==== 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 1UHH . 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) . 18937.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 276 73.0 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 . 32 8.5 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 . 15 4.0 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 -1 A A 0 0 64 0, 0.0 99,-0.1 0, 0.0 98,-0.0 0.000 360.0 360.0 360.0 132.0 5.6 -14.7 13.5 2 0 A N + 0 0 169 2,-0.0 2,-0.3 0, 0.0 98,-0.0 0.626 360.0 40.4 -73.1 -21.1 4.1 -12.4 16.1 3 1 A S S S- 0 0 35 2,-0.0 2,-0.7 166,-0.0 0, 0.0 -0.903 74.1-130.9-125.3 153.8 0.5 -12.8 14.6 4 2 A K - 0 0 205 -2,-0.3 2,-0.5 2,-0.0 -2,-0.0 -0.964 38.2-174.8-100.7 106.5 -1.5 -15.7 13.2 5 3 A L + 0 0 30 -2,-0.7 2,-0.3 91,-0.2 95,-0.1 -0.973 6.8 177.0-117.6 129.7 -2.7 -14.1 9.9 6 4 A T - 0 0 97 -2,-0.5 2,-0.1 171,-0.1 -2,-0.0 -0.863 29.0-105.6-130.8 153.6 -5.1 -15.8 7.6 7 5 A S - 0 0 51 -2,-0.3 170,-0.2 1,-0.1 169,-0.1 -0.383 18.9-173.0 -78.6 160.4 -6.9 -14.9 4.3 8 6 A D > + 0 0 71 168,-0.4 3,-1.7 3,-0.1 6,-0.3 -0.406 21.6 158.8-146.3 58.9 -10.6 -14.0 4.0 9 7 A F T 3 + 0 0 32 1,-0.3 6,-0.1 5,-0.1 80,-0.0 0.640 69.3 56.2 -70.9 -20.2 -10.9 -13.7 0.2 10 8 A D T 3 S+ 0 0 119 4,-0.1 -1,-0.3 -3,-0.1 -3,-0.0 0.484 76.6 111.7 -88.2 -3.9 -14.7 -14.2 0.0 11 9 A N X> - 0 0 39 -3,-1.7 4,-1.9 1,-0.2 3,-1.1 -0.592 66.9-143.3 -65.7 118.7 -15.4 -11.3 2.4 12 10 A P H 3> S+ 0 0 101 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.785 100.6 59.4 -56.8 -25.3 -17.1 -8.7 0.1 13 11 A R H 3> S+ 0 0 117 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.801 104.9 48.6 -73.9 -29.2 -15.2 -6.0 2.1 14 12 A W H <> S+ 0 0 0 -3,-1.1 4,-1.8 -6,-0.3 5,-0.2 0.934 114.5 44.3 -65.6 -51.1 -11.8 -7.5 1.1 15 13 A I H X S+ 0 0 57 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.896 114.5 51.5 -59.9 -41.5 -12.8 -7.7 -2.5 16 14 A G H X S+ 0 0 32 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.807 103.4 56.7 -68.9 -33.5 -14.2 -4.2 -2.3 17 15 A R H X S+ 0 0 1 -4,-1.3 4,-1.6 2,-0.2 -1,-0.2 0.935 112.0 42.7 -63.4 -45.6 -11.1 -2.8 -0.7 18 16 A H H X S+ 0 0 1 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.814 110.1 55.5 -76.5 -28.1 -9.1 -4.0 -3.7 19 17 A K H X S+ 0 0 93 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.889 105.7 54.2 -65.6 -38.0 -11.8 -2.9 -6.2 20 18 A H H X S+ 0 0 65 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.930 111.3 44.2 -55.8 -49.9 -11.5 0.6 -4.7 21 19 A X H X S+ 0 0 19 -4,-1.6 4,-2.6 2,-0.2 5,-0.2 0.895 111.3 53.9 -67.2 -40.4 -7.7 0.6 -5.3 22 20 A F H X S+ 0 0 5 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.954 112.0 44.4 -52.6 -50.1 -8.2 -0.8 -8.8 23 21 A N H < S+ 0 0 86 -4,-2.7 6,-0.2 1,-0.2 -2,-0.2 0.891 113.5 50.6 -66.5 -37.1 -10.6 2.0 -9.7 24 22 A F H < S+ 0 0 54 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.881 113.2 45.8 -67.7 -37.1 -8.3 4.6 -8.0 25 23 A L H < S+ 0 0 19 -4,-2.6 2,-1.9 1,-0.2 -2,-0.2 0.804 99.7 71.2 -76.5 -26.3 -5.3 3.2 -10.1 26 24 A D >< + 0 0 7 -4,-2.0 3,-2.4 -5,-0.2 -1,-0.2 -0.484 67.1 170.3 -85.9 66.2 -7.4 3.2 -13.3 27 25 A V T 3 S+ 0 0 107 -2,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.805 72.6 41.4 -57.4 -33.9 -7.3 6.9 -13.4 28 26 A N T 3 S- 0 0 130 -3,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.283 109.2-118.0 -96.9 13.0 -8.8 7.2 -16.9 29 27 A H < + 0 0 152 -3,-2.4 -2,-0.1 -6,-0.2 -6,-0.1 0.920 61.5 147.7 51.6 49.5 -11.5 4.4 -16.4 30 28 A N - 0 0 93 2,-0.3 -1,-0.1 50,-0.0 3,-0.1 0.618 61.9-123.0 -80.8 -14.7 -10.1 2.1 -19.1 31 29 A G S S+ 0 0 32 -5,-0.2 50,-0.7 1,-0.1 2,-0.3 0.525 87.2 65.1 79.5 5.6 -11.2 -1.0 -17.2 32 30 A K E -A 80 0A 98 48,-0.2 2,-0.3 49,-0.1 -2,-0.3 -0.986 60.6-162.9-154.3 154.6 -7.6 -2.2 -17.2 33 31 A I E -A 79 0A 1 46,-2.0 46,-3.4 -2,-0.3 2,-0.3 -0.962 10.3-145.9-140.3 151.9 -4.2 -1.2 -15.9 34 32 A S E > -A 78 0A 5 -2,-0.3 4,-1.9 44,-0.2 3,-0.5 -0.827 27.0-118.5-116.7 157.7 -0.6 -2.1 -16.8 35 33 A L H > S+ 0 0 6 39,-1.0 4,-2.4 42,-0.6 5,-0.3 0.861 114.4 63.5 -59.6 -32.8 2.6 -2.6 -14.9 36 34 A D H > S+ 0 0 73 38,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.880 104.8 45.4 -56.7 -43.6 4.1 0.2 -17.0 37 35 A E H > S+ 0 0 72 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.875 111.5 52.9 -68.6 -41.2 1.5 2.7 -15.6 38 36 A X H X S+ 0 0 8 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.910 112.6 42.0 -64.3 -46.6 2.0 1.4 -12.0 39 37 A V H X S+ 0 0 18 -4,-2.4 4,-1.9 2,-0.2 5,-0.2 0.761 112.3 56.1 -73.3 -26.9 5.9 1.9 -12.1 40 38 A Y H X S+ 0 0 164 -4,-1.3 4,-2.8 -5,-0.3 -2,-0.2 0.954 110.7 43.8 -62.0 -51.1 5.5 5.2 -13.9 41 39 A K H X S+ 0 0 62 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.933 112.9 52.4 -62.8 -45.6 3.2 6.5 -11.1 42 40 A A H X S+ 0 0 10 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.897 115.0 39.5 -59.5 -47.6 5.5 5.2 -8.4 43 41 A S H X>S+ 0 0 23 -4,-1.9 4,-2.7 2,-0.2 5,-0.6 0.868 110.6 59.2 -73.9 -36.9 8.7 6.8 -9.7 44 42 A D H X>S+ 0 0 65 -4,-2.8 4,-2.0 -5,-0.2 5,-0.6 0.939 109.0 46.3 -52.3 -49.4 6.8 10.0 -10.7 45 43 A I H X>S+ 0 0 12 -4,-2.2 4,-1.7 3,-0.2 5,-1.2 0.955 118.2 38.9 -58.3 -56.9 5.8 10.4 -7.0 46 44 A V H <5S+ 0 0 0 -4,-1.9 6,-2.8 3,-0.2 4,-0.3 0.896 125.5 35.0 -73.5 -35.2 9.2 9.7 -5.4 47 45 A I H <5S+ 0 0 80 -4,-2.7 4,-0.5 4,-0.2 -3,-0.2 0.934 128.5 31.8 -79.8 -50.8 11.4 11.5 -7.9 48 46 A N H < - 0 0 60 1,-0.1 4,-3.0 4,-0.0 5,-0.2 -0.330 31.9-102.6 -68.6 161.9 17.9 10.3 -5.3 54 52 A P H > S+ 0 0 75 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.917 124.0 47.1 -54.5 -41.9 18.5 8.1 -8.4 55 53 A E H > S+ 0 0 141 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.903 113.1 48.4 -69.0 -40.4 19.6 5.1 -6.3 56 54 A Q H > S+ 0 0 28 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.899 111.0 50.8 -65.1 -42.3 16.6 5.5 -4.0 57 55 A A H X S+ 0 0 4 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.881 110.2 49.6 -63.5 -38.7 14.2 5.8 -6.9 58 56 A K H X S+ 0 0 123 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.889 109.9 50.2 -69.7 -40.1 15.6 2.6 -8.5 59 57 A R H X S+ 0 0 115 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.929 113.4 46.8 -61.0 -47.4 15.3 0.7 -5.2 60 58 A H H X S+ 0 0 3 -4,-2.3 4,-2.3 53,-0.2 -2,-0.2 0.904 110.4 52.3 -58.1 -46.8 11.7 1.8 -4.9 61 59 A K H X S+ 0 0 77 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.923 108.3 51.7 -57.5 -43.6 10.9 1.0 -8.6 62 60 A D H X S+ 0 0 89 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.880 110.6 47.5 -62.2 -41.6 12.3 -2.5 -8.1 63 61 A A H X S+ 0 0 7 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.877 113.3 47.1 -69.8 -40.8 10.1 -3.1 -5.0 64 62 A V H X S+ 0 0 2 -4,-2.3 4,-2.4 2,-0.2 5,-0.4 0.920 111.2 53.1 -63.0 -45.9 6.9 -1.7 -6.7 65 63 A E H X S+ 0 0 68 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.930 111.9 44.1 -49.7 -51.7 7.6 -3.9 -9.8 66 64 A A H X S+ 0 0 43 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.844 112.1 54.4 -70.1 -33.5 7.9 -7.0 -7.7 67 65 A F H X S+ 0 0 9 -4,-1.9 4,-0.7 2,-0.2 3,-0.3 0.986 117.3 33.3 -61.9 -63.7 4.8 -6.1 -5.6 68 66 A F H ><>S+ 0 0 18 -4,-2.4 5,-2.1 1,-0.2 3,-0.6 0.841 115.2 60.5 -63.8 -30.6 2.4 -5.7 -8.5 69 67 A G H ><5S+ 0 0 34 -4,-2.2 3,-1.7 -5,-0.4 -1,-0.2 0.866 99.6 57.1 -62.4 -32.8 4.4 -8.5 -10.3 70 68 A G H 3<5S+ 0 0 33 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.724 102.3 54.2 -70.3 -23.8 3.4 -10.8 -7.5 71 69 A A T <<5S- 0 0 2 -4,-0.7 -1,-0.3 -3,-0.6 16,-0.2 0.179 128.9-100.7 -91.0 10.0 -0.2 -10.0 -8.3 72 70 A G T < 5S+ 0 0 47 -3,-1.7 -3,-0.2 1,-0.3 2,-0.2 0.483 73.3 143.8 93.3 3.7 0.5 -11.1 -11.8 73 71 A X < - 0 0 3 -5,-2.1 2,-0.3 -8,-0.1 -1,-0.3 -0.538 25.7-173.6 -83.3 146.0 0.9 -7.7 -13.6 74 72 A K > - 0 0 138 3,-0.3 3,-1.7 -2,-0.2 -39,-1.0 -0.972 32.0 -90.1-140.0 151.5 3.4 -7.5 -16.4 75 73 A Y T 3 S+ 0 0 98 -2,-0.3 3,-0.1 1,-0.3 -41,-0.0 -0.354 113.2 13.5 -59.9 136.2 5.1 -5.0 -18.7 76 74 A G T 3 S+ 0 0 68 1,-0.2 2,-0.4 -2,-0.0 -1,-0.3 0.555 105.5 109.3 73.9 9.1 3.1 -4.6 -21.9 77 75 A V < - 0 0 66 -3,-1.7 2,-0.6 2,-0.0 -42,-0.6 -0.960 61.6-141.6-119.2 134.0 0.1 -6.5 -20.5 78 76 A E E -A 34 0A 95 -2,-0.4 2,-0.6 -44,-0.1 -44,-0.2 -0.837 16.4-152.8 -96.5 125.2 -3.3 -4.9 -19.7 79 77 A T E -A 33 0A 9 -46,-3.4 -46,-2.0 -2,-0.6 2,-0.1 -0.834 7.7-159.2 -98.9 117.4 -4.8 -6.3 -16.5 80 78 A D E > -A 32 0A 77 -2,-0.6 4,-2.5 -48,-0.2 -48,-0.2 -0.328 36.8 -94.3 -86.1 172.5 -8.6 -6.2 -16.2 81 79 A W H > S+ 0 0 46 -50,-0.7 4,-2.8 1,-0.2 5,-0.3 0.934 121.8 52.0 -56.4 -52.0 -10.5 -6.4 -12.9 82 80 A P H > S+ 0 0 48 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.923 115.8 41.9 -53.7 -41.7 -11.1 -10.3 -13.0 83 81 A A H > S+ 0 0 29 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.868 113.1 55.4 -71.1 -35.4 -7.4 -10.9 -13.6 84 82 A Y H X S+ 0 0 3 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.960 110.5 42.2 -63.8 -50.1 -6.4 -8.3 -11.0 85 83 A I H X S+ 0 0 21 -4,-2.8 4,-1.7 2,-0.2 -1,-0.2 0.872 113.4 53.1 -70.8 -35.2 -8.4 -9.8 -8.2 86 84 A E H X S+ 0 0 41 -4,-1.7 4,-1.4 -5,-0.3 3,-0.2 0.949 112.0 46.1 -56.2 -52.0 -7.3 -13.3 -9.1 87 85 A G H X S+ 0 0 6 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.855 106.9 58.8 -57.7 -38.8 -3.7 -12.2 -9.0 88 86 A W H X S+ 0 0 7 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.855 101.3 54.5 -64.0 -37.8 -4.3 -10.4 -5.7 89 87 A K H X S+ 0 0 52 -4,-1.7 4,-2.0 -3,-0.2 -1,-0.2 0.905 110.2 47.3 -58.5 -40.1 -5.4 -13.7 -4.1 90 88 A K H X S+ 0 0 106 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.923 111.9 49.9 -66.6 -47.7 -2.1 -15.2 -5.1 91 89 A L H X S+ 0 0 2 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.951 112.7 46.1 -54.2 -54.3 -0.1 -12.3 -3.9 92 90 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 5,-0.2 0.882 112.5 50.9 -58.3 -40.5 -1.8 -12.3 -0.5 93 91 A T H X S+ 0 0 54 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.948 112.4 46.1 -63.5 -47.0 -1.4 -16.0 -0.1 94 92 A D H X S+ 0 0 75 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.902 113.0 49.7 -63.0 -43.7 2.3 -15.9 -1.0 95 93 A E H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.873 110.7 49.3 -59.4 -43.5 2.9 -12.9 1.4 96 94 A L H X S+ 0 0 15 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.867 109.4 52.7 -73.5 -30.9 1.1 -14.6 4.3 97 95 A E H X S+ 0 0 114 -4,-2.1 4,-1.4 -5,-0.2 -2,-0.2 0.922 111.1 46.2 -66.8 -40.6 3.1 -17.8 3.7 98 96 A K H <>S+ 0 0 47 -4,-2.2 5,-2.6 1,-0.2 -2,-0.2 0.935 112.5 50.8 -65.4 -46.5 6.4 -15.8 3.9 99 97 A Y H ><5S+ 0 0 39 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.896 107.7 52.5 -51.2 -48.4 5.2 -14.0 7.0 100 98 A A H 3<5S+ 0 0 67 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.831 112.9 46.3 -65.9 -27.7 4.3 -17.3 8.7 101 99 A K T 3<5S- 0 0 142 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.312 115.5-114.6 -93.2 7.0 7.8 -18.5 7.9 102 100 A N T < 5 + 0 0 122 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.860 69.7 139.5 59.0 38.5 9.6 -15.2 9.1 103 101 A E < - 0 0 88 -5,-2.6 -1,-0.2 -6,-0.1 -2,-0.1 -0.869 62.9 -89.0-109.0 148.3 10.8 -14.4 5.6 104 102 A P - 0 0 93 0, 0.0 2,-0.2 0, 0.0 -1,-0.0 -0.276 42.3-145.4 -58.6 133.8 10.8 -10.9 4.2 105 103 A T > - 0 0 7 1,-0.1 4,-2.0 -7,-0.1 5,-0.1 -0.598 21.4-116.7 -95.6 163.5 7.6 -10.0 2.4 106 104 A L H > S+ 0 0 26 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.841 117.1 56.1 -69.8 -33.8 7.3 -7.8 -0.7 107 105 A I H > S+ 0 0 6 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.890 107.8 47.7 -66.3 -35.9 5.3 -5.2 1.4 108 106 A R H > S+ 0 0 70 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.920 111.0 51.5 -64.7 -46.2 8.2 -5.0 3.9 109 107 A I H X S+ 0 0 81 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.917 113.8 44.1 -59.4 -43.0 10.8 -4.6 1.1 110 108 A W H X S+ 0 0 42 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.933 111.6 52.8 -67.4 -49.0 8.7 -1.8 -0.4 111 109 A G H X S+ 0 0 15 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.936 108.6 49.8 -53.5 -44.3 8.1 -0.1 2.9 112 110 A D H X S+ 0 0 52 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.922 113.3 47.2 -64.7 -37.0 11.9 -0.1 3.7 113 111 A A H X S+ 0 0 2 -4,-1.8 4,-0.7 -5,-0.2 -1,-0.2 0.905 115.5 44.6 -67.4 -42.7 12.5 1.5 0.2 114 112 A L H >X S+ 0 0 17 -4,-2.8 4,-2.4 1,-0.2 3,-0.9 0.923 110.4 53.4 -70.8 -44.5 9.8 4.1 0.6 115 113 A F H 3X S+ 0 0 13 -4,-3.1 4,-2.4 -5,-0.3 7,-0.3 0.841 100.1 61.9 -62.7 -33.7 10.7 5.0 4.2 116 114 A D H 3< S+ 0 0 44 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.835 113.7 38.0 -57.1 -29.3 14.4 5.7 3.1 117 115 A I H << S+ 0 0 18 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.2 0.887 120.9 41.7 -87.2 -42.3 12.9 8.4 0.9 118 116 A V H < S+ 0 0 19 -4,-2.4 2,-0.7 3,-0.0 -3,-0.2 0.847 96.3 77.9 -81.8 -35.7 10.1 9.7 3.1 119 117 A D >< - 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0 0 87 -5,-2.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.880 64.0 -91.9-110.8 141.3 -28.4 -24.1 -35.3 292 102 B P - 0 0 91 0, 0.0 2,-0.2 0, 0.0 -5,-0.1 -0.311 42.3-140.2 -54.6 132.4 -28.2 -25.7 -31.8 293 103 B T > - 0 0 2 1,-0.1 4,-2.3 -7,-0.1 5,-0.2 -0.521 19.4-115.2 -87.3 162.6 -25.0 -27.5 -31.1 294 104 B L H > S+ 0 0 30 1,-0.2 4,-2.2 2,-0.2 -39,-0.2 0.847 118.3 54.7 -64.0 -36.0 -24.7 -30.7 -29.3 295 105 B I H > S+ 0 0 7 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.825 107.9 49.3 -69.5 -31.0 -22.8 -29.0 -26.5 296 106 B R H > S+ 0 0 68 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.922 109.6 51.0 -68.3 -43.6 -25.6 -26.5 -26.1 297 107 B I H X S+ 0 0 77 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.913 113.7 45.7 -60.8 -41.5 -28.2 -29.3 -26.0 298 108 B W H X S+ 0 0 42 -4,-2.2 4,-3.3 -47,-0.2 5,-0.3 0.960 111.1 52.8 -64.9 -47.3 -26.1 -31.0 -23.2 299 109 B G H X S+ 0 0 14 -4,-2.3 4,-3.2 1,-0.2 5,-0.2 0.875 108.0 50.2 -52.3 -48.4 -25.6 -27.7 -21.4 300 110 B D H X S+ 0 0 54 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.914 113.9 45.1 -60.7 -44.8 -29.3 -27.0 -21.3 301 111 B A H X S+ 0 0 2 -4,-1.9 4,-0.9 -5,-0.2 -2,-0.2 0.919 116.2 45.6 -67.2 -39.7 -30.0 -30.5 -19.9 302 112 B L H >X S+ 0 0 12 -4,-3.3 4,-2.4 1,-0.2 3,-0.9 0.941 111.4 52.3 -70.4 -42.4 -27.2 -30.3 -17.3 303 113 B F H 3X S+ 0 0 10 -4,-3.2 4,-2.4 -5,-0.3 7,-0.3 0.811 100.2 61.7 -65.1 -28.6 -28.1 -26.8 -16.2 304 114 B D H 3< S+ 0 0 42 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.845 113.7 37.6 -63.0 -30.9 -31.7 -27.9 -15.6 305 115 B I H << S+ 0 0 18 -3,-0.9 -2,-0.2 -4,-0.9 -1,-0.2 0.908 121.9 41.2 -81.4 -43.6 -30.3 -30.3 -13.0 306 116 B V H < S+ 0 0 17 -4,-2.4 2,-0.8 1,-0.1 -3,-0.2 0.790 99.0 75.3 -83.2 -34.3 -27.6 -28.1 -11.6 307 117 B D >< - 0 0 2 -4,-2.4 3,-1.9 -5,-0.2 5,-0.1 -0.735 67.2-157.1 -84.6 104.1 -29.4 -24.7 -11.4 308 118 B K T 3 S+ 0 0 179 -2,-0.8 -1,-0.2 1,-0.3 6,-0.1 0.736 95.1 49.5 -52.3 -26.6 -31.8 -24.9 -8.4 309 119 B D T 3 S- 0 0 98 4,-0.3 -1,-0.3 -3,-0.0 -5,-0.1 0.478 98.9-139.2 -93.4 -4.4 -33.9 -22.1 -10.1 310 120 B Q < + 0 0 108 -3,-1.9 -6,-0.1 -7,-0.3 -2,-0.1 0.816 65.4 122.3 48.2 44.9 -34.0 -23.8 -13.6 311 121 B N S S- 0 0 140 2,-0.3 -1,-0.1 -8,-0.2 -7,-0.1 0.017 88.4 -94.4-121.7 22.9 -33.5 -20.5 -15.4 312 122 B G S S+ 0 0 23 -9,-0.1 40,-2.5 1,-0.1 2,-0.3 0.752 92.1 91.4 74.2 29.1 -30.3 -21.5 -17.4 313 123 B A E -D 351 0D 8 38,-0.3 2,-0.4 -10,-0.2 -2,-0.3 -0.990 53.4-151.8-155.3 145.3 -27.6 -20.2 -15.0 314 124 B I E -D 350 0D 0 36,-2.1 36,-2.7 -2,-0.3 2,-0.1 -0.902 12.8-128.8-123.2 148.1 -25.5 -21.5 -12.2 315 125 B T > - 0 0 48 -2,-0.4 4,-2.2 34,-0.2 3,-0.2 -0.394 36.6-106.4 -76.6 162.2 -23.7 -20.2 -9.1 316 126 B L H > S+ 0 0 46 32,-0.4 4,-2.6 1,-0.2 5,-0.2 0.892 122.2 56.3 -57.4 -38.2 -20.1 -20.9 -8.4 317 127 B D H > S+ 0 0 124 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.867 108.0 48.7 -61.9 -39.4 -21.1 -23.3 -5.6 318 128 B E H > S+ 0 0 33 2,-0.2 4,-2.4 -3,-0.2 -1,-0.2 0.899 109.4 51.2 -68.0 -40.1 -23.2 -25.2 -8.2 319 129 B W H X S+ 0 0 7 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.918 110.3 50.8 -61.3 -42.6 -20.3 -25.3 -10.7 320 130 B K H X S+ 0 0 33 -4,-2.6 4,-2.1 2,-0.2 5,-0.3 0.911 107.9 52.6 -58.5 -45.7 -18.2 -26.7 -7.9 321 131 B A H X S+ 0 0 50 -4,-2.0 4,-1.5 -5,-0.2 -2,-0.2 0.942 115.1 40.7 -59.5 -47.1 -20.8 -29.4 -7.1 322 132 B Y H X S+ 0 0 30 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.962 117.1 44.6 -64.1 -54.0 -20.9 -30.6 -10.7 323 133 B T H X>S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 6,-1.0 0.899 114.3 48.7 -71.1 -32.9 -17.3 -30.5 -11.6 324 134 B K H <5S+ 0 0 88 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.830 111.7 49.3 -72.1 -37.8 -16.1 -32.1 -8.4 325 135 B A H <5S+ 0 0 37 -4,-1.5 -2,-0.2 -5,-0.3 -1,-0.2 0.924 116.5 42.6 -60.7 -48.4 -18.6 -35.0 -8.7 326 136 B A H <5S- 0 0 7 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.851 105.8-134.4 -63.8 -37.6 -17.6 -35.5 -12.3 327 137 B G T <5S+ 0 0 12 -4,-2.2 -3,-0.2 2,-0.4 -4,-0.1 0.309 72.2 119.8 93.7 -1.9 -13.9 -35.2 -11.3 328 138 B I S - 0 0 44 1,-0.1 4,-1.8 0, 0.0 3,-0.2 -0.778 69.6-135.4-106.6 145.7 -9.9 -27.9 -6.6 332 142 B S H > S+ 0 0 44 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.864 106.2 61.1 -60.6 -35.6 -12.0 -24.9 -5.6 333 143 B E H > S+ 0 0 116 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.915 105.4 46.3 -62.4 -39.4 -9.3 -22.6 -7.0 334 144 B D H > S+ 0 0 30 -3,-0.2 4,-1.2 2,-0.2 3,-0.2 0.905 110.6 52.5 -68.7 -40.5 -9.6 -24.1 -10.5 335 145 B C H X S+ 0 0 0 -4,-1.8 4,-0.9 1,-0.2 3,-0.2 0.888 107.0 54.7 -59.9 -37.3 -13.5 -23.8 -10.3 336 146 B E H X S+ 0 0 55 -4,-2.3 4,-1.2 1,-0.2 3,-0.3 0.840 99.4 60.5 -65.0 -33.1 -13.0 -20.1 -9.4 337 147 B E H X S+ 0 0 18 -4,-1.3 4,-2.4 1,-0.2 -1,-0.2 0.862 96.2 61.2 -66.6 -31.7 -10.9 -19.6 -12.5 338 148 B T H X S+ 0 0 0 -4,-1.2 4,-2.5 -3,-0.2 -1,-0.2 0.912 103.9 49.0 -53.5 -47.9 -13.8 -20.6 -14.7 339 149 B F H < S+ 0 0 28 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.765 110.0 53.1 -70.5 -24.0 -15.8 -17.7 -13.2 340 150 B R H < S+ 0 0 69 -4,-1.2 -2,-0.2 -3,-0.1 -1,-0.2 0.916 112.5 42.6 -70.2 -43.3 -12.8 -15.4 -13.9 341 151 B V H < S+ 0 0 17 -4,-2.4 -2,-0.2 31,-0.2 -3,-0.1 0.892 106.5 72.3 -74.7 -41.3 -12.6 -16.4 -17.6 342 152 B C S < S- 0 0 6 -4,-2.5 2,-0.7 -5,-0.2 13,-0.1 -0.416 89.6-112.0 -71.1 149.2 -16.4 -16.3 -18.2 343 153 B D - 0 0 121 -2,-0.1 8,-0.4 8,-0.1 2,-0.3 -0.751 41.4-149.9 -74.8 112.5 -18.5 -13.1 -18.5 344 154 B I - 0 0 58 -2,-0.7 6,-0.2 -5,-0.2 -5,-0.0 -0.669 11.0-117.8 -96.4 147.2 -20.6 -13.5 -15.3 345 155 B D > - 0 0 51 4,-3.0 3,-2.1 -2,-0.3 -1,-0.1 -0.077 33.8 -88.1 -81.4-178.6 -24.2 -12.1 -15.2 346 156 B E T 3 S+ 0 0 195 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.631 127.0 50.9 -67.4 -18.6 -25.7 -9.4 -13.0 347 157 B S T 3 S- 0 0 76 2,-0.1 -1,-0.3 -32,-0.0 3,-0.1 0.336 122.7-102.0 -99.7 9.2 -26.6 -11.9 -10.4 348 158 B G S < S+ 0 0 41 -3,-2.1 -32,-0.4 1,-0.3 2,-0.3 0.672 80.8 132.6 78.4 18.7 -23.1 -13.5 -10.2 349 159 B Q - 0 0 34 -34,-0.1 -4,-3.0 -33,-0.1 2,-0.6 -0.710 58.4-129.1-108.3 155.5 -24.2 -16.5 -12.3 350 160 B L E -D 314 0D 0 -36,-2.7 -36,-2.1 -2,-0.3 2,-0.2 -0.876 31.0-151.4-101.0 112.6 -22.7 -18.3 -15.3 351 161 B D E > -D 313 0D 43 -2,-0.6 4,-2.4 -8,-0.4 -38,-0.3 -0.549 21.9-118.6 -93.4 156.1 -25.4 -18.7 -17.9 352 162 B V H > S+ 0 0 7 -40,-2.5 4,-2.3 1,-0.2 5,-0.2 0.840 112.1 58.8 -60.8 -35.2 -25.6 -21.5 -20.5 353 163 B D H > S+ 0 0 70 -41,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.930 111.8 41.3 -54.8 -50.7 -25.3 -19.0 -23.5 354 164 B E H > S+ 0 0 6 -3,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.932 112.5 52.1 -65.9 -48.1 -21.9 -17.8 -22.1 355 165 B X H X S+ 0 0 5 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.891 108.6 53.6 -61.7 -34.6 -20.7 -21.3 -21.2 356 166 B T H X S+ 0 0 9 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.937 108.5 48.2 -63.0 -43.6 -21.5 -22.5 -24.7 357 167 B R H X S+ 0 0 117 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.870 113.4 47.7 -62.6 -37.3 -19.4 -19.7 -26.3 358 168 B Q H X S+ 0 0 20 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.888 109.9 52.8 -72.9 -43.0 -16.5 -20.5 -23.9 359 169 B H H X>S+ 0 0 23 -4,-2.6 4,-2.9 2,-0.2 5,-0.8 0.870 104.8 55.6 -55.6 -41.0 -16.8 -24.2 -24.7 360 170 B L H X>S+ 0 0 11 -4,-2.1 5,-1.5 1,-0.2 4,-1.3 0.945 114.0 40.8 -58.9 -45.2 -16.6 -23.5 -28.5 361 171 B G H <>S+ 0 0 4 -4,-1.5 6,-1.4 3,-0.2 5,-0.7 0.838 121.0 41.8 -71.2 -35.4 -13.4 -21.7 -27.9 362 172 B F H <5S+ 0 0 1 -4,-2.1 -2,-0.2 4,-0.2 -3,-0.2 0.931 127.9 24.3 -82.7 -46.7 -11.9 -24.1 -25.4 363 173 B W H <5S+ 0 0 18 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.751 133.0 28.5 -90.7 -27.4 -12.8 -27.5 -26.9 364 174 B Y T < - 0 0 71 -6,-1.4 3,-1.9 1,-0.2 4,-0.2 -0.484 24.7-140.9 -58.0 119.4 -9.4 -19.3 -28.9 368 178 B P G > S+ 0 0 106 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.801 99.0 65.4 -58.2 -24.5 -6.8 -17.6 -26.7 369 179 B A G 3 S+ 0 0 76 1,-0.2 -7,-0.1 3,-0.0 -2,-0.1 0.682 99.4 52.4 -72.1 -15.3 -9.5 -15.7 -24.9 370 180 B C G X S+ 0 0 7 -3,-1.9 3,-1.1 -9,-0.2 -1,-0.2 0.282 79.0 130.4-103.8 6.6 -10.9 -19.1 -23.5 371 181 B E T < + 0 0 42 -3,-1.1 4,-0.1 -4,-0.2 -9,-0.1 -0.277 70.0 21.8 -58.7 147.8 -7.6 -20.3 -22.1 372 182 B K T > S+ 0 0 126 7,-0.3 3,-2.0 6,-0.2 -1,-0.2 0.670 73.4 145.4 67.1 21.9 -7.8 -21.5 -18.5 373 183 B L T < S+ 0 0 0 -3,-1.1 -31,-0.1 1,-0.3 -32,-0.1 0.826 82.6 33.4 -54.2 -36.2 -11.6 -22.2 -18.6 374 184 B Y T > S- 0 0 11 1,-0.5 3,-1.7 4,-0.4 -1,-0.3 -0.027 111.3-129.9-107.2 25.4 -11.1 -25.2 -16.3 375 185 B G T < - 0 0 6 -3,-2.0 3,-0.5 1,-0.3 -1,-0.5 -0.333 68.3 -29.2 62.5-146.9 -8.2 -23.6 -14.4 376 186 B G T 3 S+ 0 0 64 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.1 0.470 122.7 88.2 -77.5 -3.1 -5.2 -25.8 -14.1 377 187 B A S < S+ 0 0 21 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.845 96.3 28.4 -67.6 -37.8 -7.4 -28.9 -14.2 378 188 B V 0 0 2 -3,-0.5 -4,-0.4 -4,-0.3 -1,-0.2 -0.986 360.0 360.0-128.2 121.0 -7.4 -29.3 -18.0 379 189 B P 0 0 81 0, 0.0 -7,-0.3 0, 0.0 -174,-0.2 0.851 360.0 360.0 -66.5 360.0 -4.4 -28.0 -20.0