==== 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 TRANSCRIPTION 27-MAY-08 3D9K . COMPND 2 MOLECULE: RNA-BINDING PROTEIN 16; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.BECKER,B.LOLL,A.MEINHART . 293 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15466.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 74.7 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 . 2 0.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 15.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 167 57.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 1 0 1 1 0 5 2 1 1 0 0 2 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 . 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 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 2 A E > 0 0 167 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -49.9 54.5 7.2 -1.4 2 3 A A H > + 0 0 34 2,-0.2 4,-1.8 1,-0.2 33,-0.1 0.756 360.0 50.8 -68.2 -26.3 52.3 4.6 0.4 3 4 A V H > S+ 0 0 26 2,-0.2 4,-3.9 3,-0.2 5,-0.2 0.914 107.3 52.1 -71.5 -48.2 52.6 6.9 3.4 4 5 A K H > S+ 0 0 155 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.904 111.7 47.1 -55.5 -45.4 51.6 10.0 1.4 5 6 A T H X S+ 0 0 65 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.929 114.2 46.9 -62.3 -45.3 48.5 8.0 0.2 6 7 A F H X S+ 0 0 0 -4,-1.8 4,-3.1 25,-0.2 -2,-0.2 0.948 112.2 49.7 -59.2 -49.1 47.8 6.9 3.8 7 8 A N H X S+ 0 0 50 -4,-3.9 4,-3.4 1,-0.2 5,-0.3 0.925 111.1 50.8 -55.3 -47.6 48.3 10.5 5.1 8 9 A S H X S+ 0 0 74 -4,-2.5 4,-1.5 -5,-0.2 -1,-0.2 0.906 112.5 44.8 -55.2 -50.0 45.9 11.7 2.4 9 10 A E H < S+ 0 0 45 -4,-2.6 4,-0.3 2,-0.2 -2,-0.2 0.911 116.4 48.3 -60.0 -44.7 43.2 9.1 3.4 10 11 A L H >< S+ 0 0 0 -4,-3.1 3,-1.4 1,-0.2 -2,-0.2 0.938 113.8 43.1 -62.0 -52.0 43.8 9.9 7.1 11 12 A Y H >< S+ 0 0 94 -4,-3.4 3,-1.9 1,-0.3 -1,-0.2 0.735 95.7 77.8 -74.0 -18.8 43.6 13.7 6.9 12 13 A S G >< S+ 0 0 19 -4,-1.5 3,-2.1 -5,-0.3 -1,-0.3 0.689 73.3 84.3 -59.7 -17.8 40.6 13.5 4.5 13 14 A L G X S+ 0 0 0 -3,-1.4 3,-2.2 -4,-0.3 -1,-0.3 0.819 75.3 70.2 -51.4 -34.4 38.7 12.9 7.7 14 15 A N G < S+ 0 0 43 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.640 88.6 61.4 -60.4 -21.4 38.6 16.7 8.1 15 16 A D G < S+ 0 0 76 -3,-2.1 2,-0.4 -4,-0.2 -1,-0.3 0.489 99.5 76.6 -76.9 -6.5 36.1 16.9 5.2 16 17 A Y S < S- 0 0 20 -3,-2.2 128,-0.2 -4,-0.2 127,-0.1 -0.873 72.3-138.3-120.8 137.1 33.7 14.8 7.1 17 18 A K - 0 0 83 126,-1.9 -3,-0.0 -2,-0.4 -2,-0.0 -0.848 52.4 -88.3 -84.7 121.4 31.3 15.3 10.0 18 19 A P S S+ 0 0 29 0, 0.0 2,-0.1 0, 0.0 129,-0.1 -0.291 101.5 78.3 -65.4 155.6 31.5 12.4 12.4 19 20 A P S S- 0 0 91 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.357 84.9-140.3 -67.7 134.6 30.3 9.6 12.9 20 21 A I - 0 0 8 263,-0.2 263,-2.5 -2,-0.1 -7,-0.0 -0.472 18.3-103.5 -71.7 138.0 32.6 8.6 10.1 21 22 A S B > -A 282 0A 11 261,-0.3 4,-1.7 -2,-0.2 261,-0.3 -0.194 20.3-125.4 -57.5 149.1 31.4 6.1 7.5 22 23 A K H > S+ 0 0 127 259,-2.6 4,-2.9 1,-0.2 5,-0.2 0.920 111.1 55.6 -61.8 -45.0 32.5 2.4 7.7 23 24 A A H > S+ 0 0 16 258,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.853 106.3 50.4 -59.0 -38.0 33.7 2.6 4.1 24 25 A K H > S+ 0 0 10 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.882 111.5 47.7 -68.7 -38.5 36.0 5.6 4.9 25 26 A M H X S+ 0 0 1 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.901 110.7 51.9 -66.9 -42.2 37.5 3.8 7.9 26 27 A T H X S+ 0 0 46 -4,-2.9 4,-2.9 2,-0.2 -2,-0.2 0.900 109.8 50.3 -57.5 -43.4 38.0 0.7 5.7 27 28 A Q H X S+ 0 0 84 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.911 111.5 46.2 -63.5 -44.1 39.8 2.9 3.1 28 29 A I H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.911 115.1 49.1 -61.3 -43.8 42.1 4.5 5.8 29 30 A T H X S+ 0 0 6 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.928 108.8 50.2 -62.9 -50.2 42.7 1.0 7.2 30 31 A K H X S+ 0 0 111 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.908 111.3 50.0 -55.9 -44.7 43.5 -0.7 3.8 31 32 A A H X S+ 0 0 15 -4,-2.0 4,-0.9 -5,-0.2 -1,-0.2 0.836 111.8 48.9 -63.8 -33.0 46.0 2.2 3.1 32 33 A A H < S+ 0 0 0 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.923 113.7 45.3 -67.5 -44.8 47.6 1.6 6.5 33 34 A I H >< S+ 0 0 12 -4,-2.7 3,-1.6 1,-0.2 -2,-0.2 0.891 110.4 53.0 -69.8 -41.2 47.8 -2.2 5.9 34 35 A K H 3< S+ 0 0 180 -4,-2.9 3,-0.4 1,-0.3 -1,-0.2 0.784 108.4 53.2 -62.1 -28.2 49.2 -1.7 2.4 35 36 A A T >< + 0 0 0 -4,-0.9 3,-3.0 -5,-0.2 -1,-0.3 0.141 68.6 126.0 -92.5 18.9 51.9 0.6 4.0 36 37 A I G X + 0 0 56 -3,-1.6 3,-1.4 1,-0.3 -1,-0.2 0.736 64.8 67.5 -51.8 -24.9 52.9 -2.1 6.5 37 38 A K G 3 S+ 0 0 174 -3,-0.4 -1,-0.3 1,-0.3 3,-0.2 0.817 109.9 36.8 -60.6 -32.3 56.6 -1.6 5.3 38 39 A F G X> S+ 0 0 72 -3,-3.0 4,-2.3 -6,-0.2 3,-0.7 -0.243 76.3 139.7-114.3 38.8 56.3 1.8 6.8 39 40 A Y H <> S+ 0 0 66 -3,-1.4 4,-3.5 1,-0.3 5,-0.2 0.840 70.5 56.4 -56.5 -36.9 54.2 0.9 9.9 40 41 A K H 3> S+ 0 0 101 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.859 110.1 46.5 -62.5 -38.2 56.2 3.3 12.2 41 42 A H H <> S+ 0 0 102 -3,-0.7 4,-2.5 2,-0.2 -2,-0.2 0.889 112.0 49.8 -67.9 -42.8 55.4 6.1 9.8 42 43 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 -7,-0.2 -2,-0.2 0.968 113.2 46.8 -59.0 -53.0 51.7 5.0 9.7 43 44 A V H X S+ 0 0 2 -4,-3.5 4,-2.4 1,-0.2 5,-0.2 0.929 111.9 51.4 -53.5 -47.3 51.6 4.9 13.5 44 45 A Q H X S+ 0 0 95 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.872 109.4 49.5 -61.7 -40.2 53.4 8.3 13.6 45 46 A S H X S+ 0 0 13 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.914 110.7 49.5 -62.3 -45.4 50.9 9.9 11.3 46 47 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.940 113.9 45.7 -60.4 -50.4 47.9 8.6 13.2 47 48 A E H X S+ 0 0 23 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.838 112.7 50.6 -55.4 -43.9 49.4 9.9 16.5 48 49 A K H X S+ 0 0 106 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 0.943 110.0 51.2 -62.1 -47.1 50.2 13.3 14.9 49 50 A F H X S+ 0 0 2 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.943 111.4 46.6 -50.9 -54.2 46.6 13.5 13.6 50 51 A I H < S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.819 113.1 50.1 -63.2 -33.1 45.2 12.8 17.1 51 52 A Q H < S+ 0 0 101 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.873 122.9 30.5 -67.7 -38.1 47.6 15.3 18.7 52 53 A K H < S+ 0 0 154 -4,-2.1 -2,-0.2 -3,-0.2 -3,-0.2 0.595 94.3 102.3-103.8 -17.5 46.7 18.1 16.2 53 54 A C S < S- 0 0 18 -4,-2.6 5,-0.0 -5,-0.2 -3,-0.0 -0.083 78.5 -94.5 -69.4 167.8 43.1 17.5 15.2 54 55 A K > - 0 0 82 1,-0.1 3,-2.1 3,-0.0 4,-0.3 -0.454 47.2 -96.0 -75.0 159.6 40.0 19.4 16.5 55 56 A P G > S+ 0 0 65 0, 0.0 3,-1.2 0, 0.0 4,-0.4 0.789 121.1 60.1 -48.8 -37.9 38.1 17.9 19.5 56 57 A E G 3 S+ 0 0 67 1,-0.2 3,-0.1 45,-0.1 45,-0.1 0.638 100.9 55.0 -69.6 -14.1 35.5 16.2 17.3 57 58 A Y G <> S+ 0 0 2 -3,-2.1 4,-2.3 2,-0.1 -1,-0.2 0.381 81.3 88.2-101.2 3.1 38.1 14.0 15.4 58 59 A K H <> S+ 0 0 12 -3,-1.2 4,-2.5 -4,-0.3 5,-0.2 0.965 92.0 44.2 -62.9 -54.1 39.7 12.5 18.5 59 60 A V H > S+ 0 0 6 -4,-0.4 4,-3.1 2,-0.2 5,-0.2 0.924 113.4 50.3 -60.9 -47.4 37.2 9.5 18.6 60 61 A P H > S+ 0 0 6 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.918 110.5 52.1 -49.3 -44.2 37.5 9.1 14.8 61 62 A G H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.897 110.1 47.3 -61.5 -42.4 41.3 9.1 15.4 62 63 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.896 108.6 54.9 -60.5 -43.5 40.8 6.4 18.0 63 64 A Y H X S+ 0 0 27 -4,-3.1 4,-2.8 1,-0.2 -2,-0.2 0.811 103.5 56.8 -61.4 -29.3 38.6 4.4 15.6 64 65 A V H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.897 108.6 45.4 -66.0 -42.0 41.5 4.6 13.1 65 66 A I H X S+ 0 0 0 -4,-1.4 4,-3.0 2,-0.2 5,-0.3 0.962 115.8 47.5 -62.8 -51.2 43.8 2.9 15.7 66 67 A D H X S+ 0 0 2 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.926 112.9 47.1 -56.6 -50.3 41.1 0.3 16.5 67 68 A S H X S+ 0 0 12 -4,-2.8 4,-1.8 1,-0.2 5,-0.2 0.903 114.9 46.7 -63.7 -40.3 40.3 -0.5 12.9 68 69 A I H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.957 115.2 44.0 -64.9 -50.9 44.0 -0.8 11.9 69 70 A V H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.890 115.5 49.5 -64.7 -39.6 44.9 -3.1 14.9 70 71 A R H X S+ 0 0 80 -4,-2.6 4,-1.8 -5,-0.3 -1,-0.2 0.856 115.1 42.9 -61.9 -45.5 41.8 -5.2 14.5 71 72 A Q H X S+ 0 0 71 -4,-1.8 4,-3.3 -5,-0.3 5,-0.3 0.939 115.7 49.3 -69.9 -43.0 42.4 -5.7 10.8 72 73 A S H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 5,-0.4 0.892 111.8 47.5 -64.7 -43.0 46.1 -6.3 11.3 73 74 A R H X S+ 0 0 27 -4,-2.7 4,-1.4 -5,-0.2 -1,-0.2 0.906 117.2 43.7 -64.3 -40.3 45.5 -8.9 14.1 74 75 A H H < S+ 0 0 153 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.895 120.7 40.5 -68.8 -41.5 42.9 -10.6 11.9 75 76 A Q H < S+ 0 0 101 -4,-3.3 -2,-0.2 1,-0.1 -3,-0.2 0.827 132.4 20.4 -77.9 -35.6 44.9 -10.5 8.7 76 77 A F H < S- 0 0 77 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.515 114.2 -97.3-115.2 -12.6 48.4 -11.3 10.1 77 78 A G X - 0 0 31 -4,-1.4 4,-1.5 -5,-0.4 -1,-0.2 -0.042 33.1 -91.3 99.3 152.7 47.7 -13.0 13.4 78 79 A Q T 4 S+ 0 0 118 1,-0.2 -1,-0.1 2,-0.2 -4,-0.1 0.864 124.0 41.2 -69.2 -40.6 47.6 -11.6 17.0 79 80 A E T 4 S+ 0 0 169 1,-0.2 -1,-0.2 -6,-0.1 -2,-0.1 0.670 116.3 50.3 -82.3 -18.7 51.2 -12.3 17.9 80 81 A K T 4 S+ 0 0 165 -7,-0.1 -2,-0.2 -4,-0.1 -1,-0.2 0.635 79.6 116.7 -96.7 -18.7 52.5 -11.2 14.4 81 82 A D < - 0 0 6 -4,-1.5 -8,-0.1 1,-0.2 -12,-0.0 -0.317 43.5-170.8 -48.0 121.6 50.7 -7.9 14.3 82 83 A V S > S+ 0 0 47 2,-0.1 4,-1.3 -2,-0.1 -1,-0.2 0.665 72.7 69.1 -88.1 -20.8 53.2 -5.0 14.3 83 84 A F H > S+ 0 0 0 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.954 95.1 46.2 -72.5 -54.0 50.6 -2.2 14.8 84 85 A A H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.938 113.6 49.4 -54.7 -53.8 49.4 -2.7 18.4 85 86 A P H 4 S+ 0 0 74 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 0.840 115.8 44.6 -54.6 -36.2 52.9 -3.1 19.8 86 87 A R H >X S+ 0 0 88 -4,-1.3 3,-1.1 1,-0.2 4,-0.5 0.901 111.6 50.7 -74.9 -44.5 54.0 0.0 18.0 87 88 A F H >X S+ 0 0 1 -4,-3.2 4,-0.7 1,-0.2 3,-0.6 0.837 102.6 65.8 -55.0 -31.5 51.0 2.1 18.9 88 89 A S H 3< S+ 0 0 28 -4,-2.1 4,-0.3 -5,-0.3 -1,-0.2 0.684 83.7 72.7 -72.5 -17.2 51.7 1.0 22.5 89 90 A N H <4 S+ 0 0 100 -3,-1.1 -1,-0.2 -4,-0.4 3,-0.2 0.942 117.9 16.0 -58.9 -49.2 55.0 3.0 22.8 90 91 A N H XX S+ 0 0 87 -3,-0.6 4,-2.4 -4,-0.5 3,-0.9 0.339 92.8 116.2-105.7 4.3 53.3 6.4 22.9 91 92 A I H 3X + 0 0 1 -4,-0.7 4,-2.6 1,-0.3 5,-0.2 0.710 69.8 58.1 -56.2 -30.0 49.8 5.2 23.8 92 93 A I H 3> S+ 0 0 77 -4,-0.3 4,-1.5 -3,-0.2 -1,-0.3 0.949 113.6 39.6 -64.9 -46.5 49.6 6.9 27.2 93 94 A S H <> S+ 0 0 57 -3,-0.9 4,-2.7 2,-0.2 5,-0.2 0.900 112.5 57.0 -66.0 -43.7 50.2 10.3 25.6 94 95 A T H X S+ 0 0 4 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.939 109.7 45.1 -51.2 -49.5 48.0 9.4 22.6 95 96 A F H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.792 107.6 57.6 -69.6 -27.9 45.1 8.7 25.1 96 97 A Q H < S+ 0 0 104 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.922 111.1 43.2 -62.4 -47.8 45.9 12.0 27.0 97 98 A N H >< S+ 0 0 22 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.910 110.3 58.8 -61.1 -42.4 45.4 13.8 23.6 98 99 A L H >< S+ 0 0 0 -4,-2.7 3,-0.6 1,-0.3 -2,-0.2 0.889 97.7 57.6 -54.6 -43.0 42.3 11.6 23.0 99 100 A Y T 3< S+ 0 0 18 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.446 81.5 85.1 -78.0 3.1 40.4 12.7 26.2 100 101 A R T < S+ 0 0 143 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.1 0.067 74.9 110.6 -80.4 23.5 40.7 16.3 25.0 101 102 A C S < S- 0 0 11 -3,-0.6 -45,-0.1 1,-0.2 5,-0.1 -0.333 85.5 -71.6 -87.5 172.5 37.5 15.3 23.1 102 103 A P >> - 0 0 45 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.344 48.1-112.0 -63.1 153.2 33.9 16.6 23.9 103 104 A G G >4 S+ 0 0 60 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.822 116.5 56.3 -57.8 -36.4 32.4 15.2 27.1 104 105 A D G 34 S+ 0 0 111 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.635 101.5 58.4 -72.0 -15.0 29.8 13.1 25.2 105 106 A D G X> S+ 0 0 19 -3,-1.6 4,-1.2 1,-0.2 3,-0.8 0.595 84.4 82.8 -87.7 -11.6 32.6 11.3 23.3 106 107 A K H S+ 0 0 60 -4,-0.4 4,-1.4 1,-0.2 -1,-0.3 0.786 103.1 57.4 -59.6 -28.1 31.9 7.1 26.7 108 109 A K H <> S+ 0 0 64 -3,-0.8 4,-1.5 -4,-0.2 -1,-0.2 0.863 103.1 52.1 -72.6 -38.5 33.0 6.1 23.2 109 110 A I H X S+ 0 0 0 -4,-1.2 4,-2.0 -3,-0.3 -2,-0.2 0.938 108.7 49.3 -61.9 -48.3 36.7 5.9 24.2 110 111 A V H X S+ 0 0 44 -4,-1.7 4,-2.8 1,-0.2 -1,-0.2 0.852 105.5 58.4 -63.5 -34.8 36.0 3.6 27.2 111 112 A R H X S+ 0 0 135 -4,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.924 107.8 46.5 -58.3 -46.5 33.9 1.3 25.0 112 113 A V H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.895 113.2 49.0 -61.2 -42.9 37.0 0.8 22.7 113 114 A L H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.888 108.6 53.7 -65.2 -40.0 39.2 0.2 25.8 114 115 A N H X S+ 0 0 83 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.878 111.1 45.5 -61.1 -41.8 36.7 -2.3 27.2 115 116 A L H X S+ 0 0 59 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.859 110.0 54.4 -70.9 -36.4 36.8 -4.2 23.9 116 117 A W H <>S+ 0 0 1 -4,-2.4 5,-2.5 1,-0.2 4,-0.5 0.943 110.3 47.3 -61.6 -48.4 40.7 -4.0 23.8 117 118 A Q H ><5S+ 0 0 80 -4,-2.8 3,-0.9 3,-0.2 -2,-0.2 0.917 112.8 48.1 -51.6 -51.7 40.8 -5.6 27.3 118 119 A K H 3<5S+ 0 0 148 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.928 118.1 40.0 -61.7 -45.4 38.3 -8.4 26.4 119 120 A N T 3<5S- 0 0 59 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.326 107.8-122.6 -86.7 4.6 40.1 -9.3 23.2 120 121 A N T < 5 + 0 0 124 -3,-0.9 -3,-0.2 -4,-0.5 -4,-0.1 0.848 57.2 153.3 56.5 39.9 43.7 -8.9 24.7 121 122 A V S > - 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0 0 30 -4,-1.2 4,-1.6 -5,-0.4 3,-0.9 0.162 33.5 -95.6 101.0 138.8 11.5 27.8 -6.9 217 79 B Q T 34 S+ 0 0 129 1,-0.2 3,-0.1 2,-0.2 -1,-0.1 0.869 125.7 39.0 -45.2 -49.8 12.5 26.6 -10.4 218 80 B E T 34 S+ 0 0 179 1,-0.2 -1,-0.2 -6,-0.1 -2,-0.1 0.480 114.5 53.0 -89.0 -8.1 14.0 30.0 -11.3 219 81 B K T <4 S+ 0 0 160 -3,-0.9 -1,-0.2 -7,-0.1 -2,-0.2 0.604 80.0 119.8 -99.2 -15.2 15.6 30.6 -7.9 220 82 B D < - 0 0 10 -4,-1.6 -8,-0.1 1,-0.1 -12,-0.0 -0.269 42.1-171.1 -52.2 124.0 17.4 27.3 -7.8 221 83 B V S > S+ 0 0 43 2,-0.1 4,-1.5 3,-0.1 -1,-0.1 0.639 73.5 67.4 -86.8 -21.1 21.2 27.6 -7.5 222 84 B F H > S+ 0 0 0 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.917 93.9 50.2 -75.9 -49.0 22.1 23.9 -8.1 223 85 B A H > S+ 0 0 9 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.916 113.7 45.6 -55.4 -49.0 21.1 23.3 -11.8 224 86 B P H > S+ 0 0 72 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.921 116.7 46.2 -64.1 -42.4 23.0 26.4 -13.1 225 87 B R H >X S+ 0 0 92 -4,-1.5 3,-0.7 1,-0.2 4,-0.5 0.905 112.7 48.7 -60.2 -47.4 26.0 25.5 -10.9 226 88 B F H >< S+ 0 0 4 -4,-3.3 3,-0.5 1,-0.2 -1,-0.2 0.826 103.8 63.9 -61.1 -31.4 25.9 21.7 -12.0 227 89 B S H >< S+ 0 0 28 -4,-2.0 3,-1.1 -5,-0.2 4,-0.3 0.788 86.8 72.4 -63.0 -32.6 25.7 22.9 -15.6 228 90 B N H << S+ 0 0 109 -4,-0.8 -1,-0.2 -3,-0.7 3,-0.2 0.888 115.4 17.7 -53.0 -47.9 29.1 24.5 -15.5 229 91 B N T S+ 0 0 10 -3,-1.1 4,-2.3 1,-0.2 5,-0.2 0.786 70.3 54.9 -63.8 -31.1 28.3 19.0 -16.8 231 93 B I H > S+ 0 0 74 -4,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.963 112.0 43.1 -63.5 -53.6 30.3 17.7 -19.8 232 94 B S H > S+ 0 0 56 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.857 112.4 55.9 -54.3 -38.6 33.1 16.5 -17.6 233 95 B T H X S+ 0 0 4 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.926 109.8 43.7 -66.3 -45.1 30.6 15.1 -15.1 234 96 B F H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.842 106.5 60.1 -72.9 -35.0 28.9 12.9 -17.7 235 97 B Q H < S+ 0 0 114 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.914 112.0 41.6 -52.8 -44.6 32.2 11.8 -19.2 236 98 B N H >< S+ 0 0 15 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.890 112.9 53.8 -70.1 -40.5 32.9 10.4 -15.8 237 99 B L H >< S+ 0 0 0 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.831 100.1 61.1 -60.6 -35.3 29.3 9.0 -15.4 238 100 B Y T 3< S+ 0 0 24 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.535 83.2 79.4 -76.2 -4.6 29.5 7.1 -18.7 239 101 B R T < S+ 0 0 161 -3,-1.3 -1,-0.3 -4,-0.2 -2,-0.1 0.142 75.6 113.3 -80.6 17.9 32.4 5.1 -17.2 240 102 B C S < S- 0 0 15 -3,-0.9 -45,-0.1 1,-0.2 5,-0.1 -0.262 82.7 -68.2 -79.2 171.2 29.6 3.1 -15.5 241 103 B P >> - 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