==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 24-DEC-10 3Q4O . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN MJ0754; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR K.Y.HWANG,E.H.LEE . 169 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8495.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 128 75.7 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 . 4 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 111 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 2 0 0 0 1 1 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 12 A P 0 0 171 0, 0.0 2,-0.2 0, 0.0 117,-0.0 0.000 360.0 360.0 360.0 156.2 -12.0 -29.7 20.4 2 13 A I - 0 0 25 1,-0.1 2,-0.1 4,-0.1 3,-0.0 -0.422 360.0-134.2 -83.0 137.5 -10.1 -27.4 18.0 3 14 A S > - 0 0 37 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.493 21.1-114.0 -82.9 163.1 -6.4 -27.4 18.0 4 15 A E H > S+ 0 0 129 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.942 120.9 50.5 -58.4 -40.0 -4.1 -24.3 18.0 5 16 A E H > S+ 0 0 113 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.849 108.1 51.2 -67.4 -35.4 -3.0 -25.3 14.5 6 17 A E H > S+ 0 0 30 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.873 108.1 53.2 -69.2 -37.3 -6.6 -25.6 13.3 7 18 A K H X S+ 0 0 55 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.923 104.7 55.7 -61.5 -40.4 -7.3 -22.2 14.7 8 19 A E H X S+ 0 0 101 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.864 105.2 51.8 -62.5 -39.0 -4.4 -20.8 12.7 9 20 A G H X S+ 0 0 1 -4,-1.4 4,-3.1 2,-0.2 -1,-0.2 0.891 109.3 48.6 -67.9 -42.8 -5.9 -22.2 9.5 10 21 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.914 110.8 52.9 -61.8 -36.1 -9.3 -20.5 10.1 11 22 A I H X S+ 0 0 60 -4,-2.4 4,-1.2 1,-0.2 -2,-0.2 0.923 112.2 43.6 -68.0 -39.1 -7.6 -17.3 10.9 12 23 A E H X S+ 0 0 24 -4,-2.3 4,-2.2 -5,-0.2 3,-0.3 0.937 114.4 49.6 -67.5 -50.2 -5.6 -17.4 7.6 13 24 A M H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 5,-0.3 0.857 102.1 62.9 -62.8 -28.4 -8.7 -18.5 5.5 14 25 A R H X S+ 0 0 15 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.922 113.8 34.0 -56.5 -45.1 -10.8 -15.7 7.0 15 26 A E H X S+ 0 0 3 -4,-1.2 4,-2.2 -3,-0.3 -1,-0.2 0.804 110.5 62.5 -84.5 -26.2 -8.5 -13.2 5.4 16 27 A E H X S+ 0 0 3 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.885 106.2 47.1 -64.6 -38.8 -7.7 -15.2 2.3 17 28 A E H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.928 110.1 53.7 -67.3 -35.1 -11.5 -15.0 1.4 18 29 A K H X S+ 0 0 0 -4,-1.3 4,-3.1 -5,-0.3 5,-0.3 0.878 102.8 57.6 -65.4 -34.5 -11.3 -11.3 2.2 19 30 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.3 0.954 109.5 45.1 -58.1 -48.0 -8.3 -11.0 -0.3 20 31 A A H X S+ 0 0 1 -4,-1.8 4,-2.7 1,-0.2 5,-0.2 0.961 114.8 46.8 -61.7 -49.6 -10.5 -12.4 -3.1 21 32 A R H X S+ 0 0 8 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.941 116.2 45.5 -55.1 -47.3 -13.6 -10.2 -2.2 22 33 A D H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.921 113.9 46.1 -72.0 -40.2 -11.4 -7.0 -1.9 23 34 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 -5,-0.3 -1,-0.2 0.929 114.8 48.9 -66.6 -43.0 -9.4 -7.6 -5.1 24 35 A Y H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.3 -2,-0.2 0.920 111.8 47.8 -67.7 -33.8 -12.6 -8.4 -7.1 25 36 A L H X S+ 0 0 52 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.903 113.3 49.9 -66.2 -38.3 -14.4 -5.3 -5.8 26 37 A T H X S+ 0 0 37 -4,-2.3 4,-1.3 -5,-0.2 -2,-0.2 0.931 113.3 44.6 -67.6 -42.9 -11.4 -3.2 -6.7 27 38 A L H X S+ 0 0 2 -4,-2.7 4,-2.8 2,-0.2 5,-0.5 0.860 109.9 56.4 -75.1 -28.5 -11.2 -4.7 -10.2 28 39 A Y H X S+ 0 0 45 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.956 106.2 51.0 -58.0 -48.1 -15.0 -4.3 -10.6 29 40 A N H < S+ 0 0 104 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.837 115.0 42.2 -66.9 -25.4 -14.7 -0.7 -9.9 30 41 A K H < S+ 0 0 101 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.938 132.1 17.5 -77.6 -50.9 -11.9 -0.3 -12.5 31 42 A W H < S- 0 0 57 -4,-2.8 -3,-0.2 2,-0.1 -2,-0.2 0.620 83.3-140.6-105.3 -17.8 -13.3 -2.4 -15.4 32 43 A K < + 0 0 128 -4,-2.8 2,-0.6 -5,-0.5 -4,-0.1 0.722 42.2 156.7 60.7 31.4 -17.0 -2.8 -14.6 33 44 A L >> - 0 0 30 -6,-0.3 3,-1.6 1,-0.1 4,-0.8 -0.747 43.8-137.9 -83.4 124.7 -17.1 -6.4 -15.8 34 45 A Q H 3> S+ 0 0 97 -2,-0.6 4,-2.7 1,-0.3 3,-0.4 0.808 95.7 72.7 -56.3 -32.2 -20.1 -8.0 -14.0 35 46 A I H 3> S+ 0 0 16 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.872 96.1 50.8 -51.1 -41.4 -18.1 -11.2 -13.2 36 47 A F H <> S+ 0 0 0 -3,-1.6 4,-2.2 2,-0.2 -1,-0.3 0.877 111.7 45.6 -66.9 -39.4 -16.0 -9.3 -10.6 37 48 A K H X S+ 0 0 104 -4,-0.8 4,-1.6 -3,-0.4 -2,-0.2 0.934 115.6 47.6 -67.9 -40.4 -19.1 -7.9 -8.8 38 49 A N H X S+ 0 0 86 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.933 115.4 43.0 -66.2 -46.7 -20.9 -11.3 -8.9 39 50 A I H X S+ 0 0 9 -4,-2.8 4,-2.5 -5,-0.3 -1,-0.2 0.899 108.2 59.9 -71.3 -31.8 -17.9 -13.3 -7.6 40 51 A A H X S+ 0 0 1 -4,-2.2 4,-2.0 -5,-0.3 -1,-0.2 0.885 104.0 52.1 -55.4 -42.6 -17.1 -10.6 -5.0 41 52 A E H X S+ 0 0 142 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.889 107.3 50.9 -64.5 -39.0 -20.5 -11.3 -3.5 42 53 A S H X S+ 0 0 31 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.928 109.3 52.0 -60.8 -38.4 -19.8 -15.0 -3.4 43 54 A E H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.885 104.3 56.0 -69.9 -28.5 -16.5 -14.2 -1.6 44 55 A Q H X S+ 0 0 59 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.935 107.2 49.9 -67.5 -39.8 -18.3 -12.1 0.9 45 56 A T H X S+ 0 0 86 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.917 110.6 50.2 -59.8 -39.9 -20.5 -15.3 1.6 46 57 A H H X S+ 0 0 10 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.930 108.6 51.6 -67.2 -39.6 -17.2 -17.3 2.0 47 58 A M H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.889 109.3 51.0 -57.7 -41.0 -15.9 -14.7 4.4 48 59 A D H X S+ 0 0 87 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.886 106.7 54.5 -69.4 -34.4 -19.1 -15.0 6.4 49 60 A A H X S+ 0 0 30 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.897 110.3 45.3 -63.4 -40.9 -18.8 -18.8 6.5 50 61 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 3,-0.3 0.948 110.6 54.9 -69.2 -42.4 -15.3 -18.6 8.0 51 62 A K H X S+ 0 0 55 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.883 101.5 58.0 -57.6 -37.9 -16.5 -15.9 10.5 52 63 A Y H X S+ 0 0 153 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.927 109.0 45.0 -59.6 -39.2 -19.2 -18.2 11.7 53 64 A L H X S+ 0 0 6 -4,-1.4 4,-1.8 -3,-0.3 6,-0.2 0.913 109.9 53.8 -72.0 -37.1 -16.6 -20.8 12.6 54 65 A L H <>S+ 0 0 1 -4,-2.5 5,-3.2 1,-0.2 -2,-0.2 0.934 112.6 45.1 -60.7 -41.1 -14.3 -18.3 14.3 55 66 A E H ><5S+ 0 0 118 -4,-2.7 3,-1.1 3,-0.2 -2,-0.2 0.866 106.0 60.6 -73.7 -34.0 -17.3 -17.2 16.4 56 67 A K H 3<5S+ 0 0 105 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.894 117.7 30.7 -54.2 -36.9 -18.3 -20.8 17.1 57 68 A Y T 3<5S- 0 0 65 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.229 110.0-120.7-105.0 3.0 -14.9 -21.3 18.8 58 69 A N T < 5 + 0 0 146 -3,-1.1 -3,-0.2 1,-0.2 -4,-0.1 0.864 52.7 164.5 52.6 44.0 -14.5 -17.7 20.0 59 70 A I < - 0 0 11 -5,-3.2 -1,-0.2 -6,-0.2 -2,-0.1 -0.775 46.6-103.1 -87.6 134.4 -11.3 -17.2 18.0 60 71 A P - 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.247 36.7-118.6 -59.4 134.0 -10.4 -13.6 17.6 61 72 A D - 0 0 30 1,-0.2 -50,-0.1 2,-0.1 -10,-0.0 -0.626 11.2-152.1 -79.2 126.6 -11.2 -12.3 14.2 62 73 A P S S+ 0 0 13 0, 0.0 2,-1.5 0, 0.0 3,-0.2 0.729 81.8 86.9 -68.4 -21.3 -8.2 -11.2 12.2 63 74 A V + 0 0 17 1,-0.2 3,-0.2 8,-0.1 -2,-0.1 -0.658 44.0 153.3 -80.2 92.8 -10.6 -8.8 10.3 64 75 A K S S+ 0 0 170 -2,-1.5 2,-0.4 1,-0.3 -1,-0.2 0.583 73.5 34.9 -90.1 -11.2 -10.5 -5.8 12.7 65 76 A N - 0 0 75 -3,-0.2 -1,-0.3 5,-0.2 5,-0.1 -0.927 66.0-162.3-147.7 108.1 -11.3 -3.5 9.8 66 77 A D + 0 0 84 -2,-0.4 3,-0.1 -3,-0.2 -1,-0.1 0.563 50.3 126.0 -69.5 -4.8 -13.6 -4.6 6.9 67 78 A S S > S- 0 0 64 1,-0.1 3,-1.9 2,-0.1 -2,-0.1 -0.210 75.0 -91.4 -58.9 144.0 -12.4 -1.9 4.6 68 79 A I T 3 S+ 0 0 76 1,-0.3 -1,-0.1 -46,-0.1 3,-0.1 -0.275 110.6 17.3 -48.8 130.7 -11.1 -3.0 1.2 69 80 A G T 3 S+ 0 0 11 1,-0.2 2,-0.5 -51,-0.2 -1,-0.3 0.274 91.7 122.4 91.9 -8.7 -7.4 -3.6 1.3 70 81 A V < + 0 0 58 -3,-1.9 2,-0.3 -5,-0.1 -1,-0.2 -0.778 32.0 165.2 -94.5 127.7 -6.9 -3.9 5.1 71 82 A F - 0 0 13 -2,-0.5 -8,-0.1 1,-0.1 -5,-0.0 -0.996 36.7-153.3-137.9 149.7 -5.3 -7.0 6.4 72 83 A S S S+ 0 0 51 -2,-0.3 -1,-0.1 -10,-0.2 -9,-0.1 0.885 90.8 62.0 -84.2 -44.2 -3.8 -8.2 9.7 73 84 A N S >> S- 0 0 49 1,-0.2 3,-1.6 -61,-0.1 4,-1.1 -0.720 81.0-146.4 -85.6 121.2 -1.5 -10.9 8.1 74 85 A P H 3> S+ 0 0 71 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.746 90.6 76.6 -73.6 -12.1 0.8 -8.9 5.8 75 86 A K H 3> S+ 0 0 78 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.898 100.8 42.8 -48.2 -44.9 0.8 -11.9 3.3 76 87 A F H <> S+ 0 0 0 -3,-1.6 4,-2.7 2,-0.2 -1,-0.2 0.842 110.2 54.8 -79.8 -29.0 -2.6 -10.7 2.3 77 88 A E H X S+ 0 0 69 -4,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.949 110.9 46.3 -66.9 -41.5 -1.7 -7.1 2.2 78 89 A E H X S+ 0 0 130 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.898 113.1 48.8 -65.8 -42.2 1.2 -7.8 -0.1 79 90 A L H X S+ 0 0 21 -4,-1.9 4,-2.9 -5,-0.3 5,-0.3 0.937 109.6 53.0 -63.2 -43.1 -1.0 -10.0 -2.3 80 91 A Y H X S+ 0 0 33 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.966 112.7 43.7 -55.1 -50.3 -3.7 -7.3 -2.5 81 92 A K H X S+ 0 0 113 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.943 116.2 46.6 -67.0 -42.8 -1.3 -4.6 -3.6 82 93 A K H X S+ 0 0 99 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.923 116.2 44.6 -61.2 -43.3 0.5 -6.8 -6.1 83 94 A L H X S+ 0 0 3 -4,-2.9 4,-2.6 -5,-0.2 -2,-0.2 0.887 110.2 50.7 -80.6 -31.3 -2.7 -8.1 -7.6 84 95 A V H X S+ 0 0 27 -4,-2.7 4,-1.3 -5,-0.3 -1,-0.2 0.893 112.1 50.3 -69.6 -35.2 -4.6 -4.9 -7.9 85 96 A E H < S+ 0 0 148 -4,-1.7 4,-0.4 -5,-0.3 -2,-0.2 0.930 114.0 44.0 -65.4 -45.3 -1.6 -3.3 -9.7 86 97 A K H >< S+ 0 0 78 -4,-2.2 3,-1.6 1,-0.2 4,-0.4 0.947 114.0 50.3 -65.3 -41.2 -1.4 -6.3 -12.1 87 98 A G H >< S+ 0 0 0 -4,-2.6 3,-0.5 1,-0.3 7,-0.5 0.735 98.8 67.6 -70.9 -20.9 -5.2 -6.3 -12.7 88 99 A D T 3< S+ 0 0 82 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.705 84.9 74.4 -71.4 -11.0 -5.2 -2.6 -13.4 89 100 A K T < S- 0 0 118 -3,-1.6 2,-0.3 -4,-0.4 -1,-0.2 0.811 112.0 -30.7 -79.8 -29.9 -3.2 -3.1 -16.7 90 101 A S <> - 0 0 37 -3,-0.5 4,-2.4 -4,-0.4 -1,-0.2 -0.973 60.7 -95.4-173.3 165.8 -6.0 -4.5 -18.9 91 102 A E H > S+ 0 0 62 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.919 124.4 52.8 -58.5 -44.5 -9.3 -6.6 -18.7 92 103 A V H > S+ 0 0 34 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.939 109.3 47.3 -59.5 -44.6 -7.2 -9.7 -19.6 93 104 A D H > S+ 0 0 34 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.906 111.1 52.4 -67.4 -34.8 -4.8 -9.1 -16.7 94 105 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 -7,-0.5 -2,-0.2 0.924 110.8 47.6 -65.4 -40.5 -7.7 -8.5 -14.3 95 106 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.904 110.0 52.0 -68.5 -35.1 -9.3 -11.8 -15.4 96 107 A K H X S+ 0 0 42 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.916 107.4 52.8 -61.9 -42.6 -6.0 -13.6 -15.0 97 108 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.891 104.9 56.4 -62.0 -40.9 -5.8 -12.1 -11.5 98 109 A G H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.960 111.8 42.2 -51.3 -54.5 -9.3 -13.6 -10.8 99 110 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.915 109.9 58.1 -60.6 -37.4 -8.0 -17.0 -11.7 100 111 A T H X S+ 0 0 8 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.905 106.5 47.6 -61.7 -44.2 -4.8 -16.5 -9.8 101 112 A I H X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.903 113.2 47.8 -70.6 -36.3 -6.6 -15.8 -6.5 102 113 A E H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 -1,-0.2 0.893 110.2 53.2 -67.6 -35.8 -8.8 -18.9 -7.0 103 114 A D H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.968 111.3 45.4 -58.8 -48.6 -5.8 -21.0 -7.8 104 115 A L H X S+ 0 0 14 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.896 111.2 53.7 -58.2 -44.6 -4.1 -19.9 -4.6 105 116 A D H X S+ 0 0 2 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.922 109.0 47.9 -60.5 -44.9 -7.3 -20.4 -2.6 106 117 A I H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.931 113.0 48.2 -63.7 -44.7 -7.7 -24.0 -3.9 107 118 A A H X S+ 0 0 20 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.920 115.2 44.6 -63.4 -44.4 -4.0 -24.8 -3.1 108 119 A D H X S+ 0 0 28 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.905 110.6 53.5 -71.3 -39.1 -4.2 -23.4 0.4 109 120 A L H X S+ 0 0 0 -4,-2.6 4,-3.4 -5,-0.2 5,-0.2 0.923 107.8 51.9 -61.0 -40.0 -7.6 -25.0 1.2 110 121 A E H X S+ 0 0 56 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.921 109.3 50.4 -64.1 -40.9 -6.0 -28.4 0.2 111 122 A K H < S+ 0 0 86 -4,-1.8 4,-0.3 1,-0.2 -1,-0.2 0.937 115.6 41.2 -60.0 -48.9 -3.1 -27.7 2.6 112 123 A W H >< S+ 0 0 6 -4,-2.5 3,-1.5 1,-0.2 4,-0.3 0.894 110.9 55.6 -70.4 -41.5 -5.5 -26.9 5.5 113 124 A I H >< S+ 0 0 10 -4,-3.4 3,-1.7 1,-0.3 -1,-0.2 0.918 106.3 53.1 -55.4 -39.0 -8.0 -29.7 4.7 114 125 A N T 3< S+ 0 0 140 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.558 105.2 56.1 -74.9 -7.1 -5.1 -32.2 5.0 115 126 A K T < S+ 0 0 118 -3,-1.5 2,-0.4 -4,-0.3 -1,-0.3 0.425 103.7 64.4-100.1 -0.4 -4.2 -30.7 8.4 116 127 A T < - 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