==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 30-JAN-08 2RNN . COMPND 2 MOLECULE: E3 SUMO-PROTEIN LIGASE SIZ1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR R.SUZUKI,H.SHINDO,A.TASE,T.YAMAZAKI . 114 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9301.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 71 62.3 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 . 0 0.0 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 . 0 0.0 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 . 1 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 47.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.8 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 0 0 0 0 0 0 2 0 0 0 2 0 1 0 0 0 0 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 G 0 0 78 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-139.8 2.1 0.0 -1.2 2 -2 A S + 0 0 97 2,-0.1 3,-0.4 3,-0.1 5,-0.1 0.354 360.0 84.3-125.4 -2.1 4.1 2.9 -2.7 3 -1 A H S S+ 0 0 197 1,-0.2 -1,-0.0 3,-0.0 3,-0.0 0.448 107.2 28.5 -81.2 -0.2 1.2 5.0 -4.0 4 1 A M S S+ 0 0 158 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 0.182 125.8 37.7-142.0 12.7 0.9 6.5 -0.6 5 2 A I - 0 0 73 -3,-0.4 2,-0.2 5,-0.0 5,-0.1 -0.671 62.6-141.9-144.1-161.8 4.5 6.2 0.7 6 3 A N > - 0 0 76 -2,-0.2 3,-1.3 -5,-0.1 -3,-0.0 -0.842 19.7-136.8-175.5 136.1 8.1 6.5 -0.3 7 4 A L G > S+ 0 0 122 1,-0.3 3,-0.7 -2,-0.2 4,-0.1 0.840 112.8 48.0 -65.8 -33.5 11.4 4.7 0.4 8 5 A E G 3 S+ 0 0 153 1,-0.2 -1,-0.3 2,-0.1 0, 0.0 0.266 120.3 39.4 -90.2 11.2 13.1 8.1 0.7 9 6 A D G < S+ 0 0 119 -3,-1.3 -1,-0.2 4,-0.0 -2,-0.2 0.000 121.2 37.0-147.6 30.4 10.4 9.3 3.0 10 7 A Y S < S+ 0 0 168 -3,-0.7 -2,-0.1 -5,-0.1 3,-0.1 0.125 80.0 99.6-172.2 31.0 9.6 6.3 5.2 11 8 A W S S- 0 0 199 1,-0.4 2,-0.2 -4,-0.1 -3,-0.1 0.630 98.4 -10.1 -98.7 -19.3 12.9 4.6 5.9 12 9 A E + 0 0 166 1,-0.1 -1,-0.4 2,-0.0 -2,-0.0 -0.807 48.2 163.6-179.5 136.1 13.4 6.1 9.4 13 10 A D - 0 0 123 -2,-0.2 -1,-0.1 -3,-0.1 -4,-0.0 0.134 57.9-112.6-144.6 17.5 11.8 8.8 11.5 14 11 A E - 0 0 196 1,-0.1 -2,-0.0 2,-0.0 0, 0.0 0.793 51.6-170.4 51.2 29.0 13.1 8.0 15.0 15 12 A T - 0 0 108 1,-0.1 -1,-0.1 2,-0.0 -2,-0.1 -0.093 20.1-108.3 -50.1 147.1 9.5 7.2 15.8 16 13 A P - 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.019 21.8-114.0 -69.7 178.8 8.8 6.5 19.5 17 14 A G + 0 0 78 2,-0.0 -2,-0.0 0, 0.0 0, 0.0 -0.548 44.7 171.5-119.5 67.2 8.0 3.2 21.1 18 15 A P - 0 0 66 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.168 25.5-161.7 -69.7 166.5 4.4 3.4 22.3 19 16 A D S S+ 0 0 97 61,-0.0 59,-0.6 3,-0.0 61,-0.5 0.132 82.9 57.5-135.8 16.8 2.3 0.5 23.6 20 17 A R S S+ 0 0 191 57,-0.1 55,-0.0 58,-0.1 0, 0.0 0.619 87.9 77.4-118.3 -28.8 -1.2 1.9 23.3 21 18 A E S S- 0 0 127 56,-0.1 -1,-0.1 1,-0.0 2,-0.1 -0.771 79.3-129.8 -91.8 122.6 -1.4 2.7 19.6 22 19 A P - 0 0 94 0, 0.0 2,-0.4 0, 0.0 3,-0.1 -0.374 17.6-142.1 -69.7 145.7 -1.9 -0.3 17.3 23 20 A T > - 0 0 59 1,-0.1 4,-2.4 -2,-0.1 5,-0.4 -0.910 14.4-132.6-114.2 138.4 0.4 -0.8 14.3 24 21 A N H > S+ 0 0 113 -2,-0.4 4,-2.1 1,-0.3 5,-0.2 0.890 112.9 48.1 -50.9 -43.8 -0.7 -2.1 10.9 25 22 A E H > S+ 0 0 136 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.837 108.8 55.6 -67.2 -33.2 2.3 -4.5 11.0 26 23 A L H > S+ 0 0 62 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.961 114.7 36.0 -64.1 -53.4 1.3 -5.6 14.5 27 24 A R H X S+ 0 0 135 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.813 120.0 51.8 -70.0 -30.7 -2.2 -6.6 13.6 28 25 A N H X S+ 0 0 88 -4,-2.1 4,-2.4 -5,-0.4 5,-0.2 0.937 113.6 41.2 -71.2 -48.6 -1.1 -7.9 10.2 29 26 A E H X S+ 0 0 110 -4,-3.1 4,-2.4 2,-0.2 -2,-0.2 0.889 118.6 47.3 -66.7 -40.2 1.7 -10.1 11.6 30 27 A V H X S+ 0 0 3 -4,-2.2 4,-2.5 -5,-0.3 5,-0.2 0.909 112.7 48.7 -67.9 -43.3 -0.4 -11.3 14.4 31 28 A E H X S+ 0 0 113 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.942 115.4 43.2 -62.2 -49.6 -3.4 -12.0 12.2 32 29 A E H X S+ 0 0 103 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.927 113.9 51.1 -62.7 -46.6 -1.3 -13.9 9.7 33 30 A T H X S+ 0 0 24 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.911 112.6 46.0 -57.6 -45.1 0.6 -15.8 12.4 34 31 A I H X S+ 0 0 12 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.867 112.8 50.9 -66.6 -37.2 -2.7 -16.8 14.1 35 32 A T H < S+ 0 0 79 -4,-2.2 4,-0.3 -5,-0.2 -2,-0.2 0.909 117.2 38.4 -67.1 -43.4 -4.2 -17.9 10.8 36 33 A L H >< S+ 0 0 115 -4,-2.8 3,-1.0 1,-0.2 -2,-0.2 0.886 119.4 46.9 -74.6 -40.5 -1.2 -20.0 9.8 37 34 A M H >< S+ 0 0 3 -4,-3.0 3,-2.1 -5,-0.3 -2,-0.2 0.736 93.1 79.9 -72.8 -22.8 -0.7 -21.3 13.4 38 35 A E T 3< S+ 0 0 99 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.745 87.0 60.0 -55.9 -22.9 -4.4 -22.0 13.6 39 36 A L T < S+ 0 0 150 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.1 0.053 80.4 151.4 -94.1 25.0 -3.6 -25.2 11.6 40 37 A L < - 0 0 22 -3,-2.1 2,-0.3 1,-0.1 24,-0.1 -0.121 29.8-151.5 -54.6 153.2 -1.2 -26.4 14.4 41 38 A K > - 0 0 103 1,-0.0 4,-3.3 23,-0.0 5,-0.3 -0.781 32.4 -94.8-125.4 169.8 -0.8 -30.1 14.7 42 39 A V H > S+ 0 0 84 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.863 125.7 52.4 -50.4 -39.5 0.0 -32.6 17.5 43 40 A S H > S+ 0 0 64 2,-0.2 4,-2.3 3,-0.2 -1,-0.2 0.948 114.8 39.5 -63.5 -50.5 3.7 -32.4 16.4 44 41 A E H > S+ 0 0 15 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.964 115.8 50.4 -64.2 -54.1 3.8 -28.6 16.5 45 42 A L H X S+ 0 0 6 -4,-3.3 4,-2.7 1,-0.2 5,-0.2 0.908 113.6 46.6 -50.6 -47.3 1.7 -28.2 19.7 46 43 A K H X S+ 0 0 129 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.922 109.5 54.2 -62.4 -45.8 4.0 -30.8 21.5 47 44 A D H X S+ 0 0 45 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.931 113.2 42.3 -54.2 -50.2 7.1 -29.1 20.2 48 45 A I H X S+ 0 0 4 -4,-2.6 4,-3.1 1,-0.2 6,-0.4 0.957 111.9 52.7 -62.6 -52.9 6.1 -25.8 21.7 49 46 A C H <>S+ 0 0 4 -4,-2.7 5,-0.7 -5,-0.2 -1,-0.2 0.826 113.4 47.1 -52.5 -33.5 4.8 -27.2 24.9 50 47 A R H ><5S+ 0 0 184 -4,-2.2 3,-0.5 3,-0.2 -1,-0.2 0.941 112.6 46.1 -74.6 -50.4 8.2 -28.9 25.3 51 48 A S H 3<5S+ 0 0 14 -4,-2.6 53,-0.7 1,-0.3 -2,-0.2 0.942 119.7 40.1 -57.8 -50.8 10.3 -25.8 24.5 52 49 A V T 3<5S- 0 0 17 -4,-3.1 -1,-0.3 -5,-0.2 -2,-0.2 0.540 107.2-130.1 -76.1 -6.2 8.3 -23.6 26.7 53 50 A S T < 5 + 0 0 101 -3,-0.5 -3,-0.2 -5,-0.4 -4,-0.1 0.674 53.2 159.5 64.4 15.9 8.1 -26.4 29.2 54 51 A F < - 0 0 76 -5,-0.7 2,-0.7 -6,-0.4 -1,-0.2 -0.216 53.8 -83.4 -67.6 160.0 4.4 -25.8 29.4 55 52 A P > - 0 0 96 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 -0.536 42.0-179.1 -69.7 107.5 1.9 -28.5 30.6 56 53 A V T 3 + 0 0 72 -2,-0.7 7,-0.1 1,-0.2 -6,-0.1 0.064 56.2 103.3 -94.8 24.1 1.2 -30.7 27.6 57 54 A S T 3 S+ 0 0 122 2,-0.1 -1,-0.2 0, 0.0 -3,-0.0 0.629 72.6 66.8 -79.5 -14.2 -1.2 -32.8 29.7 58 55 A G S < S- 0 0 37 -3,-0.6 2,-0.3 1,-0.2 -2,-0.1 0.548 92.7 -89.8 -77.4-131.9 -4.1 -31.1 28.0 59 56 A R > - 0 0 171 1,-0.0 4,-2.5 -14,-0.0 3,-0.3 -0.876 35.7 -89.6-142.4 173.8 -5.0 -31.5 24.4 60 57 A K H > S+ 0 0 134 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.844 126.5 53.9 -54.5 -35.4 -4.4 -30.0 20.9 61 58 A A H > S+ 0 0 34 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.901 108.3 48.0 -66.8 -42.2 -7.3 -27.7 21.6 62 59 A V H > S+ 0 0 57 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.924 115.1 44.8 -64.7 -46.0 -5.9 -26.5 24.9 63 60 A L H X S+ 0 0 15 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.966 116.0 44.6 -62.8 -55.1 -2.5 -25.8 23.4 64 61 A Q H X S+ 0 0 45 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.834 113.6 53.3 -58.9 -33.2 -3.7 -24.1 20.3 65 62 A D H X S+ 0 0 60 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.895 108.8 48.0 -69.4 -41.4 -6.2 -22.1 22.5 66 63 A L H X S+ 0 0 69 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.941 116.4 42.4 -64.8 -49.0 -3.4 -20.9 24.8 67 64 A I H X S+ 0 0 19 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.945 114.8 50.0 -63.2 -50.2 -1.1 -19.8 21.9 68 65 A R H X S+ 0 0 71 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.925 113.7 45.5 -54.6 -48.6 -3.9 -18.3 19.9 69 66 A N H X S+ 0 0 70 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.852 109.8 57.0 -64.4 -35.3 -5.2 -16.3 22.9 70 67 A F H X S+ 0 0 54 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.957 113.8 36.3 -60.8 -53.3 -1.6 -15.3 23.8 71 68 A L H < S+ 0 0 0 -4,-2.5 4,-0.4 2,-0.2 -2,-0.2 0.871 118.3 52.3 -68.3 -37.7 -1.0 -13.7 20.4 72 69 A Q H >< S+ 0 0 75 -4,-2.6 3,-0.5 -5,-0.3 -2,-0.2 0.882 117.3 37.7 -65.9 -39.3 -4.6 -12.4 20.2 73 70 A N H >< S+ 0 0 86 -4,-2.8 3,-0.8 1,-0.2 -1,-0.2 0.627 95.1 85.8 -86.2 -15.3 -4.2 -10.8 23.6 74 71 A A T 3< S+ 0 0 4 -4,-1.3 7,-2.6 1,-0.3 2,-0.2 0.719 93.1 48.5 -57.4 -20.3 -0.6 -9.8 23.0 75 72 A L T < S+ 0 0 57 -3,-0.5 2,-0.4 -4,-0.4 -1,-0.3 -0.520 80.5 142.2-120.9 63.4 -2.1 -6.7 21.3 76 73 A V X - 0 0 51 -3,-0.8 3,-1.7 3,-0.3 2,-0.2 -0.865 62.6 -95.6-108.0 138.6 -4.7 -5.4 23.9 77 74 A V T 3 S- 0 0 132 -2,-0.4 -57,-0.1 1,-0.3 -56,-0.1 -0.281 112.1 -0.4 -51.6 112.0 -5.3 -1.8 24.7 78 75 A G T 3 S+ 0 0 64 -59,-0.6 -1,-0.3 -2,-0.2 -58,-0.1 0.897 125.5 73.4 72.4 41.2 -3.1 -1.0 27.7 79 76 A K < + 0 0 143 -3,-1.7 -3,-0.3 -60,-0.5 -2,-0.2 0.111 61.4 173.4-171.9 33.0 -1.7 -4.5 27.9 80 77 A S + 0 0 30 -61,-0.5 -5,-0.2 -5,-0.2 -6,-0.1 -0.090 4.5 176.8 -50.5 149.9 0.8 -5.0 25.1 81 78 A D >> + 0 0 58 -7,-2.6 4,-0.7 -10,-0.1 3,-0.5 -0.428 15.5 162.6-161.1 75.4 2.8 -8.2 25.1 82 79 A P H 3> + 0 0 63 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.682 67.0 82.5 -69.8 -18.1 5.1 -8.8 22.1 83 80 A Y H 3> S+ 0 0 89 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.938 93.6 43.5 -51.4 -53.7 7.0 -11.4 24.1 84 81 A R H <> S+ 0 0 71 -3,-0.5 4,-3.0 1,-0.2 5,-0.3 0.830 110.5 59.1 -62.6 -32.4 4.4 -14.1 23.3 85 82 A V H X S+ 0 0 34 -4,-0.7 4,-2.5 2,-0.2 -2,-0.2 0.961 111.0 37.7 -61.4 -54.3 4.4 -12.8 19.7 86 83 A Q H X S+ 0 0 43 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.876 117.6 52.7 -65.8 -38.5 8.1 -13.4 19.1 87 84 A A H X S+ 0 0 9 -4,-2.4 4,-2.3 -5,-0.3 -2,-0.2 0.945 113.4 41.7 -62.5 -50.3 8.0 -16.6 21.2 88 85 A V H X S+ 0 0 6 -4,-3.0 4,-3.0 2,-0.2 5,-0.2 0.935 114.1 52.0 -63.3 -48.2 5.1 -18.1 19.2 89 86 A K H X S+ 0 0 92 -4,-2.5 4,-2.5 -5,-0.3 5,-0.2 0.916 111.9 46.7 -54.8 -46.8 6.5 -17.0 15.8 90 87 A F H X S+ 0 0 36 -4,-2.4 4,-3.2 2,-0.2 -1,-0.2 0.923 112.4 49.9 -62.4 -45.9 9.9 -18.6 16.6 91 88 A L H X S+ 0 0 14 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.942 112.4 46.8 -58.6 -50.4 8.3 -21.8 17.8 92 89 A I H X S+ 0 0 30 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.948 116.3 43.8 -57.3 -52.6 6.1 -22.1 14.7 93 90 A E H X S+ 0 0 75 -4,-2.5 4,-1.5 -5,-0.2 5,-0.2 0.926 111.0 55.3 -59.4 -47.2 9.0 -21.3 12.3 94 91 A R H X>S+ 0 0 35 -4,-3.2 5,-3.0 1,-0.2 4,-1.0 0.924 112.9 41.3 -52.0 -50.1 11.4 -23.6 14.2 95 92 A I H <5S+ 0 0 20 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.825 113.5 53.9 -68.4 -31.9 9.0 -26.6 13.8 96 93 A R H <5S+ 0 0 191 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.665 118.8 35.3 -75.9 -16.8 8.2 -25.6 10.2 97 94 A K H <5S- 0 0 132 -4,-1.5 -2,-0.2 -3,-0.5 -1,-0.2 0.428 109.1-120.9-113.1 -5.5 12.0 -25.6 9.6 98 95 A N T <5 + 0 0 148 -4,-1.0 -3,-0.2 -5,-0.2 -4,-0.1 0.867 57.5 159.2 66.4 37.1 12.8 -28.6 11.8 99 96 A E < - 0 0 69 -5,-3.0 -1,-0.2 -6,-0.2 2,-0.1 -0.484 45.7 -88.8 -90.2 162.1 15.2 -26.4 13.9 100 97 A P - 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -6,-0.0 -0.365 32.1-130.9 -69.7 146.9 16.4 -27.1 17.4 101 98 A L - 0 0 54 -2,-0.1 3,-0.1 -7,-0.0 -10,-0.0 -0.826 29.0-170.1-105.0 97.8 14.4 -25.7 20.4 102 99 A P - 0 0 64 0, 0.0 2,-0.2 0, 0.0 3,-0.0 0.137 44.6 -47.3 -69.8-169.2 16.8 -23.9 22.8 103 100 A V > - 0 0 90 1,-0.1 4,-3.0 2,-0.0 5,-0.3 -0.457 43.8-146.1 -67.7 130.5 15.9 -22.6 26.3 104 101 A Y H > S+ 0 0 45 -53,-0.7 4,-2.2 -2,-0.2 5,-0.2 0.902 100.3 43.9 -63.0 -42.3 12.7 -20.7 26.4 105 102 A K H > S+ 0 0 126 2,-0.2 4,-2.6 3,-0.2 5,-0.2 0.960 118.9 41.5 -67.7 -53.0 14.0 -18.4 29.1 106 103 A D H > S+ 0 0 116 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.954 118.6 45.7 -59.7 -52.9 17.5 -17.8 27.5 107 104 A L H X S+ 0 0 34 -4,-3.0 4,-2.5 2,-0.2 5,-0.3 0.935 112.8 50.9 -56.5 -49.8 16.0 -17.5 24.0 108 105 A W H X S+ 0 0 46 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.940 111.1 47.4 -53.8 -52.4 13.3 -15.2 25.2 109 106 A N H X S+ 0 0 62 -4,-2.6 4,-2.6 1,-0.2 5,-0.4 0.883 110.3 54.3 -57.6 -40.1 15.7 -12.9 27.0 110 107 A A H X S+ 0 0 59 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.934 113.6 39.8 -60.2 -48.6 18.0 -12.9 23.9 111 108 A L H < S+ 0 0 53 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.775 113.3 58.6 -72.2 -26.6 15.2 -11.8 21.6 112 109 A R H < S+ 0 0 112 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.967 118.5 26.9 -66.8 -55.0 13.9 -9.4 24.3 113 110 A K H < 0 0 205 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.742 360.0 360.0 -79.6 -24.7 17.2 -7.4 24.6 114 111 A G < 0 0 91 -4,-1.9 -1,-0.2 -5,-0.4 -4,-0.1 -0.424 360.0 360.0 -86.6 360.0 18.1 -8.2 21.0