==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 18-FEB-03 1NZN . COMPND 2 MOLECULE: FISSION PROTEIN FIS1P; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.G.GITTIS,J.A.DOHM,R.B.HILL . 122 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8452.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 98 80.3 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 . 2 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 0 1 0 0 2 0 1 1 0 0 0 0 0 0 0 0 0 1 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 H > 0 0 205 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -45.4 -26.9 37.0 29.5 2 4 A X H > + 0 0 166 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.897 360.0 53.4 -65.5 -39.1 -28.3 33.5 28.9 3 5 A E H > S+ 0 0 170 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.872 109.5 48.8 -61.8 -38.3 -25.0 32.6 27.1 4 6 A A H > S+ 0 0 66 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.831 110.5 50.9 -69.2 -36.6 -23.1 33.8 30.2 5 7 A V H X S+ 0 0 92 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.923 110.7 48.1 -67.1 -44.8 -25.4 31.7 32.4 6 8 A L H X S+ 0 0 103 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.930 112.0 51.1 -60.3 -45.6 -24.9 28.6 30.3 7 9 A N H X S+ 0 0 76 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.898 110.0 48.5 -60.1 -44.3 -21.1 29.2 30.4 8 10 A E H X S+ 0 0 79 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.906 112.5 46.5 -65.4 -43.4 -21.0 29.6 34.2 9 11 A L H X S+ 0 0 99 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.882 113.3 50.1 -68.6 -34.9 -23.0 26.4 34.9 10 12 A V H X S+ 0 0 55 -4,-2.2 4,-2.8 -5,-0.2 -2,-0.2 0.898 106.3 55.5 -68.7 -39.6 -21.0 24.4 32.4 11 13 A S H X S+ 0 0 11 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.873 108.2 48.9 -61.6 -36.6 -17.7 25.6 33.9 12 14 A V H X S+ 0 0 67 -4,-1.5 4,-2.5 2,-0.2 5,-0.2 0.950 111.7 48.3 -67.5 -47.7 -18.9 24.3 37.3 13 15 A E H X S+ 0 0 135 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.898 113.9 48.5 -56.7 -44.6 -19.8 20.9 35.9 14 16 A D H X S+ 0 0 39 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.905 110.8 49.3 -60.5 -52.3 -16.4 20.8 34.1 15 17 A L H X S+ 0 0 21 -4,-2.4 4,-2.0 1,-0.2 5,-0.2 0.936 112.1 47.7 -57.0 -47.9 -14.4 21.7 37.2 16 18 A L H X S+ 0 0 103 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.856 112.4 50.3 -62.7 -38.6 -16.2 19.1 39.4 17 19 A K H X S+ 0 0 117 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.954 116.5 38.5 -65.5 -52.1 -15.7 16.4 36.7 18 20 A F H X S+ 0 0 27 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.715 111.3 57.9 -75.6 -19.9 -12.0 16.9 36.2 19 21 A E H X S+ 0 0 51 -4,-2.0 4,-2.9 -5,-0.2 5,-0.2 0.933 110.4 45.7 -71.9 -42.7 -11.2 17.6 39.9 20 22 A K H X S+ 0 0 140 -4,-1.6 4,-2.5 -5,-0.2 -2,-0.2 0.932 115.1 46.4 -62.9 -48.2 -12.7 14.1 40.6 21 23 A K H X S+ 0 0 79 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.901 114.9 47.2 -62.5 -42.2 -10.8 12.5 37.7 22 24 A F H X S+ 0 0 21 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.950 115.5 43.9 -64.8 -52.3 -7.5 14.3 38.7 23 25 A Q H X S+ 0 0 99 -4,-2.9 4,-1.5 2,-0.2 -2,-0.2 0.852 114.3 51.5 -62.8 -34.1 -7.8 13.4 42.4 24 26 A S H X S+ 0 0 49 -4,-2.5 4,-1.0 -5,-0.2 -2,-0.2 0.944 112.7 43.5 -68.1 -48.4 -8.9 9.8 41.5 25 27 A E H X S+ 0 0 51 -4,-2.5 4,-0.5 1,-0.2 -2,-0.2 0.811 110.1 58.2 -64.9 -34.3 -5.9 9.2 39.2 26 28 A K H >< S+ 0 0 143 -4,-2.1 3,-0.6 1,-0.2 -1,-0.2 0.877 105.8 48.5 -63.0 -41.6 -3.6 10.9 41.7 27 29 A A H 3< S+ 0 0 94 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.753 113.5 47.6 -72.0 -24.1 -4.5 8.4 44.4 28 30 A A H 3< S- 0 0 91 -4,-1.0 2,-0.3 1,-0.2 -1,-0.2 0.429 126.7 -77.2 -96.4 -2.7 -4.0 5.4 42.1 29 31 A G S << S+ 0 0 44 -3,-0.6 -1,-0.2 -4,-0.5 2,-0.2 -0.997 87.8 5.6 146.0-149.4 -0.6 6.6 40.7 30 32 A S - 0 0 117 -2,-0.3 2,-0.3 -3,-0.1 -3,-0.0 -0.491 68.3-125.3 -73.8 137.7 0.8 9.1 38.3 31 33 A V - 0 0 33 -2,-0.2 2,-0.1 -5,-0.1 -9,-0.1 -0.658 27.2-115.1 -82.8 140.0 -1.7 11.5 36.8 32 34 A S > - 0 0 44 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.381 17.0-121.7 -72.1 153.6 -1.8 11.6 33.0 33 35 A K H > S+ 0 0 82 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.875 113.6 55.5 -62.2 -35.7 -0.8 14.8 31.2 34 36 A S H > S+ 0 0 72 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.939 110.1 43.2 -63.6 -48.3 -4.2 14.8 29.6 35 37 A T H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.883 113.7 50.9 -66.7 -39.5 -6.1 14.7 32.9 36 38 A Q H X S+ 0 0 13 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.939 113.1 47.1 -63.6 -42.7 -3.8 17.3 34.5 37 39 A F H X S+ 0 0 45 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.909 109.3 51.5 -61.6 -50.6 -4.3 19.6 31.5 38 40 A E H X S+ 0 0 58 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.882 113.5 46.4 -54.1 -41.5 -8.1 19.2 31.5 39 41 A Y H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.933 112.7 48.1 -68.5 -46.1 -8.2 20.0 35.2 40 42 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.868 109.9 55.0 -61.8 -35.9 -5.9 23.0 34.8 41 43 A W H < S+ 0 0 70 -4,-2.8 4,-0.4 2,-0.2 -1,-0.2 0.883 110.7 43.6 -64.2 -42.6 -8.0 24.2 31.9 42 44 A C H >< S+ 0 0 4 -4,-1.7 3,-1.0 1,-0.2 4,-0.2 0.912 111.7 55.9 -69.2 -40.8 -11.2 24.2 34.0 43 45 A L H >< S+ 0 0 0 -4,-2.7 3,-1.4 1,-0.3 -2,-0.2 0.864 101.7 53.8 -60.4 -42.1 -9.3 25.8 36.9 44 46 A V T 3< S+ 0 0 0 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.654 109.8 50.7 -71.1 -10.9 -8.1 28.8 34.9 45 47 A R T < S+ 0 0 83 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.344 88.4 114.4-103.5 1.7 -11.8 29.4 33.9 46 48 A T S < S- 0 0 10 -3,-1.4 6,-0.1 -4,-0.2 -3,-0.0 -0.273 72.3-127.4 -70.9 161.9 -13.1 29.2 37.5 47 49 A R S S+ 0 0 193 -39,-0.1 2,-0.5 4,-0.0 -1,-0.1 0.611 87.8 84.3 -84.8 -11.9 -14.7 32.2 39.3 48 50 A Y S >> S- 0 0 153 1,-0.1 4,-1.8 -5,-0.1 3,-0.7 -0.807 70.5-146.3 -99.8 130.1 -12.3 31.7 42.2 49 51 A N H 3> S+ 0 0 99 -2,-0.5 4,-2.3 1,-0.2 5,-0.2 0.811 98.7 57.9 -59.7 -35.5 -8.8 33.1 42.3 50 52 A D H 3> S+ 0 0 91 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.849 106.9 49.1 -66.6 -30.9 -7.3 30.2 44.3 51 53 A D H <> S+ 0 0 27 -3,-0.7 4,-2.7 2,-0.2 -2,-0.2 0.903 109.5 51.4 -71.7 -42.6 -8.5 27.8 41.5 52 54 A I H X S+ 0 0 2 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.923 111.1 47.8 -60.0 -45.5 -7.0 30.0 38.8 53 55 A R H X S+ 0 0 145 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.851 111.4 50.7 -63.3 -37.3 -3.6 30.0 40.6 54 56 A K H X S+ 0 0 78 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.913 110.1 50.5 -66.8 -41.5 -3.8 26.2 41.1 55 57 A G H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.886 108.8 51.1 -62.0 -40.9 -4.5 25.9 37.4 56 58 A I H X S+ 0 0 12 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.930 110.5 49.6 -62.8 -43.0 -1.5 28.1 36.5 57 59 A V H X S+ 0 0 71 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.912 109.9 50.1 -63.5 -42.8 0.7 25.9 38.8 58 60 A L H X S+ 0 0 10 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.879 110.1 50.9 -63.5 -39.1 -0.5 22.7 37.2 59 61 A L H X S+ 0 0 0 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.879 108.4 52.4 -64.9 -39.7 0.2 24.1 33.7 60 62 A E H < S+ 0 0 78 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.833 106.8 52.9 -67.8 -30.6 3.7 25.1 34.8 61 63 A E H < S+ 0 0 91 -4,-1.7 -1,-0.2 1,-0.2 4,-0.2 0.825 109.9 49.5 -71.1 -32.2 4.3 21.5 36.0 62 64 A L H >X S+ 0 0 2 -4,-1.3 4,-1.5 1,-0.2 3,-1.4 0.778 92.2 81.5 -75.3 -28.3 3.2 20.2 32.6 63 65 A L T 3< S+ 0 0 50 -4,-1.5 3,-0.5 1,-0.3 -1,-0.2 0.873 91.8 43.8 -48.0 -53.6 5.5 22.6 30.7 64 66 A P T 34 S+ 0 0 104 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.667 116.7 50.7 -72.6 -7.6 8.8 20.6 30.9 65 67 A K T <4 S+ 0 0 134 -3,-1.4 -2,-0.2 -4,-0.2 -3,-0.1 0.663 91.6 91.0-100.8 -20.5 6.9 17.3 30.1 66 68 A G S < S- 0 0 10 -4,-1.5 2,-0.0 -3,-0.5 -3,-0.0 -0.277 74.8-106.6 -83.1 164.8 5.0 18.2 27.0 67 69 A S > - 0 0 53 1,-0.1 4,-2.7 -2,-0.0 5,-0.2 -0.247 45.9 -95.0 -73.3 172.0 5.6 17.9 23.3 68 70 A K H > S+ 0 0 176 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.874 127.9 48.6 -58.8 -37.3 6.3 21.1 21.2 69 71 A E H > S+ 0 0 116 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.930 112.5 46.5 -67.7 -48.1 2.7 21.2 20.3 70 72 A E H > S+ 0 0 54 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.865 107.8 56.7 -63.2 -39.4 1.4 20.8 23.8 71 73 A Q H X S+ 0 0 61 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.842 103.3 54.0 -63.7 -34.5 3.8 23.3 25.3 72 74 A R H X S+ 0 0 95 -4,-1.2 4,-1.3 -5,-0.2 -1,-0.2 0.861 110.4 48.0 -66.9 -35.9 2.5 26.0 23.0 73 75 A D H X S+ 0 0 57 -4,-1.2 4,-2.2 2,-0.2 -2,-0.2 0.889 108.6 52.9 -70.2 -42.4 -1.0 25.2 24.3 74 76 A Y H X S+ 0 0 8 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.917 108.0 51.9 -59.8 -42.7 0.1 25.3 27.9 75 77 A V H X S+ 0 0 28 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.869 107.2 53.7 -61.9 -36.9 1.6 28.8 27.3 76 78 A F H X S+ 0 0 39 -4,-1.3 4,-2.1 1,-0.2 -2,-0.2 0.959 112.1 42.6 -63.8 -48.9 -1.7 30.0 25.9 77 79 A Y H X S+ 0 0 56 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.759 109.9 57.6 -70.4 -22.8 -3.7 28.9 28.9 78 80 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.871 108.0 48.2 -71.5 -35.1 -1.0 30.3 31.2 79 81 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.905 112.6 48.4 -68.7 -42.9 -1.6 33.6 29.4 80 82 A V H X S+ 0 0 26 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.928 112.2 48.6 -62.6 -48.4 -5.4 33.2 29.9 81 83 A G H X S+ 0 0 0 -4,-2.7 4,-1.0 1,-0.2 -2,-0.2 0.952 113.5 45.7 -57.9 -51.3 -4.9 32.3 33.6 82 84 A N H <>S+ 0 0 9 -4,-2.4 5,-3.1 1,-0.2 3,-0.5 0.877 110.5 55.2 -61.7 -35.4 -2.7 35.3 34.3 83 85 A Y H ><5S+ 0 0 57 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.934 106.7 49.9 -62.4 -45.6 -5.0 37.6 32.3 84 86 A R H 3<5S+ 0 0 96 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.683 110.0 51.0 -67.8 -17.5 -8.0 36.5 34.5 85 87 A L T 3<5S- 0 0 35 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.371 117.4-116.4 -96.2 0.2 -5.8 37.2 37.6 86 88 A K T < 5S+ 0 0 147 -3,-1.6 2,-1.2 -4,-0.2 -3,-0.2 0.747 71.0 140.6 68.1 27.0 -5.0 40.7 36.2 87 89 A E >< + 0 0 95 -5,-3.1 4,-2.5 1,-0.2 5,-0.2 -0.602 21.4 166.7 -95.3 69.3 -1.3 39.8 35.9 88 90 A Y H > + 0 0 47 -2,-1.2 4,-3.2 1,-0.2 5,-0.2 0.859 66.5 53.1 -55.9 -45.2 -1.1 41.6 32.6 89 91 A E H > S+ 0 0 171 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.940 114.0 43.0 -59.9 -47.2 2.7 41.7 32.3 90 92 A K H > S+ 0 0 113 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.914 114.4 50.8 -64.8 -41.9 3.0 37.9 32.8 91 93 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.946 112.4 47.3 -60.4 -46.9 0.1 37.2 30.5 92 94 A L H X S+ 0 0 21 -4,-3.2 4,-2.8 1,-0.2 5,-0.3 0.834 105.8 57.1 -64.2 -38.0 1.7 39.4 27.8 93 95 A K H X S+ 0 0 153 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.2 0.948 110.8 45.3 -58.9 -45.8 5.1 37.8 28.1 94 96 A Y H X S+ 0 0 52 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.926 114.8 46.2 -60.5 -53.9 3.5 34.4 27.4 95 97 A V H X S+ 0 0 1 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.923 111.7 50.5 -57.4 -49.7 1.4 35.6 24.5 96 98 A R H X S+ 0 0 133 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.882 112.1 48.1 -60.2 -37.2 4.2 37.6 22.8 97 99 A G H X S+ 0 0 31 -4,-1.8 4,-1.2 -5,-0.3 3,-0.4 0.896 110.4 52.0 -69.2 -38.2 6.4 34.5 23.1 98 100 A L H X S+ 0 0 4 -4,-2.2 4,-3.4 1,-0.2 3,-0.4 0.898 105.7 54.9 -64.8 -37.9 3.7 32.4 21.6 99 101 A L H < S+ 0 0 35 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.749 103.2 56.3 -67.8 -23.7 3.3 34.7 18.7 100 102 A Q H < S+ 0 0 169 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.829 118.1 33.0 -75.7 -31.4 7.0 34.4 17.9 101 103 A T H < S+ 0 0 76 -4,-1.2 -2,-0.2 -3,-0.4 -3,-0.1 0.788 130.5 33.7 -92.8 -34.9 6.6 30.6 17.6 102 104 A E >< + 0 0 42 -4,-3.4 3,-1.6 -5,-0.2 -1,-0.2 -0.693 66.0 169.0-124.3 78.6 3.0 30.5 16.2 103 105 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.855 77.3 54.0 -55.8 -42.6 2.6 33.6 14.0 104 106 A Q T 3 S+ 0 0 184 1,-0.1 2,-1.3 2,-0.0 3,-0.1 0.314 76.4 113.2 -81.2 11.8 -0.7 32.4 12.5 105 107 A N <> + 0 0 23 -3,-1.6 4,-1.6 1,-0.2 3,-0.2 -0.677 37.1 174.1 -86.6 95.6 -2.3 31.9 15.9 106 108 A N H > S+ 0 0 80 -2,-1.3 4,-2.9 1,-0.2 -1,-0.2 0.680 74.9 63.9 -76.0 -18.1 -5.0 34.6 15.9 107 109 A Q H > S+ 0 0 108 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.905 105.9 45.3 -70.2 -39.6 -6.5 33.5 19.2 108 110 A A H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.898 114.3 49.2 -66.4 -42.2 -3.2 34.4 20.8 109 111 A K H X S+ 0 0 65 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.922 110.5 49.9 -63.2 -44.1 -3.2 37.7 18.9 110 112 A E H X S+ 0 0 111 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.847 108.9 53.5 -63.6 -33.2 -6.8 38.3 20.0 111 113 A L H X S+ 0 0 15 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.892 106.6 51.1 -68.1 -40.1 -5.8 37.6 23.6 112 114 A E H X S+ 0 0 27 -4,-2.0 4,-2.7 2,-0.2 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-5,-0.3 -2,-0.2 0.430 360.0 360.0 -93.0 360.0 -9.7 49.3 33.4