==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LUMINESCENT PROTEIN 03-JUL-03 1UHJ . COMPND 2 MOLECULE: AEQUORIN 2; . SOURCE 2 ORGANISM_SCIENTIFIC: AEQUOREA VICTORIA; . AUTHOR S.TOMA,K.T.CHONG,A.NAKAGAWA,K.TERANISHI,S.INOUYE,O.SHIMOMURA . 378 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18629.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 277 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 3.7 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 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 . 13 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 191 50.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 3.7 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 0 0 0 2 2 1 3 4 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A L 0 0 138 0, 0.0 2,-0.4 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 6.5 2.0 10.3 -14.1 2 4 A T - 0 0 114 171,-0.1 87,-0.0 1,-0.0 170,-0.0 -0.904 360.0-129.1-107.4 133.0 5.1 8.6 -15.6 3 5 A S - 0 0 45 -2,-0.4 170,-0.2 1,-0.1 169,-0.1 -0.218 7.3-156.5 -77.6 169.6 6.7 5.4 -14.2 4 6 A D > + 0 0 72 168,-0.6 3,-1.8 1,-0.1 6,-0.3 -0.375 29.3 156.2-142.0 56.2 10.4 4.9 -13.2 5 7 A F T 3 + 0 0 35 1,-0.3 6,-0.1 5,-0.1 -1,-0.1 0.698 69.9 55.1 -70.5 -23.8 10.8 1.1 -13.4 6 8 A D T 3 S+ 0 0 150 4,-0.1 -1,-0.3 5,-0.0 3,-0.0 0.500 79.8 111.9 -84.0 -5.0 14.5 1.0 -14.0 7 9 A N X> - 0 0 35 -3,-1.8 4,-2.2 1,-0.2 3,-1.2 -0.577 65.2-145.4 -68.2 119.0 15.1 3.0 -10.8 8 10 A P H 3> S+ 0 0 101 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.831 100.7 58.7 -57.3 -27.0 16.9 0.7 -8.2 9 11 A R H 3> S+ 0 0 115 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.784 105.6 47.7 -73.1 -27.4 14.9 2.5 -5.5 10 12 A W H <> S+ 0 0 0 -3,-1.2 4,-1.9 -6,-0.3 -1,-0.2 0.908 114.3 46.1 -71.2 -48.1 11.6 1.6 -7.1 11 13 A I H X S+ 0 0 55 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.919 115.2 47.8 -61.2 -39.5 12.7 -2.0 -7.5 12 14 A G H X S+ 0 0 32 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.763 104.6 58.7 -76.7 -27.9 14.0 -2.0 -3.9 13 15 A R H X S+ 0 0 1 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.935 112.4 40.7 -60.2 -53.0 10.8 -0.5 -2.5 14 16 A H H X S+ 0 0 1 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.813 111.9 54.7 -69.9 -26.4 8.8 -3.4 -3.9 15 17 A K H X S+ 0 0 92 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.888 104.7 55.7 -73.4 -34.4 11.4 -6.0 -2.9 16 18 A H H X S+ 0 0 64 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.934 111.6 44.0 -54.8 -47.0 11.2 -4.6 0.7 17 19 A X H X S+ 0 0 21 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.869 109.9 53.9 -70.8 -39.5 7.5 -5.3 0.6 18 20 A F H X S+ 0 0 4 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.955 111.8 46.6 -56.8 -47.5 7.8 -8.7 -1.0 19 21 A N H < S+ 0 0 91 -4,-2.7 6,-0.3 1,-0.2 -2,-0.2 0.910 112.5 49.5 -64.5 -38.8 10.2 -9.6 1.8 20 22 A F H < S+ 0 0 50 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.878 113.2 46.5 -65.4 -39.8 7.8 -8.2 4.4 21 23 A L H < S+ 0 0 19 -4,-2.8 2,-2.0 1,-0.2 -2,-0.2 0.848 99.1 72.2 -71.6 -27.3 4.9 -10.2 2.8 22 24 A D >< + 0 0 6 -4,-2.2 3,-2.0 1,-0.2 -1,-0.2 -0.511 64.1 167.0 -88.5 67.9 7.0 -13.3 2.7 23 25 A V T 3 S+ 0 0 88 -2,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.795 73.3 43.6 -63.8 -28.9 6.8 -13.8 6.4 24 26 A N T 3 S- 0 0 118 -3,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.242 108.7-120.2-101.8 20.3 8.1 -17.3 6.3 25 27 A H < + 0 0 158 -3,-2.0 -2,-0.1 -6,-0.3 -6,-0.1 0.864 61.7 145.8 47.4 46.5 10.9 -16.6 3.8 26 28 A N - 0 0 91 2,-0.3 -1,-0.1 50,-0.0 3,-0.1 0.597 62.9-122.9 -77.3 -15.5 9.6 -19.1 1.2 27 29 A G S S+ 0 0 37 1,-0.1 50,-0.6 -5,-0.1 2,-0.3 0.588 87.7 68.1 74.7 11.4 10.8 -16.8 -1.7 28 30 A K E -A 76 0A 96 48,-0.2 2,-0.3 -10,-0.1 -2,-0.3 -0.980 61.1-162.5-157.3 151.1 7.3 -16.8 -3.0 29 31 A I E -A 75 0A 0 46,-2.1 46,-3.1 -2,-0.3 2,-0.3 -0.958 10.8-145.7-135.2 148.4 3.8 -15.6 -1.9 30 32 A S E >> -A 74 0A 5 -2,-0.3 4,-1.8 44,-0.2 3,-0.9 -0.850 27.9-117.9-109.6 159.3 0.3 -16.5 -3.0 31 33 A L H 3> S+ 0 0 7 39,-1.1 4,-2.4 42,-0.5 5,-0.3 0.850 115.7 63.1 -57.3 -32.9 -3.0 -14.5 -3.5 32 34 A D H 3> S+ 0 0 76 38,-0.4 4,-1.6 1,-0.2 -1,-0.3 0.879 103.5 45.8 -58.2 -42.2 -4.3 -16.8 -0.7 33 35 A E H <> S+ 0 0 70 -3,-0.9 4,-2.5 2,-0.2 -1,-0.2 0.890 110.6 54.3 -71.8 -38.2 -1.8 -15.4 1.8 34 36 A X H X S+ 0 0 7 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.889 112.5 41.0 -62.2 -48.1 -2.6 -11.8 0.7 35 37 A V H X S+ 0 0 18 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.785 113.7 54.5 -76.3 -28.4 -6.3 -12.1 1.3 36 38 A Y H X S+ 0 0 161 -4,-1.6 4,-2.8 -5,-0.3 -2,-0.2 0.960 110.6 46.0 -60.2 -55.7 -5.9 -14.1 4.5 37 39 A K H X S+ 0 0 63 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.924 112.4 52.0 -53.9 -48.0 -3.6 -11.3 5.9 38 40 A A H X S+ 0 0 8 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.915 114.5 39.7 -57.3 -47.0 -6.0 -8.6 4.8 39 41 A S H X>S+ 0 0 24 -4,-2.0 4,-2.6 2,-0.2 5,-0.5 0.852 110.9 58.6 -77.0 -32.8 -9.1 -10.2 6.4 40 42 A D H X>S+ 0 0 57 -4,-2.8 4,-2.4 -5,-0.2 5,-0.6 0.977 109.4 45.4 -56.1 -51.1 -7.1 -11.2 9.5 41 43 A I H X>S+ 0 0 11 -4,-2.4 4,-2.1 1,-0.2 5,-1.3 0.951 118.4 39.2 -58.0 -56.5 -6.1 -7.6 10.2 42 44 A V H <5S+ 0 0 0 -4,-1.9 6,-2.5 3,-0.2 4,-0.4 0.886 124.6 36.2 -72.3 -34.9 -9.5 -6.0 9.6 43 45 A I H <5S+ 0 0 85 -4,-2.6 4,-0.4 4,-0.2 -1,-0.2 0.931 127.6 32.9 -80.4 -48.2 -11.7 -8.6 11.3 44 46 A N H < - 0 0 58 1,-0.1 4,-2.8 4,-0.0 5,-0.2 -0.307 31.7-102.3 -66.0 162.2 -18.2 -5.9 10.2 50 52 A P H > S+ 0 0 99 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.927 124.0 47.0 -54.9 -44.1 -18.8 -8.9 8.0 51 53 A E H > S+ 0 0 144 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.915 112.4 48.9 -65.7 -44.3 -19.9 -6.6 5.1 52 54 A Q H > S+ 0 0 25 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.890 110.7 52.2 -59.2 -44.3 -16.9 -4.3 5.5 53 55 A A H X S+ 0 0 6 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.892 109.4 47.7 -62.1 -43.5 -14.5 -7.3 5.6 54 56 A K H X S+ 0 0 129 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.908 111.5 51.1 -66.6 -37.6 -15.9 -8.8 2.4 55 57 A R H X S+ 0 0 115 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.893 112.9 46.4 -62.4 -43.5 -15.6 -5.4 0.7 56 58 A H H X S+ 0 0 3 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.906 110.7 52.0 -66.0 -41.8 -12.0 -5.1 1.9 57 59 A K H X S+ 0 0 57 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.940 108.3 51.5 -63.2 -45.3 -11.2 -8.6 0.8 58 60 A D H X S+ 0 0 75 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.907 110.4 49.5 -57.4 -42.2 -12.6 -7.9 -2.7 59 61 A A H X S+ 0 0 5 -4,-1.8 4,-2.2 2,-0.2 47,-0.2 0.922 113.1 45.2 -65.7 -44.0 -10.4 -4.8 -3.0 60 62 A V H X S+ 0 0 1 -4,-2.4 4,-2.5 2,-0.2 5,-0.4 0.915 111.5 53.1 -65.4 -41.9 -7.2 -6.6 -1.9 61 63 A E H X S+ 0 0 63 -4,-2.7 4,-1.9 -5,-0.2 -1,-0.2 0.930 112.5 44.9 -54.6 -45.5 -7.9 -9.5 -4.2 62 64 A A H X S+ 0 0 41 -4,-2.2 4,-1.5 -5,-0.2 -2,-0.2 0.870 111.7 53.7 -71.5 -36.5 -8.3 -7.1 -7.1 63 65 A F H X S+ 0 0 6 -4,-2.2 4,-0.7 2,-0.2 3,-0.4 0.968 116.3 35.1 -62.6 -59.4 -5.2 -5.1 -6.2 64 66 A F H ><>S+ 0 0 17 -4,-2.5 5,-2.0 1,-0.2 3,-0.5 0.832 113.5 61.6 -68.7 -28.5 -2.8 -8.1 -6.0 65 67 A G H ><5S+ 0 0 32 -4,-1.9 3,-2.0 -5,-0.4 -1,-0.2 0.869 97.8 57.4 -55.7 -38.6 -4.7 -9.6 -8.9 66 68 A G H 3<5S+ 0 0 24 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.727 101.3 56.6 -70.5 -23.7 -3.7 -6.6 -11.0 67 69 A A T <<5S- 0 0 1 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.209 128.1 -99.3 -88.2 10.1 -0.1 -7.5 -10.2 68 70 A G T < 5S+ 0 0 50 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.384 75.3 142.1 96.9 -1.9 -0.6 -11.0 -11.7 69 71 A X < - 0 0 3 -5,-2.0 2,-0.3 -8,-0.1 -1,-0.3 -0.476 26.4-174.1 -81.5 148.3 -1.1 -12.9 -8.5 70 72 A K > - 0 0 139 3,-0.3 3,-1.6 -2,-0.1 -39,-1.1 -0.958 32.6 -90.8-141.1 152.0 -3.7 -15.8 -8.4 71 73 A Y T 3 S+ 0 0 97 -2,-0.3 3,-0.1 1,-0.2 -41,-0.0 -0.438 113.1 16.0 -60.3 137.8 -5.3 -18.2 -6.0 72 74 A G T 3 S+ 0 0 69 1,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.493 104.4 109.5 74.7 7.6 -3.4 -21.5 -5.8 73 75 A V < - 0 0 66 -3,-1.6 2,-0.6 2,-0.0 -42,-0.5 -0.942 61.3-142.3-118.0 136.5 -0.3 -19.9 -7.5 74 76 A E E -A 30 0A 99 -2,-0.4 2,-0.6 -44,-0.1 -44,-0.2 -0.845 17.7-154.0 -98.5 119.2 3.0 -19.2 -5.8 75 77 A T E -A 29 0A 10 -46,-3.1 -46,-2.1 -2,-0.6 2,-0.1 -0.844 7.8-159.0-100.7 118.0 4.5 -16.0 -7.1 76 78 A D E > -A 28 0A 76 -2,-0.6 4,-2.3 -48,-0.2 -48,-0.2 -0.292 36.2 -91.6 -86.3 178.2 8.3 -15.6 -6.9 77 79 A W H > S+ 0 0 46 -50,-0.6 4,-2.6 2,-0.2 5,-0.3 0.907 122.1 49.9 -62.6 -50.1 10.2 -12.4 -6.9 78 80 A P H > S+ 0 0 83 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.923 116.2 43.7 -56.4 -41.0 10.9 -12.1 -10.7 79 81 A A H > S+ 0 0 51 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.875 113.0 54.3 -67.9 -34.2 7.2 -12.8 -11.4 80 82 A Y H X S+ 0 0 3 -4,-2.3 4,-1.9 1,-0.2 -3,-0.2 0.950 110.9 42.3 -68.2 -48.1 6.1 -10.4 -8.6 81 83 A I H X S+ 0 0 18 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.878 112.9 53.0 -70.9 -33.2 8.1 -7.4 -9.9 82 84 A E H X S+ 0 0 99 -4,-1.7 4,-1.4 -5,-0.3 -2,-0.2 0.937 111.1 48.0 -64.3 -47.1 7.1 -8.0 -13.6 83 85 A G H X S+ 0 0 7 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.855 106.1 58.1 -59.9 -33.7 3.5 -8.0 -12.5 84 86 A W H X S+ 0 0 8 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.887 100.4 57.1 -66.8 -34.2 4.0 -4.8 -10.5 85 87 A K H X S+ 0 0 48 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.934 109.3 45.6 -59.5 -38.9 5.2 -3.1 -13.7 86 88 A K H X S+ 0 0 129 -4,-1.4 4,-2.7 2,-0.2 -2,-0.2 0.935 113.5 49.5 -65.7 -47.4 1.8 -4.0 -15.2 87 89 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.945 112.3 46.3 -58.5 -52.5 -0.2 -2.9 -12.1 88 90 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.930 113.0 50.3 -60.9 -42.4 1.5 0.4 -11.8 89 91 A T H X S+ 0 0 67 -4,-1.9 4,-1.9 -5,-0.3 -1,-0.2 0.940 113.3 45.3 -59.1 -47.4 1.1 1.1 -15.6 90 92 A D H X S+ 0 0 72 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.875 113.5 50.6 -63.0 -41.5 -2.6 0.3 -15.5 91 93 A E H X S+ 0 0 0 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.919 109.7 48.5 -67.2 -44.6 -3.1 2.3 -12.3 92 94 A L H X S+ 0 0 11 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.852 110.4 52.8 -63.9 -34.0 -1.4 5.4 -13.7 93 95 A E H X S+ 0 0 108 -4,-1.9 4,-1.4 -5,-0.2 -2,-0.2 0.922 111.1 46.8 -67.7 -45.6 -3.5 5.1 -16.9 94 96 A K H <>S+ 0 0 56 -4,-2.3 5,-2.8 2,-0.2 3,-0.3 0.939 111.8 50.4 -57.1 -48.7 -6.7 5.0 -14.9 95 97 A Y H ><5S+ 0 0 84 -4,-2.5 3,-1.3 1,-0.3 -2,-0.2 0.871 108.7 51.4 -61.5 -39.1 -5.6 8.0 -12.8 96 98 A A H 3<5S+ 0 0 64 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.800 111.9 47.8 -68.8 -31.3 -4.8 10.1 -15.8 97 99 A K T 3<5S- 0 0 120 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.230 116.5-113.7 -90.8 11.1 -8.3 9.3 -17.3 98 100 A N T < 5S+ 0 0 159 -3,-1.3 -3,-0.2 1,-0.2 -2,-0.1 0.845 70.3 141.4 55.8 38.3 -10.0 10.1 -13.9 99 101 A E < - 0 0 85 -5,-2.8 -1,-0.2 -6,-0.1 -2,-0.1 -0.872 62.8 -93.3-106.2 141.0 -11.1 6.5 -13.5 100 102 A P - 0 0 94 0, 0.0 2,-0.2 0, 0.0 -5,-0.0 -0.295 42.2-138.8 -55.5 132.0 -11.0 4.9 -9.9 101 103 A T > - 0 0 3 1,-0.1 4,-2.2 -7,-0.1 5,-0.2 -0.541 17.9-117.2 -87.9 160.6 -7.7 3.1 -9.2 102 104 A L H > S+ 0 0 29 1,-0.2 4,-2.2 2,-0.2 -39,-0.2 0.851 117.8 54.6 -62.2 -35.8 -7.4 -0.3 -7.5 103 105 A I H > S+ 0 0 9 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.893 108.1 48.5 -69.5 -35.9 -5.5 1.5 -4.7 104 106 A R H > S+ 0 0 60 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.887 109.3 52.5 -64.7 -42.8 -8.3 4.0 -4.2 105 107 A I H X S+ 0 0 73 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.927 112.0 46.3 -62.4 -43.4 -10.9 1.2 -4.1 106 108 A W H X S+ 0 0 39 -4,-2.2 4,-2.8 -47,-0.2 5,-0.2 0.958 111.8 52.1 -59.9 -50.0 -8.8 -0.5 -1.4 107 109 A G H X S+ 0 0 13 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.870 107.5 50.8 -52.0 -44.7 -8.4 2.8 0.5 108 110 A D H X S+ 0 0 53 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.922 114.0 45.2 -63.5 -43.1 -12.2 3.5 0.5 109 111 A A H X S+ 0 0 1 -4,-2.0 4,-0.7 -5,-0.2 -2,-0.2 0.895 116.4 44.9 -66.5 -43.2 -12.8 -0.0 1.9 110 112 A L H >X S+ 0 0 10 -4,-2.8 4,-2.3 1,-0.2 3,-1.2 0.938 111.6 52.0 -67.1 -45.4 -10.1 0.2 4.5 111 113 A F H 3X S+ 0 0 10 -4,-3.1 4,-2.2 1,-0.3 7,-0.2 0.766 100.3 61.9 -67.0 -28.0 -11.0 3.8 5.6 112 114 A D H 3< S+ 0 0 41 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.806 113.6 38.1 -63.7 -29.2 -14.6 2.8 6.1 113 115 A I H << S+ 0 0 18 -3,-1.2 -2,-0.2 -4,-0.7 -1,-0.2 0.896 122.0 40.2 -83.2 -45.1 -13.2 0.4 8.8 114 116 A V H < S+ 0 0 17 -4,-2.3 2,-0.9 1,-0.1 -3,-0.2 0.829 98.9 76.9 -80.8 -35.0 -10.5 2.5 10.3 115 117 A D >< - 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0 0 2 -5,-2.1 2,-0.3 -8,-0.1 -1,-0.3 -0.484 24.9-176.5 -79.8 142.3 18.0 22.7 8.1 262 72 B K > - 0 0 139 3,-0.3 3,-1.7 -2,-0.2 -39,-1.1 -0.969 32.7 -92.2-138.6 153.6 20.6 22.9 5.3 263 73 B Y T 3 S+ 0 0 98 -2,-0.3 3,-0.1 1,-0.2 -41,-0.0 -0.390 112.8 15.6 -61.2 137.7 22.1 25.5 3.0 264 74 B G T 3 S+ 0 0 68 1,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.489 106.0 109.2 76.0 6.1 20.2 25.8 -0.3 265 75 B V < - 0 0 69 -3,-1.7 2,-0.6 2,-0.0 -42,-0.6 -0.944 61.1-143.9-120.2 132.8 17.2 24.0 1.2 266 76 B E E -C 222 0C 94 -2,-0.4 2,-0.6 -44,-0.2 -44,-0.2 -0.852 16.2-152.9 -96.2 120.8 13.9 25.6 2.0 267 77 B T E -C 221 0C 10 -46,-3.6 -46,-2.0 -2,-0.6 2,-0.1 -0.844 7.1-156.9 -99.5 116.9 12.3 24.1 5.2 268 78 B D E > -C 220 0C 78 -2,-0.6 4,-2.2 -48,-0.2 -48,-0.2 -0.281 35.8 -95.2 -84.6 175.2 8.5 24.2 5.4 269 79 B W H > S+ 0 0 46 -50,-0.7 4,-2.8 1,-0.2 5,-0.3 0.925 122.5 51.2 -60.3 -47.2 6.6 24.1 8.7 270 80 B P H > S+ 0 0 48 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.924 115.3 43.1 -57.8 -42.3 6.0 20.3 8.7 271 81 B A H > S+ 0 0 28 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.855 113.1 54.8 -66.3 -33.5 9.7 19.6 8.0 272 82 B Y H X S+ 0 0 3 -4,-2.2 4,-2.1 2,-0.2 -3,-0.2 0.953 110.6 42.3 -68.3 -48.2 10.7 22.2 10.7 273 83 B I H X S+ 0 0 23 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.886 113.2 53.2 -72.7 -32.8 8.7 20.7 13.5 274 84 B E H X S+ 0 0 38 -4,-1.7 4,-1.4 -5,-0.3 -1,-0.2 0.957 112.2 45.8 -61.7 -49.4 9.7 17.2 12.5 275 85 B G H X S+ 0 0 6 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.842 108.0 57.4 -59.1 -36.9 13.4 18.3 12.7 276 86 B W H X S+ 0 0 7 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.881 101.6 55.0 -68.3 -35.3 12.8 20.1 15.9 277 87 B K H X S+ 0 0 48 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.917 110.2 47.8 -58.9 -39.4 11.6 16.9 17.6 278 88 B K H X S+ 0 0 85 -4,-1.4 4,-2.8 2,-0.2 -2,-0.2 0.942 112.0 49.1 -65.5 -50.6 14.9 15.3 16.5 279 89 B L H X S+ 0 0 1 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.936 112.8 45.9 -51.6 -55.9 17.0 18.3 17.8 280 90 B A H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 5,-0.3 0.898 112.7 51.4 -58.0 -43.7 15.2 18.3 21.2 281 91 B T H X S+ 0 0 58 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.962 113.4 44.6 -58.3 -47.3 15.6 14.5 21.5 282 92 B D H X S+ 0 0 79 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.896 113.9 49.5 -65.3 -43.4 19.3 14.7 20.7 283 93 B E H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 -1,-0.2 0.884 110.2 49.4 -62.7 -44.1 19.9 17.6 23.1 284 94 B L H X S+ 0 0 15 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.868 109.8 52.9 -70.5 -30.1 18.1 16.0 26.0 285 95 B E H X S+ 0 0 105 -4,-2.1 4,-1.4 -5,-0.3 -2,-0.2 0.943 111.0 46.0 -66.0 -45.8 20.1 12.8 25.4 286 96 B K H <>S+ 0 0 61 -4,-2.2 5,-2.6 2,-0.2 3,-0.4 0.922 111.9 52.0 -60.4 -45.7 23.4 14.8 25.6 287 97 B Y H ><5S+ 0 0 38 -4,-2.8 3,-1.7 1,-0.2 -2,-0.2 0.908 107.6 51.7 -56.4 -45.2 22.2 16.7 28.7 288 98 B A H 3<5S+ 0 0 64 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.810 111.9 47.7 -63.6 -30.9 21.4 13.4 30.4 289 99 B K T 3<5S- 0 0 111 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.315 115.3-114.3 -92.8 7.3 24.9 12.2 29.6 290 100 B N T < 5S+ 0 0 124 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.844 70.2 141.3 60.0 37.3 26.6 15.4 30.8 291 101 B E < - 0 0 81 -5,-2.6 -1,-0.2 -6,-0.1 -2,-0.1 -0.856 62.1 -89.8-109.8 146.7 27.7 16.2 27.3 292 102 B P - 0 0 94 0, 0.0 2,-0.2 0, 0.0 -1,-0.0 -0.269 42.3-143.1 -61.0 132.8 27.8 19.7 25.8 293 103 B T > - 0 0 6 1,-0.1 4,-2.0 -7,-0.1 5,-0.1 -0.570 19.3-119.0 -90.3 160.7 24.5 20.7 24.1 294 104 B L H > S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.846 116.6 55.7 -64.9 -33.8 24.2 22.8 20.9 295 105 B I H > S+ 0 0 7 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.900 107.5 47.7 -68.7 -37.3 22.3 25.3 22.8 296 106 B R H > S+ 0 0 70 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.899 110.4 52.7 -62.9 -42.7 25.1 25.7 25.4 297 107 B I H X S+ 0 0 76 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.919 111.8 45.0 -62.1 -44.4 27.7 26.0 22.6 298 108 B W H X S+ 0 0 39 -4,-2.2 4,-2.7 -47,-0.2 5,-0.3 0.926 112.1 53.9 -61.2 -48.4 25.6 28.8 21.1 299 109 B G H X S+ 0 0 15 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.918 107.8 48.2 -52.7 -44.9 25.2 30.3 24.5 300 110 B D H X S+ 0 0 49 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.892 112.9 49.0 -66.4 -36.3 28.9 30.4 25.2 301 111 B A H X S+ 0 0 1 -4,-1.9 4,-0.7 -5,-0.2 -53,-0.2 0.917 115.9 42.5 -68.3 -44.0 29.6 32.0 21.7 302 112 B L H >X S+ 0 0 14 -4,-2.7 4,-2.7 1,-0.2 3,-0.9 0.907 110.4 54.6 -68.7 -44.6 26.9 34.6 22.2 303 113 B F H 3X S+ 0 0 12 -4,-3.0 4,-2.5 1,-0.3 7,-0.3 0.837 100.1 61.2 -63.4 -30.2 27.8 35.4 25.8 304 114 B D H 3< S+ 0 0 42 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.824 113.8 37.7 -61.7 -30.3 31.4 36.1 24.8 305 115 B I H << S+ 0 0 19 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.2 0.884 121.3 41.9 -83.6 -46.4 30.0 38.9 22.6 306 116 B V H < S+ 0 0 17 -4,-2.7 2,-0.8 1,-0.1 -3,-0.2 0.822 97.5 77.4 -79.9 -33.6 27.2 40.2 24.8 307 117 B D >< - 0 0 2 -4,-2.5 3,-1.7 -5,-0.2 5,-0.1 -0.702 67.0-156.0 -81.6 108.9 29.0 40.2 28.2 308 118 B K T 3 S+ 0 0 177 -2,-0.8 -1,-0.2 1,-0.3 6,-0.1 0.800 95.9 47.2 -54.6 -31.2 31.3 43.2 28.3 309 119 B D T 3 S- 0 0 98 4,-0.3 -1,-0.3 -3,-0.1 -5,-0.1 0.499 100.3-135.7 -91.9 -2.6 33.4 41.4 30.9 310 120 B Q < + 0 0 105 -3,-1.7 -6,-0.1 -7,-0.3 -2,-0.1 0.860 67.0 123.5 47.6 46.7 33.6 38.0 29.0 311 121 B N S S- 0 0 135 2,-0.3 -1,-0.1 -8,-0.2 -7,-0.1 0.160 87.2 -95.4-118.9 14.5 32.9 36.1 32.2 312 122 B G S S+ 0 0 21 -9,-0.2 40,-2.5 1,-0.2 41,-0.3 0.825 91.4 94.6 76.8 31.4 29.8 34.1 31.1 313 123 B A E -D 351 0D 8 38,-0.3 2,-0.3 -10,-0.2 -2,-0.3 -0.969 53.2-150.2-154.5 146.0 27.1 36.4 32.5 314 124 B I E -D 350 0D 2 36,-2.7 36,-3.2 -2,-0.3 2,-0.1 -0.844 9.5-135.4-119.8 147.6 24.9 39.3 31.3 315 125 B T > - 0 0 48 -2,-0.3 4,-2.3 34,-0.2 5,-0.2 -0.422 36.0-104.0 -81.6 171.2 23.2 42.3 32.7 316 126 B L H > S+ 0 0 46 32,-0.3 4,-2.3 1,-0.2 5,-0.2 0.920 123.2 52.6 -62.0 -41.9 19.6 43.4 32.0 317 127 B D H > S+ 0 0 120 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.852 110.2 49.1 -62.5 -35.9 20.8 46.1 29.6 318 128 B E H > S+ 0 0 36 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.895 110.7 49.4 -70.0 -39.7 22.9 43.5 27.7 319 129 B W H X S+ 0 0 6 -4,-2.3 4,-2.3 1,-0.2 5,-0.3 0.853 111.5 50.4 -66.8 -36.5 19.9 41.1 27.5 320 130 B K H X S+ 0 0 41 -4,-2.3 4,-2.1 -5,-0.2 5,-0.3 0.904 108.8 51.8 -65.5 -42.7 17.8 44.0 26.2 321 131 B A H X S+ 0 0 53 -4,-1.8 4,-1.4 -5,-0.2 -2,-0.2 0.930 115.1 40.8 -63.4 -42.7 20.4 44.9 23.6 322 132 B Y H X S+ 0 0 26 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.963 117.0 45.1 -71.7 -51.5 20.6 41.3 22.3 323 133 B T H X>S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 6,-1.2 0.884 114.2 49.1 -67.0 -34.9 16.9 40.3 22.3 324 134 B K H <5S+ 0 0 82 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.812 110.9 50.1 -72.7 -31.8 15.8 43.6 20.8 325 135 B A H <5S+ 0 0 34 -4,-1.4 -2,-0.2 -5,-0.3 -1,-0.2 0.928 116.9 41.3 -66.7 -44.6 18.4 43.4 18.0 326 136 B A H <5S- 0 0 6 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.847 105.7-136.4 -67.4 -31.0 17.2 39.8 17.3 327 137 B G T <5 + 0 0 16 -4,-2.0 -3,-0.2 2,-0.3 -4,-0.1 0.366 69.8 123.4 84.6 -0.3 13.6 40.9 17.7 328 138 B I S S- 0 0 42 1,-0.1 4,-1.6 0, 0.0 3,-0.4 -0.711 70.2-134.4-103.3 149.9 9.6 45.4 25.1 332 142 B S H > S+ 0 0 41 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.860 106.1 60.4 -63.1 -35.1 11.7 46.1 28.2 333 143 B E H > S+ 0 0 148 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.881 104.6 48.1 -65.5 -32.1 9.1 44.7 30.5 334 144 B D H > S+ 0 0 32 -3,-0.4 4,-1.1 2,-0.2 3,-0.3 0.888 109.9 52.3 -73.2 -39.0 9.3 41.2 28.8 335 145 B C H X S+ 0 0 0 -4,-1.6 4,-0.8 1,-0.2 3,-0.3 0.869 106.8 55.0 -60.5 -36.4 13.1 41.3 29.0 336 146 B E H X S+ 0 0 92 -4,-2.2 4,-1.0 1,-0.2 3,-0.4 0.823 98.8 61.9 -66.4 -31.0 12.7 42.1 32.7 337 147 B E H >X S+ 0 0 53 -4,-1.1 4,-2.5 -3,-0.3 3,-0.6 0.866 94.0 62.3 -64.1 -35.6 10.6 38.9 33.1 338 148 B T H 3X S+ 0 0 0 -4,-1.1 4,-2.1 -3,-0.3 -1,-0.2 0.885 102.5 50.4 -53.9 -44.4 13.5 36.8 32.0 339 149 B F H 3< S+ 0 0 20 -4,-0.8 -1,-0.2 -3,-0.4 -2,-0.2 0.714 110.0 51.1 -69.9 -22.2 15.4 38.1 35.1 340 150 B R H << S+ 0 0 151 -4,-1.0 -2,-0.2 -3,-0.6 -1,-0.2 0.903 112.5 44.5 -74.7 -43.2 12.4 37.2 37.3 341 151 B V H < S+ 0 0 19 -4,-2.5 2,-0.2 31,-0.2 -2,-0.2 0.870 109.3 66.3 -69.3 -40.1 12.1 33.6 36.0 342 152 B C S < S- 0 0 5 -4,-2.1 2,-0.6 -5,-0.3 13,-0.1 -0.536 91.5-109.2 -85.3 151.7 15.8 33.0 36.1 343 153 B D - 0 0 114 -2,-0.2 8,-0.4 8,-0.1 2,-0.2 -0.714 39.4-151.6 -74.4 119.4 18.0 32.7 39.2 344 154 B I - 0 0 79 -2,-0.6 6,-0.2 -5,-0.2 2,-0.0 -0.571 12.7-119.7 -90.6 158.1 20.1 35.9 39.0 345 155 B D > - 0 0 48 4,-2.5 3,-1.3 -2,-0.2 -1,-0.1 -0.123 39.3 -77.9 -91.2-167.9 23.6 35.9 40.5 346 156 B E T 3 S+ 0 0 184 1,-0.3 -2,-0.1 2,-0.1 -1,-0.0 0.935 129.6 41.5 -58.3 -51.0 25.1 38.1 43.3 347 157 B S T 3 S- 0 0 78 1,-0.1 -1,-0.3 2,-0.0 -3,-0.0 0.296 123.9 -96.3 -83.4 10.4 25.6 41.2 41.2 348 158 B G S < S+ 0 0 37 -3,-1.3 -32,-0.3 1,-0.3 2,-0.3 0.779 79.5 136.7 81.0 29.9 22.3 40.9 39.3 349 159 B Q - 0 0 36 -34,-0.1 -4,-2.5 -33,-0.1 2,-0.8 -0.746 56.7-125.1-111.7 152.9 23.6 39.1 36.2 350 160 B L E -D 314 0D 0 -36,-3.2 -36,-2.7 -2,-0.3 2,-0.2 -0.892 31.7-149.9 -95.3 109.2 22.2 36.2 34.2 351 161 B D E > -D 313 0D 49 -2,-0.8 4,-2.7 -8,-0.4 -38,-0.3 -0.512 18.6-121.2 -83.8 149.4 24.9 33.6 34.1 352 162 B V H > S+ 0 0 7 -40,-2.5 4,-2.8 1,-0.2 5,-0.3 0.878 110.2 58.7 -58.3 -40.2 25.2 31.2 31.1 353 163 B D H > S+ 0 0 94 -41,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.937 112.0 40.6 -52.5 -49.7 24.9 28.1 33.3 354 164 B E H > S+ 0 0 33 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.939 114.6 50.7 -68.4 -47.8 21.5 29.2 34.5 355 165 B X H X S+ 0 0 7 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.881 108.7 52.8 -59.6 -38.3 20.3 30.5 31.1 356 166 B T H X S+ 0 0 14 -4,-2.8 4,-2.5 -5,-0.2 -1,-0.2 0.934 108.4 50.7 -64.0 -42.9 21.2 27.2 29.5 357 167 B R H X S+ 0 0 56 -4,-1.8 4,-1.8 -5,-0.3 -2,-0.2 0.932 113.2 45.0 -58.6 -48.1 19.2 25.3 32.1 358 168 B Q H X S+ 0 0 16 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.865 112.9 51.3 -62.6 -41.3 16.1 27.5 31.5 359 169 B H H X>S+ 0 0 24 -4,-2.6 4,-2.5 2,-0.2 5,-0.5 0.881 106.2 53.9 -66.8 -35.3 16.6 27.3 27.7 360 170 B L H X5S+ 0 0 4 -4,-2.5 4,-1.6 1,-0.2 5,-0.5 0.942 115.1 42.5 -60.6 -45.7 16.7 23.5 27.8 361 171 B G H X>S+ 0 0 0 -4,-1.8 6,-1.2 -5,-0.2 4,-1.1 0.876 117.2 45.0 -65.8 -43.6 13.4 23.6 29.7 362 172 B F H <5S+ 0 0 0 -4,-2.6 4,-0.2 3,-0.2 -2,-0.2 0.902 123.4 30.1 -73.2 -44.5 11.7 26.2 27.6 363 173 B W H <5S+ 0 0 17 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.824 131.2 28.9 -89.6 -31.0 12.6 25.0 24.1 364 174 B Y H < - 0 0 28 -6,-1.2 3,-1.4 1,-0.2 -1,-0.2 -0.507 26.0-143.5 -61.6 119.2 9.1 22.4 32.1 368 178 B P G > S+ 0 0 104 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.747 95.0 71.0 -65.3 -20.6 6.5 24.6 33.9 369 179 B A G 3 S+ 0 0 67 1,-0.2 -2,-0.1 3,-0.0 -7,-0.1 0.758 97.8 51.3 -62.0 -26.3 9.3 26.2 35.9 370 180 B C G X S+ 0 0 1 -3,-1.4 3,-1.4 -9,-0.1 -1,-0.2 0.281 77.5 132.1 -96.2 7.1 10.5 28.0 32.7 371 181 B E T < S+ 0 0 43 -3,-1.3 4,-0.1 1,-0.2 -9,-0.0 -0.357 74.1 18.0 -62.7 141.1 7.1 29.6 31.7 372 182 B K T > S+ 0 0 123 6,-0.2 3,-2.2 7,-0.2 -1,-0.2 0.675 75.8 145.3 73.3 22.0 7.4 33.2 30.7 373 183 B L T < S+ 0 0 0 -3,-1.4 -31,-0.1 1,-0.3 -2,-0.1 0.822 84.1 33.5 -58.2 -34.5 11.2 33.1 30.2 374 184 B Y T > S- 0 0 8 1,-0.5 3,-1.8 4,-0.4 -1,-0.3 -0.054 113.3-129.2-106.1 29.3 10.7 35.6 27.4 375 185 B G G X - 0 0 5 -3,-2.2 3,-0.6 1,-0.3 -1,-0.5 -0.303 69.7 -27.4 56.0-141.2 7.8 37.3 29.2 376 186 B G G 3 S+ 0 0 69 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.1 0.440 122.1 88.6 -78.6 -1.4 4.8 37.7 26.9 377 187 B A G < S+ 0 0 19 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.809 97.0 25.7 -66.6 -34.6 7.0 37.8 23.8 378 188 B V < 0 0 2 -3,-0.6 -4,-0.4 -4,-0.2 -6,-0.2 -0.973 360.0 360.0-134.8 117.0 7.0 34.0 23.2 379 189 B P 0 0 79 0, 0.0 -7,-0.2 0, 0.0 -174,-0.2 0.841 360.0 360.0 -73.4 360.0 4.2 31.9 24.5