==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 07-MAY-07 2Z0Q . COMPND 2 MOLECULE: RHO GUANINE NUCLEOTIDE EXCHANGE FACTOR 3; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR K.MURAYAMA,M.KATO-MURAYAMA,T.TERADA,M.SHIROUZU,S.YOKOYAMA,RI . 321 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17769.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 240 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 12.1 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 139 43.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 3 0 1 1 1 0 0 0 0 0 0 1 0 0 2 1 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 0 1 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 0 2 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 1 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 4 A Q 0 0 236 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -96.3 56.2 66.0 -8.4 2 5 A V - 0 0 94 1,-0.1 2,-0.5 0, 0.0 0, 0.0 -0.533 360.0-122.5 -70.5 135.7 58.7 66.4 -5.6 3 6 A L - 0 0 127 -2,-0.2 2,-0.3 4,-0.0 -1,-0.1 -0.709 36.7-162.0 -77.3 125.3 60.2 63.1 -4.6 4 7 A T > - 0 0 58 -2,-0.5 4,-1.8 1,-0.1 5,-0.2 -0.765 32.3-122.7-111.1 160.8 59.4 62.7 -0.9 5 8 A A H > S+ 0 0 70 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.889 116.5 57.9 -62.6 -37.5 60.9 60.5 1.8 6 9 A K H > S+ 0 0 93 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.902 103.6 50.6 -59.2 -41.7 57.3 59.2 2.3 7 10 A E H > S+ 0 0 47 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.877 108.9 50.9 -67.3 -37.0 57.1 58.1 -1.4 8 11 A I H X S+ 0 0 83 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.931 110.9 49.6 -65.7 -40.0 60.4 56.2 -1.1 9 12 A K H X S+ 0 0 101 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.866 109.0 52.5 -64.3 -34.4 59.0 54.5 2.0 10 13 A R H X S+ 0 0 10 -4,-2.1 4,-2.1 141,-0.3 -2,-0.2 0.932 109.9 47.8 -66.8 -43.6 55.8 53.7 0.0 11 14 A Q H X S+ 0 0 40 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.894 111.3 51.5 -65.1 -38.0 57.9 52.1 -2.8 12 15 A E H X S+ 0 0 108 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.946 109.3 50.1 -60.5 -46.4 59.9 50.2 -0.2 13 16 A A H X S+ 0 0 4 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.880 112.0 47.4 -61.6 -37.7 56.6 48.9 1.4 14 17 A I H X S+ 0 0 6 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.910 112.8 47.9 -70.7 -41.5 55.2 47.7 -2.0 15 18 A F H X S+ 0 0 90 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.932 110.3 53.0 -64.6 -41.9 58.5 46.0 -3.0 16 19 A E H X S+ 0 0 89 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.865 103.3 57.9 -60.2 -41.7 58.6 44.3 0.5 17 20 A L H X S+ 0 0 1 -4,-1.7 4,-1.2 -5,-0.2 3,-0.2 0.954 110.3 42.3 -54.8 -50.2 55.1 43.0 0.0 18 21 A S H X S+ 0 0 3 -4,-1.8 4,-2.5 1,-0.2 3,-0.3 0.895 109.5 57.5 -69.7 -34.0 56.0 41.2 -3.2 19 22 A Q H X S+ 0 0 84 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.873 104.3 53.8 -63.2 -31.7 59.3 39.9 -1.8 20 23 A G H X S+ 0 0 11 -4,-1.9 4,-2.1 -3,-0.2 -1,-0.2 0.828 106.7 50.6 -70.1 -31.9 57.3 38.2 1.0 21 24 A E H X S+ 0 0 0 -4,-1.2 4,-2.8 -3,-0.3 5,-0.2 0.934 111.6 49.0 -66.8 -46.7 55.1 36.4 -1.5 22 25 A E H X S+ 0 0 111 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.920 111.5 49.0 -58.3 -46.0 58.3 35.3 -3.3 23 26 A D H X S+ 0 0 83 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.874 111.8 48.8 -60.7 -43.7 59.8 34.1 0.1 24 27 A L H X S+ 0 0 9 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.943 112.1 47.6 -63.5 -46.5 56.6 32.2 1.0 25 28 A I H X S+ 0 0 12 -4,-2.8 4,-2.4 1,-0.2 5,-0.2 0.934 113.1 50.1 -60.2 -46.1 56.4 30.4 -2.4 26 29 A E H X S+ 0 0 118 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.891 112.2 46.1 -60.6 -42.1 60.1 29.5 -2.2 27 30 A D H X S+ 0 0 64 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.890 112.9 48.7 -72.0 -37.9 59.7 28.1 1.3 28 31 A L H X S+ 0 0 3 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.868 112.7 48.1 -69.1 -35.2 56.6 26.1 0.5 29 32 A K H X S+ 0 0 102 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.911 112.2 51.1 -68.6 -38.1 58.2 24.6 -2.7 30 33 A L H X S+ 0 0 96 -4,-1.9 4,-3.3 -5,-0.2 5,-0.5 0.850 103.7 57.1 -64.3 -39.1 61.3 23.8 -0.6 31 34 A A H X>S+ 0 0 4 -4,-2.1 4,-2.0 1,-0.2 5,-1.6 0.949 111.6 43.2 -57.1 -49.1 59.2 22.0 2.0 32 35 A K H <>S+ 0 0 76 -4,-1.6 5,-3.3 3,-0.2 -2,-0.2 0.881 118.9 43.3 -65.6 -40.6 57.9 19.7 -0.7 33 36 A K H <5S+ 0 0 146 -4,-2.4 -2,-0.2 3,-0.2 -1,-0.2 0.882 123.0 33.3 -74.8 -40.8 61.3 19.2 -2.3 34 37 A A H <5S+ 0 0 50 -4,-3.3 -3,-0.2 -5,-0.1 -2,-0.2 0.758 135.7 17.5 -88.5 -25.3 63.5 18.7 0.8 35 38 A Y T X5S+ 0 0 61 -4,-2.0 4,-1.9 -5,-0.5 -3,-0.2 0.815 125.7 38.3-111.1 -60.2 60.9 17.0 3.0 36 39 A H H > S+ 0 0 43 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.865 112.9 46.3 -61.4 -41.2 62.6 12.7 -0.2 39 42 A X H <>S+ 0 0 10 -4,-1.9 5,-2.4 2,-0.2 6,-0.5 0.825 110.9 54.3 -72.9 -30.6 60.5 11.0 2.5 40 43 A L H ><5S+ 0 0 79 -4,-2.2 3,-1.2 3,-0.2 -1,-0.2 0.935 107.8 48.5 -66.7 -47.9 58.2 9.6 -0.2 41 44 A K H 3<5S+ 0 0 149 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.773 120.6 37.9 -63.4 -28.2 61.1 8.0 -2.1 42 45 A L T 3<5S- 0 0 120 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.211 106.3-125.7-107.8 10.7 62.4 6.5 1.1 43 46 A S T < 5 + 0 0 75 -3,-1.2 -3,-0.2 1,-0.1 -4,-0.1 0.801 53.3 155.1 48.7 38.0 59.1 5.6 2.6 44 47 A I S - 0 0 55 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.219 35.1-114.2 -70.4 163.6 53.1 6.5 4.7 47 50 A E H > S+ 0 0 135 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.896 121.3 54.3 -63.4 -35.7 51.7 8.1 1.6 48 51 A Q H > S+ 0 0 128 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.979 109.1 45.0 -58.7 -59.0 48.7 8.8 3.8 49 52 A E H 4 S+ 0 0 42 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.795 114.9 47.6 -54.4 -38.6 50.7 10.6 6.5 50 53 A L H >X>S+ 0 0 3 -4,-2.2 4,-2.6 2,-0.2 3,-0.7 0.840 109.9 52.7 -74.0 -36.4 52.7 12.7 4.0 51 54 A N H 3X5S+ 0 0 92 -4,-2.2 4,-1.4 1,-0.2 5,-0.3 0.878 107.2 53.5 -66.1 -36.0 49.6 13.6 2.1 52 55 A Q H 3<5S+ 0 0 90 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.610 115.1 40.9 -73.7 -12.6 48.1 14.8 5.3 53 56 A I H <45S+ 0 0 6 -3,-0.7 4,-0.2 -4,-0.3 -2,-0.2 0.834 132.4 15.0-103.2 -42.3 51.2 17.0 6.0 54 57 A F H X5S+ 0 0 1 -4,-2.6 4,-1.2 2,-0.1 -3,-0.2 0.507 100.8 93.8-110.9 -7.4 52.1 18.6 2.6 55 58 A G T <> S+ 0 0 33 -5,-0.3 3,-2.8 1,-0.2 4,-0.9 0.846 101.9 70.7 -78.0 -31.2 47.1 21.1 1.4 57 60 A L H >> S+ 0 0 5 1,-0.3 4,-1.3 -4,-0.2 3,-0.9 0.854 92.7 61.7 -51.1 -36.9 50.2 23.4 1.1 58 61 A D H 3< S+ 0 0 65 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.597 97.2 56.3 -67.4 -13.3 50.1 22.7 -2.6 59 62 A S H <4 S+ 0 0 58 -3,-2.8 4,-0.4 -4,-0.1 -1,-0.3 0.729 107.4 50.4 -88.8 -20.6 46.7 24.2 -3.0 60 63 A L H XX S+ 0 0 0 -4,-0.9 4,-1.3 -3,-0.9 3,-0.6 0.782 91.4 73.9 -85.6 -28.2 48.0 27.5 -1.4 61 64 A I H 3X S+ 0 0 11 -4,-1.3 4,-2.3 1,-0.2 3,-0.4 0.911 93.5 53.5 -53.2 -46.7 51.1 28.0 -3.6 62 65 A P H 3> S+ 0 0 65 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.839 102.2 60.2 -60.0 -31.1 49.1 29.1 -6.7 63 66 A L H <> S+ 0 0 24 -3,-0.6 4,-1.6 -4,-0.4 -2,-0.2 0.903 110.5 39.6 -61.0 -44.6 47.3 31.8 -4.6 64 67 A H H X S+ 0 0 0 -4,-1.3 4,-3.2 -3,-0.4 5,-0.2 0.865 111.9 56.2 -75.0 -36.1 50.5 33.5 -3.8 65 68 A E H X S+ 0 0 78 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.908 107.4 51.6 -62.9 -37.8 52.0 33.0 -7.3 66 69 A E H X S+ 0 0 95 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.925 111.2 45.6 -65.1 -43.7 48.9 34.7 -8.6 67 70 A L H X S+ 0 0 0 -4,-1.6 4,-2.5 1,-0.2 5,-0.3 0.957 114.3 48.5 -65.1 -47.3 49.4 37.7 -6.3 68 71 A L H X S+ 0 0 39 -4,-3.2 4,-2.5 1,-0.2 5,-0.2 0.923 109.5 52.6 -55.7 -46.3 53.1 37.9 -7.1 69 72 A S H X S+ 0 0 69 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.908 111.2 47.0 -57.6 -43.4 52.5 37.7 -10.8 70 73 A Q H X S+ 0 0 58 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.893 112.2 48.3 -67.4 -41.2 50.0 40.6 -10.7 71 74 A L H X S+ 0 0 5 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.876 114.3 48.2 -66.2 -34.5 52.3 42.8 -8.5 72 75 A R H >< S+ 0 0 186 -4,-2.5 3,-1.2 -5,-0.3 -2,-0.2 0.943 108.9 53.6 -69.7 -45.3 55.1 42.1 -10.9 73 76 A D H 3< S+ 0 0 134 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.775 104.7 53.8 -60.4 -32.5 53.0 42.9 -13.9 74 77 A V H 3< S+ 0 0 50 -4,-1.5 8,-0.4 -5,-0.1 -1,-0.3 0.635 81.7 111.5 -81.5 -14.0 51.9 46.3 -12.7 75 78 A R << - 0 0 71 -3,-1.2 6,-0.2 -4,-0.6 5,-0.1 -0.298 69.7-121.9 -61.7 143.1 55.5 47.6 -12.1 76 79 A K > - 0 0 103 4,-3.2 3,-2.5 1,-0.1 -1,-0.1 -0.308 35.7 -93.7 -77.0 167.9 56.6 50.3 -14.5 77 80 A P T 3 S+ 0 0 148 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.748 127.0 58.3 -54.2 -28.2 59.8 49.8 -16.6 78 81 A D T 3 S- 0 0 122 2,-0.1 3,-0.1 1,-0.0 -3,-0.0 0.361 120.4-107.7 -87.2 6.5 61.8 51.5 -13.8 79 82 A G S < S+ 0 0 38 -3,-2.5 2,-0.1 1,-0.3 -4,-0.1 0.300 79.4 123.5 89.7 -8.7 60.7 49.0 -11.2 80 83 A S - 0 0 27 -5,-0.1 -4,-3.2 -6,-0.0 2,-0.4 -0.376 51.4-138.0 -85.2 164.4 58.3 51.4 -9.3 81 84 A T - 0 0 4 -6,-0.2 3,-0.1 1,-0.1 -6,-0.1 -0.986 13.1-170.0-127.6 130.7 54.6 50.8 -8.7 82 85 A E S S+ 0 0 102 -2,-0.4 2,-0.4 -8,-0.4 -1,-0.1 0.958 75.3 6.3 -79.5 -58.6 51.8 53.4 -8.9 83 86 A H + 0 0 55 -9,-0.1 -1,-0.3 1,-0.1 4,-0.1 -0.997 43.8 167.9-133.8 137.3 48.9 51.5 -7.4 84 87 A V > + 0 0 0 -2,-0.4 4,-2.1 -3,-0.1 5,-0.2 0.413 64.4 90.3-117.2 -8.5 48.5 48.2 -5.6 85 88 A G H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.931 85.1 46.1 -56.6 -58.5 45.0 48.7 -4.2 86 89 A P H > S+ 0 0 76 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.892 113.0 51.7 -53.3 -43.4 42.9 47.3 -7.1 87 90 A I H > S+ 0 0 27 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.924 111.6 45.6 -62.0 -45.3 45.1 44.2 -7.3 88 91 A L H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 3,-0.2 0.951 112.7 49.9 -64.6 -48.7 44.8 43.4 -3.6 89 92 A V H < S+ 0 0 35 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.905 114.0 45.8 -58.0 -40.7 41.1 44.0 -3.4 90 93 A G H < S+ 0 0 59 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.798 114.8 47.6 -72.8 -26.6 40.6 41.7 -6.4 91 94 A W H >< S+ 0 0 10 -4,-1.7 3,-2.2 -3,-0.2 4,-0.3 0.843 89.3 83.2 -82.5 -33.4 42.9 39.0 -5.1 92 95 A L G >< S+ 0 0 9 -4,-2.5 3,-2.1 1,-0.3 -1,-0.2 0.733 76.7 67.7 -41.6 -41.9 41.5 38.8 -1.5 93 96 A P G > S+ 0 0 93 0, 0.0 3,-1.6 0, 0.0 -1,-0.3 0.797 89.1 67.0 -55.3 -26.2 38.6 36.5 -2.3 94 97 A C G X S+ 0 0 36 -3,-2.2 3,-1.7 1,-0.3 -2,-0.2 0.692 80.0 79.6 -70.7 -13.9 41.1 33.6 -3.0 95 98 A L G X + 0 0 1 -3,-2.1 3,-1.9 -4,-0.3 4,-0.5 0.560 65.1 91.3 -68.4 -5.3 42.1 33.7 0.7 96 99 A S G X> S+ 0 0 88 -3,-1.6 3,-1.5 1,-0.3 4,-0.7 0.844 74.8 67.5 -58.5 -28.8 38.9 31.7 1.3 97 100 A S H <> S+ 0 0 44 -3,-1.7 4,-2.1 1,-0.3 -1,-0.3 0.738 84.9 69.7 -63.7 -20.2 41.2 28.6 0.8 98 101 A Y H <> S+ 0 0 0 -3,-1.9 4,-3.0 1,-0.2 -1,-0.3 0.789 90.6 62.2 -68.3 -22.6 43.0 29.5 4.1 99 102 A D H <> S+ 0 0 61 -3,-1.5 4,-1.5 -4,-0.5 -1,-0.2 0.972 106.6 42.4 -63.2 -52.4 39.8 28.5 5.9 100 103 A S H X S+ 0 0 72 -4,-0.7 4,-1.1 1,-0.2 -2,-0.2 0.931 117.6 48.6 -58.3 -48.7 40.1 24.9 4.7 101 104 A Y H >X S+ 0 0 3 -4,-2.1 3,-0.8 1,-0.2 4,-0.6 0.937 110.4 47.0 -59.8 -54.2 43.8 24.9 5.3 102 105 A C H 3< S+ 0 0 2 -4,-3.0 4,-0.4 1,-0.2 3,-0.3 0.785 107.7 59.4 -62.7 -23.9 43.8 26.3 8.8 103 106 A S H 3< S+ 0 0 62 -4,-1.5 3,-0.3 -5,-0.2 4,-0.3 0.783 107.9 43.3 -75.2 -27.5 41.0 23.9 9.8 104 107 A N H S+ 0 0 17 -4,-0.4 4,-2.6 -3,-0.3 5,-0.2 0.917 104.9 48.8 -60.3 -43.0 45.4 20.6 14.0 107 110 A A H > S+ 0 0 23 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.921 113.8 47.2 -62.2 -41.4 45.4 17.0 12.7 108 111 A A H X S+ 0 0 2 -4,-1.6 4,-2.7 1,-0.2 -2,-0.2 0.908 113.7 46.8 -66.1 -42.6 48.7 17.6 10.8 109 112 A K H X S+ 0 0 79 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.889 110.9 52.2 -67.4 -38.3 50.3 19.1 13.9 110 113 A A H X S+ 0 0 1 -4,-2.6 4,-1.5 -5,-0.3 -2,-0.2 0.927 112.8 45.0 -63.2 -44.7 49.1 16.3 16.1 111 114 A L H X S+ 0 0 22 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.929 112.5 51.5 -63.6 -45.0 50.5 13.8 13.8 112 115 A L H X S+ 0 0 6 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.882 105.7 54.7 -61.1 -39.2 53.8 15.7 13.5 113 116 A D H < S+ 0 0 48 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.867 110.4 47.5 -62.6 -35.1 54.1 15.9 17.3 114 117 A H H >< S+ 0 0 52 -4,-1.5 3,-1.7 1,-0.2 4,-0.3 0.923 105.9 57.8 -72.2 -41.2 53.8 12.1 17.4 115 118 A K H >< S+ 0 0 23 -4,-2.4 3,-1.2 1,-0.3 7,-0.3 0.719 86.8 74.1 -61.6 -25.7 56.4 11.6 14.6 116 119 A K T 3< S+ 0 0 87 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.1 0.564 93.0 59.9 -67.8 -1.0 59.2 13.4 16.3 117 120 A Q T < S+ 0 0 121 -3,-1.7 -1,-0.3 -4,-0.1 -2,-0.2 0.728 84.1 93.5 -91.7 -29.6 59.2 10.2 18.5 118 121 A D <> - 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