==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 05-DEC-11 3UXI . COMPND 2 MOLECULE: L-RHAMNOSE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS HALODURANS; . AUTHOR T.T.N.DOAN,P.PRABHU,J.K.KIM,M.JEYA,L.W.KANG,J.K.LEE . 1612 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 56033.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1123 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 135 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 1.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.2 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 . 97 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 177 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 600 37.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 40 2.5 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 0 0 0 2 1 6 13 11 8 2 5 0 0 0 0 0 4 0 0 0 0 4 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 7 1 13 0 11 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 . 7 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 0 0 0 4 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 5 A S > 0 0 90 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -44.6 -2.9 -18.6 47.9 2 6 A Q H > + 0 0 67 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.989 360.0 40.7 -50.0 -61.6 0.3 -17.2 46.3 3 7 A F H > S+ 0 0 12 1,-0.2 4,-2.8 2,-0.2 3,-0.4 0.964 112.1 56.7 -42.9 -60.9 -1.9 -14.7 44.6 4 8 A E H > S+ 0 0 98 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.813 106.8 48.6 -50.7 -40.4 -4.0 -14.3 47.7 5 9 A R H X S+ 0 0 87 -4,-3.1 4,-1.4 -3,-0.3 -1,-0.3 0.927 112.5 48.4 -64.8 -44.6 -0.8 -13.3 49.7 6 10 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 -3,-0.4 5,-0.2 0.934 106.4 58.1 -59.9 -47.3 0.1 -10.8 47.0 7 11 A K H X S+ 0 0 56 -4,-2.8 4,-2.7 1,-0.2 10,-0.2 0.818 103.8 52.2 -48.9 -42.3 -3.5 -9.4 47.0 8 12 A I H X S+ 0 0 107 -4,-1.4 4,-2.5 -3,-0.3 -1,-0.2 0.953 105.3 54.1 -63.4 -52.7 -3.3 -8.5 50.7 9 13 A E H < S+ 0 0 24 -4,-1.4 4,-0.3 1,-0.2 -2,-0.2 0.873 114.8 40.0 -47.5 -49.6 0.1 -6.5 50.3 10 14 A Y H ><>S+ 0 0 6 -4,-1.8 3,-2.1 1,-0.2 5,-1.5 0.936 109.8 64.2 -65.0 -44.6 -1.4 -4.4 47.6 11 15 A G H ><5S+ 0 0 34 -4,-2.7 3,-3.3 1,-0.3 -2,-0.2 0.881 89.5 64.8 -41.6 -55.4 -4.7 -4.3 49.6 12 16 A Q T 3<5S+ 0 0 145 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.1 0.706 102.4 49.8 -43.2 -27.1 -3.0 -2.4 52.6 13 17 A W T < 5S- 0 0 36 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 0.480 123.6-104.0 -94.9 -3.5 -2.5 0.6 50.3 14 18 A G T < 5S+ 0 0 58 -3,-3.3 2,-0.4 -4,-0.4 -3,-0.2 0.478 71.6 150.0 90.0 8.0 -6.1 0.6 49.1 15 19 A I < - 0 0 15 -5,-1.5 2,-0.9 -6,-0.1 -1,-0.3 -0.640 38.5-150.0 -78.2 124.8 -5.1 -1.0 45.8 16 20 A D > - 0 0 91 -2,-0.4 4,-2.1 1,-0.2 5,-0.1 -0.823 14.6-176.4 -97.7 100.0 -7.9 -3.1 44.4 17 21 A V H > S+ 0 0 3 -2,-0.9 4,-3.3 1,-0.2 5,-0.3 0.912 80.7 54.4 -73.0 -39.5 -6.1 -5.8 42.5 18 22 A E H > S+ 0 0 58 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.890 109.7 49.4 -56.5 -39.6 -9.3 -7.4 41.2 19 23 A E H > S+ 0 0 109 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.895 111.1 49.2 -66.6 -39.9 -10.4 -4.1 39.8 20 24 A A H X S+ 0 0 2 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.944 112.2 47.9 -65.1 -47.9 -7.0 -3.5 38.2 21 25 A L H X S+ 0 0 7 -4,-3.3 4,-2.1 1,-0.2 -1,-0.2 0.837 111.1 52.5 -59.7 -34.5 -7.2 -7.0 36.6 22 26 A E H X S+ 0 0 103 -4,-2.0 4,-0.6 -5,-0.3 -1,-0.2 0.895 113.2 41.5 -75.1 -38.4 -10.7 -6.3 35.5 23 27 A R H >X S+ 0 0 89 -4,-2.5 4,-0.7 2,-0.2 3,-0.5 0.861 112.4 56.1 -75.3 -27.3 -9.8 -3.0 33.8 24 28 A L H >< S+ 0 0 4 -4,-2.7 3,-2.3 1,-0.3 -2,-0.2 0.977 97.2 61.4 -65.9 -55.6 -6.6 -4.5 32.3 25 29 A K H 3< S+ 0 0 87 -4,-2.1 48,-0.6 1,-0.3 -1,-0.3 0.783 103.3 56.1 -31.3 -37.1 -8.4 -7.3 30.6 26 30 A Q H << S+ 0 0 125 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.2 0.783 81.6 98.6 -74.4 -29.3 -10.2 -4.5 28.7 27 31 A V << - 0 0 14 -3,-2.3 2,-0.4 -4,-0.7 46,-0.2 -0.460 62.0-145.4 -80.7 125.7 -7.2 -2.7 27.2 28 32 A P - 0 0 59 0, 0.0 2,-0.5 0, 0.0 280,-0.3 -0.726 6.2-158.5 -91.9 130.6 -6.4 -3.5 23.5 29 33 A I - 0 0 0 -2,-0.4 46,-2.4 44,-0.1 2,-0.9 -0.905 17.0-135.8-102.7 129.9 -2.8 -3.5 22.1 30 34 A S E -ab 75 309A 5 278,-2.1 280,-2.5 -2,-0.5 2,-0.4 -0.747 18.9-152.5 -90.8 103.4 -2.4 -3.1 18.4 31 35 A I E -a 76 0A 0 44,-3.6 46,-3.2 -2,-0.9 2,-0.2 -0.605 12.8-127.7 -82.7 123.8 0.2 -5.6 17.1 32 36 A H E -a 77 0A 12 -2,-0.4 3,-0.3 44,-0.2 46,-0.2 -0.466 6.7-151.6 -69.6 139.9 2.1 -4.6 13.9 33 37 A C S > S+ 0 0 1 44,-1.9 3,-2.4 1,-0.2 4,-0.4 0.728 83.1 83.1 -84.4 -29.2 2.0 -7.2 11.1 34 38 A A G >>>S+ 0 0 18 43,-0.3 5,-2.1 1,-0.3 3,-1.1 0.831 79.1 70.6 -48.4 -37.1 5.4 -6.2 9.7 35 39 A Q G 345S+ 0 0 0 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.730 92.2 58.7 -49.4 -27.7 7.1 -8.4 12.3 36 40 A G G <45S+ 0 0 0 -3,-2.4 17,-2.4 1,-0.2 -1,-0.2 0.720 118.0 19.9 -87.5 -24.1 5.9 -11.6 10.7 37 41 A D T <45S- 0 0 6 -3,-1.1 3,-0.3 -4,-0.4 -1,-0.2 0.154 110.8-102.2-128.8 14.2 7.4 -11.5 7.1 38 42 A D T <5S- 0 0 24 -4,-0.9 -3,-0.2 1,-0.2 -4,-0.1 0.948 77.8 -53.9 60.3 55.0 10.1 -9.0 7.8 39 43 A V S S- 0 0 50 1,-0.0 4,-2.9 -13,-0.0 -1,-0.2 -0.909 84.9-100.4-146.7 159.5 1.7 -15.4 2.3 56 70 A P H > S+ 0 0 12 0, 0.0 4,-3.3 0, 0.0 5,-0.2 0.813 122.2 59.1 -57.6 -29.9 -1.2 -13.8 4.2 57 71 A E H > S+ 0 0 109 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.949 110.8 39.6 -64.0 -47.2 -2.4 -17.3 5.1 58 72 A E H > S+ 0 0 47 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.889 116.1 54.0 -63.1 -40.4 0.9 -18.0 6.8 59 73 A L H X S+ 0 0 0 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.926 109.1 45.9 -62.6 -46.9 0.9 -14.5 8.2 60 74 A R H X S+ 0 0 17 -4,-3.3 4,-2.2 1,-0.2 5,-0.2 0.924 109.6 54.9 -63.5 -44.7 -2.5 -14.8 9.8 61 75 A M H X S+ 0 0 100 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.906 107.7 51.8 -48.1 -44.7 -1.7 -18.3 11.2 62 76 A D H X S+ 0 0 1 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.885 107.0 51.0 -67.2 -40.5 1.3 -16.7 12.9 63 77 A L H X S+ 0 0 1 -4,-1.8 4,-4.0 2,-0.2 5,-0.2 0.914 107.0 53.8 -62.4 -42.7 -0.7 -13.9 14.4 64 78 A E H X S+ 0 0 75 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.899 109.6 49.2 -60.0 -40.0 -3.3 -16.3 15.9 65 79 A K H X S+ 0 0 40 -4,-1.7 4,-0.7 2,-0.2 -1,-0.2 0.932 113.9 44.2 -64.0 -49.3 -0.4 -18.2 17.5 66 80 A A H >< S+ 0 0 0 -4,-2.2 3,-1.8 1,-0.2 4,-0.5 0.956 113.8 51.7 -58.1 -49.2 1.1 -15.0 18.9 67 81 A L H >< S+ 0 0 32 -4,-4.0 3,-0.7 1,-0.3 -2,-0.2 0.782 104.2 57.2 -61.3 -30.9 -2.4 -13.9 20.0 68 82 A S H 3< S+ 0 0 58 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.628 107.2 48.7 -76.7 -14.9 -3.0 -17.2 21.8 69 83 A L T << S+ 0 0 2 -3,-1.8 -1,-0.2 -4,-0.7 -2,-0.2 0.463 101.8 76.7 -98.5 -0.6 0.1 -16.6 23.9 70 84 A I S < S- 0 0 2 -3,-0.7 -1,-0.1 -4,-0.5 4,-0.1 -0.928 80.7-127.6-118.0 117.4 -0.9 -13.0 24.7 71 85 A P + 0 0 0 0, 0.0 2,-0.2 0, 0.0 310,-0.1 -0.243 69.8 26.4 -61.2 143.3 -3.6 -12.3 27.4 72 86 A G S S- 0 0 25 308,-0.3 2,-0.4 -44,-0.1 -46,-0.1 -0.489 93.5 -70.0 107.2-173.2 -6.5 -10.0 26.5 73 87 A K + 0 0 158 -48,-0.6 -44,-0.1 -2,-0.2 2,-0.1 -0.990 62.6 168.0-124.7 132.5 -8.2 -9.2 23.3 74 88 A H - 0 0 9 -2,-0.4 39,-1.3 -46,-0.2 2,-0.3 -0.307 25.8 -99.2-132.7-160.8 -6.2 -7.1 20.9 75 89 A R E -ac 30 113A 29 -46,-2.4 -44,-3.6 37,-0.2 2,-0.5 -0.964 14.1-135.3-136.5 155.7 -5.6 -5.5 17.5 76 90 A V E -ac 31 114A 1 37,-2.4 39,-2.2 -2,-0.3 2,-0.8 -0.941 15.3-147.8-109.5 128.2 -3.7 -6.0 14.2 77 91 A N E -ac 32 115A 15 -46,-3.2 -44,-1.9 -2,-0.5 -43,-0.3 -0.860 23.4-164.8-100.0 109.0 -2.0 -3.0 12.7 78 92 A L E - c 0 116A 0 37,-3.3 39,-0.6 -2,-0.8 2,-0.4 -0.591 9.2-143.8 -97.4 150.8 -2.0 -3.5 8.9 79 93 A H E > - c 0 117A 43 -2,-0.2 3,-3.4 37,-0.2 40,-0.1 -0.930 27.3-114.6-115.5 143.9 0.0 -1.8 6.1 80 94 A A G > S+ 0 0 2 37,-3.7 3,-1.1 -2,-0.4 -1,-0.1 0.763 114.2 63.1 -36.3 -39.5 -1.1 -0.9 2.6 81 95 A I G 3 S+ 0 0 9 1,-0.3 -39,-1.7 36,-0.3 -38,-0.9 0.488 85.1 74.6 -74.1 -0.4 1.4 -3.4 1.2 82 96 A Y G < S+ 0 0 1 -3,-3.4 -1,-0.3 -41,-0.2 -2,-0.2 0.173 71.8 138.4 -97.0 21.2 -0.4 -6.3 2.9 83 97 A A < - 0 0 5 -3,-1.1 2,-0.9 1,-0.1 -41,-0.2 -0.356 53.8-140.0 -61.5 135.3 -3.1 -6.0 0.3 84 98 A E + 0 0 32 15,-1.9 2,-0.2 -2,-0.1 17,-0.1 -0.828 31.1 169.4 -95.4 84.0 -4.6 -9.1 -1.2 85 99 A T - 0 0 22 -2,-0.9 10,-0.0 1,-0.2 0, 0.0 -0.427 44.6-113.1 -74.8 172.1 -4.9 -8.0 -4.9 86 100 A D - 0 0 154 -2,-0.2 -1,-0.2 1,-0.1 4,-0.0 0.866 64.4 -56.1 -79.7 -94.6 -5.7 -11.3 -6.6 87 101 A G S S+ 0 0 75 -3,-0.1 -1,-0.1 2,-0.1 -3,-0.0 -0.123 123.2 98.5-112.0 28.7 -2.9 -12.3 -8.8 88 102 A K S S- 0 0 159 2,-0.0 -1,-0.0 0, 0.0 0, 0.0 0.440 76.4-134.5-109.3 0.4 -3.5 -8.9 -10.4 89 103 A V - 0 0 76 1,-0.1 2,-0.5 -3,-0.0 -46,-0.1 0.900 19.5-159.7 49.7 100.0 -1.1 -6.1 -9.1 90 104 A V - 0 0 28 -4,-0.0 -1,-0.1 2,-0.0 2,-0.1 -0.956 20.2-118.3-112.2 130.8 -2.9 -3.0 -8.2 91 105 A E > - 0 0 93 -2,-0.5 3,-2.3 1,-0.1 4,-0.1 -0.406 31.9-110.9 -58.9 140.5 -1.0 0.3 -8.1 92 106 A R G > S+ 0 0 3 1,-0.3 3,-1.0 2,-0.2 -1,-0.1 0.673 114.4 58.8 -50.5 -30.3 -1.1 1.9 -4.5 93 107 A D G 3 S+ 0 0 40 1,-0.2 -1,-0.3 56,-0.1 -2,-0.1 0.409 104.6 55.9 -79.6 1.4 -3.4 4.9 -5.4 94 108 A Q G < S+ 0 0 115 -3,-2.3 -1,-0.2 2,-0.1 -2,-0.2 0.244 74.6 131.1-117.1 10.9 -6.0 2.4 -6.5 95 109 A L < - 0 0 12 -3,-1.0 58,-0.1 -4,-0.1 -15,-0.0 -0.413 32.9-178.9 -68.8 139.0 -6.3 0.3 -3.3 96 110 A E > - 0 0 71 -2,-0.1 3,-1.6 1,-0.1 4,-0.1 -0.891 43.6 -95.7-134.7 165.8 -9.9 -0.3 -2.2 97 111 A P G > S+ 0 0 42 0, 0.0 3,-3.0 0, 0.0 4,-0.3 0.876 116.7 66.6 -46.7 -43.1 -11.7 -2.0 0.6 98 112 A R G > S+ 0 0 157 1,-0.3 3,-1.2 2,-0.2 4,-0.3 0.800 90.3 67.0 -55.6 -28.6 -12.2 -5.2 -1.4 99 113 A H G < S+ 0 0 14 -3,-1.6 -15,-1.9 1,-0.2 -1,-0.3 0.452 106.5 40.0 -64.3 -0.7 -8.5 -5.6 -1.2 100 114 A F G <> S+ 0 0 0 -3,-3.0 4,-3.0 -17,-0.2 -1,-0.2 0.263 78.5 109.5-139.2 7.4 -8.9 -6.2 2.5 101 115 A E H <> S+ 0 0 104 -3,-1.2 4,-3.6 -4,-0.3 5,-0.3 0.906 82.0 49.0 -48.5 -51.7 -12.0 -8.3 2.7 102 116 A K H > S+ 0 0 85 -4,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.917 112.6 48.9 -66.4 -37.5 -10.1 -11.4 3.8 103 117 A W H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.935 115.9 42.5 -62.2 -48.0 -8.2 -9.5 6.4 104 118 A V H X S+ 0 0 1 -4,-3.0 4,-2.5 2,-0.2 5,-0.2 0.976 112.8 51.7 -66.0 -51.9 -11.4 -8.0 7.8 105 119 A R H X S+ 0 0 143 -4,-3.6 4,-1.9 1,-0.3 -1,-0.2 0.842 112.8 47.7 -51.9 -40.4 -13.4 -11.2 7.6 106 120 A W H X S+ 0 0 3 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.3 0.900 110.1 51.3 -69.8 -41.6 -10.6 -12.9 9.5 107 121 A A H <>S+ 0 0 0 -4,-2.5 5,-1.9 2,-0.2 4,-0.4 0.905 110.4 49.3 -60.2 -40.8 -10.4 -10.1 12.1 108 122 A K H ><5S+ 0 0 112 -4,-2.5 3,-1.4 2,-0.2 -2,-0.2 0.942 106.7 54.2 -66.6 -51.0 -14.2 -10.3 12.8 109 123 A R H 3<5S+ 0 0 153 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.946 116.3 39.9 -43.0 -51.2 -14.2 -14.0 13.2 110 124 A H T 3<5S- 0 0 71 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.473 112.4-119.8 -87.1 4.6 -11.4 -13.5 15.9 111 125 A G T < 5 + 0 0 42 -3,-1.4 2,-0.3 -4,-0.4 -3,-0.2 0.991 63.0 144.1 58.4 62.2 -13.0 -10.4 17.4 112 126 A L < - 0 0 20 -5,-1.9 2,-0.3 -39,-0.1 -37,-0.2 -0.863 47.2-126.8-127.5 159.5 -10.1 -8.2 16.7 113 127 A G E -c 75 0A 4 -39,-1.3 -37,-2.4 -2,-0.3 2,-0.4 -0.743 21.6-147.3 -99.3 157.7 -9.7 -4.6 15.7 114 128 A L E -c 76 0A 2 -2,-0.3 2,-0.3 49,-0.3 -37,-0.2 -0.972 8.5-166.1-127.5 140.2 -7.6 -3.5 12.7 115 129 A D E -c 77 0A 10 -39,-2.2 -37,-3.3 -2,-0.4 2,-0.3 -0.915 15.6-145.3-120.7 153.4 -5.6 -0.3 12.2 116 130 A F E -cd 78 167A 0 50,-1.3 52,-1.9 -2,-0.3 -37,-0.2 -0.802 14.7-172.0-119.8 155.7 -4.2 0.8 8.8 117 131 A N E -c 79 0A 6 -39,-0.6 -37,-3.7 -2,-0.3 -36,-0.3 -0.877 23.1-133.1-144.9 124.5 -1.2 2.6 7.3 118 132 A P - 0 0 2 0, 0.0 2,-0.5 0, 0.0 52,-0.4 -0.316 32.8-125.1 -55.1 150.7 -0.7 3.8 3.8 119 133 A T + 0 0 0 1,-0.1 52,-0.1 -40,-0.1 -27,-0.0 -0.934 33.6 171.8-113.4 120.8 2.8 2.7 2.7 120 134 A L + 0 0 0 -2,-0.5 2,-0.3 50,-0.4 3,-0.1 -0.019 54.2 67.5-122.2 29.9 5.2 5.4 1.4 121 135 A F S S+ 0 0 48 1,-0.2 3,-0.1 50,-0.1 6,-0.1 -0.911 76.7 39.9-141.2 167.8 8.5 3.5 1.0 122 136 A S S S+ 0 0 96 -2,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.974 87.7 113.4 56.2 65.1 10.0 0.8 -1.2 123 137 A H S > S- 0 0 31 -3,-0.1 3,-2.0 1,-0.1 4,-0.3 -0.980 79.9-111.4-161.7 148.1 8.5 2.0 -4.4 124 138 A E G > S+ 0 0 145 -2,-0.3 3,-1.1 1,-0.3 4,-0.2 0.895 119.3 49.1 -51.6 -43.0 9.5 3.5 -7.7 125 139 A K G 3 S+ 0 0 86 1,-0.2 -1,-0.3 2,-0.1 5,-0.1 0.364 109.8 53.2 -84.4 8.8 7.9 6.8 -6.8 126 140 A A G X S+ 0 0 12 -3,-2.0 3,-1.1 3,-0.1 -1,-0.2 0.286 76.8 97.6-120.3 12.4 9.6 6.9 -3.4 127 141 A K T < S+ 0 0 127 -3,-1.1 -2,-0.1 -4,-0.3 -3,-0.1 0.768 73.2 63.7 -77.9 -23.1 13.2 6.5 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-0.484 62.2 152.5 -80.3 78.7 5.0 -9.1 44.1 369 383 A L H > S+ 0 0 15 -2,-1.9 4,-3.7 1,-0.2 3,-0.4 0.881 71.4 61.6 -63.8 -38.3 4.0 -8.2 40.6 370 384 A G H > S+ 0 0 7 -3,-0.2 4,-3.7 1,-0.2 5,-0.2 0.830 96.9 55.2 -62.3 -38.3 4.7 -11.8 39.5 371 385 A A H > S+ 0 0 16 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.861 118.5 35.2 -64.3 -39.3 2.0 -13.4 41.7 372 386 A I H X S+ 0 0 0 -4,-0.9 4,-2.9 -3,-0.4 -2,-0.2 0.863 117.3 54.0 -74.6 -45.8 -0.7 -11.1 40.2 373 387 A W H X S+ 0 0 0 -4,-3.7 4,-2.2 1,-0.2 -2,-0.2 0.954 112.8 43.8 -53.1 -52.6 1.0 -11.2 36.7 374 388 A N H X S+ 0 0 24 -4,-3.7 4,-1.7 2,-0.2 -1,-0.2 0.903 112.5 50.9 -58.7 -47.0 0.9 -15.0 36.8 375 389 A E H X S+ 0 0 55 -4,-1.3 4,-2.5 -5,-0.2 3,-0.4 0.938 110.0 51.4 -55.9 -49.5 -2.7 -15.2 38.2 376 390 A Y H X S+ 0 0 5 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.927 105.6 54.7 -51.1 -53.2 -3.8 -12.9 35.4 377 391 A C H <>S+ 0 0 0 -4,-2.2 5,-2.9 1,-0.2 -1,-0.2 0.821 110.9 46.1 -54.0 -36.8 -2.1 -15.0 32.7 378 392 A E H ><5S+ 0 0 106 -4,-1.7 3,-2.3 -3,-0.4 -1,-0.2 0.946 109.6 52.2 -68.9 -49.8 -4.1 -18.1 34.0 379 393 A R H 3<5S+ 0 0 94 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.777 113.1 48.2 -58.5 -22.0 -7.4 -16.3 34.2 380 394 A M T 3<5S- 0 0 52 -4,-1.6 -308,-0.3 -5,-0.2 -1,-0.3 0.326 114.2-117.2-106.2 6.1 -6.7 -15.3 30.6 381 395 A N T < 5S+ 0 0 148 -3,-2.3 -3,-0.2 1,-0.2 -2,-0.1 0.819 70.2 125.7 66.8 37.0 -5.8 -18.7 29.3 382 396 A V S > S+ 0 0 30 1,-0.1 3,-2.6 2,-0.1 4,-0.5 0.411 110.0 101.8 -94.6 -4.3 8.6 -19.2 30.3 387 401 A E H >> + 0 0 93 1,-0.3 3,-1.1 2,-0.2 4,-0.7 0.778 68.0 68.7 -49.2 -27.5 6.0 -21.8 29.6 388 402 A W H 3> S+ 0 0 1 1,-0.3 4,-1.5 -3,-0.2 -1,-0.3 0.751 85.2 67.1 -71.7 -22.0 5.1 -19.9 26.5 389 403 A L H <> S+ 0 0 19 -3,-2.6 4,-3.0 1,-0.2 -1,-0.3 0.857 92.7 62.6 -57.1 -38.0 8.4 -20.8 24.9 390 404 A K H S+ 0 0 13 -4,-1.8 4,-2.4 -3,-0.2 5,-1.7 0.893 109.5 49.8 -78.8 -43.3 5.0 -24.6 16.6 396 410 A E H <>S+ 0 0 42 -4,-3.1 5,-2.1 3,-0.2 -1,-0.2 0.906 110.3 52.6 -60.5 -45.6 8.2 -23.8 14.9 397 411 A K H <5S+ 0 0 156 -4,-2.1 4,-0.2 -5,-0.3 -2,-0.2 0.980 118.5 31.1 -53.9 -63.2 9.1 -27.5 14.6 398 412 A E H <5S+ 0 0 116 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.808 141.3 1.4 -78.1 -31.9 5.9 -28.7 12.9 399 413 A V T >X5S+ 0 0 24 -4,-2.4 3,-3.1 -5,-0.2 4,-0.7 0.734 120.2 60.3-120.1 -61.2 4.9 -25.6 10.9 400 414 A L T 34 0 0 85 0, 0.0 4,-3.7 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 -74.3 40.0 48.1 -2.2 406 6 B Q H > + 0 0 104 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.886 360.0 42.2 -30.7 -57.1 40.0 45.0 0.0 407 7 B F H > S+ 0 0 7 2,-0.2 4,-2.8 1,-0.2 -1,-0.3 0.834 112.9 52.2 -63.9 -37.4 36.2 45.5 0.4 408 8 B E H > S+ 0 0 92 -3,-0.4 4,-1.7 2,-0.2 -2,-0.2 0.932 111.2 47.5 -70.8 -40.0 35.8 46.3 -3.3 409 9 B R H X S+ 0 0 133 -4,-3.7 4,-1.4 2,-0.2 3,-0.2 0.942 114.0 47.0 -61.4 -49.8 37.7 43.1 -4.2 410 10 B A H >X S+ 0 0 3 -4,-2.8 4,-1.7 -5,-0.3 3,-0.6 0.947 108.2 57.3 -54.0 -49.0 35.5 41.1 -1.8 411 11 B K H 3X S+ 0 0 47 -4,-2.8 4,-1.8 1,-0.3 -1,-0.2 0.849 103.4 52.8 -51.5 -41.6 32.4 42.8 -3.2 412 12 B I H 3X S+ 0 0 89 -4,-1.7 4,-2.0 -3,-0.2 -1,-0.3 0.877 104.7 56.4 -65.8 -35.8 33.2 41.5 -6.7 413 13 B E H << S+ 0 0 32 -4,-1.4 4,-0.3 -3,-0.6 -1,-0.2 0.891 113.1 38.1 -68.4 -37.9 33.5 37.9 -5.4 414 14 B Y H ><>S+ 0 0 6 -4,-1.7 5,-1.6 1,-0.2 3,-1.2 0.800 110.8 63.3 -77.9 -26.9 30.0 37.9 -4.0 415 15 B G H ><5S+ 0 0 39 -4,-1.8 3,-2.0 -5,-0.3 -2,-0.2 0.828 88.1 69.0 -66.9 -35.5 28.8 39.9 -6.9 416 16 B Q T 3<5S+ 0 0 148 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.735 99.3 50.7 -52.6 -26.5 29.7 37.1 -9.3 417 17 B W T < 5S- 0 0 42 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.416 125.4 -99.2 -92.9 -0.8 26.8 35.1 -7.7 418 18 B G T < 5S+ 0 0 64 -3,-2.0 2,-0.8 1,-0.2 -3,-0.2 0.558 77.1 146.5 90.5 11.8 24.2 37.8 -8.1 419 19 B I < - 0 0 11 -5,-1.6 2,-1.0 -6,-0.1 -1,-0.2 -0.733 39.0-154.4 -86.3 101.4 24.7 38.8 -4.5 420 20 B D > - 0 0 90 -2,-0.8 4,-1.8 1,-0.2 5,-0.1 -0.654 11.6-176.2 -76.7 105.9 24.3 42.5 -3.9 421 21 B V H > S+ 0 0 1 -2,-1.0 4,-2.5 2,-0.2 5,-0.2 0.862 80.6 60.5 -74.4 -33.6 26.3 43.2 -0.8 422 22 B E H > S+ 0 0 65 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.871 108.4 45.6 -56.4 -38.2 25.3 46.9 -0.7 423 23 B E H > S+ 0 0 108 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.904 109.0 54.2 -73.9 -42.2 21.7 45.7 -0.4 424 24 B A H X S+ 0 0 1 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.908 110.8 46.9 -56.7 -43.5 22.6 43.1 2.3 425 25 B L H X S+ 0 0 5 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.885 107.8 56.5 -65.4 -41.1 24.2 45.8 4.4 426 26 B E H X S+ 0 0 104 -4,-1.6 4,-0.5 -5,-0.2 -2,-0.2 0.932 113.5 39.7 -55.8 -48.3 21.3 48.1 3.9 427 27 B R H >< S+ 0 0 80 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.794 111.8 57.4 -73.4 -26.5 19.0 45.4 5.3 428 28 B L H >< S+ 0 0 4 -4,-2.0 3,-1.4 1,-0.2 -2,-0.2 0.836 96.1 64.1 -73.8 -32.2 21.5 44.4 8.0 429 29 B K H 3< S+ 0 0 101 -4,-2.2 48,-0.6 1,-0.3 -1,-0.2 0.809 103.0 50.9 -57.5 -30.8 21.6 48.0 9.3 430 30 B Q T << S+ 0 0 117 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.2 0.341 79.3 106.2 -94.7 3.5 17.9 47.6 10.3 431 31 B V < - 0 0 15 -3,-1.4 46,-0.2 -4,-0.1 2,-0.2 -0.770 60.2-143.7 -92.5 123.7 17.7 44.4 12.3 432 32 B P - 0 0 63 0, 0.0 2,-0.4 0, 0.0 280,-0.4 -0.564 8.3-159.7 -76.2 146.0 17.2 44.9 16.0 433 33 B I - 0 0 0 -2,-0.2 46,-1.5 278,-0.1 2,-0.9 -0.984 15.4-138.3-127.6 118.9 19.0 42.6 18.5 434 34 B S E -lm 479 713E 6 278,-2.6 280,-3.1 -2,-0.4 2,-0.4 -0.667 19.4-156.7 -84.5 103.3 17.4 42.6 22.0 435 35 B I E -l 480 0E 2 44,-2.2 46,-2.9 -2,-0.9 2,-0.2 -0.665 14.3-124.1 -86.2 127.1 20.2 42.6 24.5 436 36 B H E -l 481 0E 7 -2,-0.4 3,-0.4 278,-0.3 46,-0.2 -0.447 5.7-150.8 -71.5 137.6 19.5 41.3 28.1 437 37 B C S >> S+ 0 0 1 44,-1.9 3,-2.3 1,-0.2 4,-0.6 0.769 84.4 83.1 -76.7 -27.8 20.2 43.5 31.1 438 38 B A G >4>S+ 0 0 18 43,-0.3 5,-2.3 1,-0.3 3,-0.7 0.844 81.0 64.9 -45.9 -40.9 21.0 40.6 33.3 439 39 B Q G 345S+ 0 0 0 -3,-0.4 3,-0.3 1,-0.2 -1,-0.3 0.707 92.8 62.5 -59.2 -23.2 24.6 40.4 32.0 440 40 B G G <45S+ 0 0 1 -3,-2.3 17,-1.8 1,-0.2 -1,-0.2 0.872 119.3 17.7 -76.2 -40.2 25.5 43.9 33.5 441 41 B D T X<5S- 0 0 5 -3,-0.7 3,-1.1 -4,-0.6 -1,-0.2 -0.005 110.1-102.0-120.4 25.6 25.0 43.2 37.2 442 42 B D T 3 5S- 0 0 26 -4,-0.4 -3,-0.2 -3,-0.3 -4,-0.1 0.926 81.7 -53.6 50.0 51.3 25.1 39.4 37.2 443 43 B V T 3 S- 0 0 39 1,-0.1 4,-2.3 -13,-0.0 -1,-0.3 -0.903 85.1-106.3-139.1 155.1 23.0 50.7 40.5 460 70 B P H > S+ 0 0 20 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.924 121.4 53.5 -48.9 -42.9 20.6 51.7 37.8 461 71 B E H > S+ 0 0 115 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.883 108.7 47.5 -63.7 -38.2 23.1 54.5 36.8 462 72 B E H > S+ 0 0 49 1,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.901 111.7 50.7 -72.8 -36.3 26.0 52.1 36.5 463 73 B L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.851 106.7 52.8 -70.8 -35.3 24.0 49.7 34.4 464 74 B R H X S+ 0 0 23 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.911 110.2 48.9 -67.3 -37.1 22.8 52.3 31.9 465 75 B M H X S+ 0 0 100 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.900 110.5 51.7 -66.5 -43.2 26.4 53.4 31.3 466 76 B D H X S+ 0 0 2 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.917 110.6 46.8 -58.8 -48.3 27.4 49.8 30.8 467 77 B L H X S+ 0 0 1 -4,-2.6 4,-3.2 1,-0.2 5,-0.3 0.948 112.7 51.0 -58.7 -45.4 24.7 49.2 28.2 468 78 B E H X S+ 0 0 73 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.891 107.9 53.0 -60.3 -34.3 25.6 52.5 26.5 469 79 B K H >< S+ 0 0 50 -4,-2.2 3,-0.9 1,-0.2 4,-0.3 0.991 114.1 40.9 -64.2 -54.8 29.3 51.4 26.4 470 80 B A H >X S+ 0 0 2 -4,-2.2 3,-2.8 1,-0.3 4,-0.8 0.894 110.0 56.8 -60.9 -45.4 28.5 48.1 24.8 471 81 B L H >< S+ 0 0 32 -4,-3.2 3,-0.8 1,-0.3 -1,-0.3 0.845 103.0 58.8 -54.7 -30.1 25.9 49.5 22.4 472 82 B S T << S+ 0 0 55 -4,-1.5 -1,-0.3 -3,-0.9 -2,-0.2 0.530 107.5 43.9 -81.7 -8.4 28.6 51.9 21.2 473 83 B L T <4 S+ 0 0 3 -3,-2.8 -1,-0.3 -4,-0.3 -2,-0.2 0.383 100.7 80.2-110.1 -0.7 30.8 49.0 20.2 474 84 B I S << S- 0 0 3 -4,-0.8 4,-0.1 -3,-0.8 -1,-0.0 -0.935 84.7-123.8-108.3 119.8 28.0 47.0 18.6 475 85 B P + 0 0 0 0, 0.0 2,-0.2 0, 0.0 310,-0.1 -0.348 69.8 14.6 -65.4 140.8 27.1 48.2 15.0 476 86 B G S S- 0 0 30 308,-0.4 2,-0.4 305,-0.1 -46,-0.1 -0.525 93.3 -59.1 102.8-161.8 23.5 49.2 14.4 477 87 B K + 0 0 140 -48,-0.6 2,-0.2 -46,-0.2 38,-0.1 -0.997 57.8 160.6-133.9 134.1 20.5 50.0 16.5 478 88 B H - 0 0 8 -2,-0.4 39,-0.9 -46,-0.2 2,-0.3 -0.487 29.4-108.3-138.6-169.2 19.0 47.6 18.9 479 89 B R E -ln 434 517E 30 -46,-1.5 -44,-2.2 37,-0.2 2,-0.4 -0.806 19.9-123.8-130.7 170.1 16.8 47.1 22.0 480 90 B V E -ln 435 518E 0 37,-2.1 39,-2.2 -2,-0.3 2,-0.6 -0.955 17.3-142.6-120.2 140.5 17.3 46.3 25.6 481 91 B N E -ln 436 519E 10 -46,-2.9 -44,-1.9 -2,-0.4 -43,-0.3 -0.902 24.0-161.6-111.5 110.4 15.5 43.4 27.2 482 92 B L - 0 0 0 37,-3.2 39,-0.4 -2,-0.6 2,-0.3 -0.705 11.9-149.2-105.9 146.8 14.3 44.2 30.8 483 93 B H > - 0 0 34 -2,-0.3 3,-1.9 37,-0.2 40,-0.0 -0.821 28.3-117.3-104.1 149.8 13.3 42.1 33.7 484 94 B A G > S+ 0 0 1 37,-2.2 3,-1.7 -2,-0.3 -1,-0.1 0.734 111.2 66.6 -51.8 -31.3 10.8 43.2 36.4 485 95 B I G 3 S+ 0 0 12 1,-0.3 -39,-2.9 -40,-0.1 -38,-0.4 0.615 86.9 73.8 -73.3 -6.3 13.4 43.1 39.3 486 96 B Y G < S+ 0 0 1 -3,-1.9 -1,-0.3 -41,-0.3 -2,-0.2 0.295 71.9 131.8 -83.8 8.5 15.0 46.0 37.4 487 97 B A < - 0 0 5 -3,-1.7 2,-0.7 1,-0.1 17,-0.2 -0.311 54.0-143.4 -60.1 142.0 12.1 48.2 38.7 488 98 B E + 0 0 25 15,-2.4 17,-0.2 -41,-0.0 18,-0.1 -0.852 25.4 174.3-112.6 84.2 13.1 51.5 40.2 489 99 B T - 0 0 23 -2,-0.7 10,-0.0 1,-0.2 14,-0.0 -0.126 48.4 -99.7 -64.8-177.0 10.7 52.0 43.0 490 100 B D - 0 0 150 1,-0.0 -1,-0.2 -2,-0.0 3,-0.1 0.565 68.7 -65.4 -72.4-116.7 11.8 55.0 44.8 491 101 B G S S+ 0 0 61 -3,-0.1 -1,-0.0 1,-0.1 -2,-0.0 0.033 117.9 112.5-102.8 24.4 13.7 53.8 47.8 492 102 B K S S- 0 0 157 1,-0.0 -1,-0.1 2,-0.0 -4,-0.0 0.828 72.1-130.0 -72.5 -49.3 10.2 52.5 48.6 493 103 B V - 0 0 97 1,-0.1 2,-0.4 -3,-0.1 -2,-0.1 0.731 27.8-173.4 86.5 100.0 9.8 48.6 48.4 494 104 B V - 0 0 32 2,-0.0 -1,-0.1 0, 0.0 5,-0.1 -0.989 25.3-112.6-130.7 132.2 6.9 47.5 46.2 495 105 B E > - 0 0 82 -2,-0.4 3,-2.8 1,-0.1 4,-0.3 -0.220 28.2-114.7 -65.1 149.1 5.6 43.9 45.8 496 106 B R G > S+ 0 0 2 1,-0.3 3,-0.9 2,-0.2 -1,-0.1 0.816 118.0 53.4 -53.9 -36.6 6.0 42.2 42.4 497 107 B D G 3 S+ 0 0 35 1,-0.2 -1,-0.3 56,-0.1 -2,-0.1 0.576 108.6 53.6 -68.7 -10.5 2.2 42.1 41.9 498 108 B Q G < S+ 0 0 105 -3,-2.8 -1,-0.2 2,-0.1 -2,-0.2 0.289 76.5 126.5-112.8 6.2 2.2 45.9 42.6 499 109 B L < - 0 0 12 -3,-0.9 58,-0.1 -4,-0.3 -4,-0.0 -0.411 38.9-171.1 -63.2 143.3 4.7 47.0 40.1 500 110 B E > - 0 0 77 -2,-0.1 3,-3.4 1,-0.1 4,-0.3 -0.922 39.4 -99.3-136.4 159.4 3.5 49.7 37.7 501 111 B P G > S+ 0 0 38 0, 0.0 3,-3.3 0, 0.0 4,-0.1 0.870 119.8 63.9 -44.7 -44.1 4.6 51.5 34.5 502 112 B R G > S+ 0 0 147 1,-0.3 3,-0.6 2,-0.2 4,-0.2 0.627 90.4 67.3 -59.7 -12.7 5.9 54.4 36.6 503 113 B H G < S+ 0 0 12 -3,-3.4 -15,-2.4 1,-0.2 -1,-0.3 0.517 109.6 36.1 -84.1 -1.4 8.3 52.0 38.1 504 114 B F G <> S+ 0 0 0 -3,-3.3 4,-2.2 -4,-0.3 -1,-0.2 0.136 81.7 109.7-131.2 23.7 10.0 51.8 34.7 505 115 B E H <> S+ 0 0 78 -3,-0.6 4,-2.6 2,-0.2 5,-0.2 0.822 77.6 52.8 -80.0 -28.5 9.7 55.3 33.5 506 116 B K H > S+ 0 0 86 -4,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.933 108.5 54.3 -64.5 -43.1 13.4 56.2 33.8 507 117 B W H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.947 111.5 43.4 -51.8 -52.5 14.0 53.1 31.7 508 118 B V H >X S+ 0 0 4 -4,-2.2 4,-2.4 2,-0.2 3,-0.5 0.972 111.6 52.4 -58.7 -56.6 11.7 54.3 29.0 509 119 B R H 3X S+ 0 0 120 -4,-2.6 4,-2.2 1,-0.3 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C S >> S+ 0 0 1 44,-1.9 3,-2.5 -2,-0.2 4,-0.6 0.832 83.9 80.7 -78.9 -31.2 39.8 3.8 -1.4 1250 38 D A G >4>S+ 0 0 19 43,-0.4 5,-1.7 1,-0.3 3,-1.2 0.855 82.8 65.0 -39.4 -48.6 36.3 2.5 -0.4 1251 39 D Q G 345S+ 0 0 0 277,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.637 93.7 61.6 -53.7 -18.6 34.6 5.8 -1.7 1252 40 D G G <45S+ 0 0 0 -3,-2.5 17,-2.5 1,-0.2 -1,-0.2 0.840 120.0 18.6 -85.2 -32.2 35.6 5.1 -5.3 1253 41 D D T X<5S- 0 0 5 -3,-1.2 3,-1.1 -4,-0.6 -2,-0.2 -0.047 109.8-101.7-128.0 30.6 33.7 1.9 -5.8 1254 42 D D T 3 5S- 0 0 26 -4,-0.4 -3,-0.2 1,-0.3 -4,-0.1 0.867 79.4 -55.9 56.0 44.2 31.1 2.0 -3.0 1255 43 D V T 3 S- 0 0 52 1,-0.1 4,-3.2 -13,-0.0 5,-0.2 -0.938 80.7-107.9-135.0 159.4 38.0 -2.3 -11.8 1272 70 D P H > S+ 0 0 16 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.848 121.0 50.2 -52.9 -39.0 41.5 -1.6 -10.3 1273 71 D E H > S+ 0 0 102 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.953 114.0 45.9 -65.2 -46.4 42.5 0.3 -13.4 1274 72 D E H > S+ 0 0 33 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.888 113.8 48.1 -62.9 -44.5 39.3 2.4 -13.2 1275 73 D L H X S+ 0 0 0 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.868 112.0 49.0 -67.9 -38.0 39.7 3.0 -9.4 1276 74 D R H X S+ 0 0 20 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.833 110.9 50.4 -64.5 -35.5 43.3 4.0 -9.7 1277 75 D M H X S+ 0 0 82 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.933 110.7 50.4 -70.5 -47.7 42.4 6.4 -12.6 1278 76 D D H X S+ 0 0 1 -4,-2.4 4,-1.7 2,-0.2 3,-0.3 0.930 109.1 51.8 -46.4 -56.5 39.7 7.8 -10.4 1279 77 D L H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 3,-0.5 0.950 106.6 51.2 -53.0 -54.3 42.1 8.2 -7.5 1280 78 D E H X S+ 0 0 71 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.857 106.8 58.1 -52.0 -33.3 44.7 10.2 -9.6 1281 79 D K H X S+ 0 0 38 -4,-1.6 4,-0.6 -3,-0.3 -1,-0.2 0.921 104.4 48.3 -64.1 -45.1 41.8 12.4 -10.7 1282 80 D A H >X S+ 0 0 2 -4,-1.7 3,-0.9 -3,-0.5 4,-0.7 0.869 109.6 51.9 -66.3 -38.1 41.0 13.4 -7.1 1283 81 D L H 3< S+ 0 0 35 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.761 96.8 69.0 -68.8 -26.4 44.7 14.2 -6.3 1284 82 D S H 3< S+ 0 0 54 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.856 110.5 35.5 -47.9 -36.3 44.8 16.4 -9.4 1285 83 D L H << S+ 0 0 4 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.2 0.515 102.7 80.2-106.9 -10.0 42.5 18.6 -7.4 1286 84 D I S < S- 0 0 2 -4,-0.7 2,-0.1 -3,-0.2 4,-0.1 -0.904 78.8-130.7-101.6 120.7 43.8 18.1 -3.9 1287 85 D P + 0 0 1 0, 0.0 2,-0.2 0, 0.0 310,-0.1 -0.441 67.5 21.6 -74.0 140.5 46.9 20.3 -3.1 1288 86 D G S S- 0 0 25 308,-0.4 2,-0.4 -2,-0.1 -46,-0.1 -0.544 95.1 -59.3 105.6-169.3 50.0 18.6 -1.6 1289 87 D K + 0 0 127 -48,-0.7 -44,-0.2 -46,-0.2 2,-0.1 -0.969 56.9 169.2-126.6 142.0 51.1 15.1 -1.4 1290 88 D H - 0 0 7 -2,-0.4 39,-1.6 -46,-0.2 2,-0.3 -0.308 26.6-116.4-134.3-160.4 49.2 12.2 0.1 1291 89 D R E -hi12461329L 33 -46,-1.7 -44,-1.8 37,-0.2 2,-0.4 -0.871 21.4-129.1-145.6 168.5 48.6 8.5 0.7 1292 90 D V E -hi12471330L 1 37,-1.6 39,-2.1 -2,-0.3 2,-0.9 -1.000 13.8-139.4-133.5 128.4 45.9 6.0 -0.1 1293 91 D N E -hi12481331L 9 -46,-3.6 -44,-1.9 -2,-0.4 -43,-0.4 -0.788 26.8-161.5 -93.5 102.6 44.3 3.8 2.5 1294 92 D L E - i 01332L 0 37,-2.2 39,-1.2 -2,-0.9 2,-0.3 -0.486 8.3-146.0 -87.7 150.0 43.8 0.4 1.0 1295 93 D H E > - i 01333L 43 37,-0.2 3,-2.2 -2,-0.2 40,-0.1 -0.865 25.2-117.4-112.2 149.5 41.5 -2.5 2.1 1296 94 D A G > S+ 0 0 0 37,-1.9 3,-1.7 -2,-0.3 -1,-0.1 0.859 110.7 62.0 -53.5 -41.5 42.3 -6.2 1.8 1297 95 D I G 3 S+ 0 0 11 1,-0.3 -39,-3.0 -40,-0.1 -1,-0.3 0.575 87.4 74.3 -66.5 -4.9 39.4 -6.9 -0.6 1298 96 D Y G < S+ 0 0 2 -3,-2.2 -1,-0.3 -41,-0.2 -2,-0.2 0.208 71.9 134.5 -92.8 13.3 41.0 -4.6 -3.1 1299 97 D A < - 0 0 6 -3,-1.7 2,-0.8 1,-0.1 17,-0.2 -0.265 56.5-132.1 -53.0 141.9 43.6 -7.3 -3.8 1300 98 D E + 0 0 26 15,-2.7 2,-0.5 14,-0.0 17,-0.2 -0.886 32.1 167.8-105.9 99.4 44.5 -8.0 -7.4 1301 99 D T - 0 0 21 -2,-0.8 4,-0.1 1,-0.3 14,-0.0 -0.943 39.3-126.5-101.1 132.4 44.4 -11.8 -7.9 1302 100 D D S S- 0 0 149 -2,-0.5 -1,-0.3 1,-0.2 3,-0.1 0.881 72.3 -44.0 -54.4 -92.9 44.5 -12.3 -11.6 1303 101 D G S S+ 0 0 71 -3,-0.1 -1,-0.2 1,-0.1 -3,-0.0 -0.071 118.8 108.0-113.8 33.3 41.5 -14.5 -12.5 1304 102 D K - 0 0 130 2,-0.0 -2,-0.1 0, 0.0 -1,-0.1 0.703 68.0-138.6-101.2 -28.7 42.5 -16.6 -9.6 1305 103 D V - 0 0 96 1,-0.2 2,-0.4 -4,-0.1 -46,-0.1 0.993 23.5-173.9 62.8 83.4 40.3 -16.5 -6.4 1306 104 D V - 0 0 37 1,-0.0 -46,-0.2 2,-0.0 -1,-0.2 -0.919 22.9-122.9-107.0 133.6 42.5 -16.4 -3.3 1307 105 D E > - 0 0 105 -2,-0.4 3,-0.7 1,-0.1 4,-0.1 -0.079 29.5-106.4 -63.7 171.8 40.9 -16.7 0.2 1308 106 D R G > S+ 0 0 2 1,-0.2 3,-1.3 2,-0.2 -1,-0.1 0.880 118.3 53.6 -75.1 -35.8 41.6 -13.9 2.7 1309 107 D D G 3 S+ 0 0 40 1,-0.2 -1,-0.2 56,-0.1 56,-0.1 0.559 106.1 57.9 -69.8 -5.9 44.1 -15.8 4.9 1310 108 D Q G < S+ 0 0 112 -3,-0.7 -1,-0.2 2,-0.1 -2,-0.2 0.372 76.1 131.3-108.1 2.4 46.0 -16.6 1.7 1311 109 D L < - 0 0 11 -3,-1.3 58,-0.2 -4,-0.1 -3,-0.1 -0.328 33.5-179.2 -65.8 132.9 46.6 -12.9 0.8 1312 110 D E > - 0 0 84 -2,-0.1 3,-1.6 56,-0.1 -2,-0.1 -0.848 43.7 -97.2-135.3 161.3 50.3 -12.0 -0.1 1313 111 D P G > S+ 0 0 41 0, 0.0 3,-1.3 0, 0.0 4,-0.1 0.724 117.4 64.6 -51.1 -28.3 52.4 -9.1 -1.2 1314 112 D R G > S+ 0 0 170 1,-0.3 3,-1.4 2,-0.2 4,-0.4 0.851 90.2 65.5 -67.5 -29.5 52.1 -10.1 -4.8 1315 113 D H G < S+ 0 0 17 -3,-1.6 -15,-2.7 1,-0.3 -1,-0.3 0.335 109.8 38.5 -74.5 8.2 48.4 -9.4 -4.7 1316 114 D F G <> S+ 0 0 0 -3,-1.3 4,-2.1 -17,-0.2 -1,-0.3 0.209 81.2 108.0-138.2 12.1 49.2 -5.7 -4.2 1317 115 D E H <> S+ 0 0 99 -3,-1.4 4,-2.7 2,-0.2 5,-0.2 0.832 79.4 52.6 -62.9 -39.7 52.2 -5.3 -6.5 1318 116 D K H > S+ 0 0 77 -4,-0.4 4,-3.1 1,-0.2 -1,-0.2 0.968 110.2 49.2 -62.3 -49.1 50.3 -3.3 -9.0 1319 117 D W H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.872 112.9 46.7 -52.2 -44.8 49.1 -0.9 -6.2 1320 118 D V H X S+ 0 0 6 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.895 112.2 49.4 -72.2 -41.1 52.7 -0.5 -4.9 1321 119 D R H X S+ 0 0 120 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.951 114.6 46.6 -58.4 -51.0 54.2 0.1 -8.4 1322 120 D W H X S+ 0 0 14 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.932 111.1 49.3 -57.6 -52.2 51.4 2.7 -9.0 1323 121 D A H <>S+ 0 0 0 -4,-2.9 5,-3.5 1,-0.2 -1,-0.2 0.840 110.2 54.0 -58.4 -35.6 51.8 4.5 -5.7 1324 122 D K H ><5S+ 0 0 118 -4,-1.8 3,-1.5 3,-0.2 -1,-0.2 0.939 105.6 49.4 -64.0 -52.9 55.6 4.7 -6.2 1325 123 D R H 3<5S+ 0 0 189 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.907 118.3 41.5 -54.7 -43.5 55.4 6.4 -9.6 1326 124 D H T 3<5S- 0 0 77 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.375 114.6-121.5 -87.4 5.3 53.0 8.9 -8.2 1327 125 D G T < 5 + 0 0 25 -3,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.871 59.1 146.7 60.3 46.3 55.0 9.2 -5.0 1328 126 D L < - 0 0 15 -5,-3.5 -37,-0.2 -6,-0.1 -1,-0.2 -0.852 44.6-130.1-114.3 147.4 52.2 8.2 -2.5 1329 127 D G E -i 1291 0L 5 -39,-1.6 -37,-1.6 -2,-0.3 2,-0.4 -0.461 23.2-143.2 -83.1 164.4 52.3 6.3 0.8 1330 128 D L E -i 1292 0L 1 -39,-0.2 -37,-0.2 49,-0.2 2,-0.2 -0.991 11.6-166.7-135.9 127.3 49.9 3.4 1.3 1331 129 D D E -i 1293 0L 14 -39,-2.1 -37,-2.2 -2,-0.4 2,-0.4 -0.592 14.9-148.5-102.9 169.7 48.1 2.4 4.4 1332 130 D F E -ij12941383L 0 50,-3.5 52,-2.1 -2,-0.2 -37,-0.2 -0.990 16.2-173.5-146.6 148.0 46.3 -1.0 4.9 1333 131 D N E -i 1295 0L 6 -39,-1.2 -37,-1.9 -2,-0.4 52,-0.2 -0.995 24.0-130.9-136.1 132.8 43.4 -2.6 6.6 1334 132 D P - 0 0 2 0, 0.0 2,-0.5 0, 0.0 52,-0.3 -0.381 30.7-123.8 -64.5 165.5 42.4 -6.3 6.8 1335 133 D T + 0 0 0 -40,-0.1 52,-0.1 1,-0.1 50,-0.0 -0.946 33.9 169.9-119.5 113.0 38.8 -6.8 6.0 1336 134 D L + 0 0 0 50,-0.5 2,-0.2 -2,-0.5 3,-0.1 0.040 58.4 63.9-115.4 28.5 36.6 -8.6 8.6 1337 135 D F S S+ 0 0 52 1,-0.1 3,-0.1 50,-0.1 6,-0.1 -0.800 76.9 47.3-138.2 175.0 33.1 -8.0 7.2 1338 136 D S S S+ 0 0 94 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.915 89.3 117.4 51.5 52.6 31.1 -9.1 4.0 1339 137 D H S > S- 0 0 29 -3,-0.1 3,-2.5 1,-0.1 -1,-0.2 -0.995 78.0-121.5-151.2 138.3 32.2 -12.7 4.3 1340 138 D E G > S+ 0 0 133 -2,-0.3 3,-0.9 1,-0.3 4,-0.2 0.806 116.5 51.7 -30.8 -46.5 30.8 -16.1 4.9 1341 139 D K G 3 S+ 0 0 74 1,-0.2 -1,-0.3 2,-0.1 18,-0.1 0.352 108.2 50.5 -92.5 9.3 33.0 -16.4 8.1 1342 140 D A G X S+ 0 0 13 -3,-2.5 3,-1.0 3,-0.1 -1,-0.2 0.081 77.5 103.6-122.8 20.6 31.7 -13.1 9.5 1343 141 D K T < S+ 0 0 143 -3,-0.9 -2,-0.1 1,-0.3 -3,-0.1 0.717 71.0 62.9 -80.7 -18.3 28.0 -13.7 9.1 1344 142 D D T 3 S- 0 0 89 2,-0.4 -1,-0.3 -4,-0.2 3,-0.1 0.491 114.3-117.2 -83.0 2.5 27.4 -14.5 12.8 1345 143 D G S < S+ 0 0 30 -3,-1.0 45,-1.3 1,-0.3 2,-0.3 0.458 87.6 101.6 73.5 -0.6 28.5 -10.9 13.3 1346 144 D L + 0 0 6 43,-0.2 -2,-0.4 1,-0.1 -1,-0.3 -0.876 35.3 151.9-111.7 149.7 31.4 -12.2 15.3 1347 145 D T S > S+ 0 0 0 -2,-0.3 3,-0.6 -3,-0.1 12,-0.2 0.457 75.6 17.8-135.6 -80.8 35.0 -12.6 14.1 1348 146 D L T 3 S+ 0 0 0 1,-0.2 60,-0.3 11,-0.1 61,-0.1 0.586 136.1 44.2 -81.4 -6.3 38.1 -12.5 16.3 1349 147 D A T 3 S+ 0 0 0 58,-0.1 -1,-0.2 59,-0.1 55,-0.1 0.245 81.2 130.1-125.3 8.3 35.6 -13.1 19.1 1350 148 D H < - 0 0 19 -3,-0.6 -3,-0.1 1,-0.1 6,-0.1 -0.184 65.8-124.8 -52.0 153.3 33.6 -15.8 17.5 1351 149 D P S S+ 0 0 38 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.803 89.3 90.3 -73.6 -26.2 33.2 -18.9 19.8 1352 150 D D > - 0 0 81 1,-0.2 4,-2.8 2,-0.0 3,-0.3 -0.588 66.8-154.3 -78.5 114.3 34.6 -21.1 17.0 1353 151 D Q H > S+ 0 0 117 -2,-0.6 4,-3.1 1,-0.2 5,-0.2 0.826 93.4 55.6 -58.5 -33.6 38.3 -21.5 17.2 1354 152 D A H > S+ 0 0 66 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.928 110.0 44.4 -67.6 -47.3 38.6 -22.2 13.5 1355 153 D I H > S+ 0 0 21 -3,-0.3 4,-1.8 2,-0.2 5,-0.2 0.930 114.2 50.6 -57.3 -48.6 36.9 -19.0 12.5 1356 154 D R H X S+ 0 0 43 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.933 113.7 46.1 -52.3 -49.8 39.0 -17.1 15.2 1357 155 D Q H X S+ 0 0 55 -4,-3.1 4,-3.5 1,-0.2 -2,-0.2 0.873 106.8 58.3 -57.1 -45.5 42.1 -18.7 13.6 1358 156 D F H X S+ 0 0 21 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.892 111.8 39.2 -57.3 -43.4 41.0 -17.9 10.1 1359 157 D W H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.890 113.0 54.8 -79.3 -41.0 40.8 -14.2 10.8 1360 158 D I H >X S+ 0 0 2 -4,-2.5 4,-2.5 -5,-0.2 3,-0.5 0.962 109.9 49.3 -49.7 -51.0 43.9 -14.2 12.9 1361 159 D D H 3X S+ 0 0 65 -4,-3.5 4,-2.5 1,-0.3 -2,-0.2 0.950 111.2 48.6 -55.8 -50.2 45.6 -15.8 9.9 1362 160 D H H 3X S+ 0 0 0 -4,-2.3 4,-1.3 1,-0.2 -1,-0.3 0.764 110.5 50.9 -58.9 -30.5 44.2 -13.1 7.7 1363 161 D C H X S+ 0 0 35 -4,-2.5 4,-2.2 1,-0.2 3,-0.8 0.950 108.5 55.9 -54.0 -50.7 48.9 -11.6 10.2 1365 163 D A H 3X S+ 0 0 8 -4,-2.5 4,-2.4 1,-0.3 -1,-0.2 0.880 108.1 46.6 -46.9 -47.3 48.8 -11.8 6.4 1366 164 D S H 3X S+ 0 0 0 -4,-1.3 4,-1.6 1,-0.2 -1,-0.3 0.715 107.3 55.5 -80.5 -19.6 47.9 -8.1 6.2 1367 165 D R H S+ 0 0 1 -4,-2.4 4,-0.9 -3,-0.4 5,-0.9 0.972 111.1 45.9 -57.5 -57.2 56.8 0.1 4.2 1375 173 D K H <5S+ 0 0 96 -4,-2.1 3,-0.5 1,-0.2 -2,-0.2 0.911 117.7 41.8 -49.7 -54.5 59.9 -1.4 2.5 1376 174 D E H <5S+ 0 0 74 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.878 121.1 38.0 -67.8 -42.2 58.9 -0.5 -1.1 1377 175 D L H <5S- 0 0 23 -4,-2.3 -1,-0.2 2,-0.3 -2,-0.2 0.371 101.8-129.7 -94.7 1.4 57.4 2.9 -0.6 1378 176 D E T <5S+ 0 0 177 -4,-0.9 -3,-0.2 -3,-0.5 -4,-0.1 0.723 80.3 84.7 56.3 30.5 60.1 3.9 2.0 1379 177 D T S S+ 0 0 16 -2,-0.3 4,-0.5 -3,-0.1 -1,-0.1 0.650 78.8 54.2 -96.1 -16.0 30.2 -8.6 28.0 1399 197 D L H > S+ 0 0 28 2,-0.2 4,-2.1 3,-0.1 3,-0.4 0.913 97.5 51.9 -89.0 -50.7 33.4 -10.2 29.3 1400 198 D T H > S+ 0 0 35 1,-0.3 4,-1.8 2,-0.2 5,-0.2 0.898 107.1 54.8 -68.7 -30.0 34.1 -13.5 27.5 1401 199 D P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.909 111.4 45.2 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