==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-OCT-10 3PF8 . COMPND 2 MOLECULE: CINNAMOYL ESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS JOHNSONII; . AUTHOR P.J.STOGIOS,K.K.LAI,C.VU,X.XU,H.CUI,S.MOLLOY,C.F.GONZALEZ,A. . 495 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19034.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 71 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 7 1.4 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 . 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 . 40 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 127 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 3 0 2 1 2 0 3 2 0 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 3 1 4 2 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 . 1 2 1 3 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 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 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 N 0 0 54 0, 0.0 28,-0.1 0, 0.0 29,-0.0 0.000 360.0 360.0 360.0 153.3 33.7 -2.6 30.2 2 -4 A L + 0 0 33 25,-0.1 3,-0.3 1,-0.1 27,-0.1 0.791 360.0 53.8 -83.5 -36.0 35.5 -4.6 33.0 3 -3 A Y S S+ 0 0 95 1,-0.2 2,-1.4 24,-0.0 -1,-0.1 0.948 107.0 47.8 -66.4 -56.5 39.1 -3.6 32.0 4 -2 A F S S+ 0 0 73 2,-0.1 2,-0.3 22,-0.0 -1,-0.2 -0.647 88.6 146.8 -89.7 75.5 38.7 0.2 32.0 5 -1 A Q + 0 0 39 -2,-1.4 2,-0.4 -3,-0.3 -3,-0.1 -0.899 32.3 44.5-119.5 147.6 36.9 0.4 35.4 6 0 A G S S- 0 0 28 19,-1.0 19,-0.4 -2,-0.3 2,-0.3 -0.911 106.8 -6.9 129.5 -95.9 36.8 2.9 38.3 7 1 A M + 0 0 122 -2,-0.4 2,-0.3 17,-0.2 17,-0.2 -0.919 55.8 176.6-134.5 155.4 36.5 6.5 37.0 8 2 A A E -A 23 0A 35 15,-1.1 15,-2.2 -2,-0.3 2,-0.6 -0.980 26.5-130.7-155.9 150.5 36.4 8.3 33.5 9 3 A T E -A 22 0A 90 -2,-0.3 2,-0.4 13,-0.2 13,-0.2 -0.941 30.8-172.5-110.9 110.4 35.9 11.9 32.2 10 4 A I E -A 21 0A 32 11,-0.8 11,-3.2 -2,-0.6 2,-0.5 -0.864 12.4-153.3-109.4 138.7 33.4 12.0 29.3 11 5 A T E -A 20 0A 84 -2,-0.4 9,-0.2 9,-0.2 2,-0.2 -0.938 15.1-175.5-117.2 114.2 32.5 14.9 26.9 12 6 A L E -A 19 0A 26 7,-2.4 7,-1.7 -2,-0.5 2,-0.4 -0.581 17.1-134.8-101.8 163.9 29.1 15.1 25.2 13 7 A E E +A 18 0A 125 5,-0.2 2,-0.4 -2,-0.2 5,-0.2 -0.967 19.2 178.7-119.5 132.9 27.6 17.6 22.7 14 8 A R E > -A 17 0A 10 3,-1.7 3,-1.9 -2,-0.4 75,-0.1 -0.912 69.9 -41.9-141.5 112.6 24.1 19.1 22.9 15 9 A D T 3 S- 0 0 13 -2,-0.4 247,-0.2 1,-0.3 2,-0.1 0.807 124.9 -36.0 34.2 57.9 22.9 21.6 20.3 16 10 A G T 3 S+ 0 0 32 1,-0.3 -1,-0.3 245,-0.1 245,-0.2 -0.197 118.8 95.1 100.4 -40.9 26.2 23.5 20.1 17 11 A L E < -A 14 0A 15 -3,-1.9 -3,-1.7 243,-0.5 2,-0.5 -0.274 69.5-120.9 -80.6 169.0 27.4 23.4 23.8 18 12 A Q E -A 13 0A 81 -5,-0.2 57,-2.3 -3,-0.1 2,-0.8 -0.957 15.5-161.4-119.6 116.2 29.8 20.9 25.6 19 13 A L E -A 12 0A 2 -7,-1.7 -7,-2.4 -2,-0.5 2,-0.3 -0.837 12.4-157.4 -97.6 98.0 28.6 18.8 28.6 20 14 A V E +A 11 0A 18 -2,-0.8 47,-1.8 -9,-0.2 -9,-0.2 -0.625 23.5 172.9 -79.3 134.0 31.7 17.5 30.6 21 15 A G E -AB 10 66A 0 -11,-3.2 -11,-0.8 -2,-0.3 2,-0.4 -0.704 34.1-120.1-135.8-176.2 31.0 14.4 32.7 22 16 A T E -AB 9 65A 2 43,-2.5 43,-1.9 -13,-0.2 2,-0.4 -0.990 20.4-166.0-134.4 120.0 32.1 11.6 35.0 23 17 A R E -AB 8 64A 10 -15,-2.2 -15,-1.1 -2,-0.4 2,-0.5 -0.917 2.6-163.3-111.0 132.3 31.5 7.8 34.2 24 18 A E E - B 0 63A 8 39,-2.4 39,-1.7 -2,-0.4 -17,-0.2 -0.981 12.9-164.9-117.0 113.0 31.9 5.1 36.9 25 19 A E - 0 0 25 -2,-0.5 -19,-1.0 -19,-0.4 36,-0.1 -0.854 5.0-162.5-104.7 138.9 32.2 1.6 35.5 26 20 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 32,-0.1 0.047 39.2 -72.0 -92.3-151.9 31.9 -1.7 37.4 27 21 A F S S+ 0 0 137 30,-0.2 3,-0.1 -22,-0.1 -25,-0.1 -0.776 91.2 48.6-106.4 152.4 33.1 -5.2 36.3 28 22 A G S S- 0 0 34 -2,-0.3 3,-0.1 1,-0.1 74,-0.0 0.032 82.3-103.9 97.7 152.9 31.4 -7.3 33.5 29 23 A E S S+ 0 0 105 1,-0.2 2,-0.3 -28,-0.1 -1,-0.1 0.190 106.5 52.8 -99.5 17.1 30.4 -6.1 30.0 30 24 A I S S+ 0 0 99 -3,-0.1 2,-0.3 2,-0.0 73,-0.2 -0.880 70.5 143.7-148.9 109.7 26.6 -5.8 30.7 31 25 A Y E -c 103 0A 4 71,-3.0 73,-2.8 -2,-0.3 30,-0.1 -0.945 48.8 -96.4-144.1 162.7 25.6 -3.7 33.8 32 26 A D E - 0 0 10 28,-0.5 30,-2.1 -2,-0.3 2,-0.4 -0.445 38.0-138.8 -81.3 156.2 22.7 -1.3 34.8 33 27 A M E -cd 106 62A 0 72,-3.4 74,-2.6 28,-0.2 2,-0.4 -0.977 10.3-159.3-129.9 131.8 23.2 2.5 34.5 34 28 A A E -cd 107 63A 0 28,-2.5 30,-2.9 -2,-0.4 2,-0.6 -0.889 9.7-149.9-107.7 128.2 22.3 5.4 36.7 35 29 A I E -cd 108 64A 3 72,-2.9 74,-2.7 -2,-0.4 2,-0.5 -0.893 19.9-155.9 -95.5 118.1 22.0 9.0 35.3 36 30 A I E -cd 109 65A 2 28,-3.7 30,-0.8 -2,-0.6 2,-0.5 -0.904 8.5-167.3-106.4 117.9 22.9 11.4 38.2 37 31 A F E -c 110 0A 3 72,-2.6 74,-2.7 -2,-0.5 77,-0.2 -0.898 6.7-153.0-110.1 126.8 21.7 15.1 38.2 38 32 A H - 0 0 2 28,-0.5 2,-0.1 -2,-0.5 6,-0.1 -0.327 23.8-116.4 -81.7 168.7 23.0 17.8 40.5 39 33 A G > - 0 0 4 74,-0.2 3,-1.9 1,-0.2 73,-0.1 -0.343 51.1 -34.8-103.0-177.3 20.8 20.7 41.6 40 34 A F T 3 S- 0 0 26 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 -0.131 123.3 -4.1 -47.9 119.2 20.7 24.5 41.2 41 35 A T T 3 S+ 0 0 75 1,-0.2 -1,-0.3 -3,-0.1 31,-0.1 0.492 113.1 106.9 71.6 12.0 24.2 26.3 41.1 42 36 A A < - 0 0 32 -3,-1.9 30,-0.3 29,-0.1 2,-0.3 -0.137 58.0-128.0-104.1-162.3 26.0 23.0 41.8 43 37 A N - 0 0 56 28,-0.1 3,-0.2 24,-0.1 -4,-0.2 -0.937 30.1 -97.7-147.4 165.6 28.2 20.5 39.9 44 38 A R S S+ 0 0 14 -2,-0.3 2,-0.4 1,-0.2 23,-0.1 0.537 108.1 61.0 -63.0 -16.1 28.6 16.7 39.1 45 39 A N + 0 0 49 4,-0.1 2,-0.3 5,-0.0 -1,-0.2 -0.677 64.2 130.4-124.3 81.3 31.2 16.1 41.9 46 40 A T S > S- 0 0 46 -2,-0.4 4,-3.2 -3,-0.2 5,-0.3 -0.892 71.6 -98.6-121.4 152.5 29.8 16.8 45.4 47 41 A S H > S+ 0 0 57 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.760 124.1 44.8 -38.0 -45.2 30.1 14.5 48.4 48 42 A L H > S+ 0 0 8 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.945 116.5 43.6 -70.0 -50.5 26.5 13.2 47.9 49 43 A L H > S+ 0 0 5 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.864 116.3 50.2 -63.4 -35.6 26.8 12.7 44.1 50 44 A R H X S+ 0 0 107 -4,-3.2 4,-2.1 1,-0.2 -1,-0.2 0.856 111.2 47.4 -69.8 -38.2 30.2 11.1 44.6 51 45 A E H X S+ 0 0 77 -4,-1.8 4,-1.4 -5,-0.3 -1,-0.2 0.647 111.6 49.6 -80.7 -15.3 29.0 8.7 47.3 52 46 A I H X S+ 0 0 1 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.848 113.5 47.6 -85.2 -37.4 25.9 7.6 45.2 53 47 A A H X S+ 0 0 0 -4,-1.7 4,-1.2 -5,-0.2 -2,-0.2 0.897 117.2 41.8 -65.0 -47.4 28.3 7.0 42.2 54 48 A N H X S+ 0 0 45 -4,-2.1 4,-1.5 2,-0.2 3,-0.5 0.964 114.9 51.1 -64.6 -56.1 30.8 5.0 44.3 55 49 A S H < S+ 0 0 31 -4,-1.4 4,-0.2 1,-0.2 -2,-0.2 0.783 109.0 49.4 -54.9 -39.6 28.1 3.1 46.2 56 50 A L H ><>S+ 0 0 0 -4,-2.0 5,-2.4 1,-0.2 3,-0.9 0.849 110.4 51.0 -70.6 -34.1 26.2 1.9 43.1 57 51 A R H ><5S+ 0 0 44 -4,-1.2 3,-1.6 -3,-0.5 -2,-0.2 0.783 101.4 61.6 -70.3 -29.2 29.5 0.7 41.5 58 52 A D T 3<5S+ 0 0 105 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.551 108.5 44.5 -74.2 -5.9 30.2 -1.2 44.8 59 53 A E T < 5S- 0 0 92 -3,-0.9 -1,-0.3 -4,-0.2 -2,-0.2 0.008 129.2-102.0-120.3 17.2 27.0 -3.2 43.9 60 54 A N T < 5S+ 0 0 81 -3,-1.6 -28,-0.5 1,-0.2 2,-0.5 0.785 80.3 131.7 59.7 41.2 28.1 -3.5 40.2 61 55 A I < - 0 0 12 -5,-2.4 -1,-0.2 -30,-0.1 -28,-0.2 -0.980 50.8-134.0-120.5 117.8 25.8 -0.6 38.9 62 56 A A E - d 0 33A 0 -30,-2.1 -28,-2.5 -2,-0.5 2,-0.3 -0.302 20.3-157.4 -71.7 157.1 27.4 2.0 36.6 63 57 A S E -Bd 24 34A 0 -39,-1.7 -39,-2.4 -30,-0.2 2,-0.4 -0.993 12.4-164.7-141.1 145.7 26.8 5.8 37.0 64 58 A V E +Bd 23 35A 0 -30,-2.9 -28,-3.7 -2,-0.3 2,-0.4 -0.997 10.7 175.5-131.0 129.7 27.0 9.0 34.9 65 59 A R E +Bd 22 36A 5 -43,-1.9 -43,-2.5 -2,-0.4 2,-0.3 -1.000 5.0 179.9-137.4 131.5 27.0 12.5 36.2 66 60 A F E -B 21 0A 7 -30,-0.8 -28,-0.5 -2,-0.4 2,-0.3 -0.920 31.1-112.4-130.5 159.2 27.4 15.7 34.2 67 61 A D - 0 0 2 -47,-1.8 -24,-0.1 -2,-0.3 3,-0.1 -0.711 37.9-124.2 -87.9 138.0 27.5 19.4 34.9 68 62 A F > - 0 0 4 -2,-0.3 3,-2.0 -26,-0.2 6,-0.3 -0.315 43.0 -73.3 -76.0 167.7 24.5 21.2 33.5 69 63 A N T 3 S+ 0 0 0 1,-0.3 7,-0.2 16,-0.2 -1,-0.1 -0.411 126.4 20.5 -62.8 132.5 24.9 24.2 31.1 70 64 A G T 3 S+ 0 0 16 5,-1.0 2,-0.3 4,-0.4 -1,-0.3 0.467 114.7 91.5 82.3 5.1 26.2 27.2 33.1 71 65 A H S X S- 0 0 10 -3,-2.0 3,-1.3 4,-0.2 -1,-0.2 -0.943 88.1 -27.5-129.3 150.8 27.4 24.8 35.9 72 66 A G T 3 S- 0 0 51 -2,-0.3 -29,-0.1 -30,-0.3 -2,-0.1 -0.120 119.4 -22.9 49.2-134.9 30.8 23.1 36.5 73 67 A D T 3 S+ 0 0 97 -53,-0.2 -1,-0.2 -4,-0.0 2,-0.2 0.464 108.6 111.5 -84.6 -5.5 33.0 22.3 33.5 74 68 A S S < S- 0 0 9 -3,-1.3 -4,-0.4 -6,-0.3 -55,-0.2 -0.533 72.6-106.7 -76.9 138.9 30.0 22.4 31.1 75 69 A D + 0 0 73 -57,-2.3 -5,-1.0 -2,-0.2 -4,-0.2 -0.033 67.9 60.4 -58.7 158.1 29.8 25.2 28.5 76 70 A G S S- 0 0 42 -7,-0.2 -6,-0.3 -6,-0.1 2,-0.2 0.038 79.7 -71.5 103.5 154.3 27.4 28.2 28.6 77 71 A K > - 0 0 130 1,-0.1 3,-1.1 -8,-0.1 4,-0.4 -0.549 32.1-133.1 -78.0 141.4 26.5 31.2 30.7 78 72 A F G > S+ 0 0 13 1,-0.2 3,-1.3 -2,-0.2 94,-0.4 0.871 107.5 66.1 -61.1 -33.2 24.6 30.6 33.9 79 73 A E G 3 S+ 0 0 65 1,-0.2 95,-0.3 92,-0.2 -1,-0.2 0.717 99.1 49.5 -54.9 -35.8 22.3 33.5 32.7 80 74 A N G < S+ 0 0 67 -3,-1.1 -1,-0.2 92,-0.1 2,-0.2 0.507 87.1 110.0 -91.4 -2.6 21.1 31.3 29.7 81 75 A M < + 0 0 1 -3,-1.3 91,-0.3 -4,-0.4 2,-0.2 -0.516 37.6 165.8 -77.8 133.0 20.2 28.2 31.8 82 76 A T - 0 0 2 -2,-0.2 4,-0.2 93,-0.1 93,-0.1 -0.756 49.9-108.7-130.7 174.1 16.5 27.3 32.4 83 77 A V S >> S+ 0 0 3 92,-0.2 3,-1.2 -2,-0.2 4,-1.1 0.881 116.2 61.0 -75.3 -37.0 15.0 24.0 33.7 84 78 A L H 3> S+ 0 0 27 1,-0.3 4,-0.9 2,-0.2 -1,-0.1 0.814 103.3 45.8 -57.2 -45.5 13.8 23.1 30.2 85 79 A N H 3> S+ 0 0 3 2,-0.2 4,-0.7 1,-0.2 -1,-0.3 0.402 105.4 61.3 -81.8 -3.5 17.3 23.1 28.5 86 80 A E H <> S+ 0 0 0 -3,-1.2 4,-2.7 2,-0.2 -2,-0.2 0.702 102.3 52.4 -86.8 -30.9 18.7 20.9 31.4 87 81 A I H X S+ 0 0 5 -4,-1.1 4,-3.4 2,-0.2 -2,-0.2 0.883 108.3 50.4 -67.6 -38.1 16.1 18.3 30.3 88 82 A E H X S+ 0 0 6 -4,-0.9 4,-1.8 2,-0.2 -2,-0.2 0.843 110.7 48.5 -64.7 -38.1 17.7 18.8 26.8 89 83 A D H X S+ 0 0 1 -4,-0.7 4,-1.3 2,-0.2 -2,-0.2 0.919 114.5 46.5 -63.8 -47.8 21.1 18.2 28.5 90 84 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.888 109.5 52.2 -61.8 -46.3 19.5 15.1 30.2 91 85 A N H X S+ 0 0 14 -4,-3.4 4,-2.4 1,-0.2 -1,-0.2 0.918 107.7 53.2 -58.8 -43.5 17.9 13.8 26.9 92 86 A A H X S+ 0 0 14 -4,-1.8 4,-0.8 1,-0.2 -1,-0.2 0.827 109.1 48.4 -59.5 -38.8 21.4 14.1 25.2 93 87 A I H X S+ 0 0 3 -4,-1.3 4,-3.2 -3,-0.2 3,-0.3 0.877 111.8 50.0 -67.4 -41.2 22.9 12.0 28.1 94 88 A L H X S+ 0 0 1 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.846 105.1 56.8 -66.0 -35.4 20.0 9.4 27.6 95 89 A N H < S+ 0 0 50 -4,-2.4 4,-0.2 2,-0.2 -1,-0.2 0.776 114.5 40.1 -63.5 -29.8 20.8 9.4 23.8 96 90 A Y H >< S+ 0 0 55 -4,-0.8 3,-0.6 -3,-0.3 -2,-0.2 0.922 117.6 47.2 -81.4 -51.8 24.3 8.4 24.8 97 91 A V H >< S+ 0 0 0 -4,-3.2 3,-1.1 1,-0.2 -2,-0.2 0.857 111.1 49.4 -61.2 -43.9 23.2 6.0 27.6 98 92 A K T 3< S+ 0 0 43 -4,-3.1 -1,-0.2 1,-0.2 -3,-0.1 0.648 110.6 52.9 -71.9 -18.3 20.5 4.1 25.6 99 93 A T T < S+ 0 0 89 -3,-0.6 -1,-0.2 -5,-0.2 -2,-0.2 0.032 84.4 109.3-107.1 25.5 23.0 3.6 22.7 100 94 A D X - 0 0 31 -3,-1.1 3,-1.0 1,-0.1 -3,-0.0 -0.875 64.0-141.9-102.5 130.6 25.7 2.0 24.9 101 95 A P T 3 S+ 0 0 110 0, 0.0 -1,-0.1 0, 0.0 -72,-0.0 0.855 98.9 49.1 -58.8 -40.7 26.5 -1.8 24.4 102 96 A H T 3 S+ 0 0 35 -72,-0.1 -71,-3.0 -74,-0.0 2,-0.7 0.546 84.6 110.4 -77.9 -10.8 27.1 -2.6 28.1 103 97 A V E < +c 31 0A 23 -3,-1.0 -71,-0.2 -73,-0.2 3,-0.1 -0.607 33.8 168.4 -79.7 108.2 23.9 -0.8 29.4 104 98 A R E + 0 0 152 -73,-2.8 2,-0.3 -2,-0.7 -72,-0.2 0.963 66.6 2.5 -76.3 -82.5 21.3 -3.2 30.7 105 99 A N E - 0 0 45 24,-0.0 -72,-3.4 25,-0.0 2,-0.4 -0.774 67.9-131.4-112.0 155.5 18.7 -0.9 32.5 106 100 A I E -ce 33 129A 5 22,-0.6 24,-2.4 -2,-0.3 25,-0.7 -0.884 20.3-172.1-105.6 133.4 18.5 2.9 32.8 107 101 A Y E -ce 34 131A 8 -74,-2.6 -72,-2.9 -2,-0.4 2,-0.4 -0.992 13.2-144.5-125.9 130.6 17.9 4.5 36.2 108 102 A L E +ce 35 132A 1 23,-2.1 25,-2.5 -2,-0.4 2,-0.4 -0.859 20.2 175.9-100.7 129.5 17.2 8.2 36.7 109 103 A V E +ce 36 133A 3 -74,-2.7 -72,-2.6 -2,-0.4 2,-0.3 -0.999 3.1 168.6-134.7 128.3 18.6 10.0 39.9 110 104 A G E -ce 37 134A 0 23,-1.7 25,-1.5 -2,-0.4 2,-0.4 -0.975 20.4-153.3-146.8 129.4 18.3 13.8 40.6 111 105 A H E > - e 0 135A 23 -74,-2.7 3,-2.1 -2,-0.3 25,-0.2 -0.826 68.6 -34.5 -98.7 141.6 19.0 16.0 43.7 112 106 A S E >> S+ e 0 137A 9 23,-1.5 26,-1.6 24,-0.6 3,-0.9 -0.294 142.0 6.0 52.3-113.6 17.1 19.3 44.1 113 107 A Q H >> S+ 0 0 4 1,-0.3 4,-2.2 2,-0.2 3,-0.9 0.832 129.3 63.6 -64.4 -32.4 16.6 20.8 40.6 114 108 A G H <> S+ 0 0 0 -3,-2.1 4,-2.5 1,-0.2 -1,-0.3 0.793 95.1 62.0 -59.5 -29.4 18.0 17.6 39.2 115 109 A G H <> S+ 0 0 0 -3,-0.9 4,-2.5 2,-0.2 -1,-0.2 0.789 104.3 45.2 -66.2 -34.2 14.9 16.0 40.8 116 110 A V H + 0 0 6 -26,-1.6 3,-0.6 -2,-0.4 4,-0.1 -0.333 57.5 136.7 -72.7 59.4 12.8 21.0 44.0 139 133 A A T > + 0 0 8 -2,-2.4 3,-1.4 1,-0.2 4,-0.5 0.695 63.6 77.8 -73.4 -21.9 9.3 21.1 42.5 140 134 A T T >> S+ 0 0 31 -3,-0.3 4,-1.8 1,-0.2 3,-1.5 0.844 71.3 81.4 -53.2 -39.4 8.9 24.1 44.9 141 135 A L H <> S+ 0 0 16 -3,-0.6 4,-1.1 1,-0.3 -1,-0.2 0.655 87.6 55.2 -39.8 -32.8 10.9 26.3 42.4 142 136 A K H <> S+ 0 0 53 -3,-1.4 4,-2.0 2,-0.2 -1,-0.3 0.889 112.5 41.1 -69.8 -44.5 7.6 26.7 40.3 143 137 A G H <> S+ 0 0 32 -3,-1.5 4,-1.2 -4,-0.5 -2,-0.2 0.708 112.3 56.1 -74.4 -26.8 5.7 28.1 43.3 144 138 A D H X>S+ 0 0 31 -4,-1.8 5,-2.0 2,-0.2 4,-1.8 0.780 110.6 45.9 -73.5 -31.2 8.9 30.1 44.3 145 139 A A H <5S+ 0 0 1 -4,-1.1 -2,-0.2 -5,-0.3 -3,-0.1 0.871 109.1 52.3 -80.9 -38.2 8.6 31.7 40.8 146 140 A L H <5S+ 0 0 105 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.839 116.1 43.2 -62.9 -34.9 4.9 32.4 40.9 147 141 A E H <5S- 0 0 156 -4,-1.2 -2,-0.2 2,-0.1 -1,-0.2 0.849 110.9-119.7 -77.8 -45.2 5.5 34.2 44.3 148 142 A G T <5S+ 0 0 4 -4,-1.8 7,-1.5 1,-0.1 2,-0.2 0.835 78.2 99.8 101.4 45.6 8.6 36.1 43.4 149 143 A N E < -H 154 0B 68 -5,-2.0 2,-0.6 5,-0.2 5,-0.2 -0.708 42.1-178.1-163.1 97.1 11.3 34.9 45.8 150 144 A T E > S-H 153 0B 8 3,-1.8 3,-2.0 -2,-0.2 26,-0.0 -0.962 80.0 -24.8-104.3 112.7 13.8 32.3 44.5 151 145 A Q T 3 S- 0 0 79 -2,-0.6 -1,-0.1 1,-0.3 3,-0.1 0.611 129.1 -46.5 55.1 28.5 16.2 31.3 47.4 152 146 A G T 3 S+ 0 0 51 1,-0.2 2,-0.7 0, 0.0 -1,-0.3 0.057 110.0 120.9 104.6 -19.2 15.7 34.6 49.2 153 147 A V E < -H 150 0B 37 -3,-2.0 -3,-1.8 11,-0.0 -1,-0.2 -0.706 52.9-148.2 -84.3 112.7 16.1 36.9 46.1 154 148 A T E +H 149 0B 107 -2,-0.7 2,-0.2 -5,-0.2 -5,-0.2 -0.442 26.8 154.1 -80.7 150.8 12.9 39.0 45.6 155 149 A Y - 0 0 21 -7,-1.5 5,-0.1 -2,-0.1 9,-0.0 -0.910 51.5 -89.5-169.5 151.6 11.5 40.2 42.2 156 150 A N > - 0 0 87 3,-0.3 3,-0.5 -2,-0.2 -8,-0.1 -0.569 31.8-155.7 -69.2 115.9 8.0 41.2 40.7 157 151 A P T 3 S+ 0 0 25 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.422 93.6 48.6 -77.8 6.0 6.5 37.8 39.3 158 152 A D T 3 S+ 0 0 121 1,-0.1 214,-0.1 -10,-0.0 -2,-0.1 0.516 121.4 33.3-115.2 -16.3 4.4 39.8 36.8 159 153 A H S < S- 0 0 126 -3,-0.5 -3,-0.3 213,-0.0 -1,-0.1 -0.515 82.3-178.2-138.6 59.6 7.2 42.0 35.5 160 154 A I - 0 0 7 -3,-0.2 13,-0.1 -5,-0.1 4,-0.0 -0.425 26.8-121.0 -58.3 129.8 10.2 39.5 35.7 161 155 A P - 0 0 52 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.152 15.8-110.9 -74.6 173.9 13.5 41.3 34.6 162 156 A D S S- 0 0 85 1,-0.3 11,-3.3 11,-0.1 12,-0.4 0.960 101.5 -3.8 -63.3 -53.6 15.8 40.3 31.7 163 157 A R E -I 172 0C 138 9,-0.3 -1,-0.3 10,-0.2 9,-0.2 -0.912 69.9-163.3-136.6 154.5 18.6 39.2 34.2 164 158 A L E -I 171 0C 13 7,-2.1 7,-2.3 -2,-0.3 -11,-0.0 -0.987 28.4-104.4-145.5 132.8 18.7 39.5 38.0 165 159 A P E -I 170 0C 97 0, 0.0 5,-0.3 0, 0.0 2,-0.1 -0.324 39.8-170.8 -62.3 142.6 21.7 39.3 40.4 166 160 A F - 0 0 26 3,-3.3 4,-0.0 -2,-0.0 0, 0.0 -0.309 44.7 -65.3-114.8-164.5 22.2 36.1 42.4 167 161 A K S S- 0 0 169 1,-0.1 3,-0.0 -2,-0.1 0, 0.0 0.936 123.7 -22.9 -49.6 -55.2 24.4 34.8 45.3 168 162 A D S S+ 0 0 143 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.478 135.5 43.9-131.6 -21.6 27.6 35.0 43.2 169 163 A L S S- 0 0 74 -91,-0.0 -3,-3.3 -5,-0.0 2,-0.4 -0.208 84.0 -95.1-115.6-163.6 26.2 34.9 39.6 170 164 A T E -I 165 0C 48 -5,-0.3 2,-0.4 -2,-0.1 -3,-0.0 -0.989 30.5-145.0-126.5 119.7 23.4 36.4 37.5 171 165 A L E -I 164 0C 0 -7,-2.3 -7,-2.1 -2,-0.4 2,-0.2 -0.690 19.7-119.7 -86.6 134.4 20.1 34.5 37.0 172 166 A G E >> -I 163 0C 5 -94,-0.4 4,-0.9 -2,-0.4 3,-0.7 -0.493 9.3-139.1 -71.3 138.3 18.3 34.7 33.6 173 167 A G H 3> S+ 0 0 1 -11,-3.3 4,-1.8 1,-0.2 -10,-0.2 0.669 102.5 62.8 -70.3 -20.0 14.7 36.0 33.7 174 168 A F H 3> S+ 0 0 16 -12,-0.4 4,-2.2 -95,-0.3 -1,-0.2 0.742 96.6 59.1 -78.7 -21.7 13.6 33.4 31.2 175 169 A Y H <> S+ 0 0 9 -3,-0.7 4,-3.0 -96,-0.2 5,-0.3 0.947 107.5 47.3 -64.4 -48.5 14.5 30.7 33.8 176 170 A L H X S+ 0 0 1 -4,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.918 114.7 43.6 -57.7 -54.2 11.9 32.5 36.2 177 171 A R H < S+ 0 0 20 -4,-1.8 4,-0.5 2,-0.2 -1,-0.2 0.876 116.1 51.6 -61.1 -41.0 9.2 32.7 33.5 178 172 A I H >< S+ 0 0 10 -4,-2.2 3,-1.5 2,-0.2 -2,-0.2 0.972 114.2 38.6 -60.0 -63.4 10.0 29.0 32.5 179 173 A A H >< S+ 0 0 3 -4,-3.0 3,-1.4 1,-0.3 5,-0.2 0.851 106.8 66.8 -58.5 -38.1 9.8 27.4 36.0 180 174 A Q T 3< S+ 0 0 32 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.647 115.9 28.4 -53.0 -23.5 6.7 29.6 36.9 181 175 A Q T < S+ 0 0 41 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.174 87.5 138.9-127.2 13.7 4.8 27.6 34.2 182 176 A L < - 0 0 4 -3,-1.4 2,-2.2 -4,-0.2 3,-0.3 -0.440 53.1-138.6 -66.4 122.4 6.6 24.3 34.3 183 177 A P > + 0 0 18 0, 0.0 4,-2.6 0, 0.0 5,-0.4 -0.291 47.5 151.8 -81.9 56.1 4.2 21.3 34.0 184 178 A I H > S+ 0 0 4 -2,-2.2 4,-2.2 1,-0.2 5,-0.1 0.944 72.3 33.6 -49.9 -63.6 6.3 19.5 36.7 185 179 A Y H > S+ 0 0 34 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.887 116.7 57.1 -66.4 -36.4 3.5 17.3 38.2 186 180 A E H 4 S+ 0 0 102 2,-0.2 4,-0.2 1,-0.2 -2,-0.2 0.953 116.3 32.6 -55.8 -64.5 1.7 16.9 34.8 187 181 A V H >< S+ 0 0 7 -4,-2.6 3,-1.7 1,-0.2 4,-0.3 0.899 117.1 57.2 -61.6 -46.8 4.7 15.4 33.0 188 182 A S H >< S+ 0 0 0 -4,-2.2 3,-2.2 -5,-0.4 -2,-0.2 0.903 95.7 63.6 -47.8 -55.8 6.1 13.6 36.1 189 183 A A T 3< S+ 0 0 36 -4,-2.4 -1,-0.3 1,-0.3 30,-0.2 0.504 84.0 78.8 -48.7 -15.6 2.8 11.6 36.8 190 184 A Q T < S+ 0 0 94 -3,-1.7 2,-0.8 -4,-0.2 -1,-0.3 0.756 72.9 88.6 -70.9 -24.2 3.3 9.7 33.4 191 185 A F < + 0 0 1 -3,-2.2 28,-0.4 -4,-0.3 29,-0.3 -0.697 46.4 169.1 -81.1 107.0 5.9 7.4 35.0 192 186 A T + 0 0 78 -2,-0.8 -1,-0.2 27,-0.1 3,-0.2 0.615 49.4 99.1 -85.6 -23.9 4.0 4.4 36.5 193 187 A K S S- 0 0 66 1,-0.2 27,-0.3 -64,-0.1 -62,-0.1 -0.013 91.8 -54.0 -65.0 165.5 7.3 2.5 37.2 194 188 A P - 0 0 28 0, 0.0 -62,-1.9 0, 0.0 2,-0.4 -0.245 55.6-173.5 -53.9 120.8 9.1 2.3 40.6 195 189 A V E -fg 132 221A 0 25,-3.6 27,-1.2 -64,-0.2 2,-0.5 -0.959 10.2-163.1-116.5 128.4 9.9 5.6 42.3 196 190 A C E -fg 133 222A 1 -64,-3.2 -62,-2.5 -2,-0.4 2,-0.4 -0.944 12.1-165.0-108.6 120.2 12.0 6.0 45.5 197 191 A L E -fg 134 223A 0 25,-2.5 27,-2.1 -2,-0.5 2,-0.4 -0.926 7.5-175.2-112.7 130.6 11.6 9.5 47.2 198 192 A I E +fg 135 224A 0 -64,-3.0 -62,-3.7 -2,-0.4 2,-0.3 -0.991 10.9 164.0-126.4 122.8 14.0 10.8 49.9 199 193 A H E - g 0 225A 0 25,-2.2 27,-1.0 -2,-0.4 2,-0.3 -0.993 32.6-123.3-141.3 145.6 13.4 14.1 51.7 200 194 A G E > - g 0 226A 0 -2,-0.3 3,-1.1 25,-0.2 27,-0.2 -0.718 10.5-144.0 -89.4 136.0 14.8 15.7 54.9 201 195 A T T 3 S+ 0 0 45 25,-2.1 26,-0.1 -2,-0.3 -1,-0.1 0.922 102.2 48.6 -63.2 -43.9 12.3 16.8 57.7 202 196 A D T 3 S+ 0 0 106 27,-1.2 2,-0.4 24,-0.3 -1,-0.3 -0.022 79.9 137.8 -88.3 28.8 14.5 19.8 58.6 203 197 A D < + 0 0 15 -3,-1.1 27,-0.1 27,-0.3 26,-0.0 -0.652 26.0 176.5 -79.6 124.9 14.8 21.0 54.9 204 198 A T S S+ 0 0 136 -2,-0.4 3,-0.2 3,-0.1 -1,-0.1 0.381 78.3 55.8-103.8 -6.6 14.4 24.9 54.6 205 199 A V S S+ 0 0 47 1,-0.3 2,-0.5 -54,-0.0 -54,-0.2 0.876 116.9 24.0 -92.4 -51.0 15.2 24.9 50.8 206 200 A V S S- 0 0 0 -6,-0.1 -1,-0.3 -66,-0.1 -6,-0.1 -0.987 85.2-124.0-121.9 118.3 12.5 22.4 49.5 207 201 A S > - 0 0 45 -2,-0.5 3,-3.2 -3,-0.2 4,-0.4 -0.434 18.2-130.5 -61.5 123.6 9.4 21.9 51.5 208 202 A P T >> S+ 0 0 20 0, 0.0 4,-1.1 0, 0.0 3,-0.9 0.742 104.6 76.5 -48.8 -20.9 9.1 18.1 52.3 209 203 A N H 3> S+ 0 0 97 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.648 81.7 68.6 -62.9 -16.9 5.5 18.4 51.0 210 204 A A H <> S+ 0 0 7 -3,-3.2 4,-2.0 2,-0.2 -1,-0.2 0.927 103.9 41.3 -67.0 -43.2 7.0 18.5 47.4 211 205 A S H <> S+ 0 0 0 -3,-0.9 4,-2.6 -4,-0.4 -2,-0.2 0.739 114.0 54.0 -74.5 -24.7 8.0 14.8 47.9 212 206 A K H X S+ 0 0 92 -4,-1.1 4,-2.5 2,-0.2 -2,-0.2 0.882 110.1 45.1 -76.4 -39.6 4.5 14.2 49.5 213 207 A K H X S+ 0 0 117 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.885 114.6 50.7 -68.4 -37.5 2.8 15.7 46.4 214 208 A Y H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.983 111.9 45.9 -57.5 -59.8 5.2 13.6 44.3 215 209 A D H < S+ 0 0 56 -4,-2.6 6,-0.2 1,-0.2 -2,-0.2 0.836 112.8 51.7 -46.9 -49.3 4.3 10.4 46.4 216 210 A Q H < S+ 0 0 155 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.941 113.6 43.5 -52.0 -59.0 0.5 11.3 46.1 217 211 A I H < S+ 0 0 59 -4,-2.3 2,-0.3 -5,-0.1 -2,-0.2 0.672 98.2 91.4 -64.9 -28.9 0.7 11.7 42.3 218 212 A Y >< - 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0 0 30 -4,-0.8 3,-0.2 -3,-0.8 -3,-0.0 -0.473 63.4-146.1 -70.4 134.1 17.8 47.0 20.2 346 95 B P S S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.842 96.5 50.9 -67.8 -37.5 17.7 50.8 20.5 347 96 B H S S+ 0 0 46 -72,-0.1 -71,-1.8 -74,-0.0 2,-0.3 0.718 89.4 95.9 -71.9 -27.1 15.5 51.5 17.4 348 97 B V E +l 276 0D 22 -3,-0.2 -71,-0.2 -6,-0.2 3,-0.1 -0.569 41.5 166.6 -76.7 129.2 12.8 49.0 18.4 349 98 B R E + 0 0 137 -73,-1.8 2,-0.4 1,-0.3 -72,-0.2 0.838 63.7 16.2-103.9 -73.4 9.7 50.4 20.3 350 99 B N E S- 0 0 56 -74,-0.0 -72,-2.2 24,-0.0 2,-0.3 -0.953 72.3-140.4-115.3 131.4 6.8 47.9 20.4 351 100 B I E -ln 278 374D 9 22,-0.5 24,-3.4 -2,-0.4 25,-0.5 -0.744 18.6-179.5 -94.8 137.7 7.2 44.2 19.8 352 101 B Y E -ln 279 376D 12 -74,-1.7 -72,-1.7 -2,-0.3 2,-0.4 -0.899 15.9-144.1-125.8 155.0 4.7 41.9 17.9 353 102 B L E -ln 280 377D 0 23,-1.9 25,-2.3 -2,-0.3 2,-0.4 -0.991 12.6-175.0-127.1 123.5 4.8 38.1 17.1 354 103 B V E -ln 281 378D 2 -74,-1.8 -72,-2.5 -2,-0.4 2,-0.4 -0.980 10.9-179.9-119.8 124.2 3.5 36.6 13.8 355 104 B G E -ln 282 379D 0 23,-2.1 25,-1.8 -2,-0.4 2,-0.3 -0.955 13.2-166.3-137.7 123.2 3.5 32.8 13.5 356 105 B H E > - n 0 380D 18 -74,-1.8 3,-1.8 -2,-0.4 25,-0.2 -0.826 63.3 -29.7-107.3 141.7 2.5 30.4 10.7 357 106 B S E > S- n 0 382D 13 23,-1.1 3,-1.8 24,-0.7 26,-1.7 -0.341 137.6 -2.4 56.1-126.0 1.9 26.6 11.1 358 107 B Q T >> S+ 0 0 2 1,-0.3 4,-2.2 2,-0.2 3,-0.9 0.745 132.7 64.5 -62.0 -27.7 4.3 25.2 13.9 359 108 B G H <> S+ 0 0 0 -3,-1.8 4,-2.4 1,-0.3 -1,-0.3 0.643 92.2 64.8 -68.3 -17.6 5.7 28.8 14.2 360 109 B G H <> S+ 0 0 0 -3,-1.8 4,-1.4 21,-0.2 -1,-0.3 0.745 105.3 41.6 -74.2 -28.7 2.1 29.6 15.3 361 110 B V H <> S+ 0 0 0 -3,-0.9 4,-2.6 -4,-0.4 5,-0.3 0.876 114.4 52.5 -82.8 -42.4 2.7 27.4 18.4 362 111 B V H X S+ 0 0 0 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.909 115.4 41.2 -58.5 -43.7 6.2 28.8 18.8 363 112 B A H X S+ 0 0 0 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.869 117.2 45.4 -73.7 -44.5 4.8 32.5 18.7 364 113 B S H X S+ 0 0 0 -4,-1.4 4,-0.8 2,-0.2 -2,-0.2 0.868 117.5 44.6 -65.3 -41.8 1.7 31.9 20.9 365 114 B M H X S+ 0 0 9 -4,-2.6 4,-1.0 2,-0.2 -2,-0.2 0.797 112.6 51.1 -75.6 -29.7 3.7 29.9 23.5 366 115 B L H X S+ 0 0 0 -4,-1.5 4,-1.1 -5,-0.3 3,-0.3 0.876 111.0 49.8 -72.0 -32.7 6.5 32.5 23.5 367 116 B A H < S+ 0 0 0 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.708 102.9 61.5 -74.4 -21.4 3.8 35.2 24.0 368 117 B G H < S+ 0 0 1 -4,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.826 111.2 37.9 -70.4 -34.8 2.5 33.0 26.9 369 118 B L H < S+ 0 0 14 -4,-1.0 -2,-0.2 -3,-0.3 -1,-0.2 0.588 125.6 40.4 -88.8 -21.0 5.9 33.4 28.7 370 119 B Y X + 0 0 5 -4,-1.1 4,-2.4 1,-0.1 3,-0.4 -0.373 68.4 135.9-121.6 50.0 6.3 37.1 27.6 371 120 B P T 4 S+ 0 0 35 0, 0.0 67,-0.1 0, 0.0 -1,-0.1 0.773 76.9 51.6 -71.0 -22.9 2.7 38.5 27.9 372 121 B D T 4 S+ 0 0 36 -3,-0.1 -2,-0.1 1,-0.1 -5,-0.0 0.713 117.1 39.6 -79.5 -27.2 4.0 41.7 29.5 373 122 B L T 4 S+ 0 0 47 -3,-0.4 -22,-0.5 -6,-0.1 2,-0.3 0.846 99.9 74.9 -91.2 -47.8 6.6 42.2 26.7 374 123 B I E < -n 351 0D 0 -4,-2.4 -22,-0.2 -7,-0.2 64,-0.1 -0.565 56.1-168.6 -74.9 129.8 4.6 41.3 23.5 375 124 B K E + 0 0 70 -24,-3.4 2,-0.3 -2,-0.3 -23,-0.2 0.746 67.8 0.8 -91.9 -26.0 2.1 43.9 22.3 376 125 B K E -n 352 0D 33 -25,-0.5 -23,-1.9 62,-0.1 2,-0.4 -0.957 57.6-153.0-159.5 151.1 0.1 41.8 19.6 377 126 B V E -no 353 440D 0 62,-1.3 64,-2.5 -2,-0.3 2,-0.6 -0.999 2.2-161.1-133.6 129.5 0.1 38.3 18.2 378 127 B V E -no 354 441D 0 -25,-2.3 -23,-2.1 -2,-0.4 2,-0.7 -0.957 13.0-162.7-112.3 110.1 -1.1 37.3 14.7 379 128 B L E -no 355 442D 0 62,-4.0 64,-2.9 -2,-0.6 2,-0.5 -0.865 6.4-172.9-100.4 109.5 -1.7 33.6 14.5 380 129 B L E S-no 356 443D 1 -25,-1.8 -23,-1.1 -2,-0.7 64,-0.2 -0.888 71.4 -32.8-102.6 123.1 -1.9 32.1 11.0 381 130 B A E S- 0 0 0 62,-2.7 -24,-0.7 -2,-0.5 2,-0.4 0.845 79.5-150.7 33.2 62.9 -3.0 28.4 10.9 382 131 B P E -n 357 0D 0 0, 0.0 2,-1.7 0, 0.0 3,-0.2 -0.534 9.9-135.7 -71.7 121.8 -1.3 27.5 14.3 383 132 B A > + 0 0 7 -26,-1.7 3,-2.3 -2,-0.4 -25,-0.1 -0.098 58.4 135.7 -68.4 38.8 -0.2 23.8 14.3 384 133 B A T > + 0 0 8 -2,-1.7 3,-0.6 1,-0.3 4,-0.5 0.459 62.0 75.3 -65.9 -2.7 -1.6 23.2 17.9 385 134 B T T 3> S+ 0 0 40 -3,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.712 71.6 85.9 -81.1 -17.9 -3.0 19.9 16.4 386 135 B L H <> S+ 0 0 17 -3,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.612 86.9 52.6 -57.3 -23.1 0.7 18.6 16.5 387 136 B K H <> S+ 0 0 54 -3,-0.6 4,-1.9 2,-0.2 3,-0.2 0.960 111.7 42.1 -75.5 -59.9 0.1 17.5 20.1 388 137 B G H 4 S+ 0 0 43 -4,-0.5 -2,-0.2 1,-0.2 4,-0.2 0.647 115.3 54.1 -61.0 -20.5 -3.1 15.4 19.4 389 138 B D H ><>S+ 0 0 48 -4,-1.6 5,-1.9 2,-0.2 3,-1.0 0.892 108.7 45.4 -79.0 -47.9 -1.4 14.1 16.3 390 139 B A H ><5S+ 0 0 0 -4,-1.2 3,-0.7 1,-0.2 -2,-0.2 0.779 109.2 58.5 -66.0 -30.8 1.7 12.8 18.1 391 140 B L T 3<5S+ 0 0 88 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.582 106.9 47.0 -75.7 -15.1 -0.6 11.3 20.8 392 141 B E T < 5S- 0 0 130 -3,-1.0 -1,-0.2 -4,-0.2 -2,-0.2 0.244 114.8-110.5-113.2 13.1 -2.4 9.1 18.1 393 142 B G T < 5S+ 0 0 4 -3,-0.7 7,-1.5 -4,-0.1 2,-0.3 0.798 85.2 104.0 62.9 37.2 0.8 7.8 16.4 394 143 B N E < +Q 399 0E 57 -5,-1.9 2,-0.5 5,-0.2 5,-0.2 -0.803 38.6 173.9-152.5 106.6 0.3 9.8 13.1 395 144 B T E > S-Q 398 0E 12 3,-2.8 3,-2.3 -2,-0.3 -9,-0.0 -0.963 78.7 -29.9-119.7 115.2 2.2 12.9 12.0 396 145 B Q T 3 S- 0 0 102 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.602 125.7 -49.1 52.4 23.6 1.5 14.3 8.5 397 146 B G T 3 S+ 0 0 62 1,-0.3 2,-0.5 0, 0.0 -1,-0.3 0.267 114.5 116.9 103.1 -7.9 0.8 10.7 7.3 398 147 B V E < -Q 395 0E 44 -3,-2.3 -3,-2.8 11,-0.0 -1,-0.3 -0.853 53.9-149.4 -93.9 123.4 3.9 9.1 8.9 399 148 B T E +Q 394 0E 94 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.2 -0.421 29.3 147.6-100.6 166.0 3.1 6.6 11.6 400 149 B Y - 0 0 34 -7,-1.5 5,-0.1 -2,-0.1 9,-0.0 -0.902 53.7 -85.0-171.7 175.7 4.5 5.1 14.9 401 150 B N B > -R 404 0F 80 3,-0.9 3,-1.6 -2,-0.3 -8,-0.1 -0.911 29.6-145.1 -98.2 121.7 3.1 3.8 18.2 402 151 B P T 3 S+ 0 0 30 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.677 103.0 49.6 -64.0 -10.3 2.4 6.7 20.6 403 152 B D T 3 S+ 0 0 119 1,-0.2 2,-0.2 -277,-0.0 -276,-0.1 0.413 116.1 44.0-100.7 -6.5 3.5 4.3 23.5 404 153 B H B < S+R 401 0F 119 -3,-1.6 -3,-0.9 -277,-0.0 -1,-0.2 -0.765 71.8 179.2-142.1 79.7 6.7 3.3 21.7 405 154 B I - 0 0 6 -2,-0.2 13,-0.1 -3,-0.2 14,-0.0 -0.814 23.8-137.8 -86.7 115.4 8.3 6.4 20.2 406 155 B P - 0 0 52 0, 0.0 3,-0.1 0, 0.0 12,-0.0 -0.080 22.3-105.0 -66.4 174.2 11.6 5.3 18.4 407 156 B D S S+ 0 0 63 1,-0.2 11,-2.8 10,-0.1 2,-0.3 0.914 101.2 3.9 -66.3 -42.8 14.9 7.2 18.6 408 157 B R E -S 417 0G 118 9,-0.3 9,-0.2 10,-0.1 -1,-0.2 -0.990 64.3-160.9-145.7 148.5 14.5 8.5 15.0 409 158 B L E -S 416 0G 23 7,-2.8 7,-1.3 -2,-0.3 2,-0.2 -0.997 26.6-116.1-131.1 135.6 11.8 8.3 12.3 410 159 B P E -S 415 0G 93 0, 0.0 2,-0.4 0, 0.0 5,-0.3 -0.528 32.2-171.2 -69.4 131.7 12.1 9.0 8.5 411 160 B F E > -S 414 0G 18 3,-2.5 3,-2.3 -2,-0.2 2,-0.4 -0.947 56.3 -60.1-130.2 111.1 10.0 12.0 7.6 412 161 B K T 3 S- 0 0 85 -2,-0.4 0, 0.0 1,-0.3 0, 0.0 -0.418 121.4 -22.9 53.5-102.7 9.5 12.7 3.9 413 162 B D T 3 S+ 0 0 164 -2,-0.4 -1,-0.3 -3,-0.1 2,-0.1 0.576 133.3 66.3-106.4 -19.0 13.2 13.2 2.9 414 163 B L E < S-S 411 0G 61 -3,-2.3 -3,-2.5 -91,-0.0 2,-0.3 -0.105 74.5-127.3 -93.3-171.4 14.4 14.1 6.4 415 164 B T E -S 410 0G 63 -5,-0.3 2,-0.3 -2,-0.1 -3,-0.0 -0.832 19.9-167.1-144.5 100.7 14.7 12.3 9.8 416 165 B L E -S 409 0G 6 -7,-1.3 -7,-2.8 -2,-0.3 -92,-0.2 -0.669 22.3-118.2 -90.3 151.0 13.2 13.7 13.0 417 166 B G E >> -S 408 0G 6 -93,-1.4 3,-0.7 -94,-0.4 4,-0.7 -0.310 17.5-114.4 -82.1 164.4 14.1 12.4 16.4 418 167 B G H >> S+ 0 0 3 -11,-2.8 3,-1.6 1,-0.2 4,-1.2 0.924 110.1 65.9 -62.1 -47.9 11.9 10.8 19.1 419 168 B F H 3> S+ 0 0 15 -12,-0.3 4,-2.1 1,-0.3 -1,-0.2 0.687 94.8 60.9 -50.3 -25.0 12.3 13.6 21.6 420 169 B Y H <> S+ 0 0 6 -3,-0.7 4,-2.2 -96,-0.2 -92,-0.3 0.915 110.4 39.8 -65.9 -46.4 10.5 15.9 19.2 421 170 B L H < S+ 0 0 9 -4,-2.1 3,-1.3 1,-0.2 -2,-0.2 0.908 114.2 54.8 -60.2 -50.2 7.7 16.9 23.9 424 173 B A H >< S+ 0 0 0 -4,-2.2 3,-1.3 1,-0.3 -1,-0.2 0.899 103.6 57.1 -52.9 -45.2 4.9 17.4 21.2 425 174 B Q H 3< S+ 0 0 25 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.655 118.7 29.9 -58.9 -28.1 2.8 14.7 23.1 426 175 B Q T << S+ 0 0 43 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 -0.123 83.1 138.8-129.9 37.0 2.9 16.7 26.4 427 176 B L < - 0 0 9 -3,-1.3 2,-1.6 1,-0.1 3,-0.2 -0.691 50.8-141.7 -85.2 126.9 3.1 20.3 25.3 428 177 B P > + 0 0 27 0, 0.0 4,-2.5 0, 0.0 5,-0.3 -0.360 43.5 156.1 -85.7 59.1 1.0 22.7 27.3 429 178 B I H > S+ 0 0 1 -2,-1.6 4,-1.9 1,-0.2 5,-0.1 0.919 72.2 28.2 -47.5 -68.7 0.2 24.7 24.1 430 179 B Y H > S+ 0 0 26 -3,-0.2 4,-3.4 2,-0.2 -1,-0.2 0.855 118.2 60.6 -64.1 -41.8 -3.2 26.4 25.0 431 180 B E H 4 S+ 0 0 107 2,-0.2 4,-0.3 1,-0.2 -2,-0.2 0.912 112.5 35.3 -49.9 -58.4 -2.3 26.5 28.7 432 181 B V H >< S+ 0 0 6 -4,-2.5 3,-1.1 1,-0.2 -1,-0.2 0.898 118.9 52.9 -66.0 -42.9 0.9 28.6 28.3 433 182 B S H >< S+ 0 0 0 -4,-1.9 3,-3.2 -5,-0.3 -2,-0.2 0.881 95.0 66.5 -60.5 -46.5 -0.8 30.7 25.4 434 183 B A T 3< S+ 0 0 39 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.622 86.9 74.0 -55.2 -13.3 -4.0 31.6 27.5 435 184 B Q T < S+ 0 0 103 -3,-1.1 2,-0.8 -4,-0.3 -1,-0.3 0.689 77.4 85.0 -70.4 -22.5 -1.5 33.6 29.6 436 185 B F < + 0 0 1 -3,-3.2 28,-0.5 -72,-0.1 -68,-0.1 -0.778 50.9 164.9 -87.0 107.2 -1.4 36.2 26.7 437 186 B T + 0 0 66 -2,-0.8 -1,-0.1 26,-0.1 3,-0.1 0.430 44.1 91.4-103.5 -5.5 -4.5 38.5 27.3 438 187 B K S S- 0 0 61 1,-0.2 27,-0.4 -64,-0.1 26,-0.2 -0.216 96.2 -42.8 -80.0 176.0 -3.6 41.5 24.9 439 188 B P - 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