==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSLATION/RNA 09-JUL-02 1M5P . COMPND 2 MOLECULE: RNA INHIBITOR SUBSTRATE; . SOURCE 2 SYNTHETIC: YES; . AUTHOR P.B.RUPERT,A.MASSEY,S.T.SIGURDSSON,A.R.FERRE-D'AMARE . 184 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11166.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 65.8 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 . 42 22.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 2 1.1 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 . 11 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 43 23.4 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+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 2 0 0 0 0 0 2 0 1 1 0 0 0 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 2 0 2 4 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 . 2 0 2 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 6 C T 0 0 112 0, 0.0 3,-0.1 0, 0.0 81,-0.1 0.000 360.0 360.0 360.0 161.9 32.1 34.5 54.7 2 7 C R - 0 0 200 81,-0.1 80,-0.0 1,-0.1 0, 0.0 -0.526 360.0-103.4 -72.5 128.2 29.8 32.3 52.6 3 8 C P + 0 0 74 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.172 49.2 178.1 -52.1 145.2 29.4 28.6 53.8 4 9 C N - 0 0 13 53,-0.2 50,-0.1 2,-0.1 52,-0.1 -0.972 45.1-111.0-148.8 157.4 31.5 26.2 51.7 5 10 C H S S+ 0 0 49 -2,-0.3 49,-2.1 55,-0.1 2,-0.3 0.832 105.4 57.6 -57.2 -34.7 32.3 22.5 51.5 6 11 C T E S-A 53 0A 0 47,-0.2 76,-2.3 78,-0.1 2,-0.5 -0.780 72.9-151.7-103.1 145.2 35.9 23.4 52.6 7 12 C I E -AB 52 81A 0 45,-1.6 45,-1.7 -2,-0.3 2,-0.5 -0.951 12.9-138.8-116.5 131.8 36.9 25.2 55.7 8 13 C Y E -AB 51 80A 50 72,-3.0 72,-2.6 -2,-0.5 2,-0.4 -0.791 22.7-167.5 -91.8 130.1 40.1 27.3 55.7 9 14 C I E +AB 50 79A 0 41,-2.3 41,-1.8 -2,-0.5 2,-0.3 -0.969 12.1 163.2-122.4 127.3 42.1 26.9 59.0 10 15 C N E +AB 49 78A 34 68,-2.6 68,-2.1 -2,-0.4 39,-0.2 -0.865 44.6 61.9-139.0 176.5 45.0 29.0 60.2 11 16 C N + 0 0 67 37,-0.9 2,-0.3 -2,-0.3 -1,-0.2 0.904 68.7 156.1 74.3 44.7 47.1 29.9 63.1 12 17 C L - 0 0 2 36,-1.5 2,-0.4 -3,-0.2 -1,-0.3 -0.771 58.2 -86.8 -99.6 149.1 48.3 26.3 63.4 13 18 C N > - 0 0 42 59,-0.4 3,-1.1 -2,-0.3 35,-0.2 -0.375 38.2-154.9 -59.7 112.6 51.6 25.5 65.1 14 19 C E T 3 S+ 0 0 111 -2,-0.4 -1,-0.2 1,-0.2 34,-0.1 0.740 83.5 68.4 -62.4 -26.5 54.1 25.8 62.3 15 20 C K T 3 S+ 0 0 186 2,-0.1 -1,-0.2 33,-0.0 2,-0.1 0.746 74.5 103.2 -68.8 -23.9 56.6 23.5 63.8 16 21 C I S < S- 0 0 27 -3,-1.1 -4,-0.0 1,-0.1 0, 0.0 -0.380 79.4-113.3 -62.0 130.1 54.5 20.4 63.4 17 22 C K > - 0 0 150 -2,-0.1 4,-2.6 1,-0.1 5,-0.3 -0.221 26.8-111.0 -63.7 153.8 55.6 18.2 60.5 18 23 C K H > S+ 0 0 107 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.897 110.8 45.1 -54.2 -52.5 53.2 17.9 57.5 19 24 C D H > S+ 0 0 106 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.932 115.9 47.5 -64.0 -40.7 52.1 14.3 57.8 20 25 C E H > S+ 0 0 99 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.928 111.0 49.2 -65.2 -46.5 51.4 14.5 61.5 21 26 C L H X S+ 0 0 10 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.956 112.2 51.6 -55.3 -47.8 49.5 17.8 61.4 22 27 C K H X S+ 0 0 65 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.2 0.877 110.9 46.5 -58.5 -41.4 47.5 16.2 58.6 23 28 C K H X S+ 0 0 136 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.971 112.9 47.8 -68.7 -48.5 46.7 13.1 60.7 24 29 C S H X S+ 0 0 23 -4,-3.0 4,-2.4 1,-0.2 5,-0.3 0.965 110.5 53.2 -54.0 -54.7 45.8 15.0 63.8 25 30 C L H X S+ 0 0 0 -4,-3.0 4,-1.4 -5,-0.2 -1,-0.2 0.871 107.8 51.1 -46.9 -44.5 43.5 17.3 61.8 26 31 C H H >X S+ 0 0 85 -4,-1.8 4,-2.7 -5,-0.2 3,-0.9 0.975 109.6 49.2 -59.9 -52.4 41.7 14.3 60.3 27 32 C A H 3X S+ 0 0 68 -4,-2.4 4,-0.6 1,-0.3 -2,-0.2 0.918 110.8 50.0 -49.8 -53.5 41.1 12.8 63.8 28 33 C I H 3< S+ 0 0 44 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.718 120.2 35.3 -59.5 -27.4 39.7 16.0 65.2 29 34 C F H X< S+ 0 0 0 -4,-1.4 3,-2.8 -3,-0.9 4,-0.5 0.696 88.0 90.9-104.7 -21.9 37.3 16.6 62.3 30 35 C S H >< S+ 0 0 48 -4,-2.7 3,-1.7 1,-0.3 -2,-0.1 0.820 78.7 67.6 -41.7 -42.9 36.1 13.1 61.3 31 36 C R T 3< S+ 0 0 171 -4,-0.6 -1,-0.3 1,-0.3 3,-0.1 0.691 93.2 58.8 -57.2 -20.5 33.2 13.3 63.7 32 37 C F T < S- 0 0 26 -3,-2.8 -1,-0.3 1,-0.3 2,-0.3 0.677 122.1 -63.3 -85.7 -16.4 31.5 16.0 61.6 33 38 C G S < S- 0 0 23 -3,-1.7 -1,-0.3 -4,-0.5 -4,-0.0 -0.871 73.2 -40.0 154.3 173.7 31.3 14.0 58.4 34 39 C Q - 0 0 123 -2,-0.3 21,-1.3 -3,-0.1 2,-0.5 -0.227 51.9-142.1 -59.7 154.3 33.3 12.3 55.7 35 40 C I E -C 54 0A 22 19,-0.2 19,-0.2 1,-0.1 3,-0.1 -0.977 12.0-166.1-124.2 117.2 36.4 14.1 54.6 36 41 C L E S- 0 0 59 17,-1.9 2,-0.3 -2,-0.5 18,-0.2 0.795 70.3 -36.0 -71.8 -28.2 37.3 14.0 50.9 37 42 C D E -C 53 0A 58 16,-1.2 16,-2.3 2,-0.0 2,-0.4 -0.935 47.7-131.4 176.5 165.2 40.8 15.3 51.5 38 43 C I E -C 52 0A 5 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.951 18.7-151.4-138.6 113.8 43.0 17.7 53.6 39 44 C L E +C 51 0A 79 12,-2.2 12,-1.7 -2,-0.4 2,-0.3 -0.730 22.9 164.1 -93.2 131.9 45.4 20.1 52.0 40 45 C V E +C 50 0A 16 -2,-0.4 2,-0.3 10,-0.2 10,-0.1 -0.980 5.9 171.5-148.0 130.2 48.5 21.1 54.0 41 46 C S - 0 0 52 8,-0.5 8,-0.4 -2,-0.3 7,-0.1 -0.996 24.9-155.7-141.2 142.3 51.7 22.7 52.8 42 47 C R + 0 0 110 -2,-0.3 2,-0.0 5,-0.2 -1,-0.0 0.098 52.3 129.4-105.8 21.0 54.6 24.1 54.8 43 48 C S S > S- 0 0 55 1,-0.1 4,-3.2 4,-0.0 3,-0.3 -0.348 78.8 -94.9 -70.8 157.3 55.8 26.4 52.1 44 49 C L T 4 S+ 0 0 122 1,-0.2 -1,-0.1 2,-0.2 -3,-0.0 0.823 124.3 34.7 -38.9 -49.4 56.3 30.1 53.0 45 50 C K T 4 S+ 0 0 154 1,-0.1 -1,-0.2 3,-0.0 -3,-0.0 0.791 124.1 40.9 -83.2 -28.4 52.8 31.1 52.0 46 51 C M T >4 S+ 0 0 71 -3,-0.3 3,-1.1 2,-0.0 -5,-0.3 0.745 85.4 109.7 -93.7 -23.0 50.9 28.0 52.9 47 52 C R T 3< S+ 0 0 99 -4,-3.2 -5,-0.2 1,-0.2 3,-0.1 -0.077 75.0 32.8 -53.2 151.5 52.5 27.1 56.3 48 53 C G T 3 S+ 0 0 11 1,-0.3 -36,-1.5 -35,-0.2 -37,-0.9 0.466 112.3 85.5 78.6 4.5 50.4 27.5 59.4 49 54 C Q E < +A 10 0A 35 -3,-1.1 -8,-0.5 -8,-0.4 2,-0.3 -0.859 47.8 175.5-136.2 167.1 47.3 26.7 57.4 50 55 C A E -AC 9 40A 1 -41,-1.8 -41,-2.3 -2,-0.3 2,-0.4 -0.923 20.2-142.5-169.0 140.8 45.2 23.9 56.0 51 56 C F E -AC 8 39A 61 -12,-1.7 -12,-2.2 -2,-0.3 2,-0.6 -0.924 14.6-159.5-108.4 138.6 42.0 23.4 54.1 52 57 C V E -AC 7 38A 0 -45,-1.7 -45,-1.6 -2,-0.4 2,-0.7 -0.964 9.8-150.0-121.0 111.4 39.8 20.5 55.1 53 58 C I E -AC 6 37A 2 -16,-2.3 -17,-1.9 -2,-0.6 -16,-1.2 -0.751 11.0-161.3 -90.2 113.3 37.4 19.4 52.3 54 59 C F E - C 0 35A 0 -49,-2.1 -19,-0.2 -2,-0.7 3,-0.1 -0.652 22.1-137.6 -92.7 145.9 34.1 17.9 53.5 55 60 C K S S+ 0 0 99 -21,-1.3 2,-0.5 -2,-0.3 -1,-0.1 0.839 95.1 42.7 -70.3 -30.2 31.8 15.8 51.4 56 61 C E S >> S- 0 0 102 -22,-0.4 3,-1.3 -51,-0.1 4,-1.2 -0.960 72.1-144.7-125.3 123.4 28.8 17.7 52.8 57 62 C V H 3> S+ 0 0 50 -2,-0.5 4,-1.9 1,-0.3 3,-0.5 0.865 101.2 62.0 -44.6 -49.1 28.6 21.4 53.4 58 63 C S H 3> S+ 0 0 70 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.889 101.4 54.8 -46.6 -43.7 26.5 20.9 56.6 59 64 C S H <> S+ 0 0 11 -3,-1.3 4,-2.4 1,-0.2 5,-0.3 0.912 103.6 53.6 -57.4 -45.9 29.5 19.1 58.0 60 65 C A H X S+ 0 0 0 -4,-1.2 4,-2.2 -3,-0.5 -1,-0.2 0.902 109.4 51.0 -56.5 -41.4 31.8 22.1 57.3 61 66 C T H X S+ 0 0 22 -4,-1.9 4,-2.8 2,-0.2 5,-0.3 0.983 111.1 43.1 -61.7 -62.3 29.4 24.3 59.3 62 67 C N H X S+ 0 0 78 -4,-2.2 4,-3.9 1,-0.2 5,-0.3 0.931 115.3 50.7 -50.3 -51.2 29.1 22.2 62.4 63 68 C A H X S+ 0 0 0 -4,-2.4 4,-3.0 -5,-0.2 -1,-0.2 0.903 110.8 50.0 -53.6 -44.6 32.8 21.6 62.5 64 69 C L H < S+ 0 0 20 -4,-2.2 4,-0.5 -5,-0.3 -2,-0.2 0.961 116.6 39.3 -60.2 -53.8 33.4 25.3 62.1 65 70 C R H >< S+ 0 0 183 -4,-2.8 3,-0.7 1,-0.2 -2,-0.2 0.921 119.2 48.5 -62.3 -44.4 31.1 26.2 64.9 66 71 C S H 3< S+ 0 0 50 -4,-3.9 -2,-0.2 -5,-0.3 -1,-0.2 0.888 118.0 36.4 -64.4 -42.6 32.2 23.3 67.1 67 72 C M T >< S+ 0 0 3 -4,-3.0 3,-1.9 -5,-0.3 2,-0.4 0.164 74.6 138.4-102.2 18.8 35.9 23.8 66.7 68 73 C Q T < S- 0 0 100 -3,-0.7 10,-0.2 -4,-0.5 9,-0.1 -0.497 86.5 -2.1 -67.9 121.3 36.4 27.5 66.7 69 74 C G T 3 S+ 0 0 25 8,-2.6 -1,-0.3 -2,-0.4 9,-0.1 0.635 90.7 168.3 76.6 11.8 39.4 28.4 68.8 70 75 C F < - 0 0 25 -3,-1.9 7,-3.0 7,-0.3 2,-0.6 -0.280 44.5-104.9 -59.0 143.0 40.0 24.7 69.7 71 76 C P E +D 76 0B 15 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.614 50.5 167.4 -73.8 115.6 43.4 24.1 71.4 72 77 C F E > -D 75 0B 9 3,-2.0 3,-1.0 -2,-0.6 -59,-0.4 -0.953 68.8 -21.4-136.3 114.4 45.6 22.4 68.8 73 78 C Y T 3 S- 0 0 56 -2,-0.4 -1,-0.1 1,-0.2 -57,-0.1 0.918 126.1 -53.9 53.3 43.4 49.3 22.0 69.4 74 79 C D T 3 S+ 0 0 80 85,-0.2 -1,-0.2 1,-0.1 86,-0.1 0.709 122.1 94.6 67.6 22.2 49.2 24.8 71.9 75 80 C K E < S-D 72 0B 58 -3,-1.0 -3,-2.0 -5,-0.1 2,-0.5 -0.992 79.5-113.1-144.1 133.0 47.5 27.4 69.6 76 81 C P E -D 71 0B 79 0, 0.0 -6,-0.2 0, 0.0 2,-0.1 -0.543 36.9-121.6 -73.3 121.5 43.8 28.2 69.3 77 82 C M - 0 0 2 -7,-3.0 -8,-2.6 -2,-0.5 2,-0.6 -0.350 19.8-152.2 -61.5 129.9 42.6 27.1 65.9 78 83 C R E -B 10 0A 130 -68,-2.1 -68,-2.6 -10,-0.2 2,-0.4 -0.936 19.6-172.3-108.4 122.4 41.1 29.9 63.7 79 84 C I E +B 9 0A 6 -2,-0.6 2,-0.3 -70,-0.2 -70,-0.2 -0.927 15.4 155.6-123.0 139.4 38.5 28.6 61.3 80 85 C Q E -B 8 0A 53 -72,-2.6 -72,-3.0 -2,-0.4 2,-0.1 -0.949 47.2 -90.6-147.3 163.8 36.5 30.1 58.4 81 86 C Y E -B 7 0A 28 -2,-0.3 -74,-0.3 -74,-0.3 2,-0.2 -0.438 54.7 -99.7 -70.8 153.2 34.7 28.8 55.3 82 87 C A - 0 0 4 -76,-2.3 -76,-0.1 1,-0.1 -1,-0.1 -0.516 24.6-128.2 -75.3 143.9 37.0 28.8 52.2 83 88 C K S S+ 0 0 188 -2,-0.2 2,-0.3 -82,-0.1 -1,-0.1 0.901 89.1 13.2 -59.2 -43.2 36.6 31.9 49.9 84 89 C T S S- 0 0 102 1,-0.1 -78,-0.1 -80,-0.0 2,-0.1 -0.804 94.4 -85.8-127.4 170.9 36.1 29.7 46.8 85 90 C D - 0 0 76 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 -0.350 43.2-116.5 -72.6 156.3 35.5 26.0 46.2 86 91 C S >> - 0 0 19 1,-0.1 4,-2.1 -2,-0.1 3,-1.1 -0.685 32.2-105.4 -91.3 151.0 38.5 23.7 46.0 87 92 C D H >> S+ 0 0 114 -2,-0.3 4,-3.4 1,-0.3 3,-0.6 0.893 118.2 59.5 -38.8 -61.7 39.1 22.0 42.6 88 93 C I H 34 S+ 0 0 67 1,-0.3 -1,-0.3 2,-0.2 -3,-0.0 0.816 113.3 38.2 -35.2 -49.2 37.8 18.6 43.8 89 94 C I H X4 S+ 0 0 19 -3,-1.1 3,-0.7 1,-0.1 -1,-0.3 0.809 118.3 48.2 -78.4 -33.1 34.4 20.2 44.6 90 95 C A H << S+ 0 0 57 -4,-2.1 2,-0.8 -3,-0.6 -2,-0.2 0.950 107.3 54.1 -72.3 -51.6 34.3 22.5 41.6 91 96 C K T 3< 0 0 167 -4,-3.4 -1,-0.2 -5,-0.2 -2,-0.1 0.025 360.0 360.0 -72.8 31.5 35.3 19.9 39.1 92 97 C M < 0 0 158 -2,-0.8 -3,-0.1 -3,-0.7 -4,-0.0 -0.650 360.0 360.0-131.5 360.0 32.4 17.8 40.4 93 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 94 6 F T 0 0 107 0, 0.0 81,-0.1 0, 0.0 82,-0.1 0.000 360.0 360.0 360.0 177.5 50.7 33.4 88.1 95 7 F R - 0 0 203 81,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.574 360.0 -96.6 -73.7 136.9 53.6 31.4 89.5 96 8 F P - 0 0 76 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.268 54.5-178.5 -54.5 145.5 53.7 27.9 88.1 97 9 F N - 0 0 11 2,-0.2 56,-0.1 53,-0.2 50,-0.1 -0.945 44.1-113.4-144.2 162.2 52.1 25.5 90.6 98 10 F H S S+ 0 0 45 -2,-0.3 49,-2.7 55,-0.1 2,-0.3 0.798 104.4 59.2 -64.9 -29.4 51.3 21.8 91.1 99 11 F T E S-E 146 0C 0 47,-0.2 76,-2.6 76,-0.1 2,-0.5 -0.774 70.5-153.8-105.3 148.1 47.6 22.7 90.9 100 12 F I E -EF 145 174C 0 45,-1.8 45,-1.8 -2,-0.3 2,-0.5 -0.973 13.1-141.6-119.4 131.5 45.7 24.5 88.1 101 13 F Y E -EF 144 173C 49 72,-3.2 72,-3.3 -2,-0.5 2,-0.4 -0.822 22.7-169.3 -93.3 131.7 42.7 26.5 88.9 102 14 F I E +EF 143 172C 0 41,-2.0 41,-2.0 -2,-0.5 2,-0.3 -0.983 11.3 163.2-126.2 132.2 40.1 26.0 86.2 103 15 F N E +EF 142 171C 28 68,-2.6 68,-3.0 -2,-0.4 39,-0.2 -0.895 43.1 70.0-144.4 176.9 36.9 27.9 85.7 104 16 F N + 0 0 47 37,-1.2 2,-0.2 -2,-0.3 38,-0.2 0.797 69.3 158.3 81.2 33.1 34.1 28.9 83.4 105 17 F L - 0 0 4 36,-1.9 2,-0.8 -3,-0.2 -1,-0.2 -0.560 54.5 -91.0 -86.5 153.5 32.8 25.3 83.8 106 18 F N > - 0 0 26 -2,-0.2 3,-1.8 59,-0.2 35,-0.1 -0.527 33.0-156.4 -70.0 107.6 29.2 24.4 83.1 107 19 F E T 3 S+ 0 0 107 -2,-0.8 -1,-0.2 1,-0.3 34,-0.1 0.620 84.1 70.1 -60.4 -12.6 27.5 24.7 86.4 108 20 F K T 3 S+ 0 0 177 58,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.610 76.6 98.9 -84.6 -7.8 24.7 22.3 85.4 109 21 F I S < S- 0 0 17 -3,-1.8 2,-0.1 1,-0.1 -4,-0.0 -0.557 78.7-113.5 -81.5 141.8 27.0 19.2 85.5 110 22 F K > - 0 0 130 -2,-0.2 4,-3.8 1,-0.1 5,-0.2 -0.362 25.8-114.9 -70.0 151.6 26.9 16.9 88.6 111 23 F K H > S+ 0 0 87 2,-0.2 4,-4.3 1,-0.2 5,-0.3 0.950 116.0 44.4 -52.4 -57.0 30.1 16.8 90.7 112 24 F D H > S+ 0 0 111 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.947 115.7 48.7 -55.0 -49.6 30.8 13.1 89.9 113 25 F E H > S+ 0 0 71 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.975 117.7 41.2 -52.3 -57.5 30.0 13.7 86.2 114 26 F L H X S+ 0 0 6 -4,-3.8 4,-2.7 2,-0.2 5,-0.2 0.928 114.4 49.9 -58.0 -52.9 32.3 16.7 86.2 115 27 F K H X S+ 0 0 78 -4,-4.3 4,-2.4 -5,-0.2 5,-0.2 0.970 113.0 47.3 -50.4 -61.3 35.1 15.2 88.3 116 28 F K H X S+ 0 0 134 -4,-2.5 4,-2.0 -5,-0.3 -2,-0.2 0.895 112.9 46.7 -46.4 -57.4 35.3 12.1 86.1 117 29 F S H X S+ 0 0 17 -4,-2.5 4,-2.5 -5,-0.3 3,-0.3 0.947 110.6 53.7 -55.1 -50.5 35.3 13.9 82.8 118 30 F L H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.3 -1,-0.2 0.910 108.8 48.8 -49.2 -47.7 37.9 16.3 84.0 119 31 F H H X S+ 0 0 87 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.3 0.873 111.2 51.2 -60.6 -37.8 40.1 13.4 85.0 120 32 F A H < S+ 0 0 67 -4,-2.0 4,-0.2 -3,-0.3 -2,-0.2 0.877 113.8 43.0 -65.9 -41.3 39.5 11.9 81.6 121 33 F I H < S+ 0 0 43 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.749 124.0 35.4 -78.0 -26.7 40.5 15.1 79.8 122 34 F F H >< S+ 0 0 0 -4,-2.1 3,-1.9 -5,-0.3 4,-0.3 0.639 87.1 89.9-105.9 -15.8 43.6 15.8 82.0 123 35 F S G >< S+ 0 0 58 -4,-2.2 3,-1.4 1,-0.3 -1,-0.1 0.723 74.4 74.1 -56.5 -22.5 45.1 12.5 82.9 124 36 F R G 3 S+ 0 0 178 1,-0.2 -1,-0.3 -4,-0.2 3,-0.1 0.602 86.3 63.2 -69.5 -9.0 47.4 12.5 79.8 125 37 F F G < S- 0 0 24 -3,-1.9 -1,-0.2 1,-0.4 2,-0.2 0.589 120.8 -68.6 -92.7 -7.2 49.7 15.2 81.3 126 38 F G S < S- 0 0 25 -3,-1.4 -1,-0.4 -4,-0.3 -4,-0.0 -0.763 77.6 -28.8 142.1 170.8 50.8 13.0 84.2 127 39 F Q - 0 0 126 -2,-0.2 21,-2.2 -3,-0.1 2,-0.6 -0.250 54.4-147.7 -53.8 137.9 49.6 11.5 87.4 128 40 F I E -G 147 0C 20 19,-0.2 19,-0.2 1,-0.1 3,-0.1 -0.953 10.7-168.1-113.0 111.9 46.8 13.4 89.0 129 41 F L E - 0 0 55 17,-1.2 2,-0.3 -2,-0.6 18,-0.2 0.773 67.6 -23.0 -72.3 -26.9 46.7 13.3 92.9 130 42 F D E -G 146 0C 69 16,-1.4 16,-2.7 2,-0.0 2,-0.4 -0.966 44.1-143.2-175.8 162.8 43.3 14.8 93.1 131 43 F I E -G 145 0C 7 -2,-0.3 2,-0.6 14,-0.2 14,-0.2 -0.960 19.7-157.6-138.5 114.6 40.5 17.0 91.6 132 44 F L E +G 144 0C 75 12,-2.3 12,-2.4 -2,-0.4 2,-0.4 -0.857 18.3 169.2-101.3 121.9 38.5 19.2 94.0 133 45 F V E +G 143 0C 9 -2,-0.6 2,-0.4 10,-0.2 10,-0.1 -0.995 6.0 176.4-133.9 132.9 35.1 20.2 92.8 134 46 F S - 0 0 46 8,-0.5 8,-0.4 5,-0.5 7,-0.0 -0.996 22.6-158.7-141.0 134.5 32.3 21.9 94.7 135 47 F R + 0 0 87 -2,-0.4 5,-0.2 5,-0.2 2,-0.1 0.080 50.9 128.7 -96.6 21.6 28.9 23.2 93.6 136 48 F S S >> S- 0 0 52 1,-0.1 4,-2.5 2,-0.0 3,-1.4 -0.379 78.4 -95.5 -73.9 158.2 28.5 25.6 96.5 137 49 F L T 34 S+ 0 0 117 1,-0.3 3,-0.1 2,-0.2 -1,-0.1 0.850 124.2 36.4 -36.5 -53.8 27.5 29.2 95.7 138 50 F K T 34 S+ 0 0 166 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.611 125.0 38.5 -82.8 -12.7 31.2 30.4 95.8 139 51 F M T X4 S+ 0 0 66 -3,-1.4 3,-1.1 3,-0.0 -5,-0.5 0.494 82.2 115.5-117.1 -4.9 32.8 27.4 94.3 140 52 F R T 3< S+ 0 0 95 -4,-2.5 -5,-0.2 1,-0.2 -33,-0.1 -0.355 73.7 32.6 -65.2 145.3 30.5 26.3 91.6 141 53 F G T 3 S+ 0 0 12 1,-0.3 -36,-1.9 -35,-0.1 -37,-1.2 0.524 108.4 81.4 86.6 7.5 31.9 26.6 88.0 142 54 F Q E < -E 103 0C 31 -3,-1.1 -8,-0.5 -8,-0.4 -1,-0.3 -0.893 50.3-175.8-139.1 169.2 35.4 25.8 89.1 143 55 F A E -EG 102 133C 0 -41,-2.0 -41,-2.0 -2,-0.3 2,-0.4 -0.946 18.5-138.0-165.5 142.1 37.6 22.9 89.9 144 56 F F E -EG 101 132C 58 -12,-2.4 -12,-2.3 -2,-0.3 2,-0.5 -0.900 14.8-165.2-106.1 137.8 41.1 22.4 91.1 145 57 F V E -EG 100 131C 0 -45,-1.8 -45,-1.8 -2,-0.4 2,-0.5 -0.964 7.5-155.9-127.0 114.4 43.2 19.7 89.6 146 58 F I E -EG 99 130C 4 -16,-2.7 -16,-1.4 -2,-0.5 -17,-1.2 -0.797 7.0-161.9 -96.5 121.7 46.3 18.8 91.4 147 59 F F E - G 0 128C 0 -49,-2.7 -19,-0.2 -2,-0.5 -20,-0.1 -0.704 24.2-132.4-100.7 151.4 49.2 17.2 89.5 148 60 F K S S+ 0 0 100 -21,-2.2 2,-0.4 -2,-0.3 -20,-0.1 0.815 95.4 40.4 -71.7 -28.0 52.0 15.2 91.1 149 61 F E > - 0 0 97 -22,-0.4 4,-1.1 -51,-0.1 -1,-0.1 -0.958 69.4-143.5-126.5 140.8 54.5 17.2 89.0 150 62 F V H >> S+ 0 0 40 -2,-0.4 4,-2.7 2,-0.2 3,-0.6 0.903 104.6 59.7 -65.0 -41.9 54.6 20.9 88.1 151 63 F S H 3> S+ 0 0 79 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.938 103.6 55.0 -51.4 -44.5 55.9 20.2 84.6 152 64 F S H 3> S+ 0 0 14 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.881 108.6 46.7 -55.3 -39.0 52.7 18.2 84.3 153 65 F A H < S+ 0 0 6 -4,-0.9 3,-2.2 -3,-0.3 2,-0.3 0.296 72.7 135.5-132.1 9.0 43.9 22.9 77.3 161 73 F Q T 3 S+ 0 0 83 -4,-0.5 10,-0.2 1,-0.3 9,-0.0 -0.448 86.5 3.4 -59.7 119.3 43.4 26.6 77.4 162 74 F G T 3 S+ 0 0 23 8,-1.9 -1,-0.3 -2,-0.3 9,-0.1 0.457 88.8 168.9 82.8 1.4 40.0 27.1 75.9 163 75 F F < - 0 0 46 -3,-2.2 7,-2.1 6,-0.2 2,-0.2 -0.180 42.1-108.8 -53.5 132.4 39.1 23.5 75.5 164 76 F P E +H 169 0D 51 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.470 48.2 167.8 -65.2 127.1 35.4 22.8 74.7 165 77 F F E > -H 168 0D 12 3,-1.8 3,-2.5 -2,-0.2 -59,-0.2 -0.948 65.0 -25.0-149.9 120.2 33.7 21.3 77.8 166 78 F Y T 3 S- 0 0 68 -2,-0.3 -58,-0.1 1,-0.3 -57,-0.1 0.861 127.0 -49.3 39.4 49.6 30.0 20.8 78.3 167 79 F D T 3 S+ 0 0 162 1,-0.1 -1,-0.3 -61,-0.0 -62,-0.0 0.494 124.4 88.1 73.6 8.0 29.4 23.7 75.9 168 80 F K E < S-H 165 0D 68 -3,-2.5 -3,-1.8 -5,-0.1 2,-0.7 -0.993 76.4-121.9-136.2 141.5 31.8 26.2 77.5 169 81 F P E -H 164 0D 75 0, 0.0 -6,-0.2 0, 0.0 -7,-0.1 -0.753 36.9-127.9 -85.0 119.8 35.5 26.8 76.8 170 82 F M - 0 0 1 -7,-2.1 -8,-1.9 -2,-0.7 2,-0.4 -0.314 11.3-141.3 -67.8 146.2 37.3 26.3 80.1 171 83 F R E -F 103 0C 121 -68,-3.0 -68,-2.6 -10,-0.2 2,-0.4 -0.913 18.5-161.1-107.1 134.9 39.7 28.9 81.4 172 84 F I E +F 102 0C 4 -2,-0.4 2,-0.3 -70,-0.2 -70,-0.2 -0.968 17.3 162.6-126.7 125.5 42.9 27.6 83.1 173 85 F Q E -F 101 0C 84 -72,-3.3 -72,-3.2 -2,-0.4 2,-0.2 -0.907 45.6 -99.3-129.9 158.0 45.2 29.4 85.5 174 86 F Y E -F 100 0C 22 -2,-0.3 -74,-0.3 -74,-0.3 -79,-0.1 -0.553 53.6 -97.5 -71.9 145.4 47.9 28.1 87.9 175 87 F A - 0 0 2 -76,-2.6 -76,-0.1 -2,-0.2 -1,-0.1 -0.378 24.6-132.5 -63.0 141.5 46.4 27.9 91.5 176 88 F K S S+ 0 0 187 1,-0.1 2,-0.3 -82,-0.1 -1,-0.1 0.825 88.6 30.6 -64.1 -29.8 47.5 31.0 93.5 177 89 F T S S- 0 0 109 -80,-0.0 -1,-0.1 1,-0.0 3,-0.1 -0.983 91.4 -99.6-135.2 141.8 48.4 28.7 96.4 178 90 F D - 0 0 75 -2,-0.3 2,-0.2 1,-0.1 -2,-0.0 -0.170 47.3-115.0 -51.8 147.8 49.8 25.2 96.9 179 91 F S >> - 0 0 22 1,-0.1 3,-1.9 -4,-0.0 4,-1.8 -0.585 28.9-103.4 -86.1 153.6 46.9 22.8 97.8 180 92 F D H 3> S+ 0 0 121 1,-0.3 4,-2.5 -2,-0.2 3,-0.3 0.871 119.4 53.5 -46.4 -48.2 47.0 21.3 101.2 181 93 F I H 34 S+ 0 0 76 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.765 111.9 47.9 -61.9 -20.1 48.2 17.8 100.1 182 94 F I H X4 S+ 0 0 17 -3,-1.9 3,-0.5 2,-0.1 -1,-0.2 0.819 113.0 45.3 -86.7 -34.7 51.1 19.5 98.3 183 95 F A H 3< S+ 0 0 62 -4,-1.8 -2,-0.2 -3,-0.3 -3,-0.1 0.895 105.2 60.7 -74.7 -42.4 52.2 21.7 101.1 184 96 F K T 3< 0 0 168 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.1 0.452 360.0 360.0 -66.2 -1.1 52.0 18.9 103.8 185 97 F M < 0 0 170 -3,-0.5 -3,-0.0 -5,-0.2 -4,-0.0 -0.485 360.0 360.0 -84.6 360.0 54.6 17.0 101.8