==== 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 TRANSLATION/RNA 09-JUL-02 1M5K . COMPND 2 MOLECULE: RNA INHIBITOR SUBSTRATE; . SOURCE 2 SYNTHETIC: YES; . AUTHOR P.B.RUPERT,A.R.FERRE-D'AMARE . 184 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11196.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 64.7 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 . 41 22.3 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 . 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 . 21 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 23.9 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 0 2 2 0 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 3 3 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 0 122 0, 0.0 82,-0.1 0, 0.0 81,-0.1 0.000 360.0 360.0 360.0 139.1 28.9 34.1 53.6 2 7 C R - 0 0 199 81,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.492 360.0-111.3 -71.1 128.4 27.1 31.7 51.4 3 8 C P + 0 0 73 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.358 45.5 179.7 -62.0 142.1 26.7 28.1 52.7 4 9 C N - 0 0 15 2,-0.3 56,-0.1 53,-0.2 57,-0.1 -0.876 45.0-110.0-138.6 167.2 28.8 25.7 50.7 5 10 C H S S+ 0 0 48 -2,-0.3 49,-2.0 55,-0.1 2,-0.3 0.801 105.4 61.8 -67.1 -29.7 29.7 22.0 50.6 6 11 C T E S-A 53 0A 0 47,-0.2 76,-2.2 76,-0.1 2,-0.5 -0.746 71.0-153.8-102.9 147.8 33.1 23.0 51.7 7 12 C I E -AB 52 81A 0 45,-1.3 45,-1.7 -2,-0.3 2,-0.5 -0.974 11.9-142.0-120.4 130.3 34.2 24.8 54.9 8 13 C Y E -AB 51 80A 44 72,-2.9 72,-2.8 -2,-0.5 2,-0.5 -0.818 21.4-168.9 -91.5 126.3 37.3 26.9 55.0 9 14 C I E +AB 50 79A 0 41,-2.5 41,-1.8 -2,-0.5 2,-0.3 -0.972 12.0 163.3-120.6 126.4 39.2 26.5 58.3 10 15 C N E +AB 49 78A 37 68,-2.3 68,-2.3 -2,-0.5 39,-0.2 -0.817 44.8 64.5-135.3 178.9 42.0 28.6 59.5 11 16 C N S S+ 0 0 65 37,-0.7 2,-0.3 1,-0.3 -1,-0.2 0.892 70.6 155.6 73.7 41.8 44.1 29.6 62.5 12 17 C L - 0 0 3 36,-1.7 2,-0.3 -3,-0.2 -1,-0.3 -0.716 56.5 -86.9 -97.7 153.6 45.3 26.0 62.7 13 18 C N > - 0 0 42 -2,-0.3 3,-0.8 59,-0.3 35,-0.2 -0.444 35.9-155.2 -62.4 121.1 48.5 25.1 64.5 14 19 C E T 3 S+ 0 0 109 -2,-0.3 -1,-0.2 1,-0.2 34,-0.1 0.577 83.1 66.6 -77.5 -11.4 51.2 25.4 61.8 15 20 C K T 3 S+ 0 0 187 2,-0.1 2,-0.4 33,-0.0 -1,-0.2 0.558 74.6 104.8 -88.8 -5.2 53.7 23.0 63.4 16 21 C I S < S- 0 0 24 -3,-0.8 -4,-0.0 1,-0.1 5,-0.0 -0.615 79.1-112.8 -78.6 126.0 51.6 19.9 62.9 17 22 C K > - 0 0 152 -2,-0.4 4,-2.9 1,-0.1 5,-0.3 -0.218 28.9-111.9 -56.8 145.9 52.7 17.7 60.1 18 23 C K H > S+ 0 0 101 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.877 112.1 43.6 -47.6 -55.7 50.4 17.5 57.1 19 24 C D H > S+ 0 0 92 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.869 115.2 48.7 -66.3 -33.7 49.2 13.9 57.4 20 25 C E H > S+ 0 0 108 2,-0.2 4,-2.7 -3,-0.2 5,-0.2 0.939 113.3 47.5 -69.7 -42.7 48.7 14.1 61.2 21 26 C L H X S+ 0 0 7 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.925 111.3 52.7 -60.3 -43.0 46.8 17.4 60.8 22 27 C K H X S+ 0 0 55 -4,-2.6 4,-1.5 -5,-0.3 -1,-0.2 0.878 111.9 43.6 -62.7 -40.3 44.7 15.8 58.0 23 28 C K H X S+ 0 0 125 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.898 110.8 53.8 -74.6 -38.9 43.8 12.7 60.1 24 29 C S H X S+ 0 0 25 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.930 109.7 50.4 -59.2 -43.3 43.0 14.8 63.3 25 30 C L H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 5,-0.2 0.891 109.5 49.6 -61.3 -42.2 40.6 16.9 61.2 26 31 C H H X S+ 0 0 89 -4,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.954 110.4 50.0 -62.4 -49.1 38.9 13.9 59.7 27 32 C A H < S+ 0 0 70 -4,-2.6 4,-0.5 1,-0.2 -2,-0.2 0.901 113.3 47.7 -54.6 -44.7 38.4 12.3 63.2 28 33 C I H < S+ 0 0 43 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.840 121.0 32.8 -67.0 -39.2 36.9 15.6 64.5 29 34 C F H >< S+ 0 0 0 -4,-2.2 3,-2.5 -5,-0.2 4,-0.4 0.647 89.8 95.1 -97.3 -14.8 34.5 16.3 61.6 30 35 C S G >< S+ 0 0 45 -4,-2.6 3,-2.2 1,-0.3 -1,-0.1 0.861 75.2 64.8 -41.0 -53.0 33.5 12.7 60.7 31 36 C R G 3 S+ 0 0 180 -4,-0.5 -1,-0.3 1,-0.3 3,-0.1 0.608 93.3 64.1 -52.1 -13.4 30.3 12.7 62.8 32 37 C F G < S- 0 0 23 -3,-2.5 2,-0.3 1,-0.3 -1,-0.3 0.685 118.1 -69.0 -87.7 -17.7 28.8 15.5 60.7 33 38 C G S < S- 0 0 27 -3,-2.2 -1,-0.3 -4,-0.4 2,-0.1 -0.910 74.1 -32.2 153.3-178.2 28.5 13.5 57.5 34 39 C Q - 0 0 126 -2,-0.3 21,-1.9 -3,-0.1 2,-0.6 -0.445 50.7-146.0 -69.7 139.9 30.6 11.9 54.7 35 40 C I E -C 54 0A 23 19,-0.2 19,-0.2 1,-0.1 3,-0.1 -0.936 8.8-166.4-109.8 112.1 33.8 13.8 53.9 36 41 C L E - 0 0 56 17,-2.0 2,-0.3 -2,-0.6 18,-0.2 0.777 68.6 -37.6 -68.2 -26.6 34.7 13.6 50.2 37 42 C D E -C 53 0A 71 16,-1.2 16,-2.2 2,-0.0 2,-0.4 -0.953 49.5-130.3 176.6 170.0 38.2 14.9 50.9 38 43 C I E -C 52 0A 8 -2,-0.3 2,-0.6 14,-0.2 14,-0.2 -0.945 16.5-151.1-144.3 118.9 40.4 17.2 52.9 39 44 C L E +C 51 0A 79 12,-2.7 12,-1.9 -2,-0.4 2,-0.4 -0.812 21.7 165.4-101.3 120.2 42.9 19.6 51.5 40 45 C V + 0 0 9 -2,-0.6 2,-0.4 10,-0.2 10,-0.1 -0.985 4.7 174.2-131.1 120.0 45.9 20.6 53.6 41 46 C S - 0 0 53 8,-0.5 8,-0.5 -2,-0.4 7,-0.1 -0.982 22.8-158.2-126.7 143.6 49.0 22.3 52.2 42 47 C R + 0 0 108 -2,-0.4 2,-0.0 5,-0.2 -1,-0.0 0.061 50.4 129.9-105.5 20.4 51.9 23.6 54.2 43 48 C S S > S- 0 0 51 1,-0.1 4,-3.3 0, 0.0 3,-0.4 -0.365 79.6 -97.3 -68.9 157.2 53.1 26.0 51.5 44 49 C L T 4 S+ 0 0 135 1,-0.2 -1,-0.1 2,-0.2 -3,-0.0 0.830 124.4 41.3 -43.9 -41.2 53.7 29.5 52.7 45 50 C K T 4 S+ 0 0 162 1,-0.1 -1,-0.2 3,-0.0 -3,-0.0 0.816 122.6 34.8 -81.5 -34.3 50.2 30.5 51.5 46 51 C M T >4 S+ 0 0 68 -3,-0.4 3,-1.5 3,-0.0 -5,-0.2 0.747 85.6 113.9 -94.8 -26.2 48.1 27.6 52.6 47 52 C R T 3< S+ 0 0 98 -4,-3.3 -5,-0.2 1,-0.3 -33,-0.1 -0.108 76.6 32.3 -48.2 144.2 49.8 26.6 55.8 48 53 C G T 3 S+ 0 0 10 1,-0.3 -36,-1.7 -35,-0.2 -37,-0.7 0.423 112.8 85.3 84.9 1.5 47.7 27.1 58.9 49 54 C Q E < +A 10 0A 35 -3,-1.5 -8,-0.5 -8,-0.5 -1,-0.3 -0.873 48.4 176.4-134.2 167.7 44.6 26.3 56.7 50 55 C A E -A 9 0A 0 -41,-1.8 -41,-2.5 -2,-0.3 2,-0.5 -0.971 20.2-139.3-164.5 151.6 42.6 23.4 55.4 51 56 C F E -AC 8 39A 55 -12,-1.9 -12,-2.7 -2,-0.3 2,-0.7 -0.979 11.2-161.1-120.1 124.7 39.4 22.7 53.4 52 57 C V E -AC 7 38A 0 -45,-1.7 -45,-1.3 -2,-0.5 2,-0.7 -0.900 11.9-153.1-107.2 107.7 37.1 19.9 54.4 53 58 C I E -AC 6 37A 3 -16,-2.2 -17,-2.0 -2,-0.7 -16,-1.2 -0.733 11.7-162.3 -87.9 115.6 34.8 18.9 51.5 54 59 C F E - C 0 35A 0 -49,-2.0 -19,-0.2 -2,-0.7 3,-0.1 -0.664 23.2-137.6 -96.3 150.2 31.5 17.5 52.6 55 60 C K S S+ 0 0 94 -21,-1.9 2,-0.4 -2,-0.3 -1,-0.1 0.840 93.5 40.4 -72.3 -35.0 29.1 15.4 50.5 56 61 C E S >> S- 0 0 100 -22,-0.4 3,-1.1 -51,-0.1 4,-1.1 -0.965 72.9-140.8-122.0 132.4 26.1 17.3 51.8 57 62 C V H >> S+ 0 0 47 -2,-0.4 4,-2.4 1,-0.3 3,-1.3 0.910 102.9 60.4 -52.1 -49.6 25.8 21.1 52.4 58 63 C S H 3> S+ 0 0 71 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.825 101.6 55.9 -49.3 -34.3 23.8 20.6 55.6 59 64 C S H <> S+ 0 0 14 -3,-1.1 4,-1.8 2,-0.2 -1,-0.3 0.852 106.6 48.4 -68.4 -34.8 26.8 18.6 57.0 60 65 C A H < S+ 0 0 6 -4,-2.5 3,-2.1 -5,-0.2 2,-0.3 0.287 73.6 134.4-102.1 8.5 33.0 23.5 65.8 68 73 C Q T 3< S+ 0 0 97 -4,-0.8 10,-0.2 -3,-0.3 9,-0.1 -0.424 86.8 2.0 -61.9 121.2 33.5 27.3 65.7 69 74 C G T 3 S+ 0 0 26 8,-3.3 -1,-0.3 -2,-0.3 9,-0.1 0.623 88.7 168.0 78.5 12.4 36.4 28.1 68.0 70 75 C F < - 0 0 31 -3,-2.1 7,-2.0 7,-0.3 2,-0.5 -0.342 45.2-108.9 -62.1 130.2 37.0 24.4 68.9 71 76 C P E +D 76 0B 12 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.462 48.8 171.2 -64.0 116.4 40.3 24.0 70.8 72 77 C F E > S-D 75 0B 12 3,-2.0 3,-1.9 -2,-0.5 -59,-0.3 -0.983 70.2 -21.1-131.5 119.2 42.5 22.2 68.2 73 78 C Y T 3 S- 0 0 57 -2,-0.5 -1,-0.1 1,-0.3 86,-0.1 0.841 127.0 -55.4 49.5 35.3 46.2 21.7 68.9 74 79 C D T 3 S+ 0 0 86 85,-0.3 -1,-0.3 1,-0.2 86,-0.1 0.596 120.3 98.5 77.8 12.9 45.8 24.6 71.4 75 80 C K E < S-D 72 0B 72 -3,-1.9 -3,-2.0 -5,-0.2 2,-0.4 -0.999 79.5-112.4-134.0 132.1 44.4 27.2 69.0 76 81 C P E -D 71 0B 73 0, 0.0 -6,-0.2 0, 0.0 2,-0.2 -0.498 37.8-122.1 -68.4 118.5 40.8 28.0 68.6 77 82 C M - 0 0 1 -7,-2.0 -8,-3.3 -2,-0.4 2,-0.5 -0.397 19.2-150.9 -63.1 127.0 39.6 26.8 65.2 78 83 C R E -B 10 0A 127 -68,-2.3 -68,-2.3 -2,-0.2 2,-0.4 -0.889 18.7-173.0-102.9 127.5 38.1 29.5 62.9 79 84 C I E +B 9 0A 3 -2,-0.5 2,-0.3 -70,-0.2 -70,-0.2 -0.964 14.4 154.8-129.2 131.6 35.5 28.2 60.4 80 85 C Q E -B 8 0A 56 -72,-2.8 -72,-2.9 -2,-0.4 2,-0.1 -0.909 47.6 -90.6-140.1 165.9 33.7 29.7 57.5 81 86 C Y E -B 7 0A 21 -2,-0.3 -74,-0.3 -74,-0.3 -79,-0.1 -0.464 54.7 -98.8 -71.9 151.8 32.0 28.5 54.3 82 87 C A - 0 0 6 -76,-2.2 -1,-0.1 1,-0.1 -76,-0.1 -0.430 24.8-128.3 -70.4 150.3 34.4 28.4 51.4 83 88 C K S S+ 0 0 194 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.915 89.3 13.0 -64.4 -43.8 34.0 31.4 49.0 84 89 C T S S- 0 0 108 1,-0.1 -1,-0.1 -80,-0.0 -80,-0.1 -0.915 95.6 -82.6-132.3 159.6 33.6 29.2 45.9 85 90 C D - 0 0 74 -2,-0.3 2,-0.2 1,-0.1 -1,-0.1 -0.196 44.1-114.2 -59.9 147.0 32.9 25.5 45.3 86 91 C S >> - 0 0 17 1,-0.1 3,-2.1 4,-0.0 4,-2.1 -0.550 34.2-107.5 -77.9 151.1 35.8 23.1 45.4 87 92 C D H 3> S+ 0 0 106 1,-0.3 4,-2.8 2,-0.2 5,-0.1 0.881 117.6 56.4 -48.8 -49.1 36.5 21.5 42.0 88 93 C I H 34 S+ 0 0 77 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.629 114.0 43.9 -62.2 -9.9 35.2 18.1 42.8 89 94 C I H X4 S+ 0 0 18 -3,-2.1 3,-0.7 3,-0.1 -1,-0.2 0.798 117.5 41.4 -98.9 -40.9 31.9 19.8 43.7 90 95 C A H 3< S+ 0 0 56 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.970 111.4 55.3 -69.3 -56.2 31.7 22.2 40.7 91 96 C K T 3< 0 0 162 -4,-2.8 -1,-0.2 -5,-0.2 -3,-0.1 0.242 360.0 360.0 -62.5 18.2 32.9 19.7 38.2 92 97 C M < 0 0 162 -3,-0.7 -3,-0.1 -2,-0.1 -4,-0.0 -0.522 360.0 360.0-111.9 360.0 30.0 17.6 39.5 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 0 111 0, 0.0 82,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0-174.7 46.9 33.5 87.7 95 7 F R - 0 0 187 81,-0.2 80,-0.0 1,-0.1 79,-0.0 -0.430 360.0 -93.1 -70.3 147.5 49.8 31.4 88.9 96 8 F P - 0 0 79 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.374 56.8-174.4 -58.9 144.6 50.0 27.8 87.5 97 9 F N - 0 0 13 53,-0.2 50,-0.1 2,-0.1 52,-0.1 -0.977 41.6-118.5-144.4 156.8 48.1 25.5 89.9 98 10 F H S S+ 0 0 44 -2,-0.3 49,-2.8 55,-0.1 2,-0.4 0.785 103.3 57.2 -61.3 -29.2 47.4 21.8 90.5 99 11 F T E S-E 146 0C 0 47,-0.2 76,-2.3 76,-0.1 2,-0.4 -0.844 73.3-150.6-108.8 141.0 43.7 22.7 90.2 100 12 F I E -EF 145 174C 0 45,-2.2 45,-1.9 -2,-0.4 2,-0.5 -0.869 12.3-139.4-108.6 143.5 42.0 24.4 87.3 101 13 F Y E -EF 144 173C 46 72,-4.8 72,-3.2 -2,-0.4 2,-0.4 -0.893 22.2-172.0-100.7 129.8 38.9 26.5 87.8 102 14 F I E +EF 143 172C 0 41,-1.9 41,-1.7 -2,-0.5 2,-0.3 -0.991 11.6 160.3-127.5 126.3 36.2 26.0 85.1 103 15 F N E +EF 142 171C 30 68,-3.0 68,-2.9 -2,-0.4 39,-0.2 -0.806 43.4 70.5-137.1-179.9 33.1 28.1 84.7 104 16 F N + 0 0 66 37,-0.8 2,-0.3 1,-0.3 -1,-0.1 0.854 69.7 157.5 75.6 37.6 30.5 29.0 82.2 105 17 F L - 0 0 2 36,-1.9 2,-0.3 -3,-0.2 -1,-0.3 -0.661 54.4 -91.8 -92.9 150.1 29.2 25.4 82.5 106 18 F N > - 0 0 31 59,-0.3 3,-0.8 -2,-0.3 35,-0.2 -0.466 33.5-156.1 -63.8 121.7 25.6 24.5 81.7 107 19 F E T 3 S+ 0 0 103 -2,-0.3 -1,-0.2 1,-0.2 35,-0.1 0.552 83.6 68.1 -79.5 -8.0 23.6 24.9 84.9 108 20 F K T 3 S+ 0 0 182 2,-0.1 2,-0.3 33,-0.0 -1,-0.2 0.656 78.1 102.0 -86.4 -12.3 20.8 22.5 83.9 109 21 F I S < S- 0 0 28 -3,-0.8 5,-0.1 1,-0.1 -4,-0.0 -0.550 77.4-113.4 -78.7 130.1 23.1 19.4 84.0 110 22 F K > - 0 0 124 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.204 24.9-118.3 -58.6 145.7 22.9 17.1 87.0 111 23 F K H > S+ 0 0 102 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.888 111.3 45.9 -52.9 -52.7 26.0 16.9 89.2 112 24 F D H > S+ 0 0 114 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.945 115.1 48.9 -60.6 -45.1 26.9 13.2 88.7 113 25 F E H > S+ 0 0 76 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.908 113.9 47.4 -60.4 -40.4 26.4 13.6 84.9 114 26 F L H X S+ 0 0 8 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.933 112.0 47.0 -69.7 -44.9 28.6 16.7 85.0 115 27 F K H X S+ 0 0 67 -4,-3.4 4,-2.4 1,-0.2 5,-0.2 0.947 112.9 51.4 -61.0 -45.0 31.4 15.2 87.1 116 28 F K H X S+ 0 0 139 -4,-2.6 4,-2.3 -5,-0.3 -2,-0.2 0.923 111.4 45.1 -57.9 -48.5 31.4 12.1 84.8 117 29 F S H X S+ 0 0 23 -4,-2.2 4,-2.4 -5,-0.2 5,-0.2 0.924 111.6 54.3 -64.9 -40.6 31.6 14.1 81.6 118 30 F L H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.920 109.8 46.3 -58.7 -42.7 34.3 16.3 83.0 119 31 F H H X S+ 0 0 89 -4,-2.4 4,-2.8 2,-0.2 3,-0.3 0.923 109.4 56.2 -66.4 -40.8 36.5 13.2 83.9 120 32 F A H < S+ 0 0 68 -4,-2.3 4,-0.3 1,-0.2 -2,-0.2 0.933 115.2 35.8 -56.5 -48.4 35.9 11.7 80.5 121 33 F I H < S+ 0 0 36 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.600 124.8 41.1 -84.5 -11.1 37.2 14.8 78.7 122 34 F F H >< S+ 0 0 0 -4,-1.4 3,-1.8 -3,-0.3 4,-0.3 0.650 87.3 86.8-108.6 -18.3 40.0 15.6 81.2 123 35 F S G >< S+ 0 0 57 -4,-2.8 3,-1.6 1,-0.3 -3,-0.1 0.825 78.5 68.7 -51.0 -37.3 41.4 12.2 82.2 124 36 F R G 3 S+ 0 0 165 -4,-0.3 -1,-0.3 1,-0.2 3,-0.1 0.653 88.5 64.0 -60.5 -17.5 43.9 12.2 79.2 125 37 F F G < S- 0 0 22 -3,-1.8 -1,-0.2 1,-0.3 2,-0.2 0.622 121.4 -63.5 -84.2 -11.5 46.0 15.1 80.6 126 38 F G S < S- 0 0 24 -3,-1.6 -1,-0.3 -4,-0.3 2,-0.0 -0.811 78.8 -34.8 148.9 172.2 47.1 13.1 83.7 127 39 F Q - 0 0 125 -2,-0.2 21,-2.0 -3,-0.1 2,-0.5 -0.348 54.2-145.9 -60.8 138.2 45.8 11.5 86.8 128 40 F I E -G 147 0C 18 19,-0.2 19,-0.2 1,-0.1 3,-0.1 -0.920 10.6-167.1-105.6 127.1 42.8 13.4 88.3 129 41 F L E - 0 0 55 17,-2.8 2,-0.3 -2,-0.5 18,-0.2 0.801 66.4 -28.8 -86.8 -31.0 42.6 13.4 92.1 130 42 F D E -G 146 0C 71 16,-1.2 16,-2.7 2,-0.0 2,-0.4 -0.956 46.6-141.3-174.9 164.3 39.1 14.8 92.4 131 43 F I E -G 145 0C 6 -2,-0.3 2,-0.6 14,-0.2 14,-0.2 -0.959 18.1-154.9-140.2 116.4 36.5 17.0 90.7 132 44 F L E +G 144 0C 70 12,-2.3 12,-2.5 -2,-0.4 2,-0.4 -0.853 19.4 168.0-100.8 123.9 34.4 19.2 92.9 133 45 F V E +G 143 0C 8 -2,-0.6 2,-0.4 10,-0.2 10,-0.2 -0.996 5.1 176.2-134.0 128.9 31.0 20.3 91.5 134 46 F S - 0 0 55 8,-0.5 8,-0.4 5,-0.5 7,-0.1 -0.993 23.4-156.5-133.5 143.9 28.2 22.0 93.4 135 47 F R + 0 0 95 -2,-0.4 5,-0.1 5,-0.2 -1,-0.0 0.142 52.0 128.2-101.8 15.3 24.9 23.3 92.2 136 48 F S S > S- 0 0 53 1,-0.1 4,-2.6 3,-0.0 3,-0.2 -0.257 78.7 -94.3 -65.3 162.2 24.4 25.7 95.0 137 49 F L T 4 S+ 0 0 132 1,-0.2 3,-0.1 2,-0.2 -1,-0.1 0.890 123.4 34.5 -43.0 -55.5 23.6 29.4 94.2 138 50 F K T 4 S+ 0 0 171 1,-0.2 -1,-0.2 3,-0.0 -3,-0.0 0.752 124.3 40.2 -79.2 -24.7 27.2 30.5 94.4 139 51 F M T >4 S+ 0 0 70 -3,-0.2 3,-1.2 3,-0.0 -5,-0.5 0.547 84.8 113.3-103.2 -5.9 28.9 27.5 93.1 140 52 F R T 3< S+ 0 0 105 -4,-2.6 -5,-0.2 1,-0.2 -33,-0.1 -0.331 73.9 31.8 -66.1 147.4 26.6 26.4 90.2 141 53 F G T 3 S+ 0 0 11 1,-0.3 -36,-1.9 -35,-0.2 -37,-0.8 0.464 110.9 81.7 84.8 4.3 28.0 26.7 86.7 142 54 F Q E < -E 103 0C 34 -3,-1.2 -8,-0.5 -8,-0.4 -1,-0.3 -0.870 51.0-176.9-136.0 169.7 31.5 25.9 87.9 143 55 F A E -EG 102 133C 0 -41,-1.7 -41,-1.9 -2,-0.3 2,-0.5 -0.963 20.2-135.4-164.4 147.5 33.7 23.0 88.9 144 56 F F E -EG 101 132C 58 -12,-2.5 -12,-2.3 -2,-0.3 2,-0.6 -0.937 14.6-164.2-111.2 131.5 37.2 22.4 90.2 145 57 F V E -EG 100 131C 0 -45,-1.9 -45,-2.2 -2,-0.5 2,-0.7 -0.955 9.0-156.1-117.3 112.0 39.3 19.8 88.6 146 58 F I E -EG 99 130C 6 -16,-2.7 -17,-2.8 -2,-0.6 -16,-1.2 -0.805 8.5-163.8 -96.3 117.2 42.2 18.8 90.8 147 59 F F E - G 0 128C 0 -49,-2.8 -19,-0.2 -2,-0.7 3,-0.1 -0.603 22.9-134.8 -95.8 157.0 45.2 17.3 89.0 148 60 F K S S+ 0 0 97 -21,-2.0 2,-0.4 -2,-0.2 -20,-0.1 0.789 93.9 41.6 -80.0 -31.3 48.0 15.4 90.6 149 61 F E S >> S- 0 0 92 -22,-0.4 4,-1.2 -51,-0.1 3,-0.8 -0.970 70.6-143.9-123.5 134.3 50.6 17.2 88.6 150 62 F V H >> S+ 0 0 44 -2,-0.4 4,-2.4 1,-0.3 3,-1.1 0.926 104.4 62.3 -57.3 -45.4 50.7 20.9 87.8 151 63 F S H 3> S+ 0 0 79 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.852 102.7 52.3 -49.1 -35.2 52.1 20.1 84.4 152 64 F S H <> S+ 0 0 12 -3,-0.8 4,-2.1 2,-0.2 -1,-0.3 0.851 107.4 50.8 -70.2 -34.6 48.9 18.3 83.8 153 65 F A H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 3,-0.7 0.953 114.3 50.4 -59.0 -48.5 44.4 20.8 80.1 157 69 F L H 3X S+ 0 0 24 -4,-2.7 4,-0.6 1,-0.2 3,-0.5 0.944 113.2 44.0 -52.6 -56.4 44.0 24.6 80.5 158 70 F R H 3< S+ 0 0 166 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.631 122.1 39.2 -65.6 -15.4 46.0 25.4 77.3 159 71 F S H << S+ 0 0 15 -4,-1.2 -85,-0.3 -3,-0.7 -1,-0.2 0.542 116.0 43.1-116.8 -6.7 44.2 22.7 75.3 160 72 F M H >< S+ 0 0 2 -4,-1.8 3,-1.9 -3,-0.5 2,-0.5 0.204 71.4 138.2-122.8 12.9 40.5 22.8 76.4 161 73 F Q T 3< S+ 0 0 87 -4,-0.6 10,-0.2 1,-0.3 9,-0.1 -0.455 84.4 2.3 -63.0 111.3 40.0 26.5 76.5 162 74 F G T 3 S+ 0 0 21 8,-1.9 -1,-0.3 -2,-0.5 9,-0.1 0.422 86.6 171.0 94.0 -2.9 36.5 27.0 75.0 163 75 F F < - 0 0 44 -3,-1.9 7,-1.9 6,-0.2 -1,-0.2 -0.116 43.3-106.6 -45.4 127.7 35.8 23.3 74.5 164 76 F P E +H 169 0D 46 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.344 50.3 171.4 -56.7 136.4 32.1 22.8 73.4 165 77 F F E > -H 168 0D 15 3,-0.9 3,-1.4 -3,-0.1 -59,-0.3 -0.771 63.4 -27.3-159.4 106.9 30.3 21.4 76.5 166 78 F Y T 3 S- 0 0 71 -2,-0.3 -57,-0.1 1,-0.3 0, 0.0 0.866 126.5 -50.5 53.9 38.3 26.6 20.8 76.9 167 79 F D T 3 S+ 0 0 163 1,-0.2 -1,-0.3 -101,-0.1 -62,-0.0 0.515 122.7 93.7 79.6 8.6 26.1 23.7 74.4 168 80 F K E < S-H 165 0D 67 -3,-1.4 2,-1.0 -5,-0.1 -3,-0.9 -0.997 77.2-120.6-133.8 138.0 28.4 26.3 76.1 169 81 F P E -H 164 0D 81 0, 0.0 -6,-0.2 0, 0.0 -7,-0.0 -0.665 41.3-129.9 -77.0 102.0 32.1 27.0 75.4 170 82 F M - 0 0 1 -7,-1.9 -8,-1.9 -2,-1.0 2,-0.4 -0.169 13.0-140.9 -58.8 142.3 33.7 26.3 78.8 171 83 F R E -F 103 0C 126 -68,-2.9 -68,-3.0 -10,-0.2 2,-0.4 -0.912 18.8-167.5-108.8 134.1 36.0 28.8 80.4 172 84 F I E +F 102 0C 3 -2,-0.4 2,-0.3 -70,-0.2 -70,-0.2 -0.959 15.3 156.7-127.3 137.7 39.1 27.6 82.3 173 85 F Q E -F 101 0C 52 -72,-3.2 -72,-4.8 -2,-0.4 2,-0.1 -0.918 47.4 -92.6-145.6 165.2 41.6 29.3 84.6 174 86 F Y E -F 100 0C 25 -2,-0.3 -74,-0.3 -74,-0.3 2,-0.1 -0.505 53.4-100.5 -75.6 155.7 44.0 28.1 87.3 175 87 F A - 0 0 4 -76,-2.3 -76,-0.1 1,-0.1 -1,-0.1 -0.518 23.5-130.6 -74.9 148.9 42.5 28.1 90.8 176 88 F K S S+ 0 0 177 -2,-0.1 2,-0.3 1,-0.1 -81,-0.2 0.916 89.4 27.5 -66.0 -40.7 43.5 31.2 92.8 177 89 F T S S- 0 0 110 1,-0.0 -1,-0.1 -80,-0.0 3,-0.1 -0.919 94.4 -92.2-126.5 149.2 44.4 29.0 95.8 178 90 F D - 0 0 70 -2,-0.3 2,-0.1 1,-0.1 -2,-0.1 -0.183 45.3-115.4 -52.2 140.3 45.6 25.4 96.3 179 91 F S >> - 0 0 20 1,-0.1 4,-2.0 -4,-0.0 3,-1.2 -0.482 32.9-105.4 -74.6 154.6 42.7 23.0 96.9 180 92 F D H 3> S+ 0 0 113 1,-0.2 4,-3.0 2,-0.2 3,-0.2 0.903 116.9 54.2 -48.1 -51.1 42.8 21.5 100.4 181 93 F I H 34 S+ 0 0 72 1,-0.3 -1,-0.2 2,-0.2 -3,-0.0 0.750 112.8 45.2 -59.7 -23.2 44.0 17.9 99.4 182 94 F I H X4 S+ 0 0 17 -3,-1.2 3,-0.7 2,-0.1 -1,-0.3 0.819 115.0 46.4 -85.4 -35.9 47.0 19.5 97.6 183 95 F A H 3< S+ 0 0 61 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.818 108.2 57.7 -74.4 -32.1 47.8 21.9 100.5 184 96 F K T 3< 0 0 160 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.1 0.337 360.0 360.0 -81.4 4.0 47.4 19.1 103.1 185 97 F M < 0 0 163 -3,-0.7 -3,-0.1 -5,-0.2 -4,-0.0 -0.390 360.0 360.0 -84.3 360.0 50.1 17.0 101.5