==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 10-APR-13 4BI9 . COMPND 2 MOLECULE: 3-KETOACYL-COA THIOLASE, PUTATIVE; . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA BRUCEI BRUCEI; . AUTHOR R.K.HARIJAN,T.-R.KIEMA,M.S.WEISS,P.A.M.MICHELS,R.K.WIERENGA . 1669 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54931.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1125 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 72 4.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 188 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 6 0.4 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 . 93 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 214 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 450 27.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 36 2.2 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 8 6 2 8 0 8 0 0 0 4 8 8 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 8 4 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 . 8 0 6 0 0 4 0 8 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 12 A K 0 0 113 0, 0.0 2,-0.3 0, 0.0 116,-0.1 0.000 360.0 360.0 360.0 123.3 50.4 82.5 62.1 2 13 A R - 0 0 28 2,-0.0 2,-0.5 267,-0.0 250,-0.5 -0.996 360.0-131.6-142.9 147.0 50.1 84.9 65.2 3 14 A V E -A 270 0A 7 267,-1.5 267,-6.5 -2,-0.3 2,-0.5 -0.848 14.0-165.3-113.7 124.1 52.3 87.6 66.6 4 15 A F E -AB 269 250A 4 246,-2.4 246,-2.0 -2,-0.5 2,-0.5 -0.861 16.8-138.7-108.4 126.5 53.4 88.1 70.1 5 16 A V E -AB 268 249A 0 263,-3.7 263,-2.2 -2,-0.5 244,-0.2 -0.703 23.2-179.3 -70.8 130.0 54.9 91.2 71.6 6 17 A V E - 0 0 31 242,-2.1 2,-0.2 -2,-0.5 -1,-0.2 0.882 42.5 -77.2 -93.9 -71.3 57.7 90.2 73.8 7 18 A G E + B 0 248A 2 241,-0.8 241,-1.8 260,-0.1 -1,-0.3 -0.829 45.3 171.7-168.5-157.3 59.3 93.3 75.3 8 19 A G E - B 0 247A 7 239,-0.2 2,-0.3 -2,-0.2 239,-0.2 -0.983 27.2 -97.3 164.5-152.8 61.6 96.2 74.7 9 20 A H E - B 0 246A 54 237,-1.6 237,-1.9 -2,-0.3 2,-0.5 -0.877 10.8-155.0-168.4 131.2 63.0 99.4 76.0 10 21 A I E - B 0 245A 7 -2,-0.3 235,-0.2 235,-0.2 2,-0.1 -0.940 20.7-144.4-107.5 129.5 62.3 103.1 75.6 11 22 A T - 0 0 1 233,-2.2 2,-0.1 -2,-0.5 -2,-0.0 -0.386 37.1 -82.4 -81.0 171.7 65.2 105.4 76.3 12 23 A T - 0 0 38 -2,-0.1 2,-0.6 1,-0.1 232,-0.2 -0.440 42.9-126.1 -69.4 146.8 64.5 108.7 77.9 13 24 A F + 0 0 0 186,-2.1 2,-0.2 352,-0.2 230,-0.2 -0.894 37.7 174.9 -99.7 122.5 63.5 111.4 75.5 14 25 A V B +T 242 0B 11 228,-1.6 228,-2.6 -2,-0.6 187,-0.1 -0.690 13.8 130.3-120.4 172.3 65.7 114.4 75.7 15 26 A G - 0 0 0 -2,-0.2 225,-0.1 226,-0.2 6,-0.1 -0.085 67.2 -34.5 141.8 117.7 66.2 117.7 73.9 16 27 A K S S+ 0 0 156 1,-0.3 224,-0.2 -2,-0.1 6,-0.0 0.649 128.1 38.5 24.0 97.0 66.5 121.4 74.7 17 28 A G S S+ 0 0 42 1,-0.5 -1,-0.3 4,-0.1 187,-0.1 0.239 94.0 104.4 112.7 -6.2 64.2 122.1 77.7 18 29 A S S > S- 0 0 13 1,-0.1 3,-3.2 184,-0.1 -1,-0.5 -0.946 74.3-136.5-106.4 129.1 65.2 118.8 79.3 19 30 A P T 3 S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.654 106.0 64.2 -58.4 -18.6 67.7 119.1 82.1 20 31 A L T 3 S+ 0 0 109 2,-0.1 2,-0.4 -5,-0.1 -6,-0.1 0.584 80.6 101.2 -81.2 -9.8 69.4 116.2 80.6 21 32 A F S < S- 0 0 30 -3,-3.2 2,-0.5 -6,-0.1 -4,-0.1 -0.629 71.8-133.4 -82.3 133.2 70.2 118.3 77.5 22 33 A I + 0 0 42 -2,-0.4 2,-0.4 -6,-0.0 7,-0.1 -0.751 23.7 179.7 -95.7 119.3 73.8 119.6 77.4 23 34 A D 0 0 109 -2,-0.5 -2,-0.0 1,-0.2 0, 0.0 -0.986 360.0 360.0-119.2 125.2 74.5 123.3 76.5 24 35 A K 0 0 142 -2,-0.4 -1,-0.2 2,-0.0 0, 0.0 0.853 360.0 360.0 -42.4 360.0 78.1 124.4 76.5 25 ! 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 26 42 A K 0 0 122 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 17.8 80.0 119.9 80.5 27 43 A K - 0 0 158 -5,-0.0 2,-0.4 0, 0.0 0, 0.0 -0.762 360.0 -88.5 152.7 154.7 79.8 116.5 78.8 28 44 A E - 0 0 158 -2,-0.2 3,-0.1 1,-0.1 0, 0.0 -0.782 41.9-109.7-100.3 139.9 79.0 115.5 75.2 29 45 A N - 0 0 40 -2,-0.4 2,-0.1 -7,-0.1 -1,-0.1 0.002 42.1 -85.3 -60.5 166.1 75.4 114.7 74.1 30 46 A K - 0 0 74 4,-0.1 2,-0.3 1,-0.1 -1,-0.1 -0.454 43.3-134.5 -72.4 143.9 74.2 111.3 73.1 31 47 A T > - 0 0 48 -2,-0.1 4,-5.4 1,-0.1 5,-0.3 -0.713 19.1-118.1 -99.3 153.1 74.8 110.1 69.6 32 48 A L H > S+ 0 0 7 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.855 122.1 49.7 -48.1 -39.7 72.3 108.5 67.3 33 49 A E H > S+ 0 0 48 2,-0.2 4,-2.8 3,-0.2 -1,-0.2 0.924 114.8 42.3 -68.1 -46.1 74.8 105.6 67.4 34 50 A E H > S+ 0 0 98 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.975 115.2 50.4 -60.4 -54.4 74.8 105.7 71.1 35 51 A L H X S+ 0 0 2 -4,-5.4 4,-1.8 1,-0.3 -2,-0.2 0.810 112.9 47.4 -55.9 -32.8 71.1 106.2 71.3 36 52 A L H X S+ 0 0 3 -4,-1.9 4,-1.9 -5,-0.3 -1,-0.3 0.930 110.5 49.8 -74.6 -47.9 70.7 103.2 69.0 37 53 A A H X S+ 0 0 18 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.903 111.4 51.6 -57.9 -41.7 73.0 101.0 70.9 38 54 A E H X S+ 0 0 63 -4,-3.0 4,-3.6 1,-0.2 5,-0.3 0.966 108.7 47.4 -59.2 -56.8 71.2 101.8 74.0 39 55 A S H X S+ 0 0 0 -4,-1.8 4,-1.1 1,-0.2 207,-0.3 0.826 116.3 47.4 -57.8 -32.4 67.7 101.1 72.8 40 56 A I H >X S+ 0 0 0 -4,-1.9 4,-1.1 2,-0.2 3,-0.9 0.993 115.0 41.2 -72.1 -63.2 68.9 97.9 71.4 41 57 A N H >X S+ 0 0 49 -4,-2.9 4,-1.2 1,-0.3 3,-1.1 0.894 112.6 56.5 -53.3 -45.9 70.9 96.6 74.4 42 58 A G H 3X S+ 0 0 12 -4,-3.6 4,-1.2 -5,-0.3 -1,-0.3 0.851 104.1 53.9 -52.9 -36.3 68.1 97.8 76.7 43 59 A A H << S+ 0 0 0 -4,-1.1 4,-0.3 -3,-0.9 -1,-0.3 0.777 100.5 63.8 -72.3 -24.5 65.6 95.7 74.8 44 60 A L H X<>S+ 0 0 12 -4,-1.1 5,-1.8 -3,-1.1 3,-0.9 0.924 100.8 46.0 -69.2 -46.6 67.8 92.7 75.3 45 61 A Q H ><5S+ 0 0 120 -4,-1.2 3,-3.3 2,-0.3 -1,-0.2 0.953 107.1 56.3 -63.6 -47.3 67.6 92.4 79.1 46 62 A N T 3<5S+ 0 0 98 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.609 118.5 37.6 -61.7 -8.2 63.8 92.9 79.3 47 63 A T T < 5S- 0 0 27 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.3 0.273 115.0-123.1-121.0 0.2 63.8 90.0 77.0 48 64 A G T < 5 + 0 0 23 -3,-3.3 -3,-0.3 1,-0.1 -2,-0.1 0.954 47.2 163.6 53.6 59.1 66.8 88.3 78.7 49 65 A L < - 0 0 11 -5,-1.8 5,-0.3 -8,-0.2 -4,-0.2 -0.050 37.1-144.0-103.4 45.5 69.0 88.0 75.7 50 66 A H > - 0 0 124 3,-0.3 3,-5.5 -6,-0.2 2,-3.0 0.397 32.1 -75.3 -21.3 95.2 71.9 87.3 77.9 51 67 A D T 3 S+ 0 0 139 1,-0.3 -1,-0.2 2,-0.2 -2,-0.0 -0.100 132.0 10.3 60.6 -66.6 75.3 88.6 77.1 52 68 A G T 3 S+ 0 0 55 -2,-3.0 -1,-0.3 36,-0.1 -2,-0.2 0.504 111.5 82.7-115.7 -13.7 76.0 86.1 74.3 53 69 A R X + 0 0 106 -3,-5.5 2,-1.7 1,-0.2 3,-0.6 0.580 68.0 103.9 -63.6 -7.1 72.5 84.7 74.2 54 70 A A T 3 + 0 0 6 -5,-0.3 35,-0.3 1,-0.2 -1,-0.2 -0.563 56.3 73.3 -77.9 79.3 72.0 87.8 72.0 55 71 A A T 3 + 0 0 43 -2,-1.7 -1,-0.2 35,-0.1 -2,-0.1 0.145 57.0 104.7-174.1 16.0 71.9 86.1 68.6 56 72 A L < + 0 0 47 -3,-0.6 2,-0.3 -7,-0.1 -2,-0.1 0.113 59.6 104.5 -96.0 20.7 68.5 84.4 68.7 57 73 A V - 0 0 3 1,-0.1 67,-0.2 64,-0.1 3,-0.1 -0.774 50.4-168.3-105.2 148.1 67.2 87.0 66.3 58 74 A D + 0 0 37 65,-3.6 2,-0.3 -2,-0.3 66,-0.2 0.511 69.9 25.8-109.0 -8.8 66.5 86.5 62.6 59 75 A K E -c 124 0A 5 64,-0.7 66,-2.4 34,-0.1 2,-0.4 -0.975 52.9-156.0-162.2 139.7 65.9 90.1 61.5 60 76 A L E -cd 125 95A 2 34,-3.1 36,-1.0 -2,-0.3 2,-0.5 -0.980 12.2-175.8-121.9 127.9 66.7 93.7 62.3 61 77 A V E -cd 126 96A 0 64,-2.3 66,-2.6 -2,-0.4 2,-0.4 -0.971 7.3-162.0-124.8 116.4 64.5 96.6 61.2 62 78 A V E -cd 127 97A 0 34,-3.0 36,-2.4 -2,-0.5 2,-0.6 -0.809 2.7-159.2 -97.8 136.3 65.5 100.2 61.9 63 79 A G E +cd 128 98A 0 64,-2.9 66,-2.0 -2,-0.4 2,-0.3 -0.957 30.7 144.3-113.0 113.8 62.9 103.0 61.7 64 80 A N - 0 0 0 34,-1.6 36,-0.2 -2,-0.6 66,-0.1 -0.954 28.2-170.2-139.7 157.3 64.5 106.4 61.2 65 81 A F S S+ 0 0 0 64,-0.3 3,-0.3 -2,-0.3 -1,-0.1 0.715 79.7 13.3-109.7 -67.2 63.5 109.5 59.4 66 82 A L S >> S+ 0 0 0 1,-0.2 4,-2.3 2,-0.1 3,-2.1 0.021 75.6 123.8-111.4 27.2 66.2 112.2 59.1 67 83 A G H 3> S+ 0 0 0 1,-0.3 6,-2.3 2,-0.2 4,-1.3 0.936 76.3 58.3 -47.9 -51.6 69.4 110.4 60.1 68 84 A E H 34 S+ 0 0 0 4,-0.3 -1,-0.3 -3,-0.3 6,-0.2 0.689 117.2 33.6 -50.8 -21.7 70.9 111.4 56.8 69 85 A L H <4 S+ 0 0 18 -3,-2.1 -2,-0.2 4,-0.2 -1,-0.2 0.884 122.2 34.7-105.4 -57.7 70.3 115.0 57.6 70 86 A F H < S+ 0 0 15 -4,-2.3 -3,-0.2 1,-0.2 -2,-0.1 0.918 139.2 19.7 -67.5 -44.4 70.6 115.8 61.4 71 87 A S S < S- 0 0 11 -4,-1.3 -1,-0.2 -5,-0.5 -3,-0.2 0.252 104.8-120.1-113.8 7.9 73.3 113.3 62.0 72 88 A S S S+ 0 0 32 -5,-0.3 2,-0.4 -6,-0.3 -4,-0.3 0.886 70.8 129.3 53.6 47.3 74.5 113.0 58.4 73 89 A Q + 0 0 8 -6,-2.3 -4,-0.2 -7,-0.2 2,-0.2 -0.954 27.0 153.9-146.1 123.3 73.8 109.4 58.4 74 90 A G + 0 0 0 491,-0.5 410,-0.0 -2,-0.4 409,-0.0 -0.560 55.2 66.6-117.1-168.9 71.9 106.7 56.4 75 91 A H + 0 0 0 -2,-0.2 4,-0.5 1,-0.1 -1,-0.1 0.878 52.2 157.8 66.5 42.2 72.5 103.0 56.1 76 92 A L > + 0 0 7 1,-0.2 4,-0.8 2,-0.2 20,-0.1 0.529 48.4 90.4 -80.7 -3.5 71.6 102.3 59.8 77 93 A G H >> S+ 0 0 2 1,-0.2 3,-0.7 2,-0.2 4,-0.6 0.940 96.3 32.5 -54.3 -54.8 70.7 98.7 59.0 78 94 A P H 3> S+ 0 0 0 0, 0.0 621,-2.5 0, 0.0 4,-1.3 0.630 107.1 73.3 -75.6 -17.3 74.3 97.4 59.7 79 95 A A H 34 S+ 0 0 3 -4,-0.5 -2,-0.2 1,-0.2 -3,-0.1 0.699 93.5 56.1 -68.7 -21.4 74.7 100.1 62.3 80 96 A A H X< S+ 0 0 2 -4,-0.8 3,-1.9 -3,-0.7 -1,-0.2 0.930 98.4 61.2 -69.8 -46.5 72.3 97.9 64.3 81 97 A V H 3< S+ 0 0 0 -4,-0.6 3,-0.4 616,-0.4 9,-0.4 0.831 108.5 40.3 -56.9 -39.3 74.6 95.0 64.0 82 98 A G T 3< S+ 0 0 0 -4,-1.3 -1,-0.3 615,-0.2 3,-0.1 -0.213 78.9 102.8-106.4 45.5 77.5 96.5 65.8 83 99 A S < + 0 0 4 -3,-1.9 -42,-0.2 1,-0.2 -1,-0.2 0.368 68.8 75.9 -94.7 4.7 75.6 98.3 68.5 84 100 A L 0 0 23 -3,-0.4 -1,-0.2 -4,-0.2 4,-0.1 0.587 360.0 360.0 -87.4 -16.4 76.8 95.5 70.7 85 101 A S 0 0 109 -3,-0.1 -48,-0.0 2,-0.1 616,-0.0 -0.623 360.0 360.0-130.3 360.0 80.2 97.2 70.6 86 ! 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 87 105 A S 0 0 107 0, 0.0 2,-1.1 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 -11.9 79.4 89.7 72.8 88 106 A S + 0 0 33 -4,-0.1 3,-0.1 1,-0.1 -33,-0.1 -0.483 360.0 133.1 -74.9 98.5 79.0 91.4 69.4 89 107 A A + 0 0 52 -2,-1.1 -1,-0.1 -35,-0.3 -7,-0.1 -0.470 20.3 111.6-151.4 70.9 77.3 88.9 67.1 90 108 A F > + 0 0 2 -9,-0.4 3,-0.9 -34,-0.1 606,-0.2 0.198 52.1 148.5-108.3 6.6 74.4 90.1 65.0 91 109 A L T 3 + 0 0 70 1,-0.2 606,-0.3 -10,-0.2 -2,-0.0 -0.092 57.4 6.9 -64.1 137.1 76.5 89.7 62.0 92 110 A N T 3 S+ 0 0 54 604,-0.3 605,-0.3 1,-0.3 -1,-0.2 0.736 90.9 134.4 70.4 31.7 75.2 88.8 58.5 93 111 A K < - 0 0 37 603,-2.1 -1,-0.3 -3,-0.9 602,-0.2 -0.756 69.4 -82.0-105.0 152.1 71.5 89.0 59.5 94 112 A P + 0 0 24 0, 0.0 -34,-3.1 0, 0.0 2,-0.3 -0.353 61.5 166.5 -53.2 122.5 68.7 90.7 57.5 95 113 A A E +d 60 0A 0 -36,-0.2 2,-0.3 -2,-0.1 -34,-0.2 -0.995 7.2 158.0-145.3 149.6 68.8 94.4 58.3 96 114 A V E -d 61 0A 14 -36,-1.0 -34,-3.0 -2,-0.3 2,-0.4 -0.965 33.8-128.2-167.1 140.4 67.3 97.5 56.8 97 115 A R E -dE 62 518A 1 421,-2.0 421,-2.6 -2,-0.3 2,-0.3 -0.832 29.4-168.0 -90.3 137.9 66.3 101.1 57.5 98 116 A V E -dE 63 517A 4 -36,-2.4 -34,-1.6 -2,-0.4 2,-0.3 -0.882 1.1-164.3-122.5 162.0 62.7 102.0 56.6 99 117 A E E + E 0 516A 0 417,-2.7 417,-2.1 -2,-0.3 396,-0.1 -0.991 29.7 151.8-154.0 133.4 61.2 105.4 56.4 100 118 A G > - 0 0 3 1,-0.6 3,-2.5 -2,-0.3 311,-0.1 -0.294 61.5-107.2-155.7 55.9 57.7 107.0 56.3 101 119 A A G > S- 0 0 0 1,-0.3 3,-1.4 2,-0.2 -1,-0.6 -0.280 97.5 -3.7 49.0-125.8 58.2 110.4 57.8 102 120 A C G 3 S+ 0 0 2 1,-0.3 3,-0.3 2,-0.1 303,-0.3 0.529 136.3 57.1 -72.4 -9.3 56.6 110.4 61.3 103 121 A A G X> + 0 0 0 -3,-2.5 4,-1.9 1,-0.2 3,-0.7 0.328 67.2 113.0-104.9 7.8 55.2 106.8 60.9 104 122 A S H <> S+ 0 0 0 -3,-1.4 4,-2.1 1,-0.3 -1,-0.2 0.783 75.0 58.6 -50.6 -31.8 58.6 105.3 60.2 105 123 A G H 3> S+ 0 0 0 264,-0.5 4,-1.1 -3,-0.3 -1,-0.3 0.933 104.3 46.8 -64.5 -50.1 58.3 103.5 63.6 106 124 A G H <> S+ 0 0 0 -3,-0.7 4,-1.7 1,-0.2 3,-0.3 0.872 111.9 53.7 -60.6 -34.9 55.1 101.7 62.7 107 125 A L H X S+ 0 0 3 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.912 98.8 59.6 -67.4 -43.9 56.6 100.7 59.4 108 126 A A H X S+ 0 0 0 -4,-2.1 4,-1.3 1,-0.3 -1,-0.2 0.835 107.6 50.7 -52.0 -31.2 59.6 99.2 61.0 109 127 A V H X S+ 0 0 8 -4,-1.1 4,-3.0 -3,-0.3 -1,-0.3 0.925 102.0 57.7 -73.6 -45.4 57.1 97.0 62.7 110 128 A Q H X S+ 0 0 12 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.774 105.3 52.7 -59.7 -26.9 55.3 96.0 59.5 111 129 A S H X S+ 0 0 21 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.958 111.4 42.3 -72.9 -53.5 58.5 94.6 58.1 112 130 A A H X S+ 0 0 0 -4,-1.3 4,-2.4 1,-0.2 5,-0.3 0.906 113.9 57.0 -58.4 -43.0 59.3 92.4 61.0 113 131 A W H X S+ 0 0 35 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.963 108.9 42.4 -47.7 -62.6 55.7 91.5 61.0 114 132 A E H X S+ 0 0 4 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.784 112.5 56.5 -61.9 -29.1 55.7 90.3 57.4 115 133 A A H X>S+ 0 0 0 -4,-2.0 4,-4.0 2,-0.2 5,-1.5 0.956 108.6 42.0 -69.7 -53.2 59.0 88.5 57.8 116 134 A L H <5S+ 0 0 8 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.886 112.9 56.4 -59.7 -39.3 58.0 86.2 60.7 117 135 A L H <5S+ 0 0 54 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.776 111.7 43.0 -64.7 -29.3 54.7 85.7 58.9 118 136 A A H <5S- 0 0 44 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.947 115.5-120.0 -72.9 -59.4 56.8 84.5 56.1 119 137 A G T <5S+ 0 0 31 -4,-4.0 -3,-0.2 2,-0.1 -4,-0.1 0.297 83.1 117.9 128.7 -1.0 59.1 82.5 58.3 120 138 A T S - 0 0 57 -2,-0.3 4,-3.8 1,-0.1 -1,-0.1 -0.084 42.2-114.1 -54.0 164.1 68.9 125.1 64.7 137 155 A A H > S+ 0 0 68 2,-0.2 4,-2.1 3,-0.2 5,-0.1 0.809 120.5 54.3 -74.6 -32.5 65.1 124.9 64.7 138 156 A R H > S+ 0 0 179 2,-0.2 4,-1.3 3,-0.2 -1,-0.2 0.978 115.7 39.5 -58.7 -55.6 65.0 126.9 61.5 139 157 A V H >> S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 3,-1.0 0.955 117.4 48.6 -57.7 -53.9 67.4 124.3 60.1 140 158 A G H 3X S+ 0 0 11 -4,-3.8 4,-1.4 1,-0.3 -1,-0.2 0.784 106.7 56.9 -60.7 -27.8 65.6 121.4 61.7 141 159 A G H 3X S+ 0 0 10 -4,-2.1 4,-0.8 2,-0.2 20,-0.4 0.770 106.8 50.3 -75.5 -26.0 62.3 122.7 60.5 142 160 A D H XX S+ 0 0 28 -4,-1.3 3,-1.2 -3,-1.0 4,-0.5 0.943 108.1 50.9 -70.8 -52.0 63.6 122.6 57.0 143 161 A Y H >< S+ 0 0 44 -4,-2.1 3,-1.1 1,-0.3 -2,-0.2 0.833 106.9 57.1 -55.1 -32.7 64.8 119.0 57.4 144 162 A L H >< S+ 0 0 39 -4,-1.4 3,-2.0 1,-0.2 -1,-0.3 0.842 88.9 73.3 -70.0 -29.7 61.4 118.3 58.7 145 163 A A H X< S+ 0 0 0 -3,-1.2 3,-2.6 -4,-0.8 -1,-0.2 0.701 74.2 83.2 -61.6 -17.4 59.9 119.6 55.4 146 164 A R T << S+ 0 0 12 -3,-1.1 346,-0.5 -4,-0.5 -1,-0.3 0.549 84.3 61.0 -57.1 -9.2 61.1 116.4 53.8 147 165 A A T < S+ 0 0 1 -3,-2.0 -1,-0.3 344,-0.1 261,-0.3 0.544 102.9 62.0 -95.1 -12.5 57.9 114.9 55.1 148 166 A A S < S- 0 0 7 -3,-2.6 2,-1.4 -4,-0.2 344,-0.2 -0.336 111.3 -84.4 -96.3-177.7 55.9 117.4 53.1 149 167 A H > - 0 0 25 1,-0.2 3,-1.4 -2,-0.1 4,-0.3 -0.698 58.4-165.6 -87.2 83.9 55.7 117.8 49.4 150 168 A Y G >> S+ 0 0 31 -2,-1.4 4,-3.0 1,-0.3 3,-2.6 0.808 70.1 50.1 -46.7 -64.0 58.8 120.0 49.5 151 169 A K G 34 S+ 0 0 96 1,-0.3 -1,-0.3 2,-0.2 -2,-0.0 0.701 123.2 33.1 -59.3 -19.4 59.2 121.9 46.3 152 170 A R G <4 S+ 0 0 71 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.232 128.0 35.0-119.8 12.9 55.6 123.1 46.4 153 171 A Q T X4 S+ 0 0 8 -3,-2.6 3,-2.1 -4,-0.3 4,-0.3 0.569 91.3 77.5-139.5 -25.3 55.1 123.4 50.2 154 172 A R T 3< S+ 0 0 54 -4,-3.0 3,-0.3 1,-0.3 -3,-0.1 0.792 80.5 85.0 -57.8 -24.2 58.3 124.6 51.8 155 173 A Q T 3 S+ 0 0 147 -5,-0.5 -1,-0.3 1,-0.2 3,-0.1 0.727 76.2 68.3 -46.5 -29.0 57.1 127.9 50.3 156 174 A L S < S- 0 0 37 -3,-2.1 2,-0.3 1,-0.2 -1,-0.2 0.990 115.0 -48.6 -59.6 -66.6 55.0 128.3 53.5 157 175 A D - 0 0 22 -4,-0.3 3,-0.4 -3,-0.3 -1,-0.2 -0.958 48.4 -94.7-160.0 173.1 57.7 128.9 56.0 158 176 A D S S+ 0 0 73 1,-0.3 2,-0.7 -2,-0.3 3,-0.2 0.724 127.9 56.9 -68.5 -20.4 61.0 127.7 57.4 159 177 A F S > S+ 0 0 47 1,-0.2 4,-1.0 -5,-0.1 -1,-0.3 -0.599 76.1 159.7-104.6 68.5 58.6 126.0 59.8 160 178 A T H >> + 0 0 0 -2,-0.7 4,-0.7 -3,-0.4 3,-0.7 0.901 60.9 54.6 -62.4 -51.9 56.8 124.2 57.1 161 179 A F H >> S+ 0 0 12 -20,-0.4 3,-0.7 1,-0.2 4,-0.6 0.840 104.1 55.3 -58.9 -38.7 55.1 121.3 58.9 162 180 A P H >> S+ 0 0 17 0, 0.0 4,-2.0 0, 0.0 3,-1.0 0.893 99.7 63.2 -55.0 -40.6 53.4 123.6 61.5 163 181 A C H X S+ 0 0 43 -4,-2.0 4,-1.1 1,-0.2 3,-0.9 0.970 109.2 57.4 -61.7 -57.9 39.4 125.7 58.8 172 190 A I H 3<>S+ 0 0 0 -4,-1.8 5,-1.9 1,-0.3 6,-0.7 0.691 103.2 52.8 -61.2 -23.7 38.0 123.1 61.1 173 191 A Q H ><5S+ 0 0 49 -4,-1.7 3,-1.9 -3,-0.2 -1,-0.3 0.920 108.4 50.2 -73.2 -41.2 36.9 125.5 63.9 174 192 A E H <<5S+ 0 0 134 -4,-0.9 -2,-0.2 -3,-0.9 -1,-0.2 0.627 101.5 63.0 -76.0 -13.2 34.9 127.6 61.4 175 193 A A T 3<5S- 0 0 69 -4,-1.1 -1,-0.3 3,-0.1 -2,-0.2 0.471 115.5-121.5 -81.8 -4.4 33.3 124.4 60.2 176 194 A G T < 5S+ 0 0 67 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.2 0.924 76.8 129.3 62.2 43.6 31.9 124.2 63.8 177 195 A H S > - 0 0 40 -2,-0.3 3,-1.2 1,-0.2 4,-0.7 -0.534 17.8-139.4 -77.1 138.9 36.8 124.5 69.5 180 198 A M T 34 S+ 0 0 28 1,-0.3 3,-0.3 -2,-0.2 -1,-0.2 0.722 111.3 66.9 -61.1 -20.5 40.4 125.6 69.2 181 199 A E T >> S+ 0 0 115 1,-0.2 3,-1.6 2,-0.2 4,-1.1 0.799 88.4 61.5 -68.0 -31.1 39.7 125.7 72.9 182 200 A D H <> S+ 0 0 3 -3,-1.2 4,-2.0 1,-0.3 -1,-0.2 0.826 93.2 65.9 -62.5 -28.6 39.4 121.9 72.8 183 201 A A H 3X S+ 0 0 0 -4,-0.7 4,-0.6 -3,-0.3 -1,-0.3 0.534 98.6 52.5 -72.6 -7.1 43.0 122.1 71.6 184 202 A A H <> S+ 0 0 1 -3,-1.6 4,-2.6 2,-0.1 -1,-0.3 0.770 104.5 54.8 -91.8 -35.7 43.9 123.4 75.0 185 203 A Y H X S+ 0 0 96 -4,-1.1 4,-2.0 2,-0.2 -2,-0.2 0.920 109.5 46.1 -61.9 -49.0 42.1 120.5 76.8 186 204 A V H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 5,-0.3 0.951 112.5 53.9 -54.3 -49.6 44.1 117.9 74.9 187 205 A A H X S+ 0 0 1 -4,-0.6 4,-1.6 1,-0.2 -2,-0.2 0.920 107.7 46.3 -53.5 -57.5 47.3 119.9 75.6 188 206 A A H X S+ 0 0 28 -4,-2.6 4,-2.5 1,-0.2 5,-0.4 0.930 110.9 55.4 -52.6 -50.5 46.8 120.1 79.4 189 207 A K H X S+ 0 0 29 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.928 109.6 41.1 -49.7 -61.8 46.0 116.4 79.6 190 208 A A H X S+ 0 0 0 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.769 114.6 54.5 -65.2 -24.2 49.1 115.0 78.0 191 209 A Y H X S+ 0 0 37 -4,-1.6 4,-1.1 -3,-0.3 -1,-0.2 0.951 110.7 41.6 -74.5 -50.8 51.4 117.4 79.7 192 210 A A H < S+ 0 0 21 -4,-2.5 4,-0.2 1,-0.2 -2,-0.2 0.809 113.0 58.1 -63.2 -31.3 50.3 116.6 83.2 193 211 A S H >< S+ 0 0 14 -4,-2.2 3,-1.6 -5,-0.4 -1,-0.2 0.892 103.4 51.7 -59.5 -41.2 50.4 113.1 82.0 194 212 A G H >< S+ 0 0 0 -4,-1.5 3,-1.4 1,-0.3 6,-0.3 0.753 96.9 68.6 -70.4 -23.0 54.0 113.7 81.1 195 213 A N T 3< S+ 0 0 40 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.580 97.9 51.4 -72.6 -9.5 54.5 114.9 84.6 196 214 A R T < S+ 0 0 110 -3,-1.6 -1,-0.3 -4,-0.2 194,-0.2 0.348 102.4 71.7-102.4 0.8 54.0 111.3 85.9 197 215 A N X - 0 0 2 -3,-1.4 3,-0.7 162,-0.1 -1,-0.1 -0.956 58.6-168.3-126.2 112.0 56.6 110.0 83.5 198 216 A P T 3 S+ 0 0 92 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 0.628 89.4 64.4 -73.0 -15.6 60.2 110.7 84.1 199 217 A L T 3 S+ 0 0 31 -187,-0.1 -186,-2.1 4,-0.1 -5,-0.1 0.828 81.3 110.6 -73.9 -29.9 61.1 109.5 80.6 200 218 A A S X S- 0 0 5 -3,-0.7 3,-0.8 -6,-0.3 165,-0.3 -0.032 70.3-139.4 -50.7 142.8 59.1 112.3 79.2 201 219 A H T 3 S+ 0 0 5 164,-1.5 3,-0.2 163,-0.6 164,-0.2 0.860 109.3 33.7 -64.0 -38.6 60.9 115.2 77.4 202 220 A M T > S+ 0 0 9 162,-2.7 3,-0.7 1,-0.2 -1,-0.2 -0.219 81.5 117.8-117.1 36.5 58.5 117.6 79.2 203 221 A H T < S+ 0 0 63 -3,-0.8 2,-0.6 1,-0.2 -1,-0.2 0.860 71.5 59.0 -68.3 -40.8 58.1 115.7 82.4 204 222 A A T 3 S+ 0 0 75 -3,-0.2 2,-0.3 -4,-0.2 -1,-0.2 -0.150 103.9 64.4 -84.3 38.2 59.6 118.5 84.4 205 223 A R < + 0 0 136 -3,-0.7 2,-0.3 -2,-0.6 -11,-0.1 -0.997 43.5 146.9-160.5 151.1 57.0 121.0 83.3 206 224 A K - 0 0 134 -2,-0.3 2,-0.3 -12,-0.1 -18,-0.0 -0.919 13.7-173.2-170.4 163.3 53.4 122.1 83.3 207 225 A V - 0 0 69 -2,-0.3 -15,-0.1 -19,-0.1 5,-0.1 -0.950 39.9 -59.4-153.3 178.6 51.3 125.2 83.2 208 226 A T > - 0 0 80 -2,-0.3 4,-1.5 1,-0.1 5,-0.2 -0.163 38.7-123.5 -60.5 149.7 47.8 126.4 83.5 209 227 A L H > S+ 0 0 68 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.880 118.6 57.5 -54.9 -41.1 45.1 125.3 81.1 210 228 A D H > S+ 0 0 121 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.872 103.5 51.4 -57.8 -37.3 44.7 129.0 80.5 211 229 A F H 4 S+ 0 0 50 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.829 114.8 42.9 -68.9 -30.0 48.3 129.1 79.5 212 230 A C H < S+ 0 0 6 -4,-1.5 -2,-0.2 1,-0.1 -1,-0.2 0.666 109.8 60.4 -83.8 -20.9 47.6 126.2 77.1 213 231 A T H < S- 0 0 33 -4,-1.9 2,-0.2 1,-0.2 -2,-0.2 0.986 115.5 -94.5 -71.4 -61.8 44.4 127.9 76.0 214 232 A Q S < S+ 0 0 107 -4,-2.1 -1,-0.2 1,-0.1 3,-0.1 -0.806 84.8 108.7-177.7-134.4 45.9 131.1 74.6 215 233 A A + 0 0 103 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.804 65.7 140.1 43.3 45.8 46.6 134.6 76.0 216 234 A S + 0 0 36 3,-0.3 5,-0.2 1,-0.1 -1,-0.2 -0.872 44.8 171.1-132.5 155.0 50.3 133.9 76.0 217 235 A D S S+ 0 0 140 -2,-0.3 -1,-0.1 3,-0.1 -2,-0.1 0.548 96.5 51.0-126.5 -38.1 53.8 135.3 75.3 218 236 A K S S+ 0 0 187 1,-0.3 -2,-0.1 2,-0.0 -7,-0.0 0.712 119.3 43.9 -71.2 -21.4 55.9 132.6 76.7 219 237 A N S S+ 0 0 13 -5,-0.1 -3,-0.3 15,-0.0 -1,-0.3 -0.756 97.6 171.5-121.9 81.7 53.6 130.5 74.5 220 238 A P - 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0 0 38 -235,-2.3 -1,-0.3 -3,-0.9 -236,-0.2 -0.741 69.4 -81.5-105.1 152.1 47.3 102.4 49.8 513 112 B P + 0 0 24 0, 0.0 -35,-3.4 0, 0.0 2,-0.3 -0.352 62.1 165.2 -53.3 121.7 50.2 101.0 51.7 514 113 B A E + n 0 478A 0 -37,-0.2 2,-0.3 -2,-0.1 -35,-0.2 -0.995 6.6 157.2-144.9 148.4 53.3 103.0 50.8 515 114 B V E - n 0 479A 12 -37,-1.0 -35,-2.8 -2,-0.3 2,-0.4 -0.965 34.4-127.2-167.2 141.2 56.8 103.4 52.2 516 115 B R E -En 99 480A 1 -417,-2.1 -417,-2.7 -2,-0.3 2,-0.3 -0.830 29.2-167.5 -91.6 138.8 60.4 104.3 51.4 517 116 B V E -En 98 481A 5 -37,-2.2 -35,-1.6 -2,-0.4 2,-0.3 -0.876 1.0-163.8-122.9 162.4 63.0 101.8 52.3 518 117 B E E +E 97 0A 0 -421,-2.6 -421,-2.0 -2,-0.3 -441,-0.1 -0.985 29.9 150.9-154.5 132.3 66.7 102.2 52.4 519 118 B G > - 0 0 3 1,-0.6 3,-2.5 -2,-0.3 311,-0.1 -0.267 61.0-107.8-155.3 54.7 69.8 100.0 52.5 520 119 B A G > S- 0 0 0 1,-0.3 3,-1.3 2,-0.2 -1,-0.6 -0.298 97.3 -3.6 50.0-124.8 72.5 102.0 50.8 521 120 B C G 3 S+ 0 0 3 1,-0.3 303,-0.3 2,-0.1 3,-0.3 0.536 136.5 56.7 -74.8 -8.0 73.2 100.5 47.4 522 121 B A G X> + 0 0 0 -3,-2.5 4,-1.9 1,-0.2 3,-0.5 0.291 67.4 112.4-106.2 9.6 70.9 97.6 48.0 523 122 B S H <> S+ 0 0 0 -3,-1.3 4,-2.3 1,-0.3 -1,-0.2 0.806 75.1 59.1 -51.3 -33.8 67.8 99.7 48.6 524 123 B G H 3> S+ 0 0 0 264,-0.5 4,-1.1 -3,-0.3 -1,-0.3 0.929 104.6 45.7 -62.1 -50.7 66.4 98.4 45.4 525 124 B G H <> S+ 0 0 0 -3,-0.5 4,-1.7 1,-0.2 -1,-0.2 0.856 112.1 54.0 -62.8 -33.8 66.5 94.7 46.4 526 125 B L H X S+ 0 0 3 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.928 98.8 59.9 -67.1 -44.7 65.0 95.7 49.7 527 126 B A H X S+ 0 0 0 -4,-2.3 4,-1.3 1,-0.3 -1,-0.2 0.826 107.7 50.1 -52.0 -30.5 62.1 97.4 48.1 528 127 B V H X S+ 0 0 9 -4,-1.1 4,-3.0 1,-0.2 -1,-0.3 0.940 101.9 58.3 -73.1 -46.6 61.4 94.0 46.6 529 128 B Q H X S+ 0 0 15 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.757 105.3 52.5 -59.0 -25.2 61.6 92.2 49.9 530 129 B S H X S+ 0 0 18 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.955 111.3 42.5 -74.6 -53.3 58.8 94.3 51.3 531 130 B A H X S+ 0 0 0 -4,-1.3 4,-2.4 1,-0.2 5,-0.3 0.897 113.9 56.8 -58.6 -42.5 56.4 93.7 48.4 532 131 B W H X S+ 0 0 33 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.959 108.8 42.5 -48.6 -61.8 57.5 90.1 48.6 533 132 B E H X S+ 0 0 5 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.791 112.3 56.8 -62.7 -29.6 56.6 89.6 52.2 534 133 B A H X>S+ 0 0 0 -4,-2.0 4,-3.9 2,-0.2 5,-1.5 0.953 108.5 41.9 -69.0 -52.6 53.3 91.5 51.8 535 134 B L H <5S+ 0 0 9 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.898 112.5 57.0 -60.2 -39.7 51.8 89.4 49.0 536 135 B L H <5S+ 0 0 54 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.764 111.5 42.9 -64.9 -27.2 53.1 86.4 50.9 537 136 B A H <5S- 0 0 47 -4,-1.0 -2,-0.2 -3,-0.4 -1,-0.2 0.939 115.6-119.8 -74.2 -58.2 51.0 87.7 53.8 538 137 B G T <5S+ 0 0 32 -4,-3.9 -3,-0.2 2,-0.1 -4,-0.1 0.288 82.9 118.1 128.3 -2.0 48.1 88.5 51.6 539 138 B T S - 0 0 58 -2,-0.3 4,-3.9 1,-0.1 -1,-0.1 -0.094 42.3-114.5 -54.4 163.5 79.4 118.5 43.0 556 155 B A H > S+ 0 0 70 2,-0.2 4,-1.9 3,-0.2 5,-0.1 0.805 120.6 53.9 -75.2 -31.7 81.2 115.1 43.1 557 156 B R H > S+ 0 0 180 2,-0.2 4,-1.2 3,-0.2 3,-0.2 0.975 115.9 39.4 -59.6 -56.0 83.1 116.2 46.2 558 157 B V H >> S+ 0 0 53 1,-0.2 4,-2.1 2,-0.2 3,-1.0 0.954 117.6 48.2 -56.7 -54.0 79.7 117.0 47.7 559 158 B G H 3X S+ 0 0 11 -4,-3.9 4,-1.2 1,-0.3 -1,-0.2 0.767 107.0 56.9 -61.3 -25.7 78.1 113.9 46.2 560 159 B G H 3X S+ 0 0 7 -4,-1.9 4,-0.7 2,-0.2 20,-0.4 0.760 106.8 50.4 -78.3 -25.5 80.9 111.8 47.5 561 160 B D H XX S+ 0 0 28 -4,-1.2 3,-1.1 -3,-1.0 4,-0.5 0.933 107.9 50.9 -69.9 -52.5 80.2 113.0 50.9 562 161 B Y H >< S+ 0 0 42 -4,-2.1 3,-1.0 1,-0.3 -2,-0.2 0.825 107.0 56.8 -56.2 -31.3 76.5 112.2 50.7 563 162 B L H >< S+ 0 0 40 -4,-1.2 3,-2.0 1,-0.2 -1,-0.3 0.836 89.0 73.3 -71.6 -29.5 77.6 108.8 49.5 564 163 B A H X< S+ 0 0 1 -3,-1.1 3,-2.6 -4,-0.7 -1,-0.2 0.699 74.2 83.7 -61.5 -18.1 79.6 108.3 52.7 565 164 B R T << S+ 0 0 10 -3,-1.0 -491,-0.5 -4,-0.5 -1,-0.3 0.512 84.3 60.6 -56.7 -7.1 76.3 107.8 54.5 566 165 B A T < S+ 0 0 2 -3,-2.0 -1,-0.3 -493,-0.1 261,-0.3 0.560 102.8 62.1 -96.5 -14.2 76.6 104.3 53.3 567 166 B A S < S- 0 0 7 -3,-2.6 2,-1.4 -4,-0.2 -493,-0.2 -0.319 111.3 -83.7 -94.9-178.0 79.8 103.9 55.2 568 167 B H > - 0 0 24 1,-0.2 3,-1.3 -2,-0.1 4,-0.3 -0.716 58.6-165.4 -85.9 86.2 80.4 104.1 59.0 569 168 B Y G >> S+ 0 0 32 -2,-1.4 4,-2.8 1,-0.3 3,-2.6 0.828 70.5 49.7 -49.4 -63.9 80.6 107.9 58.6 570 169 B K G 34 S+ 0 0 101 1,-0.3 -1,-0.3 2,-0.2 -2,-0.0 0.688 123.6 33.1 -59.4 -18.2 82.2 109.3 61.8 571 170 B R G <4 S+ 0 0 72 -3,-1.3 -1,-0.3 2,-0.1 -2,-0.2 0.220 127.9 35.0-120.6 14.0 85.0 106.8 61.7 572 171 B Q T X4 S+ 0 0 7 -3,-2.6 3,-2.1 -4,-0.3 4,-0.4 0.559 91.5 76.9-140.5 -26.3 85.5 106.4 57.9 573 172 B R T 3< S+ 0 0 57 -4,-2.8 3,-0.4 1,-0.3 -3,-0.1 0.790 80.9 84.9 -57.3 -24.9 84.8 109.7 56.1 574 173 B Q T 3 S+ 0 0 149 -5,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.722 76.6 68.1 -46.6 -29.2 88.3 110.4 57.5 575 174 B L S < S- 0 0 38 -3,-2.1 2,-0.3 1,-0.2 -1,-0.2 0.990 115.4 -48.4 -58.9 -66.1 89.7 108.7 54.4 576 175 B D - 0 0 24 -4,-0.4 3,-0.4 -3,-0.4 -1,-0.2 -0.953 48.1 -94.8-160.5 173.6 88.7 111.2 51.8 577 176 B D S S+ 0 0 73 1,-0.3 2,-0.7 -2,-0.3 3,-0.2 0.723 128.3 56.5 -69.2 -21.4 85.9 113.3 50.4 578 177 B F S > S+ 0 0 47 1,-0.2 4,-1.1 -5,-0.1 -1,-0.3 -0.609 75.8 159.2-104.6 68.5 85.6 110.3 48.1 579 178 B T H >> + 0 0 0 -2,-0.7 4,-0.7 -3,-0.4 3,-0.6 0.902 61.2 54.5 -62.5 -50.9 85.1 107.9 51.0 580 179 B F H >> S+ 0 0 12 -20,-0.4 4,-0.6 1,-0.3 3,-0.6 0.821 104.1 55.0 -61.1 -37.1 83.4 105.0 49.3 581 180 B P H >> S+ 0 0 16 0, 0.0 4,-1.9 0, 0.0 3,-1.1 0.899 100.1 63.3 -55.1 -41.6 86.1 104.6 46.6 582 181 B C H X S+ 0 0 42 -4,-2.1 4,-1.0 1,-0.2 3,-0.9 0.973 109.3 57.7 -61.0 -58.0 95.3 93.7 49.6 591 190 B I H 3<>S+ 0 0 0 -4,-1.9 5,-1.9 1,-0.3 6,-0.7 0.676 103.3 52.0 -61.4 -23.8 93.6 91.1 47.4 592 191 B Q H ><5S+ 0 0 50 -4,-1.8 3,-1.9 -3,-0.2 -1,-0.3 0.906 108.6 50.9 -73.7 -39.8 96.2 91.2 44.6 593 192 B E H <<5S+ 0 0 132 -3,-0.9 -2,-0.2 -4,-0.9 -1,-0.2 0.622 101.1 62.6 -77.0 -12.9 99.1 90.7 47.0 594 193 B A T 3<5S- 0 0 69 -4,-1.0 -1,-0.3 3,-0.1 -2,-0.2 0.463 115.6-121.1 -82.9 -2.8 97.2 87.8 48.4 595 194 B G T < 5S+ 0 0 67 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.2 0.922 77.3 128.9 61.4 43.2 97.7 86.3 44.9 596 195 B H S > - 0 0 40 -2,-0.3 3,-1.5 1,-0.2 4,-0.7 -0.536 17.9-139.7 -76.4 136.8 95.3 90.4 39.1 599 198 B M T 34 S+ 0 0 27 1,-0.3 3,-0.3 -2,-0.3 -1,-0.2 0.737 111.2 67.1 -59.3 -20.9 94.4 94.1 39.2 600 199 B E T >> S+ 0 0 117 1,-0.2 3,-1.6 2,-0.2 4,-1.0 0.791 88.1 61.4 -69.2 -30.1 94.7 93.4 35.5 601 200 B D H <> S+ 0 0 4 -3,-1.5 4,-2.0 1,-0.3 -1,-0.2 0.832 92.8 67.0 -63.5 -27.7 91.6 91.2 35.8 602 201 B A H 3X S+ 0 0 0 -4,-0.7 4,-0.6 -3,-0.3 -1,-0.3 0.547 98.2 52.1 -71.5 -7.3 89.9 94.4 36.9 603 202 B A H <> S+ 0 0 1 -3,-1.6 4,-2.9 2,-0.1 -1,-0.2 0.761 104.3 55.2 -92.5 -34.8 90.5 95.7 33.4 604 203 B Y H X S+ 0 0 99 -4,-1.0 4,-2.2 -3,-0.2 -2,-0.2 0.926 109.6 45.8 -62.0 -49.5 88.9 92.6 31.8 605 204 B V H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 5,-0.3 0.962 113.1 53.1 -53.8 -51.9 85.7 93.1 33.8 606 205 B A H X S+ 0 0 0 -4,-0.6 4,-1.7 1,-0.2 -2,-0.2 0.919 108.5 46.3 -52.0 -58.1 85.8 96.8 32.9 607 206 B A H X S+ 0 0 29 -4,-2.9 4,-2.3 1,-0.2 5,-0.4 0.932 111.1 55.0 -52.0 -49.8 86.1 96.3 29.1 608 207 B K H X S+ 0 0 26 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.923 109.7 41.8 -51.8 -58.6 83.3 93.7 29.1 609 208 B A H X S+ 0 0 0 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.779 113.8 54.7 -67.1 -25.2 80.6 95.7 30.8 610 209 B Y H X S+ 0 0 38 -4,-1.7 4,-1.2 -5,-0.3 14,-0.2 0.955 110.4 41.9 -71.5 -52.2 81.5 98.8 28.8 611 210 B A H < S+ 0 0 22 -4,-2.3 4,-0.2 1,-0.3 -2,-0.2 0.802 112.4 58.5 -62.1 -31.2 81.2 97.3 25.4 612 211 B S H >< S+ 0 0 12 -4,-2.0 3,-1.7 -5,-0.4 -1,-0.3 0.906 103.5 51.3 -60.7 -40.7 78.1 95.7 26.8 613 212 B G H >< S+ 0 0 0 -4,-1.5 3,-1.5 1,-0.3 6,-0.3 0.768 97.0 68.1 -70.2 -24.1 76.8 99.2 27.5 614 213 B N T 3< S+ 0 0 10 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.601 98.1 51.9 -71.6 -9.0 77.6 100.0 23.9 615 214 B R T < S+ 0 0 82 -3,-1.7 -1,-0.3 -4,-0.2 194,-0.2 0.379 102.1 71.3-101.8 -0.4 74.8 97.7 22.9 616 215 B N X - 0 0 2 -3,-1.5 3,-0.6 -4,-0.1 -1,-0.1 -0.962 58.5-168.1-125.9 112.8 72.3 99.3 25.3 617 216 B P T 3 S+ 0 0 38 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 0.607 90.0 63.9 -73.6 -15.8 71.0 102.8 24.5 618 217 B L T 3 S+ 0 0 27 -185,-0.1 -184,-2.1 4,-0.1 -5,-0.1 0.804 81.8 110.8 -73.3 -30.4 69.6 103.1 28.0 619 218 B A S X S- 0 0 4 -3,-0.6 3,-0.7 -6,-0.3 165,-0.3 -0.032 70.4-138.9 -49.9 143.2 73.2 102.9 29.4 620 219 B H T 3 S+ 0 0 5 164,-1.6 3,-0.3 163,-0.7 164,-0.2 0.865 109.5 33.2 -63.8 -39.7 74.7 105.9 31.0 621 220 B M T > S+ 0 0 8 162,-2.8 3,-0.7 1,-0.2 -1,-0.2 -0.213 81.5 118.7-115.9 38.3 77.9 105.1 29.2 622 221 B H T < S+ 0 0 16 -3,-0.7 2,-0.6 1,-0.3 -1,-0.2 0.870 71.3 58.8 -69.6 -40.7 76.5 103.6 26.0 623 222 B A T 3 S+ 0 0 45 -3,-0.3 2,-0.3 -4,-0.2 -1,-0.3 -0.126 103.7 63.6 -84.9 37.4 78.1 106.2 23.8 624 223 B R < + 0 0 137 -3,-0.7 2,-0.3 -2,-0.6 -10,-0.1 -0.998 43.4 147.5-160.6 152.4 81.6 105.4 24.9 625 224 B K - 0 0 121 -2,-0.3 2,-0.3 -12,-0.1 -18,-0.0 -0.915 13.9-172.5-172.1 163.0 84.3 102.8 25.0 626 225 B V - 0 0 70 -2,-0.3 -15,-0.1 -19,-0.1 5,-0.1 -0.953 39.6 -59.3-154.0 177.7 88.1 102.6 24.9 627 226 B T > - 0 0 80 -2,-0.3 4,-1.4 1,-0.1 5,-0.2 -0.144 38.7-123.8 -59.8 149.7 90.9 100.2 24.7 628 227 B L H > S+ 0 0 69 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.875 118.6 57.4 -55.2 -40.7 91.4 97.4 27.2 629 228 B D H > S+ 0 0 118 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.871 103.6 51.3 -58.7 -37.3 94.8 99.0 27.7 630 229 B F H 4 S+ 0 0 50 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.827 114.7 43.2 -68.4 -30.1 93.0 102.2 28.5 631 230 B C H < S+ 0 0 8 -4,-1.4 -2,-0.2 1,-0.1 -1,-0.2 0.657 110.1 60.0 -83.8 -20.3 91.0 100.2 31.1 632 231 B T H < S- 0 0 33 -4,-1.7 2,-0.2 1,-0.2 -2,-0.2 0.983 115.1 -95.0 -73.0 -61.2 94.2 98.4 32.1 633 232 B Q S < S+ 0 0 105 -4,-2.1 -1,-0.2 1,-0.1 3,-0.1 -0.812 84.4 108.1-177.9-135.5 96.2 101.4 33.3 634 233 B A + 0 0 104 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.805 66.0 140.5 42.0 47.5 98.8 103.8 31.9 635 234 B S + 0 0 37 3,-0.3 5,-0.2 1,-0.1 -1,-0.2 -0.870 45.4 172.7-131.6 155.4 96.2 106.5 31.8 636 235 B D S S+ 0 0 143 -2,-0.3 -1,-0.1 3,-0.1 -2,-0.1 0.554 96.5 51.0-125.3 -36.7 95.7 110.2 32.3 637 236 B K S S+ 0 0 188 1,-0.3 -2,-0.1 2,-0.0 -7,-0.0 0.725 119.3 43.8 -71.8 -22.0 92.2 110.5 31.0 638 237 B N S S+ 0 0 13 -5,-0.1 -3,-0.3 15,-0.0 -1,-0.3 -0.753 97.3 170.5-120.6 81.1 91.6 107.6 33.3 639 238 B P - 0 0 47 0, 0.0 2,-1.3 0, 0.0 14,-0.8 -0.246 50.7-103.0 -97.5 173.6 93.5 108.8 36.4 640 239 B N + 0 0 64 -5,-0.2 12,-0.1 1,-0.2 8,-0.1 -0.695 49.2 169.5 -87.9 76.4 94.2 108.1 40.1 641 240 B F + 0 0 71 -2,-1.3 -1,-0.2 10,-0.1 7,-0.1 0.649 27.5 125.1 -69.7 -19.8 91.8 110.8 41.1 642 241 B L - 0 0 1 6,-0.4 6,-0.1 9,-0.2 -2,-0.1 -0.184 56.6-149.0 -51.4 121.0 91.8 109.8 44.8 643 242 B G S S+ 0 0 35 2,-0.1 -1,-0.2 5,-0.0 5,-0.1 0.780 75.3 99.5 -57.6 -27.9 92.7 112.7 47.0 644 243 B N - 0 0 12 1,-0.1 -68,-0.1 -66,-0.1 -69,-0.0 -0.249 65.1-154.5 -57.2 147.7 94.1 110.0 49.2 645 244 B E S S+ 0 0 146 2,-0.1 -1,-0.1 3,-0.1 -2,-0.1 0.044 84.8 52.5-111.7 23.6 97.8 109.3 49.0 646 245 B I S S+ 0 0 103 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 0.693 121.4 18.3-125.1 -46.2 97.7 105.7 50.2 647 246 B Y S > S+ 0 0 19 1,-0.1 3,-1.3 2,-0.1 -5,-0.1 0.262 91.2 114.1-113.7 7.5 95.2 103.7 48.1 648 247 B K G > S+ 0 0 72 1,-0.3 3,-0.8 2,-0.1 -6,-0.4 0.867 78.5 42.8 -42.6 -51.4 95.2 106.3 45.2 649 248 B P G 3 S+ 0 0 61 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.647 95.9 78.8 -81.1 -8.1 96.8 104.1 42.6 650 249 B F G < S+ 0 0 33 -3,-1.3 2,-0.3 1,-0.1 -2,-0.1 0.230 93.7 53.0 -85.3 18.7 94.8 101.0 43.5 651 250 B L < - 0 0 1 -3,-0.8 2,-0.4 -63,-0.1 -9,-0.2 -0.938 63.1-163.9-154.2 123.8 91.8 102.3 41.6 652 251 B R >> - 0 0 3 -2,-0.3 3,-2.5 -12,-0.1 4,-0.9 -0.858 38.9-113.1-104.7 148.1 91.4 103.5 38.1 653 252 B T T 34 S+ 0 0 56 -14,-0.8 3,-0.3 -2,-0.4 -1,-0.1 0.745 116.7 71.1 -48.1 -25.2 88.3 105.5 37.0 654 253 B T T 34 S+ 0 0 9 1,-0.2 -1,-0.3 -24,-0.2 -23,-0.1 0.914 96.2 48.1 -51.5 -48.0 87.7 102.4 35.0 655 254 B D T <4 S+ 0 0 5 -3,-2.5 85,-1.0 84,-0.1 -1,-0.2 0.712 94.2 95.3 -77.7 -18.6 86.8 100.4 38.1 656 255 B C B < S-W 739 0E 16 -4,-0.9 83,-0.2 -3,-0.3 82,-0.0 -0.426 71.0-131.1 -73.0 143.6 84.5 103.1 39.4 657 256 B S - 0 0 24 81,-0.9 2,-0.3 -2,-0.1 125,-0.2 -0.070 32.1 -86.9 -77.1-171.5 80.8 102.9 38.7 658 257 B Q - 0 0 36 123,-1.4 2,-1.0 -2,-0.0 128,-0.2 -0.716 16.4-133.0-105.6 150.0 78.6 105.7 37.4 659 258 B V + 0 0 86 -2,-0.3 2,-0.3 -222,-0.2 -108,-0.1 -0.824 50.2 170.4 -97.0 92.9 76.7 108.5 39.1 660 259 B S - 0 0 0 -2,-1.0 2,-0.4 126,-0.5 -224,-0.2 -0.719 34.9-146.0-114.8 153.8 73.4 108.1 37.4 661 260 B D B +V 435 0D 1 -226,-2.7 -226,-1.7 -2,-0.3 2,-0.2 -0.878 47.8 102.3-106.0 148.1 69.9 109.3 37.5 662 261 B G E - 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0 0 57 -2,-0.3 4,-3.7 1,-0.1 -1,-0.1 -0.055 42.3-114.0 -53.0 164.6 84.0 103.8 2.1 978 155 C A H > S+ 0 0 68 2,-0.2 4,-2.3 3,-0.2 5,-0.1 0.807 120.5 54.3 -75.5 -31.9 82.1 107.1 2.1 979 156 C R H > S+ 0 0 184 2,-0.2 4,-1.3 3,-0.2 -1,-0.2 0.974 115.5 39.8 -58.6 -55.1 84.0 108.1 -1.1 980 157 C V H >> S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 3,-0.9 0.954 117.5 48.5 -58.3 -53.6 82.7 104.9 -2.6 981 158 C G H 3X S+ 0 0 12 -4,-3.7 4,-1.4 1,-0.3 -1,-0.2 0.787 106.6 56.6 -59.9 -29.9 79.3 105.3 -1.0 982 159 C G H 3X S+ 0 0 8 -4,-2.3 4,-0.8 2,-0.2 20,-0.4 0.781 106.9 50.7 -74.5 -26.9 79.1 108.9 -2.1 983 160 C D H XX S+ 0 0 28 -4,-1.3 3,-1.3 -3,-0.9 4,-0.5 0.949 107.9 50.6 -68.8 -53.8 79.6 107.6 -5.7 984 161 C Y H >< S+ 0 0 41 -4,-2.1 3,-1.1 1,-0.3 -2,-0.2 0.836 107.3 57.1 -53.0 -33.3 76.9 105.0 -5.3 985 162 C L H >< S+ 0 0 41 -4,-1.4 3,-1.9 1,-0.2 -1,-0.3 0.838 89.0 72.8 -70.6 -29.7 74.7 107.8 -4.1 986 163 C A H X< S+ 0 0 0 -3,-1.3 3,-2.6 -4,-0.8 -1,-0.2 0.691 74.4 83.3 -62.2 -16.8 75.3 109.8 -7.2 987 164 C R T << S+ 0 0 18 -3,-1.1 346,-1.8 -4,-0.5 -1,-0.3 0.537 84.2 61.3 -58.2 -8.5 73.0 107.3 -9.0 988 165 C A T < S+ 0 0 2 -3,-1.9 -1,-0.3 344,-0.1 261,-0.3 0.555 102.8 62.4 -93.9 -12.6 70.2 109.5 -7.6 989 166 C A S < S- 0 0 9 -3,-2.6 2,-1.4 -4,-0.2 344,-0.3 -0.329 111.5 -84.5 -97.1-178.8 71.6 112.4 -9.6 990 167 C H > - 0 0 19 1,-0.2 3,-1.3 131,-0.1 4,-0.3 -0.721 58.4-165.3 -85.7 84.5 72.0 112.8 -13.3 991 168 C Y G >> S+ 0 0 32 -2,-1.4 4,-3.1 340,-0.3 3,-2.5 0.810 70.3 49.8 -47.2 -63.8 75.3 110.9 -13.1 992 169 C K G 34 S+ 0 0 105 1,-0.3 -1,-0.3 338,-0.3 339,-0.0 0.682 123.0 33.7 -60.6 -19.5 77.2 111.5 -16.3 993 170 C R G <4 S+ 0 0 73 -3,-1.3 -1,-0.3 2,-0.1 -2,-0.2 0.225 128.0 34.3-118.2 13.4 76.7 115.2 -16.2 994 171 C Q T X4 S+ 0 0 7 -3,-2.5 3,-2.1 -4,-0.3 4,-0.3 0.574 91.0 77.9-140.8 -25.8 76.8 115.8 -12.4 995 172 C R T 3< S+ 0 0 56 -4,-3.1 3,-0.3 1,-0.3 -3,-0.1 0.799 80.6 85.3 -56.9 -24.3 79.2 113.3 -10.7 996 173 C Q T 3 S+ 0 0 149 -5,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.719 75.9 68.3 -46.7 -28.9 81.6 115.9 -12.2 997 174 C L S < S- 0 0 36 -3,-2.1 2,-0.3 1,-0.2 -1,-0.2 0.992 115.3 -48.7 -59.3 -66.6 81.1 118.0 -9.0 998 175 C D - 0 0 24 -3,-0.3 3,-0.4 -4,-0.3 -1,-0.2 -0.957 48.3 -94.5-160.9 172.4 82.8 115.7 -6.5 999 176 C D S S+ 0 0 76 -2,-0.3 2,-0.7 1,-0.3 3,-0.2 0.728 127.9 56.6 -67.9 -21.4 83.0 112.2 -5.1 1000 177 C F S > S+ 0 0 48 1,-0.2 4,-1.0 -5,-0.1 -1,-0.3 -0.615 76.0 159.4-104.6 68.6 80.4 113.5 -2.7 1001 178 C T H >> + 0 0 0 -2,-0.7 4,-0.8 -3,-0.4 3,-0.6 0.905 60.6 55.2 -62.1 -51.7 78.1 114.5 -5.5 1002 179 C F H >> S+ 0 0 14 -20,-0.4 3,-0.6 1,-0.2 4,-0.6 0.840 103.9 54.9 -59.4 -38.4 74.8 114.7 -3.7 1003 180 C P H >> S+ 0 0 17 0, 0.0 4,-2.0 0, 0.0 3,-1.1 0.894 99.6 63.4 -55.0 -41.5 76.0 117.1 -1.0 1004 181 C C H X S+ 0 0 44 -4,-2.0 4,-1.0 1,-0.2 3,-1.0 0.975 109.4 57.6 -60.9 -58.3 71.9 130.8 -3.6 1013 190 C I H 3<>S+ 0 0 1 -4,-1.9 5,-1.9 1,-0.3 6,-0.7 0.679 103.2 52.2 -60.7 -24.1 68.9 130.8 -1.3 1014 191 C Q H ><5S+ 0 0 51 -4,-1.7 3,-1.9 -3,-0.2 -1,-0.3 0.910 108.5 50.6 -73.8 -40.1 70.6 132.9 1.5 1015 192 C E H <<5S+ 0 0 134 -3,-1.0 -2,-0.2 -4,-0.9 -1,-0.2 0.631 101.2 62.8 -77.1 -12.3 71.6 135.6 -0.9 1016 193 C A T 3<5S- 0 0 69 -4,-1.0 -1,-0.3 3,-0.1 -2,-0.2 0.477 115.3-121.1 -83.1 -3.0 68.1 135.7 -2.1 1017 194 C G T < 5S+ 0 0 67 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.2 0.921 77.3 129.0 61.7 43.2 67.3 136.8 1.4 1018 195 C H S > - 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0 0 39 -3,-0.8 -1,-0.3 -235,-0.3 -35,-0.1 -0.754 69.9 -81.0-105.0 151.4 52.2 111.8 -13.1 1354 112 D P + 0 0 30 0, 0.0 -35,-3.1 0, 0.0 2,-0.3 -0.335 62.4 165.2 -52.5 122.6 52.7 108.5 -11.1 1355 113 D A E + k 01319F 3 -37,-0.2 2,-0.3 -2,-0.1 -35,-0.2 -0.995 6.4 157.3-146.4 147.5 56.1 107.1 -12.1 1356 114 D V E - k 01320F 16 -37,-1.0 -35,-3.0 -2,-0.3 2,-0.4 -0.965 34.6-127.2-167.0 140.9 58.4 104.5 -10.7 1357 115 D R E -Bk 9401321F 0 -417,-1.6 -417,-2.3 -2,-0.3 2,-0.3 -0.823 29.3-167.3 -90.9 139.0 61.2 102.1 -11.6 1358 116 D V E -Bk 9391322F 3 -37,-2.2 -35,-1.5 -2,-0.4 2,-0.3 -0.882 0.8-163.1-122.8 161.4 60.6 98.5 -10.6 1359 117 D E E +B 938 0F 0 -421,-2.5 -421,-1.6 -2,-0.3 -442,-0.3 -0.987 30.4 150.2-153.3 132.8 63.1 95.6 -10.5 1360 118 D G > - 0 0 1 1,-0.6 3,-2.4 -2,-0.3 311,-0.1 -0.267 61.1-107.9-156.5 54.6 63.1 91.8 -10.4 1361 119 D A G > S- 0 0 0 1,-0.3 3,-1.3 2,-0.2 -1,-0.6 -0.291 96.9 -3.3 50.1-124.6 66.2 90.8 -12.2 1362 120 D C G 3 S+ 0 0 1 1,-0.3 303,-0.3 2,-0.1 3,-0.3 0.536 136.2 56.7 -75.6 -8.1 65.3 89.3 -15.6 1363 121 D A G X> + 0 0 0 -3,-2.4 4,-1.9 1,-0.2 3,-0.7 0.297 67.5 113.3-105.2 8.7 61.6 89.6 -14.9 1364 122 D S H <> S+ 0 0 0 -3,-1.3 4,-2.2 1,-0.3 -1,-0.2 0.802 74.9 58.4 -51.3 -33.7 61.6 93.4 -14.3 1365 123 D G H 3> S+ 0 0 0 264,-0.5 4,-1.1 -3,-0.3 -1,-0.3 0.919 104.4 46.9 -63.2 -48.7 59.6 93.7 -17.5 1366 124 D G H <> S+ 0 0 0 -3,-0.7 4,-1.8 1,-0.2 3,-0.2 0.873 111.8 53.6 -62.4 -35.0 56.7 91.6 -16.4 1367 125 D L H X S+ 0 0 2 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.917 99.1 59.8 -66.8 -44.2 56.7 93.4 -13.1 1368 126 D A H X S+ 0 0 0 -4,-2.2 4,-1.2 1,-0.3 -1,-0.2 0.819 107.8 50.0 -52.3 -30.9 56.5 96.8 -14.8 1369 127 D V H X S+ 0 0 9 -4,-1.1 4,-3.0 -3,-0.2 -1,-0.3 0.936 102.0 58.2 -73.0 -46.7 53.3 95.3 -16.2 1370 128 D Q H X S+ 0 0 6 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.767 105.4 52.5 -58.4 -25.9 51.9 94.1 -12.8 1371 129 D S H X S+ 0 0 16 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.952 111.3 42.6 -74.1 -52.1 52.1 97.7 -11.5 1372 130 D A H X S+ 0 0 0 -4,-1.2 4,-2.3 1,-0.2 5,-0.3 0.889 113.5 57.2 -60.5 -40.6 50.2 99.3 -14.3 1373 131 D W H X S+ 0 0 41 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.963 108.6 42.6 -50.2 -61.2 47.8 96.4 -14.1 1374 132 D E H X S+ 0 0 4 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.792 112.2 56.7 -62.6 -29.9 47.0 96.9 -10.4 1375 133 D A H X>S+ 0 0 0 -4,-2.0 4,-3.9 2,-0.2 5,-1.4 0.952 108.6 42.1 -68.5 -52.7 46.7 100.6 -10.9 1376 134 D L H <5S+ 0 0 8 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.890 112.8 56.1 -60.8 -39.1 44.0 100.6 -13.6 1377 135 D L H <5S+ 0 0 40 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.755 111.9 43.6 -66.2 -27.6 42.3 97.9 -11.7 1378 136 D A H <5S- 0 0 30 -4,-1.0 -2,-0.3 -3,-0.4 -1,-0.2 0.938 115.2-120.3 -72.3 -59.1 42.3 100.3 -8.8 1379 137 D G T <5S+ 0 0 32 -4,-3.9 -3,-0.2 2,-0.1 -4,-0.1 0.275 83.0 117.5 128.7 -2.1 41.3 103.2 -11.0 1380 138 D T S - 0 0 58 -2,-0.3 4,-3.8 1,-0.1 -1,-0.1 -0.076 42.4-114.4 -52.8 163.3 83.6 94.5 -20.3 1397 155 D A H > S+ 0 0 69 2,-0.2 4,-2.1 3,-0.2 5,-0.1 0.799 120.3 54.3 -74.2 -32.1 81.8 91.1 -20.2 1398 156 D R H > S+ 0 0 185 2,-0.2 4,-1.2 3,-0.2 -1,-0.2 0.973 115.8 39.2 -58.9 -55.4 83.8 90.2 -17.1 1399 157 D V H >> S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 3,-0.9 0.952 117.7 48.5 -58.3 -53.4 82.6 93.4 -15.6 1400 158 D G H 3X S+ 0 0 12 -4,-3.8 4,-1.3 1,-0.3 -1,-0.2 0.786 106.9 56.6 -60.7 -28.1 79.1 93.0 -17.0 1401 159 D G H 3X S+ 0 0 8 -4,-2.1 4,-0.8 2,-0.2 20,-0.4 0.768 107.0 50.6 -75.6 -26.2 79.0 89.4 -15.8 1402 160 D D H XX S+ 0 0 28 -4,-1.2 3,-0.9 -3,-0.9 4,-0.5 0.932 107.8 50.9 -70.3 -51.3 79.6 90.7 -12.3 1403 161 D Y H >< S+ 0 0 44 -4,-2.1 3,-1.0 1,-0.3 -2,-0.2 0.823 106.9 57.0 -56.1 -31.4 76.9 93.3 -12.5 1404 162 D L H >< S+ 0 0 41 -4,-1.3 3,-2.0 1,-0.2 -1,-0.3 0.847 89.0 72.8 -72.3 -30.1 74.7 90.4 -13.6 1405 163 D A H X< S+ 0 0 0 -3,-0.9 3,-2.7 -4,-0.8 -1,-0.2 0.706 74.4 83.7 -60.3 -18.8 75.5 88.5 -10.4 1406 164 D R T << S+ 0 0 15 -3,-1.0 -492,-2.6 -4,-0.5 -1,-0.3 0.525 84.6 60.6 -56.9 -7.3 73.2 91.0 -8.6 1407 165 D A T < S+ 0 0 1 -3,-2.0 -1,-0.3 -494,-0.1 261,-0.3 0.564 102.8 62.3 -96.1 -14.2 70.4 88.7 -9.8 1408 166 D A S < S- 0 0 7 -3,-2.7 2,-1.5 -4,-0.2 -494,-0.3 -0.317 111.6 -83.9 -93.9-178.7 72.0 85.9 -7.8 1409 167 D H > - 0 0 18 1,-0.2 3,-1.4 131,-0.1 4,-0.3 -0.699 58.8-165.2 -84.9 84.4 72.6 85.5 -4.1 1410 168 D Y G >> S+ 0 0 33 -2,-1.5 4,-3.0 -498,-0.4 3,-2.5 0.809 70.4 49.6 -46.6 -64.6 75.8 87.5 -4.5 1411 169 D K G 34 S+ 0 0 104 -500,-0.3 -1,-0.3 1,-0.3 -499,-0.0 0.678 123.2 33.5 -60.1 -18.9 77.9 87.0 -1.4 1412 170 D R G <4 S+ 0 0 72 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.231 128.3 34.3-118.3 13.5 77.5 83.3 -1.5 1413 171 D Q T X4 S+ 0 0 7 -3,-2.5 3,-2.0 -4,-0.3 4,-0.4 0.560 91.4 77.4-141.5 -25.7 77.4 82.7 -5.2 1414 172 D R T 3< S+ 0 0 54 -4,-3.0 3,-0.4 1,-0.3 -3,-0.1 0.813 81.1 84.8 -57.0 -26.7 79.7 85.1 -7.1 1415 173 D Q T 3 S+ 0 0 150 -5,-0.5 -1,-0.3 1,-0.2 3,-0.1 0.704 76.4 68.1 -43.8 -29.5 82.2 82.7 -5.7 1416 174 D L S < S- 0 0 37 -3,-2.0 2,-0.3 1,-0.2 -1,-0.2 0.991 115.3 -48.4 -59.8 -65.8 81.5 80.5 -8.8 1417 175 D D - 0 0 22 -3,-0.4 3,-0.4 -4,-0.4 -1,-0.2 -0.957 48.4 -94.5-160.9 172.6 83.0 82.7 -11.5 1418 176 D D S S+ 0 0 75 -2,-0.3 2,-0.7 1,-0.3 3,-0.2 0.723 128.2 56.5 -68.1 -20.8 83.2 86.2 -12.9 1419 177 D F S > S+ 0 0 48 1,-0.2 4,-1.1 -5,-0.1 -1,-0.3 -0.614 75.4 159.2-104.9 68.4 80.4 84.8 -15.1 1420 178 D T H >> + 0 0 0 -2,-0.7 4,-0.8 -3,-0.4 3,-0.6 0.909 61.2 55.0 -63.0 -50.4 78.3 83.8 -12.2 1421 179 D F H >> S+ 0 0 13 -20,-0.4 4,-0.6 1,-0.3 3,-0.5 0.823 103.9 54.6 -60.9 -37.4 74.9 83.5 -13.9 1422 180 D P H >> S+ 0 0 18 0, 0.0 4,-1.9 0, 0.0 3,-1.1 0.895 100.2 63.6 -55.7 -41.3 76.0 81.0 -16.5 1423 181 D C H X S+ 0 0 44 -4,-2.1 4,-1.1 1,-0.2 3,-0.8 0.966 109.3 57.6 -61.3 -57.3 72.3 67.3 -13.4 1432 190 D I H 3<>S+ 0 0 0 -4,-1.8 5,-1.9 1,-0.3 6,-0.7 0.681 103.4 52.3 -62.0 -23.9 69.2 67.2 -15.5 1433 191 D Q H ><5S+ 0 0 50 -4,-1.8 3,-2.0 -3,-0.2 -1,-0.3 0.916 108.6 50.3 -73.5 -41.2 70.7 65.2 -18.4 1434 192 D E H <<5S+ 0 0 135 -4,-0.9 -2,-0.2 -3,-0.8 -1,-0.2 0.629 101.7 62.5 -76.1 -13.4 72.0 62.5 -16.0 1435 193 D A T 3<5S- 0 0 69 -4,-1.1 -1,-0.3 3,-0.1 -2,-0.2 0.465 115.7-121.1 -82.0 -3.6 68.5 62.3 -14.5 1436 194 D G T < 5S+ 0 0 69 -3,-2.0 -3,-0.2 2,-0.2 -2,-0.2 0.929 76.9 129.3 61.7 43.8 67.6 61.2 -18.0 1437 195 D H S > - 0 0 39 -2,-0.3 3,-1.2 1,-0.2 4,-0.7 -0.538 17.7-140.2 -77.1 138.1 69.4 65.4 -23.9 1440 198 D M T 34 S+ 0 0 28 1,-0.3 3,-0.2 -2,-0.2 -1,-0.2 0.712 110.9 66.9 -60.4 -20.4 71.9 68.2 -23.8 1441 199 D E T >> S+ 0 0 120 1,-0.2 3,-1.6 2,-0.2 4,-1.1 0.788 88.6 61.5 -69.5 -29.6 71.5 67.6 -27.5 1442 200 D D H <> S+ 0 0 3 -3,-1.2 4,-2.0 1,-0.3 -1,-0.2 0.833 92.7 66.4 -63.9 -28.7 68.0 68.9 -27.1 1443 201 D A H 3X S+ 0 0 0 -4,-0.7 4,-0.6 1,-0.2 -1,-0.3 0.553 98.4 52.5 -70.3 -7.3 69.7 72.1 -26.1 1444 202 D A H <> S+ 0 0 0 -3,-1.6 4,-2.8 2,-0.2 -1,-0.2 0.777 104.2 54.9 -92.5 -35.3 70.9 72.3 -29.6 1445 203 D Y H X S+ 0 0 97 -4,-1.1 4,-2.1 -3,-0.2 -2,-0.2 0.926 109.6 46.1 -61.9 -50.0 67.5 71.9 -31.1 1446 204 D V H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 5,-0.3 0.951 113.0 53.2 -52.7 -51.3 66.1 74.8 -29.1 1447 205 D A H X S+ 0 0 1 -4,-0.6 4,-1.7 1,-0.2 -2,-0.2 0.923 108.2 46.4 -52.7 -57.5 69.2 76.8 -30.1 1448 206 D A H X S+ 0 0 28 -4,-2.8 4,-2.3 1,-0.2 5,-0.4 0.936 111.0 54.9 -52.7 -50.4 68.9 76.3 -33.9 1449 207 D K H X S+ 0 0 25 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.924 109.6 41.9 -50.9 -59.7 65.2 77.1 -33.9 1450 208 D A H X S+ 0 0 0 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.780 113.8 54.9 -66.7 -24.4 65.3 80.5 -32.2 1451 209 D Y H X S+ 0 0 38 -4,-1.7 4,-1.3 -3,-0.3 14,-0.2 0.960 110.3 41.9 -72.2 -52.3 68.3 81.5 -34.2 1452 210 D A H < S+ 0 0 21 -4,-2.3 4,-0.2 1,-0.3 -2,-0.2 0.804 112.7 58.2 -61.3 -31.0 66.9 80.9 -37.6 1453 211 D S H >< S+ 0 0 11 -4,-2.0 3,-1.7 -5,-0.4 -1,-0.3 0.903 103.2 51.6 -61.3 -41.2 63.8 82.4 -36.1 1454 212 D G H >< S+ 0 0 0 -4,-1.6 3,-1.5 1,-0.3 6,-0.3 0.777 97.5 68.0 -68.7 -24.2 66.0 85.5 -35.5 1455 213 D N T 3< S+ 0 0 40 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.606 97.9 51.3 -72.4 -9.5 67.0 85.4 -39.1 1456 214 D R T < S+ 0 0 109 -3,-1.7 -1,-0.3 -4,-0.2 194,-0.2 0.374 102.4 71.8-102.4 -0.2 63.4 86.3 -40.1 1457 215 D N X - 0 0 2 -3,-1.5 3,-0.7 -4,-0.2 -1,-0.1 -0.959 58.2-168.5-124.5 112.8 63.5 89.3 -37.7 1458 216 D P T 3 S+ 0 0 93 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 0.629 89.8 64.1 -74.3 -16.1 65.6 92.4 -38.5 1459 217 D L T 3 S+ 0 0 30 -185,-0.1 -184,-2.1 4,-0.1 -5,-0.1 0.792 81.7 110.6 -72.4 -30.1 65.0 93.7 -35.0 1460 218 D A S X S- 0 0 4 -3,-0.7 3,-0.8 -6,-0.3 165,-0.3 -0.053 70.4-139.0 -51.3 143.4 66.9 90.7 -33.6 1461 219 D H T 3 S+ 0 0 5 164,-1.6 3,-0.3 163,-0.7 164,-0.2 0.870 109.5 33.3 -64.3 -40.0 70.3 91.2 -32.1 1462 220 D M T > S+ 0 0 9 162,-2.7 3,-0.6 1,-0.2 -1,-0.2 -0.227 81.6 119.2-116.0 38.2 71.5 88.0 -33.9 1463 221 D H T < S+ 0 0 62 -3,-0.8 2,-0.8 1,-0.2 -1,-0.2 0.883 71.3 58.5 -68.7 -42.2 69.3 88.4 -37.0 1464 222 D A T 3 S+ 0 0 74 -3,-0.3 2,-0.3 -4,-0.2 -1,-0.2 -0.133 103.6 64.4 -84.0 38.3 72.4 88.5 -39.3 1465 223 D R < + 0 0 134 -2,-0.8 2,-0.3 -3,-0.6 -10,-0.1 -0.998 43.2 146.9-161.0 152.1 73.7 85.2 -38.2 1466 224 D K - 0 0 132 -2,-0.3 2,-0.3 -12,-0.1 -18,-0.0 -0.916 13.8-173.0-172.3 163.2 73.1 81.5 -38.1 1467 225 D V - 0 0 69 -2,-0.3 -15,-0.1 -19,-0.1 5,-0.1 -0.956 39.8 -58.3-155.1 177.3 75.1 78.3 -38.2 1468 226 D T > - 0 0 81 -2,-0.3 4,-1.5 1,-0.1 5,-0.2 -0.128 38.6-124.1 -58.9 148.8 74.7 74.5 -38.4 1469 227 D L H > S+ 0 0 70 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.875 118.6 57.1 -54.5 -40.9 72.8 72.6 -35.8 1470 228 D D H > S+ 0 0 121 2,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.865 103.7 51.4 -59.1 -36.1 76.0 70.6 -35.4 1471 229 D F H 4 S+ 0 0 48 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.841 114.7 43.1 -69.3 -30.0 77.7 73.9 -34.6 1472 230 D C H < S+ 0 0 8 -4,-1.5 -2,-0.3 1,-0.1 -1,-0.2 0.674 110.0 60.0 -83.6 -20.7 74.9 74.4 -32.0 1473 231 D T H < S- 0 0 32 -4,-1.8 2,-0.2 1,-0.2 -2,-0.2 0.986 115.1 -94.6 -72.7 -61.5 75.2 70.8 -30.9 1474 232 D Q S < S+ 0 0 104 -4,-2.1 -1,-0.2 1,-0.1 3,-0.1 -0.805 84.6 107.4-177.2-135.8 78.9 70.9 -29.8 1475 233 D A + 0 0 103 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.816 66.0 139.4 42.3 48.4 82.3 70.1 -31.3 1476 234 D S + 0 0 36 3,-0.3 5,-0.2 1,-0.1 -1,-0.2 -0.889 45.4 174.0-133.2 155.7 83.1 73.8 -31.5 1477 235 D D S S+ 0 0 139 -2,-0.3 -1,-0.1 3,-0.1 -2,-0.1 0.552 96.3 51.4-124.7 -36.8 85.9 76.3 -30.9 1478 236 D K S S+ 0 0 191 1,-0.3 -2,-0.1 2,-0.0 -7,-0.0 0.739 119.0 44.1 -71.5 -21.8 84.1 79.4 -32.3 1479 237 D N S S+ 0 0 14 -5,-0.1 -3,-0.3 15,-0.0 -1,-0.3 -0.758 96.9 170.5-121.1 81.2 81.4 78.2 -29.9 1480 238 D P - 0 0 49 0, 0.0 2,-1.4 0, 0.0 14,-0.8 -0.263 50.8-102.8 -97.9 173.1 83.6 77.3 -26.8 1481 239 D N + 0 0 62 -5,-0.2 12,-0.1 1,-0.2 8,-0.1 -0.679 49.2 169.8 -86.9 75.9 83.3 76.4 -23.1 1482 240 D F + 0 0 73 -2,-1.4 -1,-0.2 10,-0.1 7,-0.1 0.648 27.8 124.8 -69.0 -19.4 84.3 79.9 -22.1 1483 241 D L - 0 0 1 6,-0.4 6,-0.1 9,-0.2 -2,-0.1 -0.186 56.6-149.1 -51.7 121.3 83.5 79.4 -18.5 1484 242 D G S S+ 0 0 34 2,-0.1 -1,-0.2 5,-0.0 5,-0.1 0.786 75.2 99.3 -58.2 -28.2 86.5 80.2 -16.3 1485 243 D N - 0 0 11 1,-0.1 -68,-0.1 -66,-0.1 -69,-0.0 -0.245 65.4-154.4 -55.7 147.2 85.0 77.6 -14.0 1486 244 D E S S+ 0 0 144 2,-0.1 -1,-0.1 3,-0.1 -2,-0.1 0.036 85.2 52.9-111.4 23.8 86.6 74.1 -14.2 1487 245 D I S S+ 0 0 103 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 0.693 121.2 18.2-124.7 -45.2 83.6 72.2 -13.0 1488 246 D Y S > S+ 0 0 19 1,-0.1 3,-1.1 2,-0.1 -5,-0.1 0.245 91.4 113.9-114.6 8.2 80.5 73.1 -15.1 1489 247 D K G > S+ 0 0 72 1,-0.3 3,-0.7 2,-0.1 -6,-0.4 0.860 78.4 42.6 -44.2 -50.1 82.6 74.6 -18.0 1490 248 D P G 3 S+ 0 0 59 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.663 96.3 78.8 -82.0 -9.1 81.6 72.0 -20.6 1491 249 D F G < S+ 0 0 33 -3,-1.1 2,-0.3 1,-0.1 -2,-0.1 0.208 93.8 52.3 -83.6 19.0 77.9 71.9 -19.6 1492 250 D L < - 0 0 1 -3,-0.7 2,-0.4 -63,-0.1 -9,-0.2 -0.933 63.7-163.7-154.3 124.4 77.2 75.1 -21.5 1493 251 D R >> - 0 0 3 -2,-0.3 3,-2.5 -12,-0.1 4,-0.9 -0.856 39.1-112.3-104.8 149.1 78.0 76.1 -25.0 1494 252 D T T 34 S+ 0 0 56 -14,-0.8 3,-0.2 -2,-0.4 -1,-0.1 0.739 116.9 71.2 -48.2 -24.2 77.9 79.7 -26.1 1495 253 D T T 34 S+ 0 0 9 1,-0.2 -1,-0.3 -24,-0.2 -23,-0.1 0.916 96.0 48.5 -53.1 -47.4 74.8 78.5 -28.1 1496 254 D D T <4 S+ 0 0 2 -3,-2.5 85,-1.0 84,-0.1 -1,-0.2 0.723 94.1 95.3 -76.7 -19.4 72.8 78.1 -25.0 1497 255 D C B < S-T 1580 0J 18 -4,-0.9 83,-0.2 -3,-0.2 82,-0.0 -0.405 70.9-131.0 -74.4 144.5 73.7 81.5 -23.7 1498 256 D S - 0 0 25 81,-0.9 2,-0.3 1,-0.1 125,-0.2 -0.058 31.8 -87.8 -77.8-170.9 71.5 84.5 -24.3 1499 257 D Q - 0 0 37 123,-1.4 2,-1.0 -2,-0.0 128,-0.2 -0.738 16.5-132.7-106.6 149.1 72.5 87.8 -25.7 1500 258 D V + 0 0 85 -2,-0.3 2,-0.3 -222,-0.2 -108,-0.1 -0.820 50.0 171.0 -96.1 94.4 73.8 91.0 -24.0 1501 259 D S - 0 0 0 -2,-1.0 2,-0.4 126,-0.5 -224,-0.2 -0.714 34.3-145.7-115.7 154.7 71.5 93.4 -25.7 1502 260 D D B +S 1276 0I 3 -226,-2.6 -226,-1.6 -2,-0.3 2,-0.2 -0.879 47.7 100.2-106.9 148.4 70.5 97.1 -25.6 1503 261 D G E - 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