795 74.2 54.5 -59.6 -28.0 27.2 24.9 27.5 457 527 C G H > S+ 0 0 3 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.954 111.7 43.0 -69.4 -44.1 24.3 26.1 25.3 458 528 C E H > S+ 0 0 111 -3,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.850 115.4 49.6 -70.2 -37.3 25.8 29.5 24.8 459 529 C I H X S+ 0 0 6 -4,-2.5 4,-1.6 2,-0.2 3,-0.2 0.969 112.8 45.7 -67.2 -51.9 29.4 28.2 24.3 460 530 C Y H X S+ 0 0 10 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.906 108.6 57.1 -57.6 -42.8 28.3 25.6 21.7 461 531 C K H X S+ 0 0 35 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.905 103.8 54.0 -57.4 -38.9 26.2 28.2 19.9 462 532 C R H X S+ 0 0 74 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.889 107.0 50.5 -61.6 -40.3 29.3 30.3 19.5 463 533 C W H X S+ 0 0 12 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.870 112.1 48.3 -64.3 -37.7 31.1 27.4 17.9 464 534 C I H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.897 108.6 53.1 -69.5 -39.5 28.2 27.0 15.5 465 535 C I H X S+ 0 0 20 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.860 108.9 50.3 -65.6 -33.9 28.1 30.7 14.7 466 536 C L H X S+ 0 0 33 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.911 111.3 47.5 -69.9 -43.6 31.8 30.5 13.8 467 537 C G H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.881 109.5 54.3 -62.1 -39.0 31.3 27.5 11.5 468 538 C L H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.942 104.3 54.8 -59.4 -45.6 28.3 29.3 9.9 469 539 C N H < S+ 0 0 10 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.821 110.4 47.7 -55.1 -34.5 30.6 32.3 9.2 470 540 C K H >< S+ 0 0 84 -4,-1.3 3,-1.0 2,-0.1 -2,-0.2 0.926 113.1 44.5 -73.9 -46.8 32.9 29.9 7.4 471 541 C I H >< S+ 0 0 0 -4,-2.4 3,-1.5 1,-0.3 -2,-0.2 0.875 102.6 63.2 -73.2 -31.7 30.3 28.1 5.3 472 542 C V G >< S+ 0 0 3 -4,-2.8 3,-1.2 1,-0.3 -1,-0.3 0.635 87.0 79.5 -64.1 -7.9 28.4 31.3 4.2 473 543 C R G < S+ 0 0 63 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.1 0.136 92.5 48.2 -83.5 15.7 31.8 31.9 2.6 474 544 C M G < 0 0 87 -3,-1.5 -1,-0.2 -112,-0.3 -2,-0.2 0.039 360.0 360.0-135.2 24.4 30.6 29.6 -0.2 475 545 C Y < 0 0 126 -3,-1.2 -2,-0.2 -113,-0.1 -3,-0.1 0.287 360.0 360.0-138.0 360.0 27.2 31.1 -0.8 476 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 477 401 D P 0 0 32 0, 0.0 12,-1.5 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 178.9 50.4 39.3 28.0 478 402 D I E +T 488 0F 27 44,-0.4 10,-0.2 10,-0.2 2,-0.2 -0.928 360.0 164.3-107.6 102.5 50.4 38.7 31.8 479 403 D V E -T 487 0F 39 8,-1.9 8,-3.1 -2,-0.6 2,-0.5 -0.681 46.3 -93.4-115.7 165.7 53.4 36.6 32.5 480 404 D Q E -T 486 0F 145 -2,-0.2 6,-0.2 6,-0.2 5,-0.1 -0.727 47.1-149.9 -72.9 120.1 55.6 35.5 35.4 481 405 D N > - 0 0 56 4,-1.8 3,-2.3 -2,-0.5 -1,-0.0 -0.171 40.3 -75.4 -77.4-172.2 58.5 38.0 35.7 482 406 D L T 3 S+ 0 0 194 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.618 135.3 50.7 -61.0 -11.9 62.0 37.2 36.9 483 407 D Q T 3 S- 0 0 174 2,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.203 115.6-112.0-113.2 8.4 60.5 37.2 40.4 484 408 D G S < S+ 0 0 38 -3,-2.3 2,-0.2 1,-0.2 -2,-0.1 0.238 74.1 123.3 89.2 -14.4 57.7 34.8 39.8 485 409 D Q S S- 0 0 123 1,-0.1 -4,-1.8 -5,-0.1 2,-0.5 -0.521 71.8 -96.8 -87.9 152.4 54.7 37.2 40.2 486 410 D M E +T 480 0F 101 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.502 57.3 165.5 -69.7 115.6 52.0 37.9 37.6 487 411 D V E -T 479 0F 34 -8,-3.1 -8,-1.9 -2,-0.5 2,-1.3 -0.897 44.3 -97.2-130.8 159.8 53.0 41.1 35.6 488 412 D H E -T 478 0F 58 -2,-0.3 2,-0.5 -10,-0.2 -10,-0.2 -0.645 36.2-172.1 -77.7 98.1 52.1 43.0 32.5 489 413 D Q - 0 0 114 -12,-1.5 3,-0.1 -2,-1.3 -9,-0.0 -0.764 23.6-130.1 -80.4 125.2 54.6 42.0 29.9 490 414 D A - 0 0 58 -2,-0.5 2,-0.4 1,-0.1 -1,-0.1 0.078 35.1 -82.3 -56.0-179.2 54.1 44.3 26.9 491 415 D I - 0 0 27 1,-0.0 -1,-0.1 2,-0.0 29,-0.0 -0.783 45.4-105.3 -94.4 142.1 53.8 42.7 23.4 492 416 D S > - 0 0 43 -2,-0.4 4,-2.1 1,-0.1 3,-0.2 -0.492 19.5-139.6 -66.4 128.4 56.9 41.8 21.4 493 417 D P H > S+ 0 0 97 0, 0.0 4,-3.0 0, 0.0 5,-0.1 0.849 104.0 54.7 -57.9 -33.7 57.6 44.3 18.6 494 418 D R H > S+ 0 0 204 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.886 106.8 49.8 -70.5 -34.6 58.5 41.4 16.3 495 419 D T H > S+ 0 0 46 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.881 112.1 48.9 -68.0 -38.0 55.2 39.7 17.0 496 420 D L H X S+ 0 0 28 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.958 111.9 48.3 -62.4 -47.1 53.5 43.0 16.2 497 421 D N H X S+ 0 0 105 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.873 108.7 54.7 -61.7 -37.5 55.6 43.2 13.0 498 422 D A H X S+ 0 0 39 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.921 109.4 47.1 -61.8 -45.0 54.6 39.6 12.2 499 423 D W H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.964 111.4 50.4 -59.3 -52.7 50.9 40.6 12.4 500 424 D V H X S+ 0 0 37 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.919 111.1 50.7 -51.7 -44.0 51.4 43.7 10.3 501 425 D K H X S+ 0 0 111 -4,-2.8 4,-2.7 2,-0.2 5,-0.4 0.924 107.5 52.1 -60.5 -48.8 53.2 41.5 7.7 502 426 D V H X>S+ 0 0 26 -4,-2.4 4,-2.2 1,-0.2 5,-0.8 0.937 115.5 40.7 -55.6 -46.7 50.4 39.0 7.6 503 427 D V H <5S+ 0 0 2 -4,-2.4 4,-0.4 3,-0.2 -1,-0.2 0.801 113.8 54.6 -72.8 -30.7 47.8 41.7 7.0 504 428 D E H <5S+ 0 0 135 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.910 122.7 25.0 -70.0 -41.9 50.1 43.5 4.6 505 429 D E H <5S+ 0 0 158 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.937 135.0 29.4 -88.5 -53.4 50.6 40.5 2.3 506 430 D K T <5S- 0 0 96 -4,-2.2 -3,-0.2 -5,-0.4 -2,-0.1 0.795 90.8-156.5 -77.3 -28.5 47.6 38.3 2.8 507 431 D A < - 0 0 39 -5,-0.8 2,-2.2 -4,-0.4 5,-0.2 -0.197 55.5 -34.2 62.4-170.9 45.0 41.0 3.7 508 432 D F S S+ 0 0 6 -5,-0.1 113,-0.3 109,-0.1 112,-0.2 -0.392 93.1 139.6 -82.0 68.5 41.9 40.1 5.7 509 433 D S S >> S- 0 0 22 -2,-2.2 3,-1.9 111,-0.1 4,-0.5 -0.542 72.9 -87.1-102.0 172.0 41.5 36.6 4.3 510 434 D P T >4 S+ 0 0 64 0, 0.0 3,-0.8 0, 0.0 108,-0.1 0.782 125.4 61.3 -51.1 -26.3 40.4 33.4 6.2 511 435 D E T 3> S+ 0 0 114 1,-0.2 4,-1.3 2,-0.2 -3,-0.1 0.790 89.7 67.5 -73.2 -29.3 44.1 32.8 7.0 512 436 D V H <> S+ 0 0 0 -3,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.722 92.7 63.1 -64.6 -20.4 44.5 36.0 9.0 513 437 D I H S+ 0 0 84 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.886 115.6 53.5 -56.9 -34.1 44.2 31.7 13.0 515 439 D M H X S+ 0 0 77 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.951 107.0 48.7 -63.0 -50.6 47.3 33.9 12.9 516 440 D F H < S+ 0 0 0 -4,-2.1 4,-0.5 2,-0.2 -1,-0.2 0.925 113.2 47.6 -56.9 -48.6 45.7 36.7 15.0 517 441 D S H >< S+ 0 0 47 -4,-2.3 3,-1.2 1,-0.2 4,-0.3 0.942 112.9 49.5 -57.4 -44.7 44.6 34.2 17.6 518 442 D A H 3< S+ 0 0 48 -4,-2.4 3,-0.4 1,-0.3 -1,-0.2 0.829 114.4 44.0 -65.8 -33.3 48.0 32.6 17.6 519 443 D L T 3< S+ 0 0 44 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.370 112.2 53.2 -94.0 2.3 49.8 35.9 18.0 520 444 D S X + 0 0 1 -3,-1.2 3,-2.4 -4,-0.5 -1,-0.2 0.256 68.7 144.0-123.5 13.7 47.5 37.3 20.7 521 445 D E T 3 S+ 0 0 112 -3,-0.4 -3,-0.0 -4,-0.3 -4,-0.0 -0.283 80.2 5.8 -58.5 122.9 47.5 34.6 23.3 522 446 D G T 3 S+ 0 0 38 1,-0.2 -44,-0.4 -45,-0.1 -1,-0.3 0.535 96.0 155.8 81.9 6.2 47.4 36.1 26.8 523 447 D A < - 0 0 1 -3,-2.4 -1,-0.2 -46,-0.2 84,-0.2 -0.335 37.4-135.3 -73.5 141.5 46.9 39.6 25.3 524 448 D T > - 0 0 0 1,-0.1 4,-2.7 79,-0.1 5,-0.2 -0.566 34.1-101.0 -77.8 162.7 45.2 42.4 27.3 525 449 D P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.901 127.9 53.6 -48.4 -41.3 42.6 44.6 25.6 526 450 D Q H > S+ 0 0 87 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.931 108.4 48.0 -61.6 -43.0 45.4 47.2 25.3 527 451 D D H > S+ 0 0 4 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.913 111.3 50.8 -64.1 -40.5 47.6 44.6 23.5 528 452 D L H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.914 110.8 48.7 -64.5 -38.4 44.7 43.7 21.2 529 453 D N H X S+ 0 0 26 -4,-2.6 4,-2.9 -5,-0.2 -1,-0.2 0.852 107.4 55.3 -70.0 -34.0 44.2 47.4 20.3 530 454 D T H X S+ 0 0 55 -4,-2.3 4,-0.9 1,-0.2 -2,-0.2 0.934 107.9 50.0 -62.3 -42.3 47.9 47.8 19.7 531 455 D M H < S+ 0 0 3 -4,-2.2 -2,-0.2 1,-0.2 4,-0.2 0.858 114.6 44.0 -62.0 -39.5 47.7 44.9 17.2 532 456 D L H >< S+ 0 0 7 -4,-1.7 3,-1.5 1,-0.2 -2,-0.2 0.928 112.1 50.0 -73.1 -44.0 44.7 46.5 15.5 533 457 D N H 3< S+ 0 0 135 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.556 100.0 66.3 -75.7 -9.3 46.0 50.1 15.4 534 458 D T T 3< S+ 0 0 51 -4,-0.9 2,-1.3 -5,-0.2 -1,-0.3 0.589 72.7 102.4 -84.3 -10.7 49.3 48.9 13.9 535 459 D V < - 0 0 15 -3,-1.5 2,-1.4 -4,-0.2 3,-0.4 -0.597 62.7-163.8 -73.7 91.5 47.5 47.9 10.7 536 460 D G + 0 0 81 -2,-1.3 -1,-0.1 1,-0.2 -3,-0.1 -0.593 62.6 13.5 -89.2 76.7 48.5 50.9 8.6 537 461 D G S S+ 0 0 61 -2,-1.4 -1,-0.2 2,-0.0 -2,-0.0 0.715 80.9 101.8 129.9 58.6 46.2 51.0 5.6 538 462 D H > + 0 0 64 -3,-0.4 4,-2.2 -31,-0.0 3,-0.3 -0.199 39.3 162.2-148.2 57.7 43.0 49.0 5.5 539 463 D Q H > + 0 0 150 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.778 65.7 45.9 -62.0 -50.6 40.4 51.7 6.3 540 464 D A H > S+ 0 0 52 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.920 116.3 46.8 -60.9 -42.8 37.0 50.3 5.2 541 465 D A H > S+ 0 0 3 -3,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.910 110.2 52.2 -66.4 -41.9 37.7 46.9 6.8 542 466 D M H X S+ 0 0 36 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.856 108.5 51.5 -66.0 -33.1 38.9 48.4 10.1 543 467 D Q H X S+ 0 0 127 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.880 110.3 49.9 -67.4 -37.1 35.8 50.5 10.3 544 468 D M H X S+ 0 0 35 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.908 112.0 46.6 -66.3 -46.0 33.7 47.3 9.7 545 469 D L H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.923 110.9 53.4 -61.6 -43.7 35.6 45.5 12.5 546 470 D K H X S+ 0 0 95 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.924 107.8 49.6 -59.8 -46.3 35.2 48.5 14.8 547 471 D E H X S+ 0 0 110 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.925 109.9 51.5 -58.8 -44.8 31.5 48.6 14.4 548 472 D T H X S+ 0 0 9 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.911 110.9 48.0 -59.3 -42.6 31.2 44.8 15.1 549 473 D I H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.943 111.0 51.1 -62.1 -44.9 33.2 45.3 18.3 550 474 D N H X S+ 0 0 88 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.835 109.2 51.0 -64.4 -33.5 31.0 48.2 19.3 551 475 D E H X S+ 0 0 96 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.945 111.5 46.9 -65.0 -47.5 27.9 46.1 18.7 552 476 D E H X S+ 0 0 56 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.866 111.5 52.1 -63.5 -36.1 29.3 43.3 20.9 553 477 D A H X S+ 0 0 10 -4,-2.7 4,-1.9 2,-0.2 24,-0.4 0.890 110.5 47.8 -65.7 -39.5 30.2 45.9 23.5 554 478 D A H X S+ 0 0 58 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.879 110.3 52.2 -69.7 -37.8 26.7 47.2 23.4 555 479 D E H X S+ 0 0 81 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.883 106.4 54.6 -62.6 -40.7 25.3 43.6 23.7 556 480 D W H X S+ 0 0 43 -4,-2.1 4,-0.6 2,-0.2 -2,-0.2 0.951 108.8 47.0 -56.9 -53.7 27.5 43.0 26.7 557 481 D D H >< S+ 0 0 58 -4,-1.9 3,-1.4 1,-0.2 -2,-0.2 0.940 111.5 51.3 -53.7 -47.3 26.1 46.1 28.6 558 482 D R H 3< S+ 0 0 157 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.827 115.9 41.5 -61.3 -34.2 22.5 45.0 27.7 559 483 D L H 3< S+ 0 0 95 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.406 115.4 55.3 -92.2 -1.1 23.2 41.5 29.1 560 484 D H S << S- 0 0 74 -3,-1.4 -1,-0.2 -4,-0.6 -2,-0.1 -0.534 70.8-166.4-136.7 76.7 25.2 42.8 32.1 561 485 D P - 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0 0 63 1,-0.1 -4,-0.2 -2,-0.1 -1,-0.1 -0.675 26.3 -69.3-139.4-168.5 37.2 47.4 41.2 573 497 D R - 0 0 76 -2,-0.2 -1,-0.1 1,-0.1 -11,-0.0 -0.251 47.3 -98.0 -78.9 169.7 34.2 47.8 38.9 574 498 D E - 0 0 68 -11,-0.1 2,-0.1 -2,-0.0 -1,-0.1 -0.808 55.2-110.1 -77.1 127.4 32.2 45.4 36.9 575 499 D P - 0 0 8 0, 0.0 2,-0.2 0, 0.0 10,-0.0 -0.424 29.3-151.0 -66.1 134.5 33.7 45.9 33.4 576 500 D R >> - 0 0 60 -2,-0.1 4,-2.2 8,-0.1 3,-1.1 -0.558 35.7 -97.1 -87.1 171.0 31.4 47.5 30.8 577 501 D G H 3> S+ 0 0 0 -24,-0.4 4,-2.3 1,-0.3 6,-0.2 0.907 127.5 54.8 -57.5 -39.9 31.8 46.7 27.1 578 502 D S H 34>S+ 0 0 39 1,-0.2 5,-2.0 2,-0.2 6,-1.8 0.734 108.7 50.1 -63.2 -26.6 33.9 49.9 26.6 579 503 D D H X45S+ 0 0 1 -3,-1.1 3,-1.0 4,-0.2 -1,-0.2 0.870 108.6 49.5 -77.3 -45.6 36.2 48.5 29.4 580 504 D I H 3<5S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.3 26,-0.2 0.872 111.5 51.4 -60.2 -34.0 36.5 45.1 27.8 581 505 D A T 3<5S- 0 0 5 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.517 114.5-122.7 -79.0 -8.7 37.4 46.9 24.6 582 506 D G T < 5S+ 0 0 17 -3,-1.0 -3,-0.2 -5,-0.2 3,-0.1 0.566 82.0 112.9 79.8 10.6 40.0 48.9 26.4 583 507 D T S - 0 0 61 -2,-0.4 4,-2.4 1,-0.1 3,-0.4 -0.438 29.2-114.2 -70.0 155.7 43.4 51.3 32.2 587 511 D L H > S+ 0 0 25 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.915 119.9 59.3 -54.7 -39.8 45.9 48.5 31.6 588 512 D Q H > S+ 0 0 143 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.883 107.3 44.7 -55.5 -42.5 46.0 48.3 35.4 589 513 D E H > S+ 0 0 57 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.900 111.6 51.3 -72.7 -40.9 42.3 47.6 35.5 590 514 D Q H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 12,-0.2 0.930 110.7 49.4 -61.3 -44.6 42.4 45.0 32.7 591 515 D I H X S+ 0 0 33 -4,-2.9 4,-3.4 1,-0.2 -2,-0.2 0.933 110.4 52.7 -59.0 -42.0 45.2 43.2 34.5 592 516 D G H < S+ 0 0 13 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.878 110.3 45.2 -60.2 -44.4 43.1 43.4 37.6 593 517 D W H < S+ 0 0 3 -4,-2.5 7,-2.8 1,-0.1 3,-0.3 0.897 117.7 45.4 -66.4 -39.5 40.0 41.8 35.9 594 518 D M H < S+ 0 0 35 -4,-2.5 2,-1.8 1,-0.2 -2,-0.2 0.938 108.3 55.8 -69.8 -48.0 42.2 39.1 34.3 595 519 D T S < S+ 0 0 63 -4,-3.4 2,-0.4 -5,-0.2 -1,-0.2 -0.463 88.7 116.8 -84.7 65.1 44.3 38.3 37.5 596 520 D H S S- 0 0 72 -2,-1.8 -3,-0.0 -3,-0.3 -4,-0.0 -0.991 70.1-108.4-137.0 140.0 41.2 37.5 39.5 597 521 D N S S+ 0 0 110 1,-0.4 -2,-0.0 -2,-0.4 3,-0.0 -0.945 120.6 8.5-107.1 115.9 39.9 34.3 41.2 598 522 D P S S- 0 0 99 0, 0.0 -1,-0.4 0, 0.0 -3,-0.1 0.863 113.7-146.7 -81.4 151.4 37.6 33.7 39.5 599 523 D P - 0 0 63 0, 0.0 -5,-0.2 0, 0.0 -6,-0.1 -0.113 23.6-127.9 -85.9 168.9 38.4 36.3 36.8 600 524 D I - 0 0 48 -7,-2.8 2,-2.8 -10,-0.1 3,-0.2 -0.939 31.3-151.0-103.1 98.4 36.7 38.5 34.3 601 525 D P > + 0 0 55 0, 0.0 4,-2.5 0, 0.0 3,-0.3 -0.325 30.4 163.8 -71.2 64.7 38.8 37.4 31.3 602 526 D V H > S+ 0 0 0 -2,-2.8 4,-2.3 1,-0.2 5,-0.2 0.796 71.5 54.8 -59.4 -27.9 38.5 40.7 29.5 603 527 D G H > S+ 0 0 1 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.953 111.6 42.4 -69.5 -44.3 41.3 39.8 27.1 604 528 D E H > S+ 0 0 77 -3,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.853 115.5 50.1 -72.7 -33.5 39.6 36.5 26.0 605 529 D I H X S+ 0 0 7 -4,-2.5 4,-1.6 2,-0.2 3,-0.2 0.971 112.7 45.4 -67.9 -51.9 36.2 38.2 25.7 606 530 D Y H X S+ 0 0 2 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.907 108.6 57.3 -57.9 -42.7 37.4 41.1 23.6 607 531 D K H X S+ 0 0 18 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.903 103.7 53.8 -57.3 -39.1 39.4 38.7 21.4 608 532 D R H X S+ 0 0 96 -4,-1.6 4,-1.9 -3,-0.2 -1,-0.2 0.892 107.0 50.7 -61.8 -40.3 36.2 36.9 20.6 609 533 D W H X S+ 0 0 12 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.869 112.0 48.1 -63.8 -37.6 34.6 40.2 19.5 610 534 D I H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.898 108.7 53.2 -69.8 -39.1 37.6 40.8 17.3 611 535 D I H X S+ 0 0 24 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.865 108.8 50.3 -66.0 -34.4 37.4 37.3 15.8 612 536 D L H X S+ 0 0 45 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.910 111.4 47.4 -69.0 -44.2 33.8 37.8 14.9 613 537 D G H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.876 110.8 53.0 -61.4 -39.0 34.5 41.1 13.2 614 538 D L H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.946 106.1 52.4 -60.2 -49.1 37.4 39.4 11.4 615 539 D N H X S+ 0 0 11 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.929 109.6 50.9 -54.7 -43.2 35.1 36.6 10.1 616 540 D K H X S+ 0 0 48 -4,-2.0 4,-0.6 2,-0.2 3,-0.3 0.908 116.1 38.3 -58.0 -51.6 32.8 39.3 8.7 617 541 D I H X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.808 110.9 61.5 -76.4 -20.6 35.5 41.3 6.9 618 542 D V H < S+ 0 0 1 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.744 107.9 43.7 -73.7 -26.7 37.2 38.0 5.9 619 543 D R H < S+ 0 0 83 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.550 108.6 58.9 -90.6 -15.1 34.0 37.0 4.0 620 544 D M H < 0 0 117 -4,-0.6 -2,-0.2 -5,-0.2 -3,-0.1 0.759 360.0 360.0 -77.6 -30.2 33.7 40.6 2.5 621 545 D Y < 0 0 166 -4,-1.4 -2,-0.2 -113,-0.3 -3,-0.1 0.311 360.0 360.0-116.4 360.0 37.1 40.2 0.9