==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 30-JUN-05 2CXS . COMPND 2 MOLECULE: GLUCOSE-6-PHOSPHATE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR N.TANAKA,A.HAGA,N.NABA,K.SHIRAIWA,Y.KUSAKABE,K.HASHIMOTO,T.F . 1114 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37394.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 822 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 78 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 2 0.2 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 . 74 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 133 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 438 39.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 31 2.8 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 6 0 3 6 2 3 5 1 0 8 2 0 0 0 2 2 3 0 2 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 4 4 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 PARALLEL BRIDGES PER LADDER . 9 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 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 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 M 0 0 137 0, 0.0 2,-0.2 0, 0.0 368,-0.1 0.000 360.0 360.0 360.0-165.3 9.2 -25.1 -8.7 2 2 A A > - 0 0 0 1,-0.1 4,-2.0 367,-0.0 5,-0.2 -0.675 360.0-102.1-115.1 167.3 10.7 -21.7 -9.6 3 3 A A H > S+ 0 0 25 -2,-0.2 4,-0.7 1,-0.2 503,-0.1 0.878 116.9 47.4 -56.6 -44.6 12.9 -20.4 -12.5 4 4 A L H >4 S+ 0 0 0 501,-0.3 3,-0.8 1,-0.2 6,-0.2 0.941 115.1 43.3 -65.2 -48.2 16.2 -20.3 -10.5 5 5 A T H 34 S+ 0 0 18 1,-0.2 -1,-0.2 500,-0.1 -2,-0.2 0.760 112.6 53.5 -72.1 -25.3 15.9 -23.8 -8.9 6 6 A R H 3< S+ 0 0 168 -4,-2.0 -1,-0.2 4,-0.1 -2,-0.2 0.599 87.0 106.0 -78.9 -14.1 14.7 -25.3 -12.2 7 7 A N S+ 0 0 85 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.818 97.5 55.8 -64.1 -33.4 20.5 -26.5 -14.7 9 9 A Q H > S+ 0 0 67 2,-0.2 4,-1.8 1,-0.2 62,-0.2 0.857 109.0 48.7 -65.4 -37.1 23.4 -24.0 -14.3 10 10 A F H > S+ 0 0 6 -3,-0.3 4,-2.7 -6,-0.2 -1,-0.2 0.917 109.7 49.8 -68.0 -44.5 22.1 -23.2 -10.8 11 11 A Q H X S+ 0 0 77 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.866 110.2 52.3 -63.8 -34.1 21.8 -26.9 -9.8 12 12 A K H X S+ 0 0 123 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.904 110.5 47.9 -64.1 -43.6 25.3 -27.4 -11.1 13 13 A L H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.921 112.8 48.1 -61.8 -46.6 26.5 -24.5 -8.9 14 14 A L H X S+ 0 0 31 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.894 111.6 49.3 -63.5 -42.7 24.7 -25.9 -5.9 15 15 A E H X S+ 0 0 102 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.901 110.8 50.7 -62.1 -43.2 26.1 -29.4 -6.4 16 16 A W H X>S+ 0 0 44 -4,-2.3 4,-2.8 2,-0.2 5,-0.5 0.920 109.3 51.7 -59.5 -44.7 29.6 -28.0 -6.7 17 17 A H H X5S+ 0 0 22 -4,-2.5 4,-1.9 1,-0.2 5,-0.4 0.932 109.2 49.5 -57.7 -48.2 29.0 -26.1 -3.5 18 18 A R H <5S+ 0 0 144 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.888 120.3 36.3 -57.6 -42.1 27.9 -29.3 -1.6 19 19 A A H <5S+ 0 0 61 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.806 133.6 17.3 -81.7 -32.4 30.9 -31.2 -2.9 20 20 A N H ><5S+ 0 0 57 -4,-2.8 3,-2.1 -5,-0.2 4,-0.2 0.660 92.5 88.8-121.8 -22.8 33.7 -28.5 -2.8 21 21 A S G >< - 0 0 100 -2,-0.8 4,-2.5 1,-0.1 3,-0.3 -0.958 23.8-155.2-129.2 111.0 40.1 -21.7 2.6 26 26 A L H > S+ 0 0 0 -2,-0.5 4,-2.3 1,-0.2 5,-0.2 0.864 91.9 52.8 -56.7 -47.3 40.9 -18.0 2.1 27 27 A R H > S+ 0 0 60 410,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.920 115.3 42.7 -54.5 -45.6 44.3 -18.0 3.9 28 28 A E H > S+ 0 0 126 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.850 108.7 57.9 -71.8 -36.5 45.5 -20.9 1.7 29 29 A L H X S+ 0 0 42 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.915 110.5 44.4 -58.7 -43.8 44.0 -19.5 -1.5 30 30 A F H < S+ 0 0 15 -4,-2.3 3,-0.3 1,-0.2 6,-0.2 0.884 112.6 50.7 -69.9 -39.4 46.1 -16.4 -1.1 31 31 A E H < S+ 0 0 162 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.885 111.8 47.8 -64.7 -39.0 49.3 -18.3 -0.1 32 32 A A H < S+ 0 0 88 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.693 117.4 40.5 -75.6 -20.5 49.0 -20.6 -3.2 33 33 A D >< - 0 0 54 -4,-0.9 3,-1.8 -3,-0.3 -1,-0.2 -0.826 53.6-174.5-141.5 96.7 48.4 -17.8 -5.7 34 34 A P T 3 S+ 0 0 101 0, 0.0 3,-0.3 0, 0.0 4,-0.3 0.644 89.0 60.9 -62.4 -16.0 50.2 -14.4 -5.7 35 35 A E T 3> S+ 0 0 94 1,-0.2 4,-2.1 2,-0.1 5,-0.2 0.323 71.4 106.3 -93.1 7.1 47.9 -13.2 -8.5 36 36 A R H <> S+ 0 0 6 -3,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.906 79.2 47.0 -57.8 -48.9 44.7 -13.6 -6.5 37 37 A F H >4 S+ 0 0 24 -3,-0.3 3,-0.6 1,-0.2 -1,-0.2 0.940 113.4 49.9 -55.6 -48.1 44.1 -9.9 -6.0 38 38 A N H 34 S+ 0 0 93 -4,-0.3 3,-0.5 1,-0.2 -1,-0.2 0.821 114.1 44.4 -60.3 -34.1 44.8 -9.2 -9.7 39 39 A N H 3< S+ 0 0 78 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.626 117.4 43.3 -88.6 -15.7 42.4 -11.9 -10.9 40 40 A F S << S+ 0 0 13 -4,-1.4 15,-1.6 -3,-0.6 16,-0.4 -0.267 101.3 74.7-128.0 45.1 39.5 -11.1 -8.5 41 41 A S E -A 54 0A 21 -3,-0.5 2,-0.5 13,-0.2 13,-0.2 -0.990 58.4-146.3-151.9 154.1 39.3 -7.2 -8.5 42 42 A L E -A 53 0A 14 11,-2.3 11,-3.0 -2,-0.3 2,-0.8 -0.987 4.8-163.3-125.2 119.9 38.1 -4.5 -10.8 43 43 A N E -A 52 0A 83 -2,-0.5 2,-0.6 9,-0.2 9,-0.2 -0.866 17.6-162.6-102.6 97.9 39.9 -1.1 -11.0 44 44 A L E -A 51 0A 18 7,-2.9 7,-2.3 -2,-0.8 2,-0.8 -0.734 9.3-158.6 -90.4 120.9 37.4 1.2 -12.7 45 45 A N E +A 50 0A 80 -2,-0.6 5,-0.2 5,-0.2 -2,-0.0 -0.870 14.9 174.1 -96.3 108.7 38.7 4.5 -14.1 46 46 A T - 0 0 2 3,-2.2 4,-0.1 -2,-0.8 -1,-0.1 0.479 48.6-119.5 -87.7 -5.1 35.7 6.9 -14.4 47 47 A N S S+ 0 0 127 2,-0.3 3,-0.1 1,-0.0 -2,-0.1 0.369 111.0 66.6 70.3 0.1 38.0 9.8 -15.5 48 48 A H S S- 0 0 107 1,-0.7 438,-0.2 1067,-0.1 2,-0.2 -0.160 124.3 -42.0-133.1 37.0 36.7 11.5 -12.4 49 49 A G - 0 0 4 431,-0.1 -3,-2.2 1065,-0.1 -1,-0.7 -0.404 68.4 -89.2 118.2 160.4 38.3 9.2 -9.9 50 50 A H E -A 45 0A 38 -5,-0.2 430,-2.0 -2,-0.2 2,-0.5 -0.825 21.9-158.4-106.4 146.2 38.8 5.4 -9.6 51 51 A I E -AB 44 479A 0 -7,-2.3 -7,-2.9 -2,-0.3 2,-0.7 -0.980 9.5-161.2-120.6 115.6 36.6 2.8 -7.9 52 52 A L E -AB 43 478A 2 426,-3.6 426,-2.4 -2,-0.5 2,-0.8 -0.877 3.2-167.9 -97.4 115.6 38.4 -0.4 -6.9 53 53 A V E -AB 42 477A 3 -11,-3.0 -11,-2.3 -2,-0.7 2,-0.8 -0.886 9.0-172.4-102.1 99.5 36.0 -3.3 -6.4 54 54 A D E +AB 41 476A 2 422,-3.0 422,-2.4 -2,-0.8 -13,-0.2 -0.846 19.1 161.3 -98.9 107.2 38.2 -5.9 -4.7 55 55 A Y > + 0 0 16 -15,-1.6 3,-1.0 -2,-0.8 -14,-0.2 0.120 41.9 109.0-110.1 20.3 36.3 -9.2 -4.3 56 56 A S T 3 + 0 0 0 -16,-0.4 4,-0.2 1,-0.3 -1,-0.1 0.737 66.2 66.9 -71.8 -23.7 39.3 -11.4 -3.8 57 57 A K T 3 S+ 0 0 2 417,-0.4 417,-1.4 -3,-0.2 -1,-0.3 0.049 82.9 109.2 -86.5 28.0 38.6 -12.0 -0.1 58 58 A N S < S- 0 0 2 -3,-1.0 2,-2.3 415,-0.2 414,-0.1 -0.696 85.7-105.9-100.2 158.1 35.5 -14.0 -1.2 59 59 A L S S+ 0 0 6 -2,-0.3 2,-0.3 264,-0.1 -35,-0.1 -0.438 82.7 111.2 -81.5 67.4 35.0 -17.8 -0.9 60 60 A V - 0 0 0 -2,-2.3 2,-0.3 -4,-0.2 -2,-0.1 -0.953 46.4-164.9-140.7 154.1 35.4 -18.2 -4.7 61 61 A S > - 0 0 24 -2,-0.3 4,-2.4 -37,-0.0 5,-0.2 -0.754 48.1 -90.4-124.5 177.4 37.7 -19.7 -7.3 62 62 A K H > S+ 0 0 135 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.896 128.4 52.3 -53.3 -43.9 38.0 -19.2 -11.0 63 63 A E H > S+ 0 0 111 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.900 108.3 49.5 -61.3 -45.0 35.6 -22.1 -11.5 64 64 A V H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.925 111.9 48.2 -61.4 -46.3 33.0 -20.7 -9.1 65 65 A M H X S+ 0 0 17 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.893 110.8 51.6 -62.9 -40.3 33.1 -17.3 -10.9 66 66 A Q H X S+ 0 0 112 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.910 110.9 47.9 -60.7 -44.8 32.8 -19.0 -14.3 67 67 A M H X S+ 0 0 11 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.889 111.8 50.1 -63.9 -40.3 29.7 -20.9 -13.1 68 68 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.915 111.1 47.7 -65.0 -44.6 28.1 -17.8 -11.6 69 69 A V H X S+ 0 0 15 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.904 111.3 51.4 -63.0 -42.0 28.7 -15.8 -14.9 70 70 A E H X S+ 0 0 97 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.874 108.7 52.1 -60.4 -39.6 27.2 -18.7 -16.9 71 71 A L H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.911 107.0 52.1 -63.2 -44.2 24.2 -18.7 -14.5 72 72 A A H <>S+ 0 0 0 -4,-2.2 5,-2.0 2,-0.2 -2,-0.2 0.904 111.8 46.9 -58.0 -42.4 23.7 -15.0 -15.1 73 73 A K H ><5S+ 0 0 99 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.925 111.2 50.8 -64.8 -45.4 23.7 -15.6 -18.9 74 74 A S H 3<5S+ 0 0 53 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.770 107.2 54.9 -62.5 -29.1 21.3 -18.5 -18.5 75 75 A R T 3<5S- 0 0 38 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.409 115.1-117.0 -87.2 2.0 18.9 -16.4 -16.5 76 76 A G T <>5 + 0 0 31 -3,-1.5 4,-2.2 -4,-0.2 -3,-0.2 0.826 57.3 155.7 69.8 36.5 18.8 -13.7 -19.3 77 77 A V H > S+ 0 0 74 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.927 112.2 45.5 -61.6 -47.3 21.7 -9.0 -20.4 79 79 A A H > S+ 0 0 60 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.896 113.4 50.6 -62.0 -41.7 18.3 -9.1 -22.2 80 80 A A H X S+ 0 0 17 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.904 110.7 49.3 -62.7 -43.2 16.5 -8.0 -19.0 81 81 A R H X S+ 0 0 13 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.933 110.1 50.3 -59.2 -49.1 18.9 -5.1 -18.6 82 82 A D H X S+ 0 0 75 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.874 109.1 52.9 -59.3 -38.1 18.5 -4.0 -22.2 83 83 A N H <>S+ 0 0 73 -4,-2.1 5,-2.1 2,-0.2 4,-0.5 0.869 108.4 49.4 -65.2 -40.1 14.7 -4.1 -21.7 84 84 A M H ><5S+ 0 0 0 -4,-2.0 3,-1.3 1,-0.2 14,-0.3 0.957 112.8 47.4 -60.5 -50.2 14.9 -1.9 -18.6 85 85 A F H 3<5S+ 0 0 28 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.726 109.1 54.7 -65.8 -24.3 17.1 0.6 -20.5 86 86 A S T 3<5S- 0 0 64 -4,-1.4 26,-0.4 -5,-0.2 -1,-0.3 0.484 117.7-105.9 -90.6 -4.2 14.8 0.7 -23.5 87 87 A G T < 5 + 0 0 9 -3,-1.3 27,-0.2 -4,-0.5 -3,-0.2 0.614 61.1 160.3 89.1 13.3 11.6 1.5 -21.6 88 88 A S < - 0 0 45 -5,-2.1 2,-2.2 -6,-0.2 10,-0.6 -0.353 53.9-108.1 -61.4 148.2 10.0 -1.9 -21.7 89 89 A K + 0 0 75 1,-0.2 8,-0.3 8,-0.2 7,-0.2 -0.416 57.3 155.8 -84.2 68.8 7.3 -2.3 -19.0 90 90 A I + 0 0 35 -2,-2.2 2,-1.7 -7,-0.2 -1,-0.2 0.603 53.0 85.6 -75.5 -14.9 9.3 -4.7 -16.9 91 91 A N B >>> +F 96 0B 6 5,-2.1 5,-2.1 -3,-0.2 4,-0.8 -0.702 66.0 176.1 -78.9 83.8 7.4 -3.8 -13.7 92 92 A Y T 345 + 0 0 66 -2,-1.7 -1,-0.2 1,-0.2 -2,-0.1 0.690 64.6 56.4 -77.5 -22.5 4.9 -6.4 -14.8 93 93 A T T 345S+ 0 0 12 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.768 121.2 30.1 -78.5 -24.8 2.5 -6.4 -11.8 94 94 A E T <45S- 0 0 42 -3,-0.5 -2,-0.2 2,-0.1 -1,-0.2 0.431 104.5-126.1-108.3 -2.0 1.9 -2.6 -12.3 95 95 A D T <5 + 0 0 102 -4,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.948 63.2 138.3 48.7 57.0 2.4 -2.5 -16.1 96 96 A R B < -F 91 0B 69 -5,-2.1 -5,-2.1 -7,-0.2 -1,-0.2 -0.942 55.7-119.3-127.8 149.3 5.1 0.2 -15.7 97 97 A A - 0 0 3 -2,-0.3 2,-0.4 -8,-0.3 -8,-0.2 -0.313 22.7-136.1 -70.4 166.8 8.4 1.0 -17.2 98 98 A V + 0 0 5 -10,-0.6 -11,-0.2 -14,-0.3 3,-0.2 -0.892 39.3 154.6-131.7 98.0 11.4 1.2 -14.9 99 99 A L >> + 0 0 0 170,-2.5 3,-1.0 -2,-0.4 4,-1.0 -0.113 22.2 128.1-134.0 39.8 13.4 4.2 -15.9 100 100 A H H 3> S+ 0 0 2 1,-0.2 4,-0.7 169,-0.2 3,-0.4 0.841 80.7 65.0 -57.4 -28.4 15.5 5.7 -13.1 101 101 A V H 34 S+ 0 0 5 1,-0.2 3,-0.4 -3,-0.2 -1,-0.2 0.816 94.9 57.3 -64.5 -28.7 18.3 5.4 -15.7 102 102 A A H X4 S+ 0 0 0 -3,-1.0 3,-1.6 1,-0.2 -1,-0.2 0.859 95.5 65.0 -67.0 -34.3 16.4 8.0 -17.8 103 103 A L H 3< S+ 0 0 4 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.805 114.1 30.7 -58.6 -32.6 16.5 10.5 -15.0 104 104 A R T 3< S+ 0 0 0 -4,-0.7 2,-2.0 -3,-0.4 -1,-0.3 0.055 80.2 135.1-115.0 20.8 20.3 10.7 -15.2 105 105 A N X + 0 0 12 -3,-1.6 3,-1.4 1,-0.2 193,-0.1 -0.505 24.5 173.3 -73.4 81.9 20.6 10.0 -19.0 106 106 A R T 3 S+ 0 0 78 -2,-2.0 -1,-0.2 1,-0.3 192,-0.1 0.711 71.9 64.1 -66.0 -23.5 23.2 12.8 -19.6 107 107 A S T 3 S- 0 0 64 -3,-0.1 -1,-0.3 2,-0.1 -2,-0.1 0.704 94.5-143.6 -71.1 -22.7 23.6 11.6 -23.2 108 108 A N < + 0 0 78 -3,-1.4 -2,-0.1 1,-0.2 3,-0.1 0.602 38.3 161.9 61.7 16.2 20.0 12.5 -23.9 109 109 A T - 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0 0 6 -4,-1.4 4,-1.6 -5,-0.4 -1,-0.2 0.126 29.7 -87.9 91.7 151.4 20.0 16.8 35.4 848 290 B F H > S+ 0 0 15 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.834 122.3 60.4 -65.6 -34.5 21.1 14.5 38.2 849 291 B D H > S+ 0 0 109 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.933 107.8 45.0 -56.7 -47.9 17.5 14.0 39.5 850 292 B H H > S+ 0 0 48 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.844 110.3 55.2 -66.8 -34.2 16.5 12.5 36.1 851 293 B F H X S+ 0 0 1 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.905 106.7 50.4 -63.0 -42.3 19.6 10.4 36.0 852 294 B E H X S+ 0 0 49 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.858 108.3 53.2 -62.7 -36.4 18.7 9.0 39.5 853 295 B Q H X S+ 0 0 78 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.898 106.9 52.0 -63.9 -41.9 15.2 8.2 38.0 854 296 B L H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.935 111.8 46.3 -57.1 -49.2 16.9 6.4 35.2 855 297 B L H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.886 110.4 54.0 -58.9 -42.0 18.9 4.3 37.7 856 298 B S H X S+ 0 0 36 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.855 105.6 52.3 -64.9 -36.9 15.8 3.7 39.8 857 299 B G H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.918 110.5 47.9 -64.2 -44.6 13.9 2.3 36.8 858 300 B A H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.904 110.2 53.1 -59.8 -42.6 16.8 -0.1 36.1 859 301 B H H X S+ 0 0 28 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.885 105.6 53.8 -60.9 -40.4 16.7 -1.1 39.8 860 302 B W H X S+ 0 0 64 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.936 111.3 45.0 -58.2 -47.3 13.0 -1.8 39.6 861 303 B M H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.834 109.1 56.6 -68.3 -33.4 13.6 -4.2 36.7 862 304 B D H X S+ 0 0 1 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.918 109.9 45.5 -60.4 -45.6 16.6 -5.7 38.5 863 305 B Q H X S+ 0 0 60 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.894 111.1 52.5 -66.2 -40.9 14.3 -6.6 41.4 864 306 B H H X S+ 0 0 15 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.949 112.2 46.0 -56.1 -49.3 11.7 -7.9 39.0 865 307 B F H < S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.888 116.4 45.8 -60.1 -42.0 14.3 -10.1 37.5 866 308 B L H < S+ 0 0 49 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.856 121.4 32.4 -70.6 -38.0 15.6 -11.3 40.9 867 309 B K H < S+ 0 0 153 -4,-2.5 -2,-0.2 -5,-0.1 -1,-0.2 0.636 93.7 95.9-100.7 -18.2 12.3 -12.0 42.7 868 310 B T S < S- 0 0 21 -4,-1.8 5,-0.1 -5,-0.3 -4,-0.0 -0.621 77.6-111.4 -90.2 130.8 9.9 -13.2 40.0 869 311 B P > - 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0 0 53 -3,-0.8 2,-0.6 -4,-0.2 -3,-0.0 -0.398 60.6-136.3 -63.6 128.9 45.2 12.7 -7.4 1114 556 B K 0 0 204 -2,-0.2 -1,-0.1 -1065,-0.0 -1065,-0.1 -0.806 360.0 360.0 -93.6 118.6 43.5 16.0 -7.8 1115 557 B L 0 0 98 -2,-0.6 -1067,-0.1 -1067,-0.1 -1066,-0.0 -0.898 360.0 360.0-106.2 360.0 39.8 15.8 -8.6