==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 02-APR-09 3GXL . COMPND 2 MOLECULE: TGF-BETA RECEPTOR TYPE-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.SMITH,C.JANSON . 285 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14641.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 65.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 45 15.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 0.4 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-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 . 15 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 0 0 1 1 0 0 2 0 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 2 1 2 0 2 1 1 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 1 1 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 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 I > 0 0 76 0, 0.0 3,-1.2 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -86.6 9.4 54.9 -5.6 2 2 A A G > + 0 0 0 1,-0.3 3,-1.8 2,-0.2 64,-0.1 0.861 360.0 67.6 -57.2 -36.1 12.3 53.6 -3.4 3 3 A R G 3 S+ 0 0 213 1,-0.3 -1,-0.3 62,-0.2 63,-0.0 0.834 107.1 38.3 -52.6 -36.7 12.8 50.9 -5.9 4 4 A T G < S+ 0 0 83 -3,-1.2 2,-0.5 2,-0.0 -1,-0.3 0.143 92.8 103.9-105.0 17.4 14.0 53.4 -8.5 5 5 A I < - 0 0 3 -3,-1.8 2,-0.6 19,-0.2 19,-0.2 -0.877 53.0-157.6-104.2 132.7 16.0 55.8 -6.3 6 6 A V E -A 23 0A 98 17,-2.3 17,-1.9 -2,-0.5 2,-0.2 -0.936 15.4-136.0-110.1 118.1 19.8 55.7 -6.3 7 7 A L E +A 22 0A 59 -2,-0.6 15,-0.3 15,-0.2 3,-0.1 -0.526 28.7 169.5 -74.2 139.0 21.5 57.1 -3.2 8 8 A Q E + 0 0 74 13,-2.8 2,-0.3 1,-0.3 14,-0.2 0.705 55.1 11.7-120.3 -33.7 24.5 59.3 -4.0 9 9 A E E -A 21 0A 91 12,-1.5 12,-2.8 0, 0.0 2,-0.5 -0.980 62.8-121.6-156.2 138.0 25.7 61.1 -0.9 10 10 A S E +A 20 0A 74 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.688 34.3 171.0 -78.1 122.6 25.2 61.1 2.9 11 11 A I E - 0 0 71 8,-2.5 2,-0.3 -2,-0.5 9,-0.2 0.317 50.7 -59.1-120.0 10.2 24.0 64.5 3.8 12 12 A G E -A 19 0A 34 7,-1.0 7,-2.9 2,-0.0 2,-0.3 -0.959 46.5-101.7 148.6-166.8 23.0 64.3 7.5 13 13 A K E -A 18 0A 175 -2,-0.3 5,-0.2 5,-0.3 4,-0.1 -0.974 16.2-141.5-159.6 145.4 20.7 62.5 10.0 14 14 A G - 0 0 28 3,-2.2 3,-0.2 -2,-0.3 5,-0.1 -0.071 55.1 -75.6 -91.3-163.2 17.6 63.2 12.0 15 15 A R S S+ 0 0 122 1,-0.3 2,-0.3 -2,-0.0 -1,-0.0 0.901 130.2 8.1 -61.0 -37.1 16.8 62.3 15.6 16 16 A F S S+ 0 0 81 23,-0.1 -1,-0.3 20,-0.0 -2,-0.1 -0.986 119.0 42.1-140.0 138.3 16.4 58.8 14.0 17 17 A G S S- 0 0 13 -2,-0.3 -3,-2.2 -3,-0.2 2,-0.4 0.154 74.0-102.9 100.3 142.2 17.3 58.1 10.4 18 18 A E E -AB 13 31A 93 13,-2.0 13,-2.7 -5,-0.2 2,-0.4 -0.863 31.4-134.2-103.6 134.8 20.1 58.9 8.1 19 19 A V E -AB 12 30A 34 -7,-2.9 -8,-2.5 -2,-0.4 -7,-1.0 -0.769 26.1-180.0 -95.7 130.6 19.6 61.6 5.4 20 20 A W E -AB 10 29A 61 9,-3.4 9,-3.0 -2,-0.4 2,-0.6 -0.919 29.4-131.7-127.7 152.0 20.8 61.0 1.8 21 21 A R E +AB 9 28A 43 -12,-2.8 -13,-2.8 -2,-0.3 -12,-1.5 -0.913 43.0 171.4 -99.0 123.1 20.7 62.9 -1.4 22 22 A G E -AB 7 27A 0 5,-3.1 5,-2.3 -2,-0.6 2,-0.4 -0.733 32.4-119.7-126.9 178.2 19.4 60.5 -4.0 23 23 A K E A 6 0A 102 -17,-1.9 -17,-2.3 3,-0.2 -2,-0.0 -0.990 360.0 360.0-124.2 126.9 18.3 60.5 -7.7 24 24 A W 0 0 147 -2,-0.4 -19,-0.2 -19,-0.2 -22,-0.1 -0.972 360.0 360.0-120.9 360.0 14.7 59.5 -8.6 25 ! 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 26 28 A E 0 0 106 0, 0.0 54,-0.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 139.1 17.5 64.9 -7.0 27 29 A V E -B 22 0A 9 -5,-2.3 -5,-3.1 52,-0.2 2,-0.4 -0.934 360.0-116.9-144.8 163.1 15.5 64.1 -3.9 28 30 A A E -BC 21 78A 14 50,-2.7 50,-2.8 -2,-0.3 2,-0.4 -0.875 29.2-166.8-105.4 139.2 16.2 63.8 -0.2 29 31 A V E -BC 20 77A 1 -9,-3.0 -9,-3.4 -2,-0.4 2,-0.5 -0.994 11.3-162.3-131.4 132.2 15.8 60.4 1.5 30 32 A K E -BC 19 76A 29 46,-2.7 46,-1.4 -2,-0.4 2,-0.5 -0.966 15.7-158.4-113.5 120.9 15.7 59.6 5.2 31 33 A I E -BC 18 75A 12 -13,-2.7 -13,-2.0 -2,-0.5 2,-0.3 -0.884 9.1-173.9-108.9 128.2 16.3 56.0 6.0 32 34 A F E - C 0 74A 3 42,-2.9 42,-2.6 -2,-0.5 2,-0.1 -0.805 21.8-123.1-113.2 155.3 15.2 54.2 9.2 33 35 A S > - 0 0 42 -2,-0.3 3,-1.9 40,-0.2 7,-0.2 -0.461 36.9 -98.7 -90.6 167.9 16.0 50.7 10.4 34 36 A S G > S+ 0 0 87 38,-0.4 3,-1.3 1,-0.3 4,-0.1 0.805 122.7 59.3 -58.0 -31.5 13.2 48.2 11.3 35 37 A R G 3 S+ 0 0 224 1,-0.3 -1,-0.3 2,-0.1 3,-0.3 0.611 100.8 57.0 -74.7 -9.3 13.5 49.0 15.0 36 38 A E G X> S+ 0 0 37 -3,-1.9 4,-2.3 1,-0.2 3,-0.5 0.137 70.3 119.3-105.5 20.9 12.8 52.6 14.3 37 39 A E H <> + 0 0 112 -3,-1.3 4,-3.4 1,-0.2 5,-0.3 0.863 69.5 56.0 -53.1 -43.3 9.4 51.8 12.6 38 40 A R H 3> S+ 0 0 220 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.901 110.4 44.7 -60.5 -39.5 7.4 53.8 15.1 39 41 A S H <> S+ 0 0 40 -3,-0.5 4,-2.0 2,-0.2 5,-0.2 0.912 115.8 47.6 -69.7 -41.9 9.4 57.0 14.4 40 42 A W H X S+ 0 0 32 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.950 114.3 46.2 -62.2 -50.7 9.2 56.4 10.7 41 43 A F H X S+ 0 0 115 -4,-3.4 4,-2.8 1,-0.2 -2,-0.2 0.930 111.0 51.4 -59.7 -49.0 5.5 55.7 10.7 42 44 A R H X S+ 0 0 50 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.895 112.4 44.8 -59.3 -42.9 4.6 58.7 12.9 43 45 A E H X S+ 0 0 11 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.908 112.9 51.7 -69.1 -37.8 6.5 61.2 10.7 44 46 A A H X S+ 0 0 5 -4,-2.4 4,-1.4 -5,-0.2 -2,-0.2 0.921 109.5 52.3 -60.7 -40.8 5.0 59.6 7.6 45 47 A E H < S+ 0 0 64 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.898 109.5 47.2 -61.5 -45.3 1.6 60.0 9.3 46 48 A I H >< S+ 0 0 0 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.941 111.1 51.0 -64.6 -48.0 2.1 63.7 10.0 47 49 A Y H 3< S+ 0 0 18 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.751 106.7 56.0 -62.0 -24.0 3.3 64.4 6.5 48 50 A Q T 3< S+ 0 0 125 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.356 77.7 131.8 -91.3 9.1 0.2 62.6 5.0 49 51 A T S X S- 0 0 11 -3,-1.8 3,-1.6 1,-0.1 4,-0.3 -0.323 71.8 -92.6 -59.9 138.4 -2.2 64.9 6.9 50 52 A V T 3 S+ 0 0 67 1,-0.3 -1,-0.1 73,-0.2 -2,-0.0 -0.259 105.1 0.8 -56.4 135.6 -4.9 66.3 4.7 51 53 A M T 3 S+ 0 0 102 -3,-0.1 -1,-0.3 73,-0.1 73,-0.1 0.732 88.1 132.5 56.2 30.4 -4.1 69.7 3.2 52 54 A L < + 0 0 6 -3,-1.6 -2,-0.1 -5,-0.2 -1,-0.1 0.845 34.1 108.0 -77.7 -34.3 -0.6 69.8 4.9 53 55 A R + 0 0 173 -4,-0.3 2,-0.3 -6,-0.1 5,-0.1 -0.147 39.4 152.1 -50.7 135.3 1.3 70.9 1.7 54 56 A H > - 0 0 51 3,-0.4 3,-1.9 4,-0.0 56,-0.0 -0.962 56.6-109.0-161.0 150.4 2.5 74.5 1.8 55 57 A E T 3 S+ 0 0 128 -2,-0.3 4,-0.1 1,-0.3 55,-0.1 0.778 119.2 48.8 -59.3 -24.6 5.4 76.4 0.2 56 58 A N T 3 S+ 0 0 7 90,-0.1 91,-2.7 53,-0.1 2,-0.4 0.090 97.2 79.2-104.9 22.9 7.0 76.7 3.6 57 59 A I B < S-e 147 0B 7 -3,-1.9 -3,-0.4 89,-0.3 91,-0.2 -0.997 98.0 -96.1-125.9 131.5 6.7 73.1 4.7 58 60 A L - 0 0 18 89,-2.7 2,-0.6 -2,-0.4 -2,-0.1 -0.209 45.8-112.5 -48.6 131.1 9.2 70.5 3.3 59 61 A G - 0 0 9 -4,-0.1 20,-2.1 -6,-0.1 2,-0.3 -0.586 30.6-146.9 -74.2 115.0 7.5 68.9 0.3 60 62 A F E +D 78 0A 28 -2,-0.6 18,-0.2 18,-0.2 3,-0.1 -0.647 21.8 175.9 -85.4 134.6 6.8 65.2 1.1 61 63 A I E - 0 0 52 16,-2.9 2,-0.3 -2,-0.3 17,-0.2 0.835 54.6 -45.1-102.3 -52.2 7.0 62.7 -1.8 62 64 A A E -D 77 0A 16 15,-1.5 15,-2.9 2,-0.0 2,-0.4 -0.983 31.7-123.2-176.8 162.9 6.4 59.4 -0.2 63 65 A A E +D 76 0A 30 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.917 45.0 158.8-111.9 139.5 6.9 56.7 2.5 64 66 A D E -D 75 0A 51 11,-2.2 11,-2.8 -2,-0.4 2,-0.3 -0.939 36.1-123.1-154.0 174.8 8.2 53.3 1.3 65 67 A N E -D 74 0A 83 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.944 19.0-166.7-123.5 145.9 9.9 50.1 2.2 66 68 A K E -D 73 0A 58 7,-2.1 7,-2.7 -2,-0.3 2,-0.7 -0.928 5.5-161.5-140.7 113.0 13.0 48.7 0.4 67 69 A D E -D 72 0A 110 -2,-0.4 5,-0.2 5,-0.2 -2,-0.0 -0.833 3.7-172.4 -93.7 114.1 14.3 45.2 0.9 68 70 A N - 0 0 69 3,-2.1 -1,-0.1 -2,-0.7 4,-0.1 0.431 57.7 -95.3 -87.3 4.6 17.9 44.9 -0.1 69 71 A G S S+ 0 0 66 2,-0.3 3,-0.1 -3,-0.0 -2,-0.1 0.186 119.9 47.9 104.1 -15.7 17.9 41.1 0.2 70 72 A T S S+ 0 0 121 1,-0.5 2,-0.3 0, 0.0 -3,-0.1 0.651 120.8 2.6-121.3 -42.4 19.2 41.1 3.8 71 73 A W - 0 0 152 -5,-0.1 -3,-2.1 -38,-0.0 -1,-0.5 -0.965 69.0-113.4-145.8 161.1 17.2 43.7 5.6 72 74 A T E - D 0 67A 53 -2,-0.3 -38,-0.4 -5,-0.2 2,-0.4 -0.827 24.4-153.4-100.9 134.7 14.3 46.0 5.0 73 75 A Q E - D 0 66A 30 -7,-2.7 -7,-2.1 -2,-0.4 2,-0.6 -0.831 10.0-138.7-104.8 142.8 14.8 49.8 5.1 74 76 A L E -CD 32 65A 8 -42,-2.6 -42,-2.9 -2,-0.4 2,-0.3 -0.920 28.9-161.1-104.7 116.7 12.0 52.2 6.0 75 77 A W E -CD 31 64A 1 -11,-2.8 -11,-2.2 -2,-0.6 2,-0.4 -0.744 23.3-175.0-106.0 146.6 12.1 55.2 3.6 76 78 A L E -CD 30 63A 10 -46,-1.4 -46,-2.7 -2,-0.3 2,-0.4 -0.995 18.4-163.0-132.5 127.8 10.8 58.8 3.6 77 79 A V E +CD 29 62A 2 -15,-2.9 -16,-2.9 -2,-0.4 -15,-1.5 -0.945 15.4 161.0-119.3 138.3 11.4 60.8 0.5 78 80 A S E -CD 28 60A 14 -50,-2.8 -50,-2.7 -2,-0.4 -18,-0.2 -0.872 43.6 -65.9-143.7 177.3 11.2 64.6 0.0 79 81 A D - 0 0 60 -20,-2.1 2,-0.5 -2,-0.3 -52,-0.2 -0.202 49.3-126.4 -60.7 158.3 12.2 67.5 -2.2 80 82 A Y - 0 0 52 -54,-0.5 2,-0.5 -53,-0.1 -1,-0.1 -0.946 21.8-172.2-114.0 130.9 15.9 68.3 -2.3 81 83 A H > - 0 0 30 -2,-0.5 3,-1.8 1,-0.1 58,-0.2 -0.973 17.0-148.5-124.7 112.5 17.1 71.8 -1.5 82 84 A E T 3 S+ 0 0 157 -2,-0.5 -1,-0.1 1,-0.3 58,-0.1 0.802 93.8 60.1 -50.0 -39.1 20.8 72.4 -2.2 83 85 A H T 3 S- 0 0 60 56,-0.5 -1,-0.3 1,-0.2 57,-0.1 0.755 88.5-167.6 -64.1 -25.2 21.3 74.9 0.6 84 86 A G < + 0 0 22 -3,-1.8 55,-2.6 55,-0.3 -1,-0.2 -0.419 45.1 12.2 73.5-146.1 20.3 72.4 3.2 85 87 A S B > -F 138 0B 15 53,-0.2 4,-2.5 1,-0.1 53,-0.3 -0.196 64.4-125.1 -68.1 156.5 19.5 73.6 6.7 86 88 A L H > S+ 0 0 0 51,-2.9 4,-3.1 48,-0.9 5,-0.3 0.871 114.4 60.7 -64.7 -36.4 19.0 77.2 7.9 87 89 A F H > S+ 0 0 37 47,-2.0 4,-1.4 50,-0.4 -1,-0.2 0.952 108.4 40.8 -54.5 -53.6 21.8 76.3 10.4 88 90 A D H > S+ 0 0 93 46,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.907 114.7 53.5 -61.4 -43.2 24.2 75.6 7.6 89 91 A Y H X S+ 0 0 40 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.922 109.7 46.1 -58.8 -48.5 23.0 78.5 5.5 90 92 A L H < S+ 0 0 0 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.746 111.6 52.5 -69.0 -25.3 23.5 81.0 8.3 91 93 A N H < S+ 0 0 76 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.872 115.9 40.4 -75.7 -37.3 27.0 79.7 9.2 92 94 A R H < S+ 0 0 191 -4,-2.1 2,-0.3 -5,-0.2 -2,-0.2 0.790 120.7 29.4 -83.0 -29.5 28.0 80.0 5.5 93 95 A Y < - 0 0 78 -4,-2.4 2,-0.3 -5,-0.2 -1,-0.0 -0.848 58.9-139.0-132.5 166.6 26.5 83.4 4.6 94 96 A T - 0 0 60 -2,-0.3 2,-0.3 116,-0.0 115,-0.2 -0.757 33.0-136.2-111.7 162.8 25.4 86.7 5.9 95 97 A V B -h 209 0C 11 113,-3.1 115,-2.9 -2,-0.3 2,-0.1 -0.890 4.5-119.8-128.6 158.5 22.2 88.2 4.7 96 98 A T > - 0 0 87 -2,-0.3 4,-2.4 113,-0.2 5,-0.2 -0.335 40.9-102.1 -81.7 169.8 20.7 91.5 3.5 97 99 A V H > S+ 0 0 56 113,-0.2 4,-2.4 1,-0.2 5,-0.2 0.937 126.9 47.9 -58.5 -45.7 17.8 93.1 5.3 98 100 A E H > S+ 0 0 143 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.877 110.9 51.2 -62.5 -39.0 15.5 91.8 2.6 99 101 A G H > S+ 0 0 17 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.855 109.1 50.6 -67.5 -35.4 17.0 88.4 2.8 100 102 A M H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.936 110.5 48.8 -66.7 -47.3 16.5 88.4 6.6 101 103 A I H X S+ 0 0 14 -4,-2.4 4,-3.1 1,-0.2 5,-0.3 0.904 110.4 52.3 -59.1 -42.5 12.9 89.4 6.2 102 104 A K H X S+ 0 0 80 -4,-2.3 4,-2.1 1,-0.2 43,-0.4 0.903 111.7 45.3 -62.2 -42.4 12.4 86.6 3.6 103 105 A L H X S+ 0 0 2 -4,-2.0 4,-1.7 2,-0.2 42,-0.2 0.920 118.0 42.8 -67.7 -44.1 13.8 83.9 5.9 104 106 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.919 115.5 48.0 -68.8 -45.9 11.9 85.1 9.0 105 107 A L H X S+ 0 0 30 -4,-3.1 4,-2.7 -5,-0.2 5,-0.2 0.931 111.8 49.6 -61.9 -46.3 8.6 85.6 7.1 106 108 A S H X S+ 0 0 7 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.890 111.9 48.3 -62.3 -38.9 8.7 82.3 5.3 107 109 A T H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.936 113.7 47.0 -66.4 -43.8 9.4 80.4 8.6 108 110 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 172,-0.2 0.870 110.6 53.0 -64.0 -37.4 6.6 82.3 10.3 109 111 A S H X S+ 0 0 12 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.877 110.1 48.3 -66.1 -37.3 4.3 81.6 7.4 110 112 A G H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.899 113.1 45.8 -70.7 -40.0 5.1 77.9 7.6 111 113 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.889 110.9 53.5 -70.5 -36.6 4.5 77.7 11.4 112 114 A A H X S+ 0 0 10 -4,-2.5 4,-1.9 164,-0.2 -1,-0.2 0.906 109.0 49.8 -63.7 -40.1 1.3 79.7 11.0 113 115 A H H < S+ 0 0 16 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.936 112.0 47.8 -62.6 -46.9 0.1 77.1 8.4 114 116 A L H < S+ 0 0 1 -4,-2.2 13,-2.6 1,-0.2 -2,-0.2 0.952 115.5 44.1 -58.0 -50.3 1.0 74.3 10.8 115 117 A H H < S+ 0 0 13 -4,-3.0 2,-0.4 11,-0.2 -1,-0.2 0.740 96.9 93.5 -66.4 -26.9 -0.8 75.9 13.7 116 118 A M < - 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0 0 65 0, 0.0 -2,-0.1 0, 0.0 2,-0.1 -0.250 52.4 -78.8 -75.8 173.0 27.8 73.9 27.2 226 234 A S S S+ 0 0 106 1,-0.2 -5,-0.0 2,-0.0 0, 0.0 -0.407 119.0 17.7 -68.6 149.3 27.3 72.2 23.8 227 235 A D S S- 0 0 153 1,-0.1 -1,-0.2 -3,-0.1 2,-0.0 0.964 96.3-157.9 51.0 57.8 24.6 69.5 23.9 228 236 A P - 0 0 6 0, 0.0 -58,-0.2 0, 0.0 -57,-0.2 -0.296 6.8-126.0 -68.5 151.7 23.2 71.0 27.1 229 237 A S > - 0 0 50 -59,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.404 28.5-102.8 -89.5 170.8 21.0 69.0 29.5 230 238 A V H > S+ 0 0 23 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.927 121.8 50.5 -60.6 -45.4 17.6 70.0 30.8 231 239 A E H > S+ 0 0 95 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.899 108.6 50.8 -60.4 -43.6 19.0 71.1 34.1 232 240 A E H > S+ 0 0 77 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.903 115.5 43.3 -62.2 -41.0 21.7 73.2 32.6 233 241 A M H X S+ 0 0 0 -4,-2.1 4,-3.1 1,-0.2 5,-0.4 0.929 111.3 54.5 -68.9 -46.3 19.1 74.9 30.4 234 242 A R H X>S+ 0 0 51 -4,-3.3 4,-2.3 1,-0.2 5,-1.8 0.879 104.1 54.5 -55.9 -42.6 16.5 75.3 33.2 235 243 A K H <>S+ 0 0 123 -4,-2.3 5,-2.5 3,-0.2 -1,-0.2 0.877 116.8 37.4 -61.4 -37.3 19.0 77.1 35.5 236 244 A V H <5S+ 0 0 12 -4,-1.1 6,-2.5 -3,-0.4 -2,-0.2 0.943 127.2 32.2 -79.6 -51.6 19.7 79.7 32.8 237 245 A V H <5S+ 0 0 2 -4,-3.1 -3,-0.2 4,-0.2 -2,-0.2 0.866 132.4 26.1 -76.8 -39.3 16.2 80.1 31.2 238 246 A C T <5S+ 0 0 18 -4,-2.3 -3,-0.2 -5,-0.4 -4,-0.1 0.889 130.4 30.2 -94.0 -46.6 14.0 79.5 34.3 239 247 A E T - 0 0 53 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.530 360.0-128.4 -81.2 146.0 17.9 99.4 11.7 253 262 A E H > S+ 0 0 100 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.911 111.1 50.5 -58.8 -43.7 14.1 99.6 11.6 254 263 A A H > S+ 0 0 5 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.916 112.2 46.6 -61.5 -44.3 13.8 96.1 10.3 255 264 A L H > S+ 0 0 41 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.827 109.3 55.4 -67.3 -31.6 16.1 94.8 13.0 256 265 A R H X S+ 0 0 126 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.897 108.2 48.2 -68.0 -39.5 14.2 96.8 15.6 257 266 A V H X S+ 0 0 20 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.925 111.9 49.8 -65.6 -44.1 11.0 95.0 14.5 258 267 A M H X S+ 0 0 1 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.935 109.4 51.0 -59.1 -48.6 12.7 91.6 14.7 259 268 A A H X S+ 0 0 13 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.901 108.8 51.0 -57.1 -44.5 14.0 92.3 18.2 260 269 A K H X S+ 0 0 88 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.912 109.5 50.9 -60.7 -43.4 10.6 93.3 19.4 261 270 A I H < S+ 0 0 5 -4,-2.1 4,-0.4 2,-0.2 13,-0.2 0.948 109.1 52.1 -58.8 -48.3 9.2 90.1 18.0 262 271 A M H >X S+ 0 0 6 -4,-2.6 3,-2.0 1,-0.2 4,-1.1 0.941 108.9 48.5 -52.6 -54.6 11.9 88.1 19.7 263 272 A R H >< S+ 0 0 130 -4,-2.5 3,-0.8 1,-0.3 -1,-0.2 0.909 110.0 52.3 -54.3 -44.4 11.1 89.6 23.1 264 273 A E T 3< S+ 0 0 46 -4,-2.3 10,-1.4 1,-0.2 -1,-0.3 0.481 109.2 51.2 -73.1 -0.9 7.4 88.9 22.7 265 274 A C T <4 S+ 0 0 0 -3,-2.0 -1,-0.2 -4,-0.4 -2,-0.2 0.563 103.3 61.3-104.7 -17.4 8.3 85.3 21.9 266 275 A W << + 0 0 13 -4,-1.1 -2,-0.2 -3,-0.8 -3,-0.1 0.286 65.1 131.4 -97.7 10.7 10.4 84.8 25.0 267 276 A Y - 0 0 100 -4,-0.2 6,-0.1 1,-0.1 -71,-0.1 -0.331 62.6-127.9 -60.9 145.3 8.0 85.5 27.9 268 277 A A S S+ 0 0 62 1,-0.1 2,-0.6 -93,-0.1 -92,-0.3 0.820 97.9 68.8 -63.8 -30.4 8.2 82.8 30.5 269 278 A N S >> S- 0 0 99 1,-0.1 3,-1.8 -94,-0.1 4,-0.6 -0.822 75.5-151.8 -94.5 117.4 4.4 82.4 30.2 270 279 A G G >4 S+ 0 0 8 -2,-0.6 3,-1.1 1,-0.3 -1,-0.1 0.826 92.8 64.0 -55.5 -35.6 3.3 80.9 26.9 271 280 A A G 34 S+ 0 0 53 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.664 98.3 56.6 -65.1 -16.1 -0.0 82.7 27.0 272 281 A A G <4 S+ 0 0 51 -3,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.677 88.8 99.0 -88.5 -19.2 1.8 86.1 26.8 273 282 A R S << S- 0 0 15 -3,-1.1 -8,-0.2 -4,-0.6 -9,-0.1 -0.159 80.0-100.8 -68.6 160.6 3.6 85.2 23.6 274 283 A L - 0 0 32 -10,-1.4 2,-0.2 -13,-0.2 -1,-0.1 -0.361 36.3-115.9 -75.5 160.0 2.6 86.3 20.1 275 284 A T > - 0 0 77 1,-0.1 4,-2.1 -2,-0.1 5,-0.2 -0.591 22.0-115.0 -93.1 161.4 0.9 83.9 17.7 276 285 A A H > S+ 0 0 3 1,-0.2 4,-2.5 -2,-0.2 -164,-0.2 0.883 117.0 54.3 -62.5 -37.4 2.5 82.8 14.5 277 286 A L H > S+ 0 0 103 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.918 107.3 49.1 -63.3 -44.7 -0.2 84.5 12.5 278 287 A R H > S+ 0 0 145 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.908 111.9 49.7 -61.9 -40.8 0.4 87.9 14.2 279 288 A I H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.918 109.7 51.0 -64.3 -42.2 4.1 87.5 13.5 280 289 A K H X S+ 0 0 70 -4,-2.5 4,-2.3 -172,-0.2 -2,-0.2 0.925 110.4 49.6 -60.3 -46.0 3.5 86.7 9.9 281 290 A K H X S+ 0 0 116 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.954 112.5 46.3 -57.5 -52.9 1.3 89.8 9.6 282 291 A T H X S+ 0 0 39 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.894 114.3 47.5 -57.7 -44.2 3.9 92.1 11.1 283 292 A L H X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.838 110.1 53.9 -67.5 -32.8 6.7 90.6 9.0 284 293 A S H X S+ 0 0 48 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.917 108.1 49.1 -67.1 -43.5 4.5 90.9 5.9 285 294 A Q H X S+ 0 0 112 -4,-2.4 4,-1.6 1,-0.2 3,-0.3 0.923 111.3 49.5 -61.5 -45.6 3.9 94.6 6.6 286 295 A L H < S+ 0 0 17 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.881 107.0 55.8 -61.3 -39.6 7.6 95.2 7.1 287 296 A S H < S+ 0 0 65 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.841 107.0 50.3 -62.2 -34.1 8.4 93.4 3.8 288 297 A Q H < 0 0 162 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.848 360.0 360.0 -72.9 -35.4 6.1 95.8 2.0 289 298 A Q < 0 0 187 -4,-1.6 -2,-0.2 -5,-0.1 -3,-0.1 0.978 360.0 360.0 -74.8 360.0 7.7 98.9 3.6