==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-OCT-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-NOV-12 3ZD8 . COMPND 2 MOLECULE: PROTEIN XNI; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.S.ANSTEY-GILBERT,G.R.HEMSWORTH,C.S.FLEMMING,M.R.G.HODSKINS . 478 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23497.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 340 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 32 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 178 37.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.1 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 2 2 1 4 1 0 4 2 2 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 2 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 . 5 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 A A 0 0 128 0, 0.0 2,-0.4 0, 0.0 108,-0.1 0.000 360.0 360.0 360.0 153.5 40.6 17.2 6.9 2 3 A V + 0 0 24 102,-0.1 108,-2.3 106,-0.1 2,-0.4 -0.945 360.0 178.9-116.1 133.8 42.9 18.5 9.6 3 4 A H E -a 110 0A 25 -2,-0.4 40,-1.9 106,-0.2 39,-1.7 -0.933 14.1-160.7-132.1 108.2 42.7 17.6 13.2 4 5 A L E -ab 111 43A 0 106,-2.7 108,-2.6 -2,-0.4 2,-0.5 -0.798 1.7-158.2 -90.5 125.8 45.3 19.3 15.4 5 6 A L E -ab 112 44A 0 38,-2.7 40,-2.0 -2,-0.5 2,-0.5 -0.919 8.2-167.8-102.3 128.1 46.2 17.9 18.8 6 7 A I E -ab 113 45A 0 106,-2.8 108,-3.0 -2,-0.5 2,-0.6 -0.957 5.0-157.5-118.9 114.8 47.8 20.4 21.2 7 8 A V E -ab 114 46A 0 38,-2.8 40,-2.9 -2,-0.5 2,-1.6 -0.856 14.8-144.9 -97.3 120.6 49.3 19.0 24.4 8 9 A D E > - b 0 47A 16 106,-2.1 4,-2.0 -2,-0.6 3,-0.3 -0.705 28.5-167.5 -76.4 91.0 49.7 21.4 27.3 9 10 A A H > S+ 0 0 0 -2,-1.6 4,-2.6 38,-1.4 -1,-0.2 0.832 75.1 44.7 -64.2 -43.4 53.0 19.6 28.2 10 11 A L H > S+ 0 0 17 37,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.809 111.5 55.2 -73.8 -27.6 53.7 21.0 31.7 11 12 A N H > S+ 0 0 35 -3,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.959 113.9 40.7 -65.4 -47.8 50.1 20.5 32.8 12 13 A L H X S+ 0 0 2 -4,-2.0 4,-2.0 102,-0.2 -2,-0.2 0.949 117.9 47.0 -65.9 -48.1 50.3 16.8 31.8 13 14 A I H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.861 109.8 51.6 -65.7 -39.6 53.9 16.3 33.2 14 15 A R H X S+ 0 0 120 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.877 112.0 46.9 -66.7 -37.3 53.3 18.0 36.6 15 16 A R H X S+ 0 0 95 -4,-1.4 4,-1.5 -5,-0.2 -2,-0.2 0.876 111.1 50.0 -74.7 -37.8 50.2 15.9 37.2 16 17 A I H X S+ 0 0 6 -4,-2.0 4,-2.7 2,-0.2 5,-0.4 0.930 112.5 48.7 -64.9 -44.6 51.8 12.6 36.2 17 18 A H H X S+ 0 0 23 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.911 105.7 57.4 -60.5 -41.6 54.8 13.4 38.5 18 19 A A H < S+ 0 0 80 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.864 115.5 38.5 -55.7 -35.5 52.3 14.3 41.4 19 20 A V H < S+ 0 0 103 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.892 135.3 14.2 -81.5 -45.7 50.9 10.7 41.1 20 21 A Q H < S- 0 0 117 -4,-2.7 -3,-0.2 1,-0.2 -2,-0.2 0.553 87.2-146.3-111.0 -10.0 54.0 8.7 40.4 21 22 A G < + 0 0 22 -4,-2.7 -1,-0.2 -5,-0.4 -2,-0.1 -0.120 49.8 5.5 65.0-168.3 57.0 10.8 41.2 22 23 A S S S+ 0 0 40 2,-0.1 2,-0.1 1,-0.0 49,-0.1 -0.601 105.8 43.7 -93.7 151.0 60.2 10.4 39.2 23 24 A P + 0 0 113 0, 0.0 4,-0.1 0, 0.0 48,-0.1 0.566 64.8 153.7 -81.8 151.8 61.2 8.9 36.9 24 25 A C > + 0 0 0 -2,-0.1 4,-2.3 2,-0.1 5,-0.2 0.320 34.5 105.4-128.5 12.8 58.2 9.6 34.7 25 26 A V H > S+ 0 0 32 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.919 84.5 49.6 -59.6 -45.3 59.3 9.5 31.1 26 27 A E H > S+ 0 0 167 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.909 110.8 47.8 -64.2 -43.3 57.7 6.1 30.4 27 28 A T H > S+ 0 0 41 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.920 111.9 52.5 -61.4 -42.0 54.3 7.1 31.9 28 29 A C H X S+ 0 0 3 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.864 109.4 48.1 -56.9 -40.1 54.5 10.3 29.8 29 30 A Q H X S+ 0 0 30 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.883 110.8 50.8 -71.5 -38.1 55.2 8.3 26.6 30 31 A H H X S+ 0 0 107 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.926 109.8 51.0 -64.2 -43.7 52.3 5.9 27.4 31 32 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.885 109.2 50.7 -59.5 -42.2 50.0 8.9 27.9 32 33 A L H X S+ 0 0 3 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.955 109.7 50.1 -63.4 -48.0 51.0 10.4 24.6 33 34 A D H X S+ 0 0 56 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.899 111.8 48.3 -53.1 -45.1 50.3 7.1 22.8 34 35 A Q H X S+ 0 0 82 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.904 110.7 51.2 -66.2 -36.2 46.9 6.8 24.4 35 36 A L H X S+ 0 0 6 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.879 110.6 47.9 -69.6 -39.4 46.1 10.4 23.4 36 37 A I H X S+ 0 0 27 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.881 113.4 48.6 -65.4 -39.2 47.1 9.9 19.8 37 38 A M H < S+ 0 0 138 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.923 113.5 46.4 -68.2 -44.5 45.0 6.7 19.6 38 39 A H H < S+ 0 0 95 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.922 123.9 31.6 -61.6 -45.2 42.0 8.3 21.2 39 40 A S H < S- 0 0 14 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.690 83.2-151.4 -92.5 -25.9 42.1 11.5 19.0 40 41 A Q < - 0 0 125 -4,-2.3 -3,-0.1 -5,-0.2 -4,-0.1 0.941 28.0-170.4 51.3 54.3 43.5 10.2 15.7 41 42 A P - 0 0 14 0, 0.0 -37,-0.2 0, 0.0 -1,-0.1 -0.372 32.1-154.4 -75.5 157.0 45.1 13.6 14.8 42 43 A T S S+ 0 0 42 -39,-1.7 197,-2.7 1,-0.2 2,-0.3 0.626 87.9 28.6 -92.4 -22.9 46.7 14.5 11.5 43 44 A H E S-bC 4 238A 11 -40,-1.9 -38,-2.7 195,-0.3 2,-0.3 -0.985 70.1-176.7-140.9 145.7 48.8 17.1 13.2 44 45 A A E +b 5 0A 0 193,-2.6 2,-0.3 -2,-0.3 -38,-0.2 -0.996 7.1 175.2-149.1 151.2 50.3 17.4 16.8 45 46 A V E -b 6 0A 0 -40,-2.0 -38,-2.8 -2,-0.3 2,-0.5 -0.979 20.6-145.2-153.1 143.8 52.3 19.8 18.9 46 47 A A E -bd 7 89A 0 42,-2.7 44,-2.8 -2,-0.3 2,-0.4 -0.972 21.9-151.3-109.4 119.5 53.4 19.9 22.6 47 48 A V E -bd 8 90A 0 -40,-2.9 -38,-1.4 -2,-0.5 -37,-0.6 -0.792 12.6-170.0 -99.6 133.7 53.5 23.4 24.0 48 49 A F 0 0 7 42,-3.0 -40,-0.0 -2,-0.4 -2,-0.0 -0.951 360.0 360.0-123.4 138.7 56.0 24.3 26.8 49 50 A D 0 0 144 -2,-0.4 42,-0.1 42,-0.2 -2,-0.0 -0.678 360.0 360.0 -67.9 360.0 56.2 27.4 29.0 50 ! 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 51 57 A G > 0 0 103 0, 0.0 4,-1.2 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 176.3 55.3 38.7 30.1 52 58 A W H > + 0 0 89 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.804 360.0 63.1 -68.2 -28.7 52.7 41.5 29.7 53 59 A R H > S+ 0 0 17 1,-0.2 4,-1.7 2,-0.2 7,-0.2 0.890 104.0 47.2 -66.1 -40.1 50.4 40.1 32.5 54 60 A H H 4 S+ 0 0 112 -3,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.838 106.7 58.8 -68.4 -33.7 53.0 40.6 35.2 55 61 A Q H < S+ 0 0 81 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.901 114.4 36.4 -60.9 -38.7 53.7 44.1 33.9 56 62 A R H < S+ 0 0 122 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.709 133.7 23.6 -89.9 -21.0 50.0 45.1 34.5 57 63 A L >< - 0 0 10 -4,-1.7 3,-2.2 -5,-0.2 -1,-0.3 -0.762 67.5-167.7-146.1 91.3 49.5 43.1 37.7 58 64 A P T 3 S+ 0 0 85 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.818 86.0 60.1 -57.0 -34.3 52.8 42.4 39.5 59 65 A D T > S+ 0 0 91 109,-0.1 3,-2.8 2,-0.1 -5,-0.1 0.665 74.3 133.9 -59.4 -21.9 51.2 39.8 41.9 60 66 A Y T < S- 0 0 42 -3,-2.2 108,-0.2 1,-0.3 107,-0.1 -0.094 88.3 -20.2 -46.4 123.2 50.2 37.6 38.9 61 67 A K T > S+ 0 0 97 106,-2.0 3,-1.0 1,-0.2 -1,-0.3 0.588 97.1 158.0 51.3 20.3 51.1 33.9 39.6 62 68 A A T < + 0 0 42 -3,-2.8 -1,-0.2 105,-0.3 -3,-0.0 -0.513 60.9 16.3 -79.9 138.4 53.6 35.1 42.3 63 69 A G T 3 S+ 0 0 80 1,-0.3 -1,-0.2 -2,-0.2 -2,-0.1 0.358 86.9 150.9 81.3 -4.0 54.6 32.6 45.0 64 70 A R < - 0 0 55 -3,-1.0 -1,-0.3 1,-0.1 103,-0.0 -0.236 59.4 -82.6 -59.4 149.8 53.3 29.7 42.9 65 71 A P - 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.271 44.7-125.9 -66.7 135.3 55.1 26.5 43.6 66 72 A P - 0 0 119 0, 0.0 3,-0.0 0, 0.0 0, 0.0 -0.164 34.6 -88.9 -68.1 168.1 58.4 25.9 41.8 67 73 A M - 0 0 49 1,-0.1 2,-0.1 2,-0.1 5,-0.0 -0.615 49.9-103.2 -74.2 135.1 59.1 22.8 39.7 68 74 A P >> - 0 0 55 0, 0.0 4,-2.3 0, 0.0 3,-1.8 -0.427 27.5-125.6 -61.7 132.4 60.6 20.0 41.8 69 75 A E H 3> S+ 0 0 76 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.782 108.7 55.9 -45.6 -38.9 64.3 19.8 41.1 70 76 A E H 3> S+ 0 0 103 2,-0.2 4,-0.5 1,-0.2 -1,-0.3 0.788 109.0 46.3 -74.6 -23.9 64.1 16.1 40.2 71 77 A L H X> S+ 0 0 1 -3,-1.8 3,-1.0 2,-0.2 4,-0.8 0.889 107.0 58.9 -81.6 -40.1 61.4 16.8 37.5 72 78 A H H >< S+ 0 0 120 -4,-2.3 3,-1.3 1,-0.2 -2,-0.2 0.921 104.1 52.2 -49.3 -45.3 63.6 19.7 36.3 73 79 A D H 3< S+ 0 0 128 -4,-2.0 4,-0.3 1,-0.3 -1,-0.2 0.706 108.1 50.7 -67.0 -23.9 66.4 17.2 35.6 74 80 A E H XX S+ 0 0 23 -3,-1.0 4,-2.0 -4,-0.5 3,-0.8 0.571 83.8 95.1 -81.2 -14.8 64.1 14.9 33.6 75 81 A M H S+ 0 0 89 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.877 112.4 48.5 -64.1 -34.7 65.4 17.1 28.6 77 83 A A H <> S+ 0 0 51 -3,-0.8 4,-1.2 -4,-0.3 -2,-0.2 0.827 109.6 53.8 -73.3 -31.2 64.5 13.4 28.5 78 84 A L H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 3,-0.4 0.952 107.4 49.0 -68.2 -47.0 60.8 14.3 28.4 79 85 A R H X S+ 0 0 86 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.921 110.7 51.3 -55.6 -46.9 61.1 16.6 25.4 80 86 A A H X S+ 0 0 52 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.808 105.3 56.9 -59.3 -32.1 63.1 13.9 23.6 81 87 A A H X S+ 0 0 7 -4,-1.2 4,-0.8 -3,-0.4 -1,-0.2 0.898 108.7 45.5 -71.6 -35.2 60.3 11.4 24.4 82 88 A F H ><>S+ 0 0 3 -4,-1.8 5,-2.1 2,-0.2 3,-1.1 0.965 113.6 48.7 -66.3 -51.3 57.7 13.7 22.6 83 89 A E H ><5S+ 0 0 110 -4,-2.5 3,-1.7 1,-0.3 -2,-0.2 0.861 104.3 60.2 -59.8 -34.7 59.9 14.3 19.6 84 90 A Q H 3<5S+ 0 0 143 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.785 103.1 52.2 -61.3 -31.2 60.6 10.5 19.2 85 91 A R T <<5S- 0 0 78 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.361 128.4-100.1 -85.6 4.9 56.9 10.0 18.8 86 92 A G T < 5S+ 0 0 32 -3,-1.7 -3,-0.2 -4,-0.2 -42,-0.2 0.544 83.4 130.4 88.7 11.7 56.8 12.6 16.0 87 93 A V < - 0 0 0 -5,-2.1 -1,-0.2 -6,-0.2 -2,-0.2 -0.823 51.0-139.6-104.1 104.5 55.4 15.4 18.2 88 94 A P - 0 0 30 0, 0.0 -42,-2.7 0, 0.0 2,-0.6 -0.203 10.7-132.9 -60.9 148.6 57.4 18.7 18.0 89 95 A C E -d 46 0A 16 -44,-0.2 2,-0.4 -42,-0.1 -42,-0.2 -0.920 25.1-171.1-107.3 112.5 58.0 20.7 21.2 90 96 A W E d 47 0A 45 -44,-2.8 -42,-3.0 -2,-0.6 6,-0.0 -0.903 360.0 360.0-111.0 141.5 57.2 24.4 20.9 91 97 A S 0 0 101 -2,-0.4 -42,-0.2 -44,-0.2 -44,-0.0 -0.788 360.0 360.0-124.1 360.0 58.0 27.2 23.4 92 ! 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 93 103 A A > 0 0 28 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -41.3 52.2 28.7 26.7 94 104 A D H > + 0 0 33 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.831 360.0 51.5 -67.6 -33.7 48.4 29.0 27.0 95 105 A D H > S+ 0 0 17 2,-0.2 4,-2.5 3,-0.2 133,-0.3 0.837 110.1 49.9 -67.5 -36.4 48.3 31.9 24.6 96 106 A L H > S+ 0 0 28 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.941 112.7 46.4 -67.8 -45.6 50.3 29.9 22.0 97 107 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.918 113.1 50.9 -59.1 -42.4 48.0 27.0 22.4 98 108 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.3 0.936 109.8 49.2 -63.1 -47.9 45.0 29.3 22.1 99 109 A T H X S+ 0 0 5 -4,-2.5 4,-2.5 126,-0.5 5,-0.2 0.943 112.8 46.1 -57.8 -50.6 46.4 31.0 18.9 100 110 A L H X S+ 0 0 6 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.945 114.3 49.4 -56.2 -48.1 47.1 27.6 17.1 101 111 A A H X S+ 0 0 0 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.870 114.3 42.3 -63.3 -40.6 43.6 26.2 18.1 102 112 A V H X S+ 0 0 8 -4,-2.4 4,-2.2 -5,-0.2 5,-0.2 0.928 113.1 54.5 -75.8 -40.6 41.6 29.3 16.9 103 113 A K H X S+ 0 0 95 -4,-2.5 4,-0.8 -5,-0.3 -2,-0.2 0.935 112.9 41.3 -56.6 -49.2 43.6 29.6 13.7 104 114 A V H <>S+ 0 0 5 -4,-2.4 5,-1.8 -5,-0.2 3,-0.3 0.896 115.6 49.2 -71.0 -36.9 43.0 26.0 12.7 105 115 A T H ><5S+ 0 0 20 -4,-1.8 3,-0.9 -5,-0.2 -1,-0.2 0.800 106.6 54.3 -75.8 -27.5 39.3 25.9 13.7 106 116 A Q H 3<5S+ 0 0 75 -4,-2.2 189,-0.5 1,-0.2 -1,-0.2 0.760 101.6 60.3 -74.5 -20.1 38.4 29.2 11.9 107 117 A A T 3<5S- 0 0 34 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.457 130.9 -96.0 -84.9 -1.9 39.8 27.8 8.6 108 118 A G T < 5S+ 0 0 42 -3,-0.9 -3,-0.2 1,-0.3 -2,-0.1 0.409 88.5 114.1 104.5 5.1 37.3 25.0 9.0 109 119 A H < - 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0 0 11 -4,-1.4 2,-0.4 -5,-0.5 -1,-0.2 -0.354 14.2 -96.2 95.2 173.6 38.9 36.6 40.6 164 174 A I B > > -H 169 0B 36 5,-3.1 5,-2.4 1,-0.1 3,-0.6 -0.913 28.9-168.3-135.0 106.7 41.2 33.6 40.2 165 175 A S G > 5S+ 0 0 111 -2,-0.4 3,-2.5 1,-0.2 -1,-0.1 0.947 83.5 61.0 -65.7 -50.4 42.7 32.7 43.5 166 176 A S G 3 5S+ 0 0 102 1,-0.3 -1,-0.2 2,-0.1 -102,-0.0 0.726 115.3 34.9 -39.1 -38.1 45.4 30.3 42.1 167 177 A S G < 5S- 0 0 15 -3,-0.6 -106,-2.0 2,-0.1 -1,-0.3 0.245 111.0-113.4-108.9 9.5 46.9 33.2 40.1 168 178 A K T < 5 + 0 0 103 -3,-2.5 -3,-0.2 1,-0.2 -2,-0.1 0.866 64.7 147.9 52.9 38.5 46.4 36.1 42.6 169 179 A V B < -H 164 0B 3 -5,-2.4 -5,-3.1 1,-0.1 -1,-0.2 -0.935 29.5-167.9 -95.4 111.6 43.8 37.8 40.2 170 180 A P - 0 0 69 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.763 6.1-167.6 -78.5 -23.4 41.5 39.5 42.7 171 181 A G - 0 0 2 43,-0.2 2,-0.6 -7,-0.1 -10,-0.3 -0.469 61.1 -16.6 64.4-145.2 38.6 40.5 40.5 172 182 A V S > S- 0 0 2 -11,-2.3 3,-2.0 3,-0.1 36,-0.1 -0.794 76.5-117.6 -97.2 123.6 36.4 42.8 42.3 173 183 A A T 3 S+ 0 0 61 -2,-0.6 3,-0.1 1,-0.3 -2,-0.1 -0.322 99.7 20.9 -62.6 125.9 36.7 43.0 46.1 174 184 A G T 3 S+ 0 0 48 1,-0.2 2,-0.6 -12,-0.1 -1,-0.3 0.454 97.2 107.4 96.1 -0.4 33.5 41.9 47.7 175 185 A I < - 0 0 9 -3,-2.0 -1,-0.2 -14,-0.3 -3,-0.1 -0.959 49.7-170.0-113.9 116.9 32.1 40.0 44.8 176 186 A G > - 0 0 28 -2,-0.6 4,-2.5 -3,-0.1 3,-0.3 -0.420 38.5 -84.8 -98.8-178.9 32.2 36.2 45.1 177 187 A P H > S+ 0 0 83 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.855 123.9 45.0 -55.1 -46.2 31.5 33.3 42.7 178 188 A K H > S+ 0 0 158 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.843 113.4 50.3 -75.7 -29.9 27.7 33.1 43.0 179 189 A S H > S+ 0 0 28 -3,-0.3 4,-2.9 2,-0.2 5,-0.2 0.920 108.3 53.6 -68.9 -40.7 27.3 36.9 42.8 180 190 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.931 109.6 49.5 -57.2 -43.3 29.5 37.0 39.6 181 191 A T H X S+ 0 0 30 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.936 111.2 47.6 -63.3 -48.8 27.2 34.3 38.1 182 192 A Q H X S+ 0 0 86 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.905 110.8 51.4 -63.2 -43.1 24.0 36.2 38.9 183 193 A L H X S+ 0 0 1 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.917 113.9 43.8 -58.5 -42.5 25.4 39.4 37.5 184 194 A L H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.805 106.2 59.1 -78.0 -29.8 26.4 37.8 34.3 185 195 A V H < S+ 0 0 88 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.933 118.0 34.2 -63.3 -37.4 23.2 35.8 33.8 186 196 A E H < S+ 0 0 119 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.917 131.4 26.8 -81.3 -46.4 21.3 39.1 33.8 187 197 A F H < S- 0 0 20 -4,-2.6 2,-1.6 -5,-0.2 -3,-0.2 0.467 84.6-146.3-109.1 -5.0 23.7 41.6 32.2 188 198 A Q < + 0 0 85 -4,-1.9 2,-0.3 -5,-0.2 -4,-0.1 -0.191 67.2 18.1 78.3 -42.4 25.8 39.3 29.9 189 199 A S S > S- 0 0 23 -2,-1.6 4,-1.8 -6,-0.1 5,-0.1 -0.922 83.8 -96.7-153.8 163.4 29.2 41.1 30.0 190 200 A L H > S+ 0 0 0 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.911 127.5 50.5 -50.7 -46.7 31.2 43.6 32.0 191 201 A E H > S+ 0 0 16 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.903 106.4 55.8 -58.3 -43.1 30.1 46.3 29.5 192 202 A G H > S+ 0 0 3 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.866 111.3 43.6 -54.7 -43.5 26.5 45.1 30.0 193 203 A I H < S+ 0 0 0 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.925 114.1 47.7 -67.3 -50.6 26.9 45.7 33.8 194 204 A Y H < S+ 0 0 19 -4,-2.5 3,-0.3 1,-0.2 -2,-0.2 0.694 113.0 48.6 -76.0 -21.2 28.6 49.0 33.6 195 205 A E H < S+ 0 0 54 -4,-2.1 2,-0.5 -5,-0.2 3,-0.4 0.914 116.8 42.1 -70.3 -52.9 26.1 50.4 31.1 196 206 A N S >< S+ 0 0 76 -4,-1.6 3,-1.3 -5,-0.3 4,-0.4 -0.095 74.6 134.2 -88.9 37.1 23.1 49.3 33.1 197 207 A L G > + 0 0 29 -2,-0.5 3,-0.8 -3,-0.3 -1,-0.2 0.774 66.5 58.2 -70.0 -28.7 24.6 50.3 36.5 198 208 A D G 3 S+ 0 0 95 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.811 104.6 54.3 -62.7 -32.7 21.3 52.0 37.6 199 209 A A G < S+ 0 0 58 -3,-1.3 2,-0.3 -6,-0.1 -1,-0.2 0.514 87.6 100.1 -81.1 -5.4 19.6 48.6 37.2 200 210 A V S < S- 0 0 2 -3,-0.8 5,-0.1 -4,-0.4 -17,-0.0 -0.675 86.0 -96.1 -89.2 137.6 22.0 46.7 39.4 201 211 A A >> - 0 0 44 -2,-0.3 4,-2.0 1,-0.1 3,-1.3 -0.060 30.8-118.6 -50.2 147.2 21.0 45.9 43.0 202 212 A E H 3> S+ 0 0 156 1,-0.3 4,-0.9 2,-0.2 -1,-0.1 0.800 109.1 64.3 -60.6 -39.5 22.3 48.3 45.6 203 213 A K H 34 S+ 0 0 136 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.743 116.1 30.1 -55.7 -30.8 24.4 45.7 47.5 204 214 A W H <> S+ 0 0 24 -3,-1.3 4,-2.5 2,-0.1 5,-0.2 0.689 101.5 80.2 -99.3 -28.3 26.6 45.3 44.4 205 215 A R H X S+ 0 0 74 -4,-2.0 4,-3.1 1,-0.2 5,-0.2 0.900 95.5 44.1 -48.5 -54.7 26.5 48.8 42.8 206 216 A K H X S+ 0 0 155 -4,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.907 112.4 51.4 -60.8 -47.6 29.0 50.5 45.0 207 217 A K H 4 S+ 0 0 80 -4,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.928 114.3 45.6 -57.2 -42.5 31.5 47.6 44.9 208 218 A L H >< S+ 0 0 0 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.913 111.5 50.8 -67.4 -45.7 31.3 47.7 41.1 209 219 A E H >< S+ 0 0 114 -4,-3.1 3,-0.8 1,-0.2 -2,-0.2 0.900 111.6 46.4 -60.1 -41.8 31.6 51.5 40.8 210 220 A T T 3< S+ 0 0 90 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.424 118.3 41.2 -87.7 0.2 34.7 51.8 43.0 211 221 A H T <> S+ 0 0 62 -3,-1.0 4,-1.9 -4,-0.4 -1,-0.2 -0.059 72.5 123.1-133.1 30.0 36.6 48.9 41.3 212 222 A K H <> S+ 0 0 73 -3,-0.8 4,-2.2 2,-0.2 5,-0.2 0.901 75.6 49.7 -56.8 -45.3 35.8 49.4 37.6 213 223 A E H > S+ 0 0 177 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.918 111.5 49.7 -66.9 -39.1 39.4 49.6 36.5 214 224 A M H > S+ 0 0 67 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.854 108.1 53.1 -64.3 -40.7 40.3 46.4 38.3 215 225 A A H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.962 113.7 42.8 -60.3 -52.5 37.3 44.4 36.8 216 226 A F H X S+ 0 0 27 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.868 114.4 51.3 -63.5 -36.6 38.3 45.3 33.3 217 227 A L H X S+ 0 0 28 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.909 110.0 48.3 -64.1 -43.4 42.0 44.7 34.0 218 228 A C H X S+ 0 0 0 -4,-2.4 4,-1.9 -58,-0.2 -2,-0.2 0.796 107.9 55.0 -73.3 -27.7 41.3 41.2 35.5 219 229 A R H X S+ 0 0 4 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.929 107.9 49.6 -66.1 -44.7 39.2 40.3 32.5 220 230 A D H < S+ 0 0 33 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.902 111.6 48.9 -60.6 -42.1 42.1 41.1 30.1 221 231 A I H < S+ 0 0 4 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.888 112.0 48.7 -62.0 -42.8 44.5 39.0 32.3 222 232 A A H < S+ 0 0 11 -4,-1.9 2,-0.2 -66,-0.2 -1,-0.2 0.732 94.7 93.0 -72.2 -22.2 42.0 36.1 32.3 223 233 A R S < S- 0 0 27 -4,-1.6 2,-0.3 -5,-0.1 -128,-0.0 -0.524 75.7-130.6 -75.1 134.6 41.5 36.3 28.5 224 234 A L - 0 0 7 -2,-0.2 2,-0.5 -105,-0.2 -129,-0.1 -0.612 20.8-123.0 -81.4 140.4 43.8 34.1 26.2 225 235 A Q - 0 0 39 -2,-0.3 -126,-0.5 1,-0.1 3,-0.3 -0.777 28.2-179.1 -87.5 125.5 45.5 35.9 23.4 226 236 A T + 0 0 12 -2,-0.5 -1,-0.1 1,-0.2 -123,-0.1 0.175 68.3 64.0-112.6 17.8 44.6 34.3 20.1 227 237 A D + 0 0 100 247,-0.1 -1,-0.2 2,-0.1 -131,-0.1 -0.054 64.0 145.4-134.3 27.4 46.6 36.5 17.6 228 238 A L - 0 0 76 -133,-0.3 2,-0.5 -3,-0.3 0, 0.0 -0.319 58.5-104.7 -63.0 151.3 50.2 35.8 18.6 229 239 A H - 0 0 157 2,-0.0 2,-0.5 1,-0.0 -1,-0.1 -0.721 36.6-150.6 -73.9 124.2 52.8 35.8 15.8 230 240 A I - 0 0 27 -2,-0.5 -134,-0.0 1,-0.1 -1,-0.0 -0.906 9.3-158.9-100.8 127.2 53.8 32.1 15.2 231 241 A D S S+ 0 0 154 -2,-0.5 -1,-0.1 2,-0.0 -2,-0.0 0.890 76.4 47.4 -70.7 -44.4 57.4 31.5 14.0 232 242 A G S S- 0 0 20 1,-0.0 2,-0.3 2,-0.0 -2,-0.1 0.036 81.3-124.6 -79.0-167.4 56.6 28.0 12.5 233 243 A N > - 0 0 61 1,-0.0 3,-1.5 0, 0.0 4,-0.3 -0.959 26.4-104.3-138.6 160.7 53.8 26.9 10.2 234 244 A L G > S+ 0 0 38 -2,-0.3 3,-2.0 1,-0.2 4,-0.1 0.823 113.5 66.4 -52.3 -36.0 51.1 24.1 10.4 235 245 A Q G > S+ 0 0 139 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.802 91.4 61.3 -63.8 -24.6 53.0 21.9 7.9 236 246 A Q G < S+ 0 0 109 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.666 100.9 58.6 -69.5 -14.3 55.9 21.4 10.3 237 247 A L G < S+ 0 0 0 -3,-2.0 -193,-2.6 -4,-0.3 -1,-0.2 0.307 70.8 130.9 -99.9 4.2 53.3 19.7 12.7 238 248 A R B < -C 43 0A 170 -3,-1.1 2,-0.5 -195,-0.2 -195,-0.3 -0.397 54.8-133.3 -66.6 135.1 52.1 17.0 10.4 239 249 A L - 0 0 22 -197,-2.7 2,-0.5 -2,-0.1 -153,-0.1 -0.803 15.8-162.3 -97.2 123.8 52.2 13.7 12.3 240 250 A V 0 0 122 -2,-0.5 -198,-0.0 -154,-0.2 -197,-0.0 -0.946 360.0 360.0-103.3 123.1 53.7 10.6 10.6 241 251 A R 0 0 123 -2,-0.5 -156,-0.0 -155,-0.0 -2,-0.0 -0.126 360.0 360.0 50.2 360.0 52.8 7.2 12.1 242 !* 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 0.0 243 2 B A 0 0 112 0, 0.0 2,-0.5 0, 0.0 109,-0.1 0.000 360.0 360.0 360.0 155.7 22.1 52.6 25.6 244 3 B V + 0 0 9 107,-0.1 109,-2.0 103,-0.1 2,-0.4 -0.961 360.0 173.9-112.9 127.7 24.6 50.9 23.3 245 4 B H E -i 353 0C 24 -2,-0.5 39,-2.0 107,-0.2 40,-1.9 -0.933 13.9-161.2-132.6 109.3 24.6 51.5 19.5 246 5 B L E -ij 354 285C 0 107,-2.3 109,-2.4 -2,-0.4 2,-0.6 -0.799 3.8-155.6 -94.3 123.2 27.5 49.8 17.6 247 6 B L E -ij 355 286C 0 38,-2.8 40,-1.9 -2,-0.5 2,-0.6 -0.879 9.8-166.1 -98.2 122.4 28.3 51.2 14.1 248 7 B I E -ij 356 287C 0 107,-3.1 109,-2.8 -2,-0.6 2,-0.6 -0.927 3.1-159.5-114.4 111.2 30.0 48.5 12.0 249 8 B V E -ij 357 288C 0 38,-2.8 40,-2.5 -2,-0.6 2,-1.4 -0.793 15.2-144.4 -96.8 121.6 31.7 49.8 8.8 250 9 B D E > - 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0 0 48 -2,-1.3 4,-2.6 -11,-0.1 3,-0.2 -0.277 59.2 -78.5-110.7-172.8 15.2 46.8 5.1 384 151 B A H > S+ 0 0 45 1,-0.3 4,-3.2 2,-0.2 5,-0.2 0.909 126.1 48.8 -63.1 -46.5 12.3 44.4 5.0 385 152 B P H > S+ 0 0 87 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.834 111.1 52.0 -56.8 -37.9 10.3 46.2 2.3 386 153 B F H > S+ 0 0 25 -3,-0.2 4,-3.1 2,-0.2 5,-0.3 0.950 111.4 46.5 -62.7 -48.2 13.4 46.5 0.2 387 154 B I H X>S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-1.3 0.937 111.5 52.2 -61.6 -44.2 14.0 42.7 0.5 388 155 B D H <5S+ 0 0 107 -4,-3.2 4,-0.4 3,-0.2 -1,-0.2 0.894 114.2 43.4 -54.8 -42.1 10.3 42.1 -0.3 389 156 B K H <5S+ 0 0 187 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.944 121.1 37.4 -71.1 -46.9 10.6 44.2 -3.4 390 157 B E H <5S+ 0 0 99 -4,-3.1 -2,-0.2 -5,-0.1 -3,-0.2 0.834 136.6 12.2 -80.0 -35.8 14.0 42.8 -4.7 391 158 B F T <5S- 0 0 18 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.1 0.683 82.3-135.7-118.8 -27.4 13.7 39.1 -3.7 392 159 B G S - 0 0 34 -2,-0.3 3,-2.0 -3,-0.1 4,-0.4 -0.510 41.7-108.3 -76.6 152.9 11.6 36.9 4.0 395 162 B P G > S+ 0 0 23 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.853 119.1 52.9 -50.8 -43.9 15.1 37.9 5.3 396 163 B Q G 3 S+ 0 0 143 1,-0.3 4,-0.3 2,-0.1 -31,-0.1 0.642 103.4 59.6 -68.9 -13.1 15.6 34.4 6.9 397 164 B Q G <> S+ 0 0 26 -3,-2.0 4,-2.5 1,-0.2 -1,-0.3 0.484 78.6 94.0 -90.8 -5.1 14.8 32.7 3.6 398 165 B L H <> S+ 0 0 0 -3,-1.5 4,-2.5 -4,-0.4 5,-0.2 0.868 79.3 53.8 -61.4 -40.8 17.6 34.5 1.7 399 166 B P H > S+ 0 0 6 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.918 111.6 46.8 -59.3 -41.8 20.2 31.7 2.1 400 167 B D H > S+ 0 0 10 -4,-0.3 4,-1.1 2,-0.2 -2,-0.2 0.892 110.5 54.3 -58.5 -45.1 17.7 29.3 0.6 401 168 B Y H >X S+ 0 0 17 -4,-2.5 4,-2.8 1,-0.2 3,-0.9 0.932 110.3 44.2 -53.7 -51.6 17.0 31.8 -2.1 402 169 B W H 3X S+ 0 0 21 -4,-2.5 4,-1.0 1,-0.3 -1,-0.2 0.716 105.5 63.3 -70.9 -23.5 20.7 32.1 -3.1 403 170 B G H 3< S+ 0 0 0 -4,-1.3 -1,-0.3 -5,-0.2 58,-0.2 0.764 116.2 31.0 -65.2 -29.4 21.0 28.3 -2.8 404 171 B L H << S+ 0 0 0 -4,-1.1 11,-2.0 -3,-0.9 14,-0.3 0.894 129.9 33.0 -89.6 -61.5 18.5 28.2 -5.7 405 172 B A H < S- 0 0 23 -4,-2.8 -3,-0.2 9,-0.2 -2,-0.1 0.837 100.3-143.1 -67.7 -36.9 19.2 31.3 -7.8 406 173 B G < - 0 0 12 -4,-1.0 2,-0.4 -5,-0.4 -1,-0.1 -0.284 14.3 -98.3 91.2 168.6 23.0 31.4 -7.1 407 174 B I B > > -O 412 0D 38 5,-2.4 5,-2.4 1,-0.1 3,-1.2 -0.885 29.4-171.4-129.1 99.7 25.3 34.5 -6.5 408 175 B S G > 5S+ 0 0 117 -2,-0.4 3,-2.1 1,-0.3 -1,-0.1 0.913 82.4 65.1 -60.2 -44.0 27.1 35.4 -9.8 409 176 B S G 3 5S+ 0 0 95 1,-0.3 -1,-0.3 2,-0.1 -2,-0.0 0.713 113.9 31.5 -44.9 -35.1 29.4 38.0 -8.0 410 177 B S G < 5S- 0 0 15 -3,-1.2 -106,-2.6 2,-0.1 -105,-0.3 0.223 113.1-110.2-110.8 5.8 31.0 35.1 -6.0 411 178 B K T < 5 + 0 0 35 -3,-2.1 -3,-0.2 -4,-0.3 -109,-0.1 0.852 65.7 150.5 61.6 33.3 30.7 32.3 -8.5 412 179 B V B < -O 407 0D 4 -5,-2.4 -5,-2.4 1,-0.1 -1,-0.2 -0.859 27.9-167.6 -92.5 107.5 28.1 30.5 -6.4 413 180 B P - 0 0 67 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.791 5.9-170.2 -69.3 -29.7 26.1 28.7 -9.1 414 181 B G - 0 0 2 43,-0.2 2,-0.5 -7,-0.1 -10,-0.2 -0.474 61.4 -18.7 64.5-147.6 23.0 27.6 -7.1 415 182 B V S > S- 0 0 2 -11,-2.0 3,-2.0 3,-0.1 36,-0.1 -0.846 77.8-117.8 -90.2 121.1 20.8 25.1 -9.2 416 183 B A T 3 S+ 0 0 61 -2,-0.5 3,-0.1 1,-0.3 38,-0.1 -0.363 98.9 21.6 -64.1 127.5 21.6 25.3 -13.0 417 184 B G T 3 S+ 0 0 49 1,-0.2 2,-0.5 -12,-0.1 -1,-0.3 0.415 96.3 106.3 93.1 1.2 18.5 26.4 -14.8 418 185 B I < - 0 0 9 -3,-2.0 -1,-0.2 -14,-0.3 -3,-0.1 -0.971 49.4-173.6-110.7 123.5 16.7 28.1 -11.9 419 186 B G > - 0 0 30 -2,-0.5 4,-2.4 -3,-0.1 5,-0.2 -0.408 40.7 -79.9-103.1-175.5 16.8 31.9 -12.1 420 187 B P H > S+ 0 0 81 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.864 124.8 45.3 -55.3 -49.9 15.6 34.6 -9.6 421 188 B K H > S+ 0 0 157 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.853 113.0 51.9 -70.1 -31.2 11.9 34.7 -10.2 422 189 B S H > S+ 0 0 31 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.949 108.1 52.3 -68.4 -39.7 11.7 30.8 -10.2 423 190 B A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.922 109.4 49.3 -61.8 -45.3 13.6 30.8 -6.8 424 191 B T H X S+ 0 0 32 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.920 111.2 49.3 -57.4 -45.1 11.1 33.2 -5.4 425 192 B Q H X S+ 0 0 93 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.895 111.3 49.2 -67.6 -38.7 8.1 31.2 -6.6 426 193 B L H X S+ 0 0 1 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.903 114.2 45.0 -63.6 -40.8 9.5 27.9 -5.2 427 194 B L H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.818 107.4 56.2 -77.4 -34.5 10.2 29.5 -1.8 428 195 B V H < S+ 0 0 88 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.924 118.1 36.3 -59.1 -39.6 6.9 31.3 -1.5 429 196 B E H < S+ 0 0 66 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.1 0.914 132.5 24.3 -83.6 -42.3 5.2 27.9 -2.0 430 197 B F H < S- 0 0 55 -4,-2.7 2,-2.0 -5,-0.2 5,-0.3 0.415 85.8-145.2-109.5 -4.3 7.5 25.5 -0.1 431 198 B Q < + 0 0 115 -4,-2.0 2,-0.3 -5,-0.2 -4,-0.1 -0.175 69.1 15.3 75.4 -47.2 9.3 27.9 2.4 432 199 B S S > S- 0 0 33 -2,-2.0 4,-1.5 -6,-0.2 3,-0.2 -0.944 85.6 -93.8-150.7 168.7 12.7 26.3 2.5 433 200 B L H > S+ 0 0 0 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.775 124.3 56.5 -58.6 -27.2 14.9 23.9 0.6 434 201 B E H > S+ 0 0 82 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.923 105.2 48.7 -69.1 -46.1 13.6 21.2 3.0 435 202 B G H > S+ 0 0 12 -5,-0.3 4,-0.6 2,-0.2 -2,-0.2 0.781 110.6 53.3 -63.9 -29.2 10.1 21.9 2.0 436 203 B I H >< S+ 0 0 0 -4,-1.5 3,-0.6 1,-0.2 -2,-0.2 0.959 115.6 37.6 -68.8 -51.6 11.0 21.7 -1.7 437 204 B Y H 3< S+ 0 0 21 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.550 95.3 82.6 -85.0 -7.1 12.7 18.4 -1.4 438 205 B E H 3< S+ 0 0 163 -4,-1.7 2,-0.3 1,-0.3 -1,-0.2 0.927 115.9 9.4 -51.6 -48.0 10.2 16.8 1.1 439 206 B N X< + 0 0 92 -3,-0.6 3,-1.3 -4,-0.6 4,-0.4 -0.708 63.6 175.4-144.9 88.7 8.0 16.0 -1.9 440 207 B L G > S+ 0 0 30 -3,-0.5 3,-1.3 1,-0.3 -1,-0.1 0.788 82.2 66.8 -60.8 -30.0 9.6 16.6 -5.3 441 208 B D G 3 S+ 0 0 123 1,-0.3 -1,-0.3 7,-0.0 4,-0.1 0.763 95.9 57.0 -63.6 -24.0 6.4 15.1 -6.9 442 209 B A G < S+ 0 0 56 -3,-1.3 -1,-0.3 -6,-0.2 2,-0.2 0.631 89.5 92.1 -80.7 -14.4 4.5 18.2 -5.6 443 210 B V S < S- 0 0 1 -3,-1.3 5,-0.1 -4,-0.4 -17,-0.0 -0.559 94.9 -92.5 -80.0 142.0 6.9 20.6 -7.5 444 211 B A >> - 0 0 45 -2,-0.2 4,-1.6 1,-0.1 3,-1.5 -0.232 35.3-119.1 -53.1 145.9 5.9 21.6 -11.0 445 212 B E H 3> S+ 0 0 154 1,-0.3 4,-0.7 2,-0.2 -1,-0.1 0.792 109.0 65.6 -65.1 -31.6 7.3 19.3 -13.6 446 213 B K H 34 S+ 0 0 140 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.771 115.3 30.6 -57.6 -28.5 9.3 22.1 -15.4 447 214 B W H <> S+ 0 0 26 -3,-1.5 4,-2.0 2,-0.1 5,-0.2 0.657 98.6 87.9-100.7 -22.5 11.5 22.4 -12.2 448 215 B R H X S+ 0 0 69 -4,-1.6 4,-2.0 1,-0.2 5,-0.1 0.857 90.5 40.7 -53.1 -53.2 11.4 18.9 -10.9 449 216 B K H X S+ 0 0 63 -4,-0.7 4,-2.8 1,-0.2 5,-0.2 0.891 112.7 53.9 -66.8 -41.4 14.4 17.3 -12.8 450 217 B K H > S+ 0 0 87 -4,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.909 111.3 46.7 -56.8 -44.7 16.7 20.3 -12.4 451 218 B L H < S+ 0 0 0 -4,-2.0 4,-0.3 2,-0.2 3,-0.2 0.942 113.2 48.3 -66.8 -44.4 16.2 20.2 -8.6 452 219 B E H >< S+ 0 0 133 -4,-2.0 3,-1.0 -5,-0.2 4,-0.2 0.938 111.8 48.7 -60.8 -49.6 16.7 16.5 -8.3 453 220 B T H 3< S+ 0 0 103 -4,-2.8 -1,-0.2 1,-0.2 3,-0.2 0.797 120.6 36.4 -58.3 -32.2 19.9 16.5 -10.4 454 221 B H T 3X S+ 0 0 61 -4,-1.3 4,-2.2 -3,-0.2 -1,-0.2 0.080 73.7 122.9-117.7 23.1 21.4 19.4 -8.4 455 222 B K H <> S+ 0 0 102 -3,-1.0 4,-1.8 -4,-0.3 5,-0.2 0.859 76.5 52.3 -52.7 -41.8 20.2 18.7 -4.8 456 223 B E H > S+ 0 0 85 -4,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.922 109.4 49.6 -66.6 -42.2 23.8 18.6 -3.4 457 224 B M H > S+ 0 0 52 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.919 107.1 55.8 -59.3 -44.7 24.7 22.0 -5.0 458 225 B A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.911 112.0 40.8 -56.2 -47.3 21.5 23.6 -3.6 459 226 B F H X S+ 0 0 50 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.882 116.8 49.2 -73.5 -36.4 22.4 22.7 0.0 460 227 B L H X S+ 0 0 36 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.893 110.3 50.1 -61.4 -44.4 26.0 23.5 -0.4 461 228 B C H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.909 108.5 53.3 -70.3 -35.6 25.3 26.9 -1.9 462 229 B R H X S+ 0 0 21 -4,-1.9 4,-1.2 -5,-0.3 -1,-0.2 0.936 109.1 49.1 -60.3 -47.1 22.9 27.7 0.9 463 230 B D H < S+ 0 0 47 -4,-2.0 3,-0.3 1,-0.2 -2,-0.2 0.897 111.6 48.8 -60.3 -39.9 25.7 26.9 3.5 464 231 B I H < S+ 0 0 5 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.860 109.7 51.9 -73.8 -26.6 28.1 29.1 1.7 465 232 B A H < S+ 0 0 10 -4,-1.9 2,-0.2 -5,-0.2 -1,-0.2 0.684 91.2 96.5 -77.5 -20.9 25.6 32.0 1.5 466 233 B R S < S- 0 0 92 -4,-1.2 2,-0.3 -3,-0.3 -104,-0.0 -0.531 75.9-130.8 -71.3 134.6 25.0 31.8 5.2 467 234 B L - 0 0 13 -2,-0.2 2,-0.4 -105,-0.2 -129,-0.1 -0.701 19.4-122.1 -85.7 135.3 27.0 34.2 7.3 468 235 B Q + 0 0 58 -2,-0.3 -126,-0.4 1,-0.1 3,-0.2 -0.639 29.2 178.7 -77.8 127.1 28.9 32.8 10.4 469 236 B T + 0 0 58 -2,-0.4 -1,-0.1 1,-0.1 -123,-0.1 0.213 67.2 66.6-117.7 17.0 27.8 34.5 13.5 470 237 B D + 0 0 105 2,-0.1 -1,-0.1 -125,-0.0 -131,-0.1 0.021 62.9 143.8-127.2 23.6 29.9 32.5 16.1 471 238 B L - 0 0 45 -133,-0.3 2,-0.4 -3,-0.2 -365,-0.0 -0.310 57.6-108.2 -64.2 150.4 33.4 33.5 15.2 472 239 B H - 0 0 54 -370,-0.1 2,-0.5 -349,-0.0 -1,-0.1 -0.641 34.1-150.0 -73.4 130.8 35.9 33.9 18.1 473 240 B I - 0 0 34 -2,-0.4 -134,-0.0 1,-0.1 -1,-0.0 -0.938 10.7-158.4-107.0 127.4 36.6 37.7 18.6 474 241 B D S S+ 0 0 43 -2,-0.5 -1,-0.1 -248,-0.1 -247,-0.1 0.849 75.3 47.8 -71.1 -37.3 40.1 38.8 20.0 475 242 B G S S- 0 0 13 1,-0.0 2,-0.3 2,-0.0 -2,-0.1 -0.042 76.1-127.1 -88.8-166.5 38.9 42.2 21.3 476 243 B N > - 0 0 15 1,-0.1 3,-1.2 -2,-0.0 4,-0.3 -0.956 25.6-106.2-144.2 163.3 36.0 43.4 23.3 477 244 B L G > S+ 0 0 26 -2,-0.3 3,-2.1 1,-0.3 4,-0.3 0.818 112.0 66.1 -62.1 -36.5 33.3 46.1 23.1 478 245 B Q G > S+ 0 0 58 1,-0.3 3,-1.2 2,-0.2 -1,-0.3 0.836 95.3 59.8 -56.6 -32.9 34.9 48.4 25.6 479 246 B Q G < S+ 0 0 104 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.674 101.8 56.1 -66.5 -15.9 37.8 48.9 23.1 480 247 B L G < S+ 0 0 0 -3,-2.1 -194,-2.3 -4,-0.3 -1,-0.2 0.361 75.2 127.3-101.1 1.1 35.2 50.2 20.6 481 248 B R B < -K 285 0C 115 -3,-1.2 2,-0.3 -4,-0.3 -196,-0.3 -0.377 51.7-139.2 -64.1 132.3 33.7 53.1 22.7 482 249 B L 0 0 37 -198,-2.4 -153,-0.1 -2,-0.1 -2,-0.1 -0.761 360.0 360.0 -87.7 140.8 33.7 56.5 21.0 483 250 B V 0 0 192 -2,-0.3 -198,-0.0 -154,-0.0 -199,-0.0 -0.850 360.0 360.0 -96.9 360.0 34.6 59.7 22.9