==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-MAR-06 2GAF . COMPND 2 MOLECULE: CAP-SPECIFIC MRNA (NUCLEOSIDE-2'-O-)- . SOURCE 2 ORGANISM_SCIENTIFIC: VACCINIA VIRUS; . AUTHOR C.M.MOURE,B.R.BOWMAN,P.D.GERSHON,F.A.QUIOCHO . 733 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31250.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 520 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 54 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 252 34.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.6 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 1 1 1 1 3 4 3 0 0 1 2 2 1 2 1 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 0 2 2 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 PARALLEL BRIDGES PER LADDER . 3 2 3 6 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 0 1 0 1 1 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 1 A X 0 0 224 0, 0.0 2,-1.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-175.6 27.1 7.4 80.1 2 2 A D + 0 0 114 234,-0.1 236,-0.4 235,-0.0 2,-0.2 -0.580 360.0 117.0 -93.1 82.8 28.5 11.0 80.1 3 3 A V - 0 0 62 -2,-1.5 2,-0.3 234,-0.2 236,-0.2 -0.623 40.8-166.9-124.7-179.2 26.6 12.7 77.3 4 4 A V B -a 239 0A 50 234,-2.4 236,-1.4 -2,-0.2 237,-0.6 -0.988 19.2-130.9-169.3 163.3 24.3 15.6 77.7 5 5 A S + 0 0 83 -2,-0.3 2,-0.3 234,-0.2 3,-0.1 -0.993 28.2 173.6-128.7 127.3 21.6 17.8 76.1 6 6 A L - 0 0 27 -2,-0.4 235,-0.1 1,-0.1 -2,-0.0 -0.952 36.7-135.9-133.8 153.4 21.7 21.6 76.1 7 7 A D S S- 0 0 133 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 0.878 91.2 -12.0 -70.3 -40.7 19.7 24.4 74.5 8 8 A K S S- 0 0 102 -3,-0.1 -1,-0.3 248,-0.0 2,-0.1 -0.962 77.1-101.0-154.8 161.2 22.8 26.2 73.4 9 9 A P - 0 0 1 0, 0.0 2,-0.8 0, 0.0 241,-0.0 -0.421 51.2 -87.0 -84.9 168.5 26.5 26.1 74.1 10 10 A F + 0 0 21 1,-0.2 3,-0.1 -2,-0.1 178,-0.1 -0.678 50.8 171.9 -76.4 112.5 28.2 28.5 76.5 11 11 A X + 0 0 10 -2,-0.8 177,-2.1 1,-0.2 2,-0.3 0.829 62.8 26.0 -88.3 -39.4 29.0 31.5 74.3 12 12 A Y B > S-B 187 0B 2 175,-0.2 3,-2.6 1,-0.1 4,-0.4 -0.968 79.6-115.4-131.4 146.7 30.2 34.0 76.9 13 13 A F G > S+ 0 0 8 173,-2.2 3,-1.7 -2,-0.3 174,-0.1 0.802 110.8 63.3 -44.8 -44.4 31.8 33.6 80.4 14 14 A E G 3 S+ 0 0 140 1,-0.3 -1,-0.3 172,-0.1 171,-0.0 0.600 96.9 60.8 -61.8 -11.4 28.8 35.2 82.2 15 15 A E G < S+ 0 0 63 -3,-2.6 2,-0.6 2,-0.0 -1,-0.3 0.649 73.3 106.9 -91.0 -17.4 26.7 32.3 80.9 16 16 A I < - 0 0 2 -3,-1.7 210,-0.1 -4,-0.4 211,-0.1 -0.530 52.7-168.3 -66.1 113.4 28.7 29.6 82.7 17 17 A D + 0 0 114 -2,-0.6 2,-0.3 209,-0.1 -1,-0.1 -0.096 54.8 41.9 -98.5 32.3 26.3 28.6 85.5 18 18 A N - 0 0 74 2,-0.0 2,-0.3 208,-0.0 211,-0.2 -0.985 57.3-152.3-164.8 171.3 28.6 26.4 87.7 19 19 A E - 0 0 91 -2,-0.3 2,-0.3 210,-0.1 207,-0.2 -0.995 3.6-167.4-154.5 155.7 32.0 25.9 89.2 20 20 A L - 0 0 66 205,-0.4 2,-0.4 -2,-0.3 209,-0.2 -0.929 38.6 -98.7-137.1 158.6 34.5 23.3 90.5 21 21 A D - 0 0 111 -2,-0.3 204,-0.0 207,-0.1 -2,-0.0 -0.695 46.9-112.7 -82.8 130.8 37.7 23.7 92.5 22 22 A Y - 0 0 89 -2,-0.4 -1,-0.1 1,-0.1 203,-0.1 -0.249 24.6-146.9 -60.6 150.8 40.7 23.7 90.2 23 23 A E > - 0 0 70 -3,-0.0 3,-1.1 1,-0.0 2,-0.4 -0.960 9.2-144.3-127.1 112.2 43.0 20.7 90.5 24 24 A P T 3 S+ 0 0 107 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 0.277 91.1 72.2 -57.3 13.3 46.8 21.2 89.9 25 25 A E T 3 0 0 136 -2,-0.4 -3,-0.0 0, 0.0 0, 0.0 0.855 360.0 360.0 -98.7 -44.9 47.0 17.8 88.3 26 26 A S < 0 0 75 -3,-1.1 169,-0.1 168,-0.0 168,-0.0 0.854 360.0 360.0 -61.5 360.0 45.2 18.2 84.9 27 ! 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 28 32 A K 0 0 126 0, 0.0 164,-0.0 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 148.5 44.4 19.5 73.2 29 33 A K + 0 0 197 2,-0.0 0, 0.0 165,-0.0 0, 0.0 -0.172 360.0 91.0-137.8 41.7 44.5 16.6 70.7 30 34 A L S > S- 0 0 34 161,-0.1 3,-1.1 257,-0.0 2,-0.3 -0.995 73.0-111.7-139.7 145.8 44.1 18.2 67.2 31 35 A P T 3 S+ 0 0 62 0, 0.0 -2,-0.0 0, 0.0 254,-0.0 -0.599 101.9 0.4 -79.4 131.5 46.6 19.4 64.6 32 36 A Y T >> S+ 0 0 125 -2,-0.3 4,-1.9 1,-0.1 3,-1.8 0.629 86.6 145.2 67.8 13.0 46.7 23.2 64.0 33 37 A Q H <> + 0 0 13 -3,-1.1 4,-2.9 1,-0.3 5,-0.2 0.857 67.0 58.4 -49.4 -38.5 44.0 23.3 66.7 34 38 A G H 3> S+ 0 0 31 -4,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.840 106.4 48.1 -61.7 -31.8 45.5 26.6 67.8 35 39 A Q H <> S+ 0 0 46 -3,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.842 110.6 50.0 -76.6 -35.2 44.9 28.0 64.3 36 40 A L H X S+ 0 0 0 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.918 108.8 54.0 -68.4 -42.1 41.4 26.7 64.2 37 41 A K H X S+ 0 0 26 -4,-2.9 4,-2.0 154,-0.3 -2,-0.2 0.936 113.4 41.1 -56.4 -50.6 40.8 28.3 67.6 38 42 A L H X S+ 0 0 28 -4,-1.7 4,-2.3 2,-0.2 5,-0.3 0.951 114.2 53.4 -63.8 -48.2 42.0 31.7 66.3 39 43 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 5,-0.3 0.933 111.0 44.9 -51.1 -56.1 40.2 31.3 63.0 40 44 A L H X S+ 0 0 2 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.932 114.6 47.5 -56.3 -51.5 36.7 30.6 64.6 41 45 A G H X S+ 0 0 6 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.821 116.5 42.1 -62.6 -35.5 36.9 33.4 67.2 42 46 A E H X S+ 0 0 5 -4,-2.3 4,-3.4 2,-0.2 5,-0.3 0.838 114.1 51.7 -80.4 -34.0 38.0 36.0 64.7 43 47 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.3 -2,-0.2 0.896 113.6 45.7 -66.0 -40.7 35.6 34.8 62.1 44 48 A F H X S+ 0 0 1 -4,-2.6 4,-2.5 -5,-0.3 -2,-0.2 0.965 116.7 45.7 -66.2 -51.1 32.9 35.1 64.8 45 49 A F H X S+ 0 0 3 -4,-2.4 4,-2.4 2,-0.2 3,-0.3 0.971 116.4 41.9 -54.7 -63.6 34.2 38.5 65.8 46 50 A L H X S+ 0 0 0 -4,-3.4 4,-2.1 1,-0.3 -1,-0.2 0.886 113.8 55.2 -54.1 -40.1 34.6 40.0 62.3 47 51 A S H X S+ 0 0 1 -4,-2.0 4,-2.7 -5,-0.3 -1,-0.3 0.907 105.7 50.1 -61.5 -43.5 31.3 38.4 61.4 48 52 A K H X S+ 0 0 13 -4,-2.5 4,-1.9 -3,-0.3 6,-0.2 0.956 111.7 49.0 -60.0 -46.1 29.5 40.1 64.2 49 53 A L H <>S+ 0 0 1 -4,-2.4 6,-1.7 1,-0.2 5,-1.7 0.829 109.6 52.5 -61.3 -31.0 31.0 43.4 63.2 50 54 A Q H ><5S+ 0 0 15 -4,-2.1 3,-1.6 -5,-0.2 -1,-0.2 0.951 108.4 51.0 -67.6 -47.2 29.9 42.7 59.6 51 55 A R H 3<5S+ 0 0 27 -4,-2.7 590,-0.2 1,-0.3 -2,-0.2 0.813 110.6 47.8 -58.4 -36.6 26.3 42.1 60.8 52 56 A H T 3<5S- 0 0 14 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.149 115.6-110.5 -96.6 20.4 26.2 45.3 62.8 53 57 A G T < 5S+ 0 0 7 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.476 89.7 109.0 69.4 7.6 27.5 47.5 59.9 54 58 A I < + 0 0 19 -5,-1.7 -4,-0.2 -6,-0.2 -5,-0.1 0.751 64.5 61.3 -91.3 -19.4 30.8 48.2 61.6 55 59 A L S > S+ 0 0 1 -6,-1.7 3,-2.5 -9,-0.2 -5,-0.2 0.862 74.5 110.7 -73.9 -33.1 33.2 46.1 59.4 56 60 A D T 3 S- 0 0 13 -7,-0.3 29,-0.1 1,-0.3 3,-0.1 -0.173 96.4 -7.6 -51.7 118.0 32.6 47.9 56.1 57 61 A G T 3 S+ 0 0 11 27,-2.7 71,-0.4 1,-0.2 668,-0.3 0.549 101.0 144.3 74.4 8.6 35.5 50.0 54.9 58 62 A A E < -c 85 0B 0 -3,-2.5 28,-2.2 26,-0.5 2,-0.5 -0.406 50.9-132.2 -81.6 155.2 37.3 49.4 58.2 59 63 A T E -cd 86 129B 1 69,-2.7 71,-2.6 26,-0.2 2,-0.6 -0.931 22.5-147.4-101.4 125.8 41.1 48.9 58.6 60 64 A V E -cd 87 130B 0 26,-3.2 28,-3.2 -2,-0.5 2,-0.7 -0.869 8.9-160.5 -99.4 120.7 41.7 45.9 60.9 61 65 A V E -cd 88 131B 0 69,-3.6 71,-2.8 -2,-0.6 2,-0.6 -0.900 7.7-173.8-105.7 116.7 44.8 46.3 63.0 62 66 A Y E -cd 89 132B 1 26,-3.0 28,-3.3 -2,-0.7 2,-0.6 -0.954 3.5-166.8-113.5 117.1 46.0 43.0 64.3 63 67 A I E S+cd 90 133B 7 69,-2.3 71,-2.3 -2,-0.6 72,-0.2 -0.935 77.3 17.5-109.8 121.5 48.9 43.2 66.8 64 68 A G S S+ 0 0 13 26,-3.5 -1,-0.2 -2,-0.6 27,-0.2 0.782 81.6 145.7 87.3 33.5 50.8 40.0 67.6 65 69 A S + 0 0 2 25,-1.1 6,-0.2 -3,-0.5 3,-0.2 0.677 25.7 150.0 -77.1 -22.0 49.3 38.4 64.5 66 70 A A + 0 0 23 1,-0.3 29,-0.2 27,-0.2 26,-0.1 -0.328 66.8 10.8 -64.7 144.1 52.3 36.2 63.5 67 71 A P S S+ 0 0 82 0, 0.0 29,-2.8 0, 0.0 -1,-0.3 -0.954 82.3 166.4 -76.5 -21.8 52.4 33.7 62.2 68 72 A G >> + 0 0 4 27,-0.2 3,-1.4 -3,-0.2 4,-0.5 0.744 7.5 157.1 56.4 34.7 48.7 34.3 61.4 69 73 A T T >4 S+ 0 0 28 1,-0.3 3,-1.5 2,-0.2 4,-0.5 0.913 71.9 58.6 -51.9 -44.7 48.2 31.6 58.7 70 74 A H T >> S+ 0 0 4 1,-0.3 4,-1.4 2,-0.2 3,-1.0 0.710 88.2 73.9 -59.8 -24.0 44.5 31.6 59.4 71 75 A I H <> S+ 0 0 2 -3,-1.4 4,-3.2 1,-0.3 -1,-0.3 0.815 85.5 64.3 -62.1 -31.3 44.2 35.3 58.6 72 76 A R H S+ 0 0 19 -3,-1.0 4,-2.3 -4,-0.5 -1,-0.2 0.891 110.7 47.3 -72.7 -38.8 41.3 32.6 55.3 74 78 A L H X S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 5,-0.4 0.961 113.3 49.7 -64.4 -50.0 39.5 35.5 57.0 75 79 A R H X S+ 0 0 28 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.917 113.4 44.4 -54.1 -50.5 40.8 37.9 54.4 76 80 A D H X S+ 0 0 43 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.874 111.3 56.6 -64.6 -37.0 39.6 35.7 51.5 77 81 A H H < S+ 0 0 21 -4,-2.3 4,-0.5 1,-0.2 -2,-0.2 0.977 115.3 33.5 -57.8 -60.3 36.3 35.1 53.2 78 82 A F H >X>S+ 0 0 0 -4,-2.4 5,-1.8 1,-0.2 3,-0.6 0.815 113.4 61.7 -68.3 -31.0 35.3 38.7 53.5 79 83 A Y H ><5S+ 0 0 68 -4,-2.3 3,-2.1 -5,-0.4 -1,-0.2 0.977 105.3 46.6 -59.5 -51.5 37.0 39.7 50.3 80 84 A N T 3<5S+ 0 0 108 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.607 105.7 60.9 -66.7 -11.1 34.7 37.4 48.3 81 85 A L T <45S- 0 0 12 -3,-0.6 -1,-0.3 -4,-0.5 -2,-0.2 0.517 115.0-116.8 -91.1 -6.8 31.7 38.8 50.2 82 86 A G T <<5 + 0 0 21 -3,-2.1 2,-0.6 -4,-0.5 -3,-0.2 0.552 63.8 149.7 84.1 6.7 32.5 42.2 48.8 83 87 A V < - 0 0 15 -5,-1.8 2,-0.6 1,-0.1 -1,-0.3 -0.626 46.4-131.5 -75.8 118.0 33.2 43.6 52.3 84 88 A I + 0 0 12 -2,-0.6 -27,-2.7 -3,-0.1 -26,-0.5 -0.594 40.5 160.0 -77.4 120.8 35.8 46.3 51.9 85 89 A I E -c 58 0B 13 -2,-0.6 2,-0.5 -28,-0.2 -26,-0.2 -0.989 33.0-153.6-141.3 148.3 38.6 45.9 54.4 86 90 A K E -c 59 0B 38 -28,-2.2 -26,-3.2 -2,-0.3 2,-0.4 -0.993 22.0-153.2-120.9 123.2 42.2 47.0 54.8 87 91 A W E -ce 60 105B 3 17,-2.7 19,-2.5 -2,-0.5 2,-0.4 -0.839 12.8-175.5-102.9 135.4 44.3 44.6 57.0 88 92 A X E -ce 61 106B 10 -28,-3.2 -26,-3.0 -2,-0.4 2,-0.5 -0.953 4.3-169.8-132.1 114.5 47.3 45.7 59.0 89 93 A L E -ce 62 107B 1 17,-2.3 19,-2.6 -2,-0.4 2,-0.5 -0.902 2.7-173.7-108.9 123.0 49.3 43.0 60.8 90 94 A I E +ce 63 108B 2 -28,-3.3 -26,-3.5 -2,-0.5 -25,-1.1 -0.954 17.1 147.9-117.6 130.7 52.0 44.1 63.3 91 95 A D E - e 0 109B 23 17,-2.0 19,-0.7 -2,-0.5 20,-0.1 -0.976 51.9-130.8-160.2 145.9 54.3 41.6 65.0 92 96 A G S S+ 0 0 19 -2,-0.3 2,-0.2 17,-0.2 19,-0.2 0.798 100.5 50.7 -65.9 -25.8 57.9 41.4 66.3 93 97 A R S S- 0 0 199 17,-0.1 -27,-0.2 15,-0.1 17,-0.2 -0.690 99.0 -90.3-110.8 163.3 58.2 38.2 64.2 94 98 A H - 0 0 147 -2,-0.2 2,-0.1 15,-0.1 -1,-0.1 -0.388 35.4-133.0 -75.7 150.0 57.4 37.4 60.6 95 99 A H - 0 0 15 1,-0.2 -27,-0.2 -29,-0.2 -29,-0.1 -0.407 40.4 -70.9 -93.2 172.0 54.0 36.2 59.3 96 100 A D > - 0 0 39 -29,-2.8 3,-1.5 1,-0.1 4,-0.2 -0.374 43.2-126.1 -61.8 136.2 53.2 33.3 57.0 97 101 A P G > S+ 0 0 87 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.677 101.8 80.0 -61.4 -17.9 54.3 34.1 53.4 98 102 A I G 3 S+ 0 0 62 1,-0.3 -2,-0.1 3,-0.0 -29,-0.0 0.485 89.3 59.0 -69.6 3.7 50.8 33.4 52.1 99 103 A L G < S+ 0 0 1 -3,-1.5 3,-0.3 -4,-0.0 -1,-0.3 0.591 89.2 89.0-102.7 -16.2 50.0 36.9 53.4 100 104 A N S < S+ 0 0 38 -3,-1.7 3,-0.1 -4,-0.2 6,-0.1 -0.398 74.5 41.9 -78.7 158.9 52.6 38.6 51.2 101 105 A G S S+ 0 0 5 1,-0.2 2,-0.4 4,-0.1 -1,-0.2 0.857 82.8 121.5 73.8 35.4 51.7 39.8 47.7 102 106 A L > - 0 0 13 3,-0.4 3,-1.1 -3,-0.3 -1,-0.2 -0.992 53.4-152.8-133.8 124.9 48.3 41.2 48.6 103 107 A R T 3 S+ 0 0 43 -2,-0.4 -1,-0.1 1,-0.2 271,-0.1 0.875 96.2 53.5 -61.4 -41.3 47.4 44.9 48.0 104 108 A D T 3 S+ 0 0 6 1,-0.1 -17,-2.7 -18,-0.1 2,-0.5 0.481 101.5 67.8 -77.2 -2.8 44.8 44.9 50.8 105 109 A V E < -e 87 0B 13 -3,-1.1 2,-0.6 -19,-0.2 -3,-0.4 -0.967 61.6-162.8-126.9 126.2 47.2 43.6 53.5 106 110 A T E -e 88 0B 54 -19,-2.5 -17,-2.3 -2,-0.5 2,-0.5 -0.890 10.0-153.7-103.7 118.9 50.2 45.4 55.0 107 111 A L E -e 89 0B 50 -2,-0.6 2,-0.5 -19,-0.2 -17,-0.2 -0.820 12.7-175.1 -97.1 126.9 52.7 43.3 56.9 108 112 A V E -e 90 0B 14 -19,-2.6 -17,-2.0 -2,-0.5 2,-0.9 -0.976 14.3-163.6-123.8 123.7 54.8 45.0 59.6 109 113 A T E +e 91 0B 50 -2,-0.5 2,-0.3 -19,-0.2 -17,-0.2 -0.749 47.8 113.5-108.2 86.8 57.6 43.4 61.5 110 114 A R - 0 0 153 -2,-0.9 2,-0.6 -19,-0.7 -17,-0.1 -0.994 67.3-117.3-150.2 149.5 58.1 45.7 64.5 111 115 A F - 0 0 166 -2,-0.3 2,-0.2 -19,-0.2 5,-0.1 -0.803 42.6-131.5 -87.9 123.5 57.7 45.5 68.2 112 116 A V + 0 0 26 -2,-0.6 2,-0.3 4,-0.1 -20,-0.0 -0.522 31.2 170.2 -82.2 146.8 55.1 48.0 69.0 113 117 A D >> - 0 0 67 -2,-0.2 4,-2.1 41,-0.0 3,-0.8 -0.953 55.1 -87.2-145.8 158.4 55.4 50.6 71.8 114 118 A E H 3> S+ 0 0 104 -2,-0.3 4,-1.9 1,-0.3 5,-0.1 0.805 127.8 55.3 -33.9 -41.9 53.4 53.7 72.8 115 119 A E H 3> S+ 0 0 142 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.935 107.9 44.0 -60.5 -54.2 55.5 55.6 70.3 116 120 A Y H <> S+ 0 0 33 -3,-0.8 4,-2.4 1,-0.2 5,-0.3 0.907 109.6 57.7 -61.5 -43.9 54.9 53.5 67.2 117 121 A L H X S+ 0 0 1 -4,-2.1 4,-1.7 1,-0.2 5,-0.2 0.942 104.0 50.9 -53.7 -51.9 51.1 53.3 68.0 118 122 A R H X S+ 0 0 112 -4,-1.9 4,-2.2 -5,-0.3 3,-0.4 0.944 110.1 52.9 -51.2 -48.1 50.7 57.0 67.9 119 123 A S H X S+ 0 0 62 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.919 108.2 45.9 -55.2 -52.3 52.5 57.1 64.5 120 124 A I H X S+ 0 0 3 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.759 110.3 56.5 -68.0 -20.0 50.3 54.5 62.8 121 125 A K H X S+ 0 0 41 -4,-1.7 4,-2.8 -3,-0.4 -1,-0.2 0.910 105.9 48.3 -75.0 -43.0 47.2 56.2 64.1 122 126 A K H < S+ 0 0 163 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.815 116.3 47.7 -65.0 -26.2 48.3 59.6 62.5 123 127 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