==== 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 TRANSFERASE 18-OCT-06 2ISQ . COMPND 2 MOLECULE: CYSTEINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR J.A.FRANCOIS,S.KUMARAN,J.M.JEZ . 328 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14507.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 238 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 2.4 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 . 21 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 30.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.7 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 0 3 1 0 0 0 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 1 4 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 . 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 0 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 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 3 A S 0 0 187 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 169.7 80.8 13.8 -22.4 2 4 A R - 0 0 174 0, 0.0 2,-0.5 0, 0.0 0, 0.0 -0.837 360.0 -94.5-141.4 177.8 78.7 13.7 -19.2 3 5 A I - 0 0 152 -2,-0.2 2,-0.1 1,-0.0 3,-0.0 -0.864 37.9-117.0-105.5 131.4 75.5 15.3 -17.8 4 6 A A - 0 0 32 -2,-0.5 3,-0.1 1,-0.2 6,-0.0 -0.389 10.7-140.0 -65.3 136.3 75.6 18.4 -15.6 5 7 A K S S- 0 0 161 1,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.882 82.2 -23.1 -62.0 -37.4 74.3 17.9 -12.0 6 8 A D S > S- 0 0 52 1,-0.0 3,-2.3 -3,-0.0 4,-0.3 -0.974 79.7 -78.1-165.1 170.7 72.7 21.2 -12.4 7 9 A V G > S+ 0 0 50 -2,-0.3 3,-2.0 1,-0.3 4,-0.2 0.782 118.5 67.5 -49.2 -32.8 72.8 24.5 -14.2 8 10 A T G > S+ 0 0 16 1,-0.3 3,-0.9 2,-0.2 -1,-0.3 0.759 92.9 58.5 -63.2 -25.5 75.7 25.8 -12.1 9 11 A E G < S+ 0 0 77 -3,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.464 96.9 65.5 -82.0 0.8 78.0 23.2 -13.7 10 12 A L G < S+ 0 0 103 -3,-2.0 -1,-0.2 -4,-0.3 -2,-0.2 0.467 79.0 108.7 -96.6 -7.7 77.1 24.8 -17.0 11 13 A I S < S+ 0 0 23 -3,-0.9 27,-0.1 -4,-0.2 35,-0.0 -0.335 71.6 4.1 -71.4 150.9 78.9 28.0 -16.2 12 14 A G S S+ 0 0 12 23,-0.1 146,-0.0 1,-0.1 147,-0.0 -0.215 72.4 102.7 75.9-165.5 82.1 29.1 -17.8 13 15 A N + 0 0 131 1,-0.2 -1,-0.1 25,-0.0 146,-0.0 0.811 56.2 176.3 53.1 35.7 84.1 27.3 -20.6 14 16 A T - 0 0 11 1,-0.1 -1,-0.2 19,-0.1 21,-0.1 -0.396 28.1-101.9 -71.7 149.4 82.8 29.8 -23.1 15 17 A P - 0 0 48 0, 0.0 19,-2.2 0, 0.0 2,-0.4 -0.127 20.1-135.2 -69.2 161.5 84.0 29.7 -26.7 16 18 A L E -A 33 0A 56 17,-0.2 2,-0.3 150,-0.1 17,-0.2 -0.963 24.2-178.6-120.1 133.4 86.6 31.8 -28.6 17 19 A V E -A 32 0A 51 15,-2.0 15,-3.7 -2,-0.4 2,-0.3 -0.989 25.4-118.6-136.4 144.8 85.9 33.1 -32.1 18 20 A Y E -A 31 0A 113 -2,-0.3 2,-0.6 13,-0.3 13,-0.2 -0.599 21.6-130.2 -83.3 141.5 87.9 35.2 -34.6 19 21 A L + 0 0 9 11,-2.7 11,-0.4 -2,-0.3 241,-0.0 -0.815 34.2 174.0 -88.9 122.0 86.6 38.6 -35.7 20 22 A N + 0 0 113 -2,-0.6 -1,-0.2 2,-0.1 3,-0.2 0.928 62.8 15.1 -98.1 -71.5 86.8 38.5 -39.5 21 23 A N S > S+ 0 0 108 238,-0.3 3,-0.7 1,-0.2 239,-0.1 0.650 120.9 58.3 -85.3 -12.7 85.4 41.4 -41.4 22 24 A V T 3 S+ 0 0 13 1,-0.2 -1,-0.2 234,-0.1 234,-0.1 0.717 99.1 62.5 -83.3 -21.6 85.1 43.9 -38.6 23 25 A A T > S+ 0 0 12 -3,-0.2 3,-2.1 7,-0.1 -1,-0.2 0.146 74.2 149.7 -88.9 19.7 88.8 43.6 -38.0 24 26 A E T < + 0 0 156 -3,-0.7 3,-0.1 1,-0.3 -3,-0.1 -0.313 65.1 26.2 -56.8 131.9 89.6 44.9 -41.4 25 27 A G T 3 S+ 0 0 58 1,-0.3 -1,-0.3 254,-0.0 2,-0.3 0.291 89.4 132.9 97.0 -8.2 92.9 46.8 -41.4 26 28 A C < - 0 0 29 -3,-2.1 -1,-0.3 1,-0.2 254,-0.3 -0.565 36.0-177.5 -80.1 138.6 94.3 44.8 -38.5 27 29 A V S S+ 0 0 70 252,-2.1 259,-2.7 -2,-0.3 253,-0.2 0.539 78.4 66.3-101.9 -18.9 97.8 43.4 -38.7 28 30 A G S S- 0 0 9 251,-2.7 2,-0.4 257,-0.3 260,-0.2 -0.346 91.3-116.5 -89.5 178.8 97.2 41.9 -35.4 29 31 A R E - b 0 288A 91 258,-3.8 260,-3.5 255,-0.2 2,-0.5 -0.961 20.2-154.9-124.1 135.8 94.6 39.2 -34.8 30 32 A V E - b 0 289A 3 -2,-0.4 -11,-2.7 -11,-0.4 2,-0.4 -0.945 10.4-178.7-119.3 123.6 91.4 39.5 -32.6 31 33 A A E -Ab 18 290A 6 258,-3.0 260,-2.2 -2,-0.5 2,-0.5 -0.939 19.0-141.5-115.2 135.6 89.6 36.6 -31.0 32 34 A A E -Ab 17 291A 0 -15,-3.7 -15,-2.0 -2,-0.4 2,-1.0 -0.851 4.9-142.7-102.5 130.3 86.4 37.2 -28.9 33 35 A K E -Ab 16 292A 3 258,-2.5 260,-2.2 -2,-0.5 2,-1.7 -0.800 22.6-142.6 -90.5 102.3 85.7 35.3 -25.7 34 36 A L E > + b 0 293A 13 -19,-2.2 3,-1.5 -2,-1.0 258,-0.1 -0.472 37.8 160.0 -73.5 83.1 81.9 34.8 -26.0 35 37 A E G > + 0 0 0 -2,-1.7 3,-1.8 258,-1.3 -1,-0.2 0.594 68.3 81.3 -75.3 -9.7 80.6 35.2 -22.4 36 38 A M G 3 S+ 0 0 15 257,-0.7 -1,-0.3 259,-0.3 260,-0.2 0.656 81.9 65.4 -67.1 -15.3 77.3 35.9 -24.1 37 39 A M G < S+ 0 0 114 -3,-1.5 -1,-0.3 -22,-0.1 -2,-0.2 0.216 74.6 121.2 -91.6 11.1 77.2 32.1 -24.3 38 40 A E S X S- 0 0 8 -3,-1.8 3,-2.5 1,-0.1 -27,-0.1 -0.319 87.3 -95.1 -69.0 161.7 77.0 31.7 -20.6 39 41 A P T 3 S+ 0 0 51 0, 0.0 -1,-0.1 0, 0.0 -28,-0.1 0.858 128.8 30.3 -46.2 -38.8 73.9 29.9 -19.3 40 42 A C T 3 S- 0 0 17 2,-0.3 4,-0.1 39,-0.0 -3,-0.1 -0.119 120.3-100.9-114.3 35.0 72.2 33.3 -18.8 41 43 A S S < S+ 0 0 37 -3,-2.5 255,-1.2 -5,-0.1 2,-0.3 0.304 89.0 78.5 69.8 -7.7 74.0 35.3 -21.6 42 44 A S B > S-F 295 0B 0 253,-0.2 3,-1.3 33,-0.1 -2,-0.3 -0.891 80.6-116.0-135.6 168.0 76.6 37.2 -19.5 43 45 A V T >> S+ 0 0 8 251,-2.1 3,-1.9 -2,-0.3 4,-0.7 0.722 104.9 75.1 -66.5 -23.0 79.9 37.0 -17.7 44 46 A K H 3> S+ 0 0 19 1,-0.3 4,-2.6 250,-0.3 -1,-0.3 0.607 73.3 79.4 -68.5 -10.8 78.2 37.6 -14.4 45 47 A D H <> S+ 0 0 0 -3,-1.3 4,-1.2 1,-0.2 -1,-0.3 0.808 93.9 53.9 -64.9 -24.1 77.0 34.1 -14.4 46 48 A R H <> S+ 0 0 2 -3,-1.9 4,-2.6 -4,-0.2 -2,-0.2 0.969 114.5 33.7 -72.4 -57.8 80.5 33.3 -13.3 47 49 A I H X S+ 0 0 1 -4,-0.7 4,-2.4 2,-0.2 5,-0.3 0.748 109.7 67.2 -73.3 -22.5 80.7 35.7 -10.3 48 50 A G H X S+ 0 0 0 -4,-2.6 4,-1.1 2,-0.2 -1,-0.2 0.969 112.6 32.9 -58.8 -49.4 77.0 35.1 -9.5 49 51 A F H X S+ 0 0 49 -4,-1.2 4,-3.2 -5,-0.2 5,-0.3 0.938 116.9 55.2 -70.5 -50.2 77.9 31.5 -8.7 50 52 A S H X S+ 0 0 10 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.924 107.9 47.6 -51.8 -52.3 81.4 32.2 -7.3 51 53 A M H X S+ 0 0 1 -4,-2.4 4,-1.0 2,-0.2 -1,-0.2 0.869 117.3 43.3 -60.0 -37.7 80.3 34.7 -4.7 52 54 A I H >X S+ 0 0 0 -4,-1.1 4,-2.2 -5,-0.3 3,-1.1 0.992 116.1 46.9 -67.1 -63.5 77.5 32.4 -3.5 53 55 A S H 3X S+ 0 0 12 -4,-3.2 4,-2.6 1,-0.3 5,-0.2 0.826 109.2 54.1 -46.5 -44.2 79.6 29.3 -3.5 54 56 A D H 3X S+ 0 0 29 -4,-3.1 4,-1.9 -5,-0.3 -1,-0.3 0.838 109.2 48.8 -64.7 -33.0 82.5 30.9 -1.7 55 57 A A H <<>S+ 0 0 0 -3,-1.1 5,-2.0 -4,-1.0 6,-0.8 0.914 110.7 50.4 -72.2 -43.4 80.2 32.0 1.1 56 58 A E H ><5S+ 0 0 51 -4,-2.2 3,-2.1 1,-0.2 -2,-0.2 0.963 112.2 46.9 -56.8 -54.9 78.7 28.5 1.4 57 59 A K H 3<5S+ 0 0 171 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.890 109.6 52.5 -55.9 -43.3 82.1 27.0 1.6 58 60 A K T 3<5S- 0 0 133 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.359 115.9-121.3 -75.3 9.3 83.3 29.6 4.2 59 61 A G T < 5S+ 0 0 57 -3,-2.1 -3,-0.2 2,-0.1 -2,-0.1 0.541 80.1 123.2 64.5 8.3 80.1 28.5 6.1 60 62 A L S > - 0 0 125 -2,-0.3 4,-2.9 -3,-0.0 3,-2.1 -0.999 34.6-107.2-135.7 129.8 73.1 28.2 4.2 63 65 A P T 34 S+ 0 0 63 0, 0.0 26,-0.2 0, 0.0 25,-0.1 -0.183 105.3 13.0 -53.0 144.4 70.3 27.6 1.6 64 66 A G T 34 S+ 0 0 76 24,-1.5 25,-0.1 2,-0.3 3,-0.1 0.580 128.2 60.6 64.7 6.2 66.8 28.4 2.8 65 67 A E T <4 S+ 0 0 99 -3,-2.1 74,-0.2 1,-0.2 -1,-0.2 0.608 91.8 62.4-123.8 -53.7 68.4 30.1 5.8 66 68 A S < - 0 0 6 -4,-2.9 24,-0.9 72,-0.1 2,-0.6 -0.403 69.9-142.9 -77.5 151.5 70.4 32.9 4.5 67 69 A V E -gh 90 140C 21 72,-2.3 74,-2.1 22,-0.1 2,-0.2 -0.927 14.5-144.2-120.6 105.5 68.9 35.8 2.5 68 70 A L E -gh 91 141C 0 22,-2.2 24,-2.9 -2,-0.6 2,-0.4 -0.493 20.7-176.5 -71.5 132.5 71.1 37.1 -0.3 69 71 A I E +gh 92 142C 0 72,-2.4 74,-1.4 -2,-0.2 75,-0.3 -0.995 10.1 157.7-133.3 135.7 71.0 40.8 -0.9 70 72 A E E -g 93 0C 2 22,-1.8 24,-1.5 -2,-0.4 2,-0.7 -0.920 34.7-132.9-161.9 132.1 72.7 42.9 -3.6 71 73 A P E +g 94 0C 12 0, 0.0 2,-0.2 0, 0.0 24,-0.2 -0.764 51.4 130.2 -87.1 116.2 72.1 46.3 -5.3 72 74 A T - 0 0 1 22,-2.5 256,-0.1 -2,-0.7 -2,-0.1 -0.768 40.7-175.4-173.0 123.3 72.4 45.9 -9.0 73 75 A S S S+ 0 0 4 254,-0.4 2,-0.1 -2,-0.2 22,-0.1 0.075 76.5 78.7-103.2 21.0 70.4 46.9 -12.1 74 76 A G S >> S- 0 0 10 255,-0.8 3,-1.3 254,-0.1 4,-0.7 -0.334 105.5 -68.9-114.7-164.3 72.9 44.9 -14.2 75 77 A N H 3> S+ 0 0 15 253,-0.3 4,-2.8 1,-0.3 5,-0.2 0.697 117.7 74.0 -62.9 -21.7 73.8 41.4 -15.2 76 78 A T H 3> S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.861 90.6 58.9 -62.2 -32.4 74.9 40.6 -11.6 77 79 A G H <> S+ 0 0 1 -3,-1.3 4,-2.8 2,-0.2 -1,-0.2 0.961 110.6 40.4 -58.9 -51.1 71.3 40.5 -10.7 78 80 A V H X S+ 0 0 6 -4,-0.7 4,-2.4 2,-0.2 5,-0.4 0.948 112.9 54.6 -62.9 -51.1 70.6 37.7 -13.2 79 81 A G H X S+ 0 0 0 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.943 115.5 38.9 -47.4 -56.3 73.8 35.9 -12.5 80 82 A L H X S+ 0 0 0 -4,-2.7 4,-3.2 2,-0.2 5,-0.3 0.927 114.6 57.3 -59.6 -47.5 73.0 35.7 -8.8 81 83 A A H X S+ 0 0 1 -4,-2.8 4,-3.0 -5,-0.3 3,-0.2 0.948 107.2 41.7 -50.0 -66.2 69.3 35.0 -9.5 82 84 A F H X S+ 0 0 7 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.870 119.2 48.4 -55.5 -35.4 69.5 31.9 -11.6 83 85 A T H X S+ 0 0 0 -4,-1.5 4,-2.2 -5,-0.4 -1,-0.2 0.865 110.9 48.6 -72.5 -37.6 72.2 30.5 -9.3 84 86 A A H X>S+ 0 0 2 -4,-3.2 5,-2.3 -3,-0.2 4,-1.8 0.897 110.8 53.9 -67.4 -38.6 70.2 31.3 -6.1 85 87 A A H <5S+ 0 0 51 -4,-3.0 3,-0.3 -5,-0.3 -2,-0.2 0.951 111.1 43.2 -58.9 -53.3 67.2 29.6 -7.8 86 88 A A H <5S+ 0 0 54 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.893 120.3 42.5 -61.4 -41.2 69.1 26.4 -8.5 87 89 A K H <5S- 0 0 58 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.605 113.1-113.8 -83.8 -13.8 70.7 26.4 -5.1 88 90 A G T <5 + 0 0 41 -4,-1.8 -24,-1.5 -3,-0.3 2,-0.4 0.940 61.8 144.5 81.8 50.9 67.6 27.4 -3.1 89 91 A Y < - 0 0 13 -5,-2.3 2,-0.4 -26,-0.2 -1,-0.2 -0.956 51.2-121.9-122.0 139.0 68.5 30.8 -1.7 90 92 A K E -g 67 0C 110 -24,-0.9 -22,-2.2 -2,-0.4 2,-0.4 -0.671 34.1-161.5 -78.4 128.2 66.2 33.8 -1.2 91 93 A L E -g 68 0C 4 -2,-0.4 22,-3.2 20,-0.4 2,-0.5 -0.951 12.3-167.4-119.5 134.3 67.6 36.7 -3.3 92 94 A I E -gi 69 113C 6 -24,-2.9 -22,-1.8 -2,-0.4 2,-0.4 -0.969 9.2-168.8-117.5 128.6 66.7 40.3 -2.9 93 95 A I E -gi 70 114C 0 20,-1.9 22,-2.7 -2,-0.5 2,-0.4 -0.967 4.3-161.7-122.6 135.8 67.7 42.8 -5.6 94 96 A T E +gi 71 115C 0 -24,-1.5 -22,-2.5 -2,-0.4 22,-0.2 -0.913 22.1 148.1-116.0 142.6 67.7 46.5 -5.4 95 97 A M E - i 0 116C 3 20,-1.5 22,-1.9 -2,-0.4 28,-0.1 -0.953 53.6 -78.5-167.4 149.2 67.8 48.9 -8.4 96 98 A P E > - i 0 117C 0 0, 0.0 3,-1.0 0, 0.0 22,-0.2 -0.252 39.5-125.8 -52.9 136.9 66.5 52.3 -9.4 97 99 A A T 3 S+ 0 0 36 20,-3.0 21,-0.1 1,-0.3 19,-0.1 0.789 105.1 78.7 -55.8 -24.3 62.8 52.0 -10.5 98 100 A S T 3 + 0 0 58 19,-0.3 -1,-0.3 24,-0.0 3,-0.1 0.929 63.5 106.9 -48.7 -53.7 64.1 53.6 -13.7 99 101 A M S < S- 0 0 11 -3,-1.0 5,-0.1 1,-0.1 -4,-0.0 0.019 85.3 -99.1 -34.9 116.3 65.5 50.3 -15.0 100 102 A S > - 0 0 34 3,-0.1 3,-0.8 1,-0.1 4,-0.3 0.179 28.5-107.8 -40.1 154.2 63.2 49.2 -17.8 101 103 A T T >> S+ 0 0 70 1,-0.2 3,-3.7 2,-0.2 4,-1.8 0.927 112.1 62.6 -51.7 -58.5 60.5 46.6 -17.3 102 104 A E H 3> S+ 0 0 118 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.774 96.9 60.8 -41.2 -36.0 62.1 43.7 -19.2 103 105 A R H <> S+ 0 0 33 -3,-0.8 4,-0.5 1,-0.2 -1,-0.3 0.627 109.2 42.3 -71.6 -12.4 65.0 43.8 -16.7 104 106 A R H <> S+ 0 0 64 -3,-3.7 4,-3.1 -4,-0.3 5,-0.3 0.814 102.1 65.3 -97.9 -43.0 62.6 43.0 -13.9 105 107 A I H X S+ 0 0 96 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.852 105.3 49.2 -46.2 -38.8 60.5 40.4 -15.7 106 108 A I H X S+ 0 0 55 -4,-1.2 4,-0.8 2,-0.2 -1,-0.2 0.902 110.9 44.5 -72.9 -43.8 63.6 38.3 -15.7 107 109 A L H ><>S+ 0 0 7 -4,-0.5 5,-2.3 -3,-0.2 3,-0.7 0.902 115.0 50.8 -67.0 -40.4 64.6 38.5 -12.1 108 110 A L H ><5S+ 0 0 91 -4,-3.1 3,-2.7 1,-0.3 -2,-0.2 0.910 101.3 61.5 -62.5 -42.5 61.0 37.9 -11.1 109 111 A A H 3<5S+ 0 0 82 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.772 104.3 50.8 -54.3 -28.1 60.9 34.9 -13.3 110 112 A F T <<5S- 0 0 74 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.348 125.1-102.9 -92.5 4.0 63.7 33.4 -11.1 111 113 A G T < 5 + 0 0 64 -3,-2.7 -20,-0.4 1,-0.2 -3,-0.2 0.706 64.5 163.1 82.6 19.9 61.8 34.2 -7.9 112 114 A V < - 0 0 9 -5,-2.3 2,-1.0 -6,-0.1 -1,-0.2 -0.473 41.2-129.8 -72.4 141.6 63.9 37.2 -7.0 113 115 A E E -i 92 0C 88 -22,-3.2 -20,-1.9 -2,-0.2 2,-0.3 -0.834 32.4-155.5 -94.9 100.7 62.4 39.6 -4.5 114 116 A L E -i 93 0C 38 -2,-1.0 2,-0.5 -22,-0.2 -20,-0.2 -0.593 17.0-174.7 -83.0 135.9 62.7 42.9 -6.3 115 117 A V E -i 94 0C 34 -22,-2.7 -20,-1.5 -2,-0.3 2,-0.3 -0.960 11.7-155.7-131.5 111.7 62.9 46.2 -4.5 116 118 A L E -i 95 0C 66 -2,-0.5 2,-0.2 -22,-0.2 -22,-0.0 -0.623 11.3-159.0 -87.2 146.9 62.9 49.3 -6.7 117 119 A T E -i 96 0C 12 -22,-1.9 -20,-3.0 -2,-0.3 -19,-0.3 -0.711 41.1 -57.3-120.4 172.0 64.5 52.5 -5.3 118 120 A D > - 0 0 72 -2,-0.2 3,-2.1 -22,-0.2 4,-0.3 -0.278 44.1-147.0 -51.0 114.2 64.2 56.3 -6.1 119 121 A P G > S+ 0 0 65 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.717 97.9 59.9 -57.5 -20.7 65.1 56.5 -9.9 120 122 A A G 3 S+ 0 0 71 1,-0.2 -2,-0.1 2,-0.1 206,-0.0 0.626 99.3 55.4 -82.5 -17.3 66.6 59.9 -9.1 121 123 A K G X> S- 0 0 118 -3,-2.1 4,-1.9 1,-0.2 3,-0.9 0.393 90.3-165.4 -96.2 1.7 69.1 58.4 -6.6 122 124 A G H <> - 0 0 2 -3,-0.5 4,-1.2 -4,-0.3 3,-0.3 -0.099 61.7 -25.0 49.4-143.0 70.5 56.0 -9.2 123 125 A M H 3> S+ 0 0 2 202,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.721 135.1 68.4 -73.4 -20.9 72.6 53.2 -7.8 124 126 A K H <> S+ 0 0 160 -3,-0.9 4,-1.6 1,-0.2 -1,-0.2 0.911 103.6 43.6 -63.1 -41.6 73.4 55.3 -4.8 125 127 A G H X S+ 0 0 9 -4,-1.9 4,-2.2 -3,-0.3 -1,-0.2 0.849 112.4 52.8 -71.8 -33.7 69.8 55.0 -3.7 126 128 A A H X S+ 0 0 0 -4,-1.2 4,-1.9 -5,-0.2 -2,-0.2 0.897 108.1 51.2 -66.7 -41.5 69.7 51.3 -4.5 127 129 A I H X S+ 0 0 53 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.872 109.9 49.8 -64.3 -38.4 72.8 50.7 -2.4 128 130 A A H X S+ 0 0 51 -4,-1.6 4,-3.0 2,-0.2 3,-0.5 0.992 109.8 48.5 -62.6 -61.6 71.3 52.5 0.5 129 131 A K H X S+ 0 0 64 -4,-2.2 4,-2.3 1,-0.3 -1,-0.2 0.835 110.1 56.0 -46.7 -38.3 68.0 50.5 0.4 130 132 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -1,-0.3 0.931 110.6 40.7 -63.3 -48.6 70.2 47.4 0.2 131 133 A E H X S+ 0 0 103 -4,-2.0 4,-2.7 -3,-0.5 -2,-0.2 0.851 112.7 56.3 -69.3 -33.2 72.1 48.0 3.4 132 134 A E H X S+ 0 0 91 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.920 110.7 44.8 -61.4 -43.3 68.9 49.2 5.0 133 135 A I H X S+ 0 0 12 -4,-2.3 4,-2.6 -5,-0.3 -2,-0.2 0.854 110.0 55.1 -67.9 -36.8 67.4 45.8 4.1 134 136 A L H < S+ 0 0 56 -4,-2.1 6,-0.3 2,-0.2 -2,-0.2 0.917 106.9 50.7 -62.2 -44.5 70.6 44.1 5.3 135 137 A A H < S+ 0 0 88 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.925 114.5 44.1 -58.1 -47.2 70.2 45.8 8.7 136 138 A K H < S+ 0 0 145 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.813 97.6 86.2 -68.1 -35.6 66.6 44.6 8.9 137 139 A T >< - 0 0 28 -4,-2.6 3,-1.0 1,-0.1 -70,-0.1 -0.604 63.8-155.0 -79.6 121.9 67.3 41.0 7.7 138 140 A P T 3 S+ 0 0 125 0, 0.0 -1,-0.1 0, 0.0 -72,-0.1 0.936 97.9 24.4 -55.2 -56.6 68.4 38.5 10.4 139 141 A N T 3 S+ 0 0 78 -74,-0.2 -72,-2.3 2,-0.0 -74,-0.1 0.006 94.0 149.5-101.3 27.5 70.2 36.1 8.1 140 142 A G E < -h 67 0C 19 -3,-1.0 2,-0.3 -6,-0.3 -72,-0.2 -0.269 22.9-176.1 -63.0 146.7 70.9 38.8 5.5 141 143 A Y E -h 68 0C 55 -74,-2.1 -72,-2.4 -80,-0.0 2,-0.4 -0.860 11.1-157.1-149.8 109.9 74.1 38.6 3.4 142 144 A M E -h 69 0C 17 -2,-0.3 -72,-0.2 -74,-0.2 -74,-0.1 -0.737 3.7-157.7 -90.1 132.3 75.2 41.2 0.9 143 145 A L - 0 0 2 -74,-1.4 5,-0.2 -2,-0.4 -1,-0.1 0.920 12.3-160.6 -76.3 -45.9 77.6 40.0 -1.8 144 146 A Q >> - 0 0 86 -75,-0.3 4,-4.1 3,-0.1 3,-1.5 0.995 3.2-161.6 61.6 71.7 79.2 43.3 -2.8 145 147 A Q T 34 S+ 0 0 0 1,-0.3 37,-0.1 2,-0.2 -1,-0.1 0.722 88.7 52.8 -56.4 -26.1 80.6 42.5 -6.3 146 148 A F T 34 S+ 0 0 17 1,-0.1 86,-2.1 85,-0.1 85,-0.6 0.703 122.4 29.6 -83.9 -18.3 83.0 45.5 -6.1 147 149 A E T <4 S+ 0 0 93 -3,-1.5 -2,-0.2 84,-0.2 -3,-0.1 0.746 94.7 101.9-106.1 -37.1 84.4 44.4 -2.8 148 150 A N >< - 0 0 15 -4,-4.1 3,-1.3 -5,-0.2 -97,-0.1 -0.309 55.9-156.4 -58.9 121.6 84.0 40.6 -2.9 149 151 A P T 3> S+ 0 0 92 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.703 88.9 73.9 -71.0 -20.6 87.3 38.8 -3.7 150 152 A A H 3> S+ 0 0 2 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.681 87.0 68.8 -66.9 -15.3 85.4 35.8 -5.0 151 153 A N H X> S+ 0 0 1 -3,-1.3 4,-1.0 2,-0.2 3,-0.6 0.998 110.8 25.0 -67.0 -67.8 84.6 38.0 -8.0 152 154 A P H 3> S+ 0 0 18 0, 0.0 4,-1.9 0, 0.0 3,-0.3 0.864 115.1 67.6 -67.7 -31.7 88.1 38.2 -9.5 153 155 A K H 3X S+ 0 0 91 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.852 98.2 52.3 -56.5 -35.3 89.2 34.9 -7.9 154 156 A I H S+ 0 0 16 -4,-1.1 4,-2.7 -3,-0.6 5,-0.6 0.894 108.6 49.3 -69.7 -36.3 86.8 33.0 -10.2 155 157 A H H <>S+ 0 0 3 -4,-1.0 5,-3.6 -3,-0.3 -1,-0.2 0.789 109.8 52.6 -71.2 -26.5 88.2 34.7 -13.3 156 158 A Y H <5S+ 0 0 73 -4,-1.9 -1,-0.2 3,-0.2 -2,-0.2 0.782 116.1 40.5 -77.2 -27.0 91.6 33.7 -12.1 157 159 A E H <5S+ 0 0 93 -4,-1.3 -2,-0.2 -5,-0.2 -3,-0.2 0.771 137.2 3.7 -91.4 -30.6 90.5 30.1 -11.7 158 160 A T T X5S+ 0 0 40 -4,-2.7 4,-3.1 -5,-0.1 5,-0.3 0.720 124.9 47.3-119.4 -68.9 88.4 29.8 -14.8 159 161 A T H > S+ 0 0 32 0, 0.0 4,-3.2 0, 0.0 5,-0.4 0.924 111.0 55.6 -49.6 -49.7 92.9 29.5 -17.7 162 164 A E H X S+ 0 0 28 -4,-3.1 4,-1.7 1,-0.2 -2,-0.2 0.878 111.0 44.2 -50.8 -44.7 90.2 29.0 -20.3 163 165 A I H X S+ 0 0 0 -4,-2.1 4,-2.1 -3,-0.4 6,-0.4 0.942 112.7 51.1 -67.7 -48.7 91.8 31.8 -22.4 164 166 A W H <>S+ 0 0 57 -4,-2.7 5,-1.9 1,-0.2 3,-0.4 0.964 117.6 38.6 -52.9 -56.1 95.3 30.6 -21.9 165 167 A K H <5S+ 0 0 182 -4,-3.2 3,-0.3 1,-0.2 -1,-0.2 0.753 114.8 54.8 -69.1 -24.5 94.4 27.1 -23.0 166 168 A G H <5S+ 0 0 52 -4,-1.7 -1,-0.2 -5,-0.4 -2,-0.2 0.784 109.5 44.9 -80.2 -27.1 92.1 28.2 -25.7 167 169 A T T ><5S- 0 0 16 -4,-2.1 3,-1.3 -3,-0.4 -1,-0.2 0.371 113.7-114.6 -94.9 1.7 94.6 30.5 -27.4 168 170 A G T 3 5 - 0 0 56 -4,-0.3 -3,-0.2 -3,-0.3 -4,-0.1 0.656 65.1 -68.2 73.0 14.8 97.3 27.8 -27.2 169 171 A G T 3 S+ 0 0 4 -4,-0.2 4,-2.6 51,-0.1 5,-0.3 0.266 74.3 122.5 102.1 -8.1 87.3 44.9 -12.6 182 184 A G H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.4 0.823 73.5 47.0 -54.5 -37.5 87.0 41.2 -11.5 183 185 A T H >>S+ 0 0 18 2,-0.2 4,-1.8 3,-0.2 5,-0.8 0.955 115.9 40.4 -70.2 -55.4 87.6 39.9 -15.0 184 186 A I H >5S+ 0 0 1 -7,-0.2 4,-0.5 3,-0.2 -2,-0.2 0.849 122.7 44.2 -62.8 -36.0 90.6 42.0 -16.1 185 187 A T H X5S+ 0 0 14 -4,-2.6 4,-1.5 3,-0.2 -2,-0.2 0.889 120.7 36.9 -78.2 -44.1 92.1 41.6 -12.6 186 188 A G H X5S+ 0 0 3 -4,-2.2 4,-1.6 -5,-0.3 -3,-0.2 0.989 127.5 33.2 -72.4 -63.0 91.4 37.9 -12.1 187 189 A A H X5S+ 0 0 0 -4,-1.8 4,-2.5 -5,-0.4 5,-0.2 0.896 118.3 56.8 -59.0 -42.8 92.0 36.6 -15.6 188 190 A G H X< - 0 0 47 -4,-2.9 3,-1.8 -5,-0.2 -1,-0.3 -0.929 59.9-158.2-143.8 113.2 103.6 34.8 -19.6 196 198 A A T 3 S+ 0 0 78 -2,-0.4 -4,-0.1 1,-0.3 -3,-0.1 0.664 93.5 65.4 -64.2 -15.8 104.8 38.1 -18.1 197 199 A N T 3 S+ 0 0 115 2,-0.1 2,-0.5 -5,-0.1 -1,-0.3 0.562 70.5 113.2 -84.6 -9.7 104.8 39.5 -21.6 198 200 A V < - 0 0 0 -3,-1.8 2,-0.3 -7,-0.2 -25,-0.2 -0.523 61.6-145.4 -66.4 116.1 101.0 39.3 -21.9 199 201 A K E -d 173 0A 69 -27,-2.5 -25,-2.4 -2,-0.5 2,-0.5 -0.658 5.1-148.7 -86.0 139.6 99.7 42.9 -22.0 200 202 A L E -d 174 0A 0 -2,-0.3 39,-2.2 37,-0.3 40,-1.3 -0.945 9.2-165.3-111.7 124.0 96.4 43.7 -20.3 201 203 A Y E -de 175 240A 11 -27,-2.7 -25,-2.7 -2,-0.5 2,-0.3 -0.941 5.3-156.4-113.2 117.6 94.3 46.5 -21.8 202 204 A G E -de 176 241A 0 38,-2.3 40,-3.4 -2,-0.6 2,-0.5 -0.666 8.8-147.9 -89.2 146.6 91.5 47.9 -19.7 203 205 A V E +de 177 242A 0 -27,-2.3 -25,-2.3 -2,-0.3 22,-0.2 -0.967 23.1 163.6-121.1 128.7 88.6 49.6 -21.5 204 206 A E E - e 0 243A 8 38,-2.1 40,-1.9 -2,-0.5 2,-0.2 -0.897 43.1 -83.9-134.8 165.0 86.6 52.5 -20.1 205 207 A P E > - e 0 244A 0 0, 0.0 3,-1.7 0, 0.0 40,-0.2 -0.485 22.0-140.3 -73.2 136.1 84.2 55.1 -21.4 206 208 A V G > S+ 0 0 71 38,-2.0 3,-0.6 1,-0.3 39,-0.2 0.810 108.7 57.3 -61.7 -24.1 85.7 58.3 -22.9 207 209 A E G 3 S+ 0 0 65 37,-0.4 -1,-0.3 1,-0.2 38,-0.1 0.544 123.0 21.1 -82.9 -9.6 82.8 59.9 -21.1 208 210 A S G < S+ 0 0 1 -3,-1.7 2,-2.2 8,-0.2 19,-0.3 -0.168 76.5 156.2-150.5 44.4 83.8 58.5 -17.7 209 211 A A X > + 0 0 5 -3,-0.6 5,-2.2 6,-0.2 3,-1.1 -0.415 8.7 153.1 -77.4 67.5 87.5 57.7 -18.2 210 212 A I G > 5 + 0 0 39 -2,-2.2 3,-1.2 1,-0.3 -1,-0.2 0.749 66.0 60.7 -69.8 -28.1 88.5 57.9 -14.5 211 213 A L G 3 5S+ 0 0 47 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.577 104.8 53.3 -75.3 -8.1 91.5 55.5 -14.8 212 214 A S G < 5S- 0 0 51 -3,-1.1 -1,-0.3 30,-0.0 -2,-0.2 -0.021 133.8 -87.3-113.6 26.2 93.0 58.0 -17.2 213 215 A G T < 5S+ 0 0 57 -3,-1.2 -3,-0.2 1,-0.3 -2,-0.1 0.361 86.9 141.5 85.1 -6.3 92.7 61.0 -15.0 214 216 A G < - 0 0 28 -5,-2.2 -1,-0.3 1,-0.1 -7,-0.1 -0.202 54.2-116.8 -69.4 159.8 89.1 61.6 -16.2 215 217 A K - 0 0 163 -3,-0.1 -6,-0.2 1,-0.1 -1,-0.1 -0.755 38.9-101.3 -95.3 142.5 86.2 62.8 -14.1 216 218 A P + 0 0 62 0, 0.0 -8,-0.2 0, 0.0 108,-0.1 -0.287 55.5 149.5 -63.4 147.4 83.3 60.4 -13.7 217 219 A G - 0 0 14 8,-0.1 2,-0.3 106,-0.1 -7,-0.1 -0.949 46.1 -63.9-163.6 179.4 80.2 61.1 -15.8 218 220 A P + 0 0 82 0, 0.0 2,-0.3 0, 0.0 7,-0.1 -0.612 49.8 160.7 -84.3 138.3 77.3 59.5 -17.6 219 221 A H - 0 0 20 -2,-0.3 26,-0.0 6,-0.2 0, 0.0 -0.854 40.6-128.6-141.0 173.5 77.8 57.1 -20.6 220 222 A K S S+ 0 0 109 -2,-0.3 2,-2.5 1,-0.1 46,-0.1 0.479 71.5 111.2-107.6 -4.5 75.6 54.5 -22.3 221 223 A I > - 0 0 0 45,-0.1 3,-1.8 46,-0.1 107,-0.1 -0.403 62.3-152.2 -72.0 75.1 78.0 51.6 -22.3 222 224 A Q T 3 S+ 0 0 33 -2,-2.5 45,-0.4 1,-0.2 107,-0.1 -0.168 74.5 38.3 -50.1 135.1 76.1 49.4 -19.8 223 225 A G T 3 S+ 0 0 13 1,-0.4 -1,-0.2 105,-0.2 2,-0.2 0.097 114.3 46.9 110.7 -21.8 78.4 47.1 -17.9 224 226 A I S < S+ 0 0 4 -3,-1.8 -1,-0.4 1,-0.2 104,-0.3 -0.692 70.9 67.9-136.0-170.8 81.3 49.4 -17.4 225 227 A G + 0 0 5 -47,-1.2 -6,-0.2 -22,-0.2 -1,-0.2 0.961 45.4 173.8 58.2 57.2 82.2 53.0 -16.4 226 228 A A - 0 0 9 -48,-0.4 101,-0.1 -47,-0.3 -1,-0.1 0.616 44.1-124.3 -69.8 -11.9 81.2 52.7 -12.8 227 229 A G S S+ 0 0 19 -19,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.731 83.4 60.2 74.6 21.7 82.6 56.2 -12.2 228 230 A F S S- 0 0 78 -12,-0.0 -2,-0.2 0, 0.0 -1,-0.1 -0.942 92.1 -96.2-172.0 153.2 85.0 55.0 -9.5 229 231 A I - 0 0 91 -2,-0.3 -49,-0.1 -19,-0.1 -48,-0.0 -0.692 43.8-137.4 -85.7 104.3 87.9 52.6 -9.0 230 232 A P - 0 0 5 0, 0.0 3,-0.5 0, 0.0 -83,-0.1 -0.102 12.9-122.8 -55.1 152.7 86.4 49.3 -7.5 231 233 A S S S+ 0 0 84 -85,-0.6 -84,-0.2 1,-0.2 -85,-0.1 0.918 110.8 54.7 -65.8 -43.4 88.2 47.5 -4.7 232 234 A V S S+ 0 0 15 -86,-2.1 2,-0.2 -52,-0.1 -1,-0.2 0.698 88.0 97.1 -64.5 -19.5 88.6 44.3 -6.7 233 235 A L - 0 0 10 -3,-0.5 2,-0.6 -53,-0.4 -51,-0.1 -0.539 60.5-159.2 -74.0 134.6 90.3 46.1 -9.5 234 236 A N > - 0 0 63 -53,-0.3 3,-2.4 -2,-0.2 4,-0.5 -0.800 7.1-174.0-117.1 85.0 94.1 45.9 -9.4 235 237 A V G > S+ 0 0 73 -2,-0.6 3,-0.8 1,-0.3 -1,-0.1 0.697 77.7 71.6 -51.5 -23.2 95.2 48.8 -11.5 236 238 A D G 3 S+ 0 0 145 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.795 93.6 55.6 -68.2 -24.0 98.8 47.7 -11.2 237 239 A L G < S+ 0 0 26 -3,-2.4 2,-0.4 -38,-0.0 -37,-0.3 0.699 85.9 99.1 -79.5 -19.8 98.0 44.8 -13.5 238 240 A I < - 0 0 22 -3,-0.8 -37,-0.2 -4,-0.5 3,-0.1 -0.576 49.5-173.4 -75.7 122.7 96.7 47.1 -16.3 239 241 A D S S- 0 0 72 -39,-2.2 2,-0.3 -2,-0.4 -38,-0.2 0.713 72.1 -1.5 -85.8 -24.9 99.3 47.7 -19.0 240 242 A E E -e 201 0A 63 -40,-1.3 -38,-2.3 2,-0.0 2,-0.6 -0.927 60.4-137.5-166.6 141.1 97.2 50.3 -20.8 241 243 A V E -e 202 0A 35 -2,-0.3 2,-0.4 -40,-0.2 -38,-0.2 -0.925 21.4-162.4-106.7 117.5 93.7 51.9 -20.5 242 244 A V E -e 203 0A 11 -40,-3.4 -38,-2.1 -2,-0.6 2,-0.4 -0.816 6.9-147.6 -99.9 137.2 91.9 52.3 -23.8 243 245 A Q E -e 204 0A 77 -2,-0.4 2,-0.3 -40,-0.2 -40,-0.0 -0.860 16.2-179.8-107.9 140.7 89.0 54.7 -24.0 244 246 A V E -e 205 0A 0 -40,-1.9 -38,-2.0 -2,-0.4 -37,-0.4 -0.992 21.6-127.3-137.5 144.7 86.0 54.2 -26.3 245 247 A S > - 0 0 23 -2,-0.3 4,-2.2 -40,-0.2 5,-0.2 -0.433 25.4-114.5 -87.1 164.5 82.9 56.3 -26.8 246 248 A S H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.925 119.1 51.8 -62.3 -42.7 79.3 55.2 -26.5 247 249 A D H > S+ 0 0 116 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.918 108.5 49.3 -60.5 -46.0 79.0 55.9 -30.2 248 250 A E H > S+ 0 0 63 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.962 113.4 46.7 -55.7 -54.8 82.0 53.8 -31.2 249 251 A S H X S+ 0 0 0 -4,-2.2 4,-3.2 1,-0.2 -1,-0.2 0.873 113.0 49.6 -54.7 -43.6 80.9 50.9 -29.1 250 252 A I H X S+ 0 0 16 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.894 112.1 47.2 -66.7 -41.1 77.4 51.1 -30.5 251 253 A D H X S+ 0 0 94 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.948 115.0 46.2 -66.5 -45.1 78.6 51.2 -34.0 252 254 A M H X S+ 0 0 26 -4,-3.2 4,-3.3 1,-0.2 3,-0.4 0.959 109.4 53.5 -60.0 -51.2 81.0 48.3 -33.4 253 255 A A H X S+ 0 0 3 -4,-3.2 4,-1.1 1,-0.3 11,-0.5 0.856 111.9 47.9 -50.6 -36.9 78.3 46.3 -31.7 254 256 A R H X S+ 0 0 72 -4,-1.7 4,-2.1 2,-0.2 -1,-0.3 0.834 110.8 49.0 -75.1 -33.6 76.2 46.9 -34.8 255 257 A Q H X>S+ 0 0 45 -4,-2.0 4,-3.0 -3,-0.4 5,-0.7 0.880 105.1 59.6 -72.7 -36.7 79.0 45.9 -37.1 256 258 A L H X5S+ 0 0 0 -4,-3.3 6,-2.6 1,-0.2 4,-0.9 0.870 111.0 41.4 -58.6 -37.2 79.6 42.7 -35.1 257 259 A A H X5S+ 0 0 31 -4,-1.1 4,-1.2 4,-0.3 -2,-0.2 0.951 120.2 40.5 -75.8 -50.4 76.0 41.6 -35.8 258 260 A L H <5S+ 0 0 143 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.900 129.7 26.6 -65.5 -45.5 75.8 42.7 -39.5 259 261 A K H <5S+ 0 0 102 -4,-3.0 -238,-0.3 -5,-0.2 -3,-0.2 0.729 135.5 27.3 -92.0 -26.7 79.2 41.5 -40.6 260 262 A E H <> - 0 0 0 30,-2.1 4,-1.2 -2,-0.2 3,-1.2 -0.310 41.4-102.2 -75.8 165.6 75.9 44.0 -26.0 266 268 A I H 3> S+ 0 0 8 1,-0.3 4,-1.5 2,-0.2 3,-0.3 0.859 121.9 58.6 -59.1 -36.5 77.2 47.5 -26.3 267 269 A S H 3> S+ 0 0 3 -45,-0.4 4,-1.9 1,-0.2 -1,-0.3 0.766 102.3 55.7 -65.4 -22.9 80.1 46.8 -23.8 268 270 A S H <> S+ 0 0 0 -3,-1.2 4,-2.8 2,-0.2 -1,-0.2 0.843 102.7 54.3 -75.5 -33.7 81.2 44.1 -26.2 269 271 A G H X S+ 0 0 0 -4,-1.2 4,-2.6 -3,-0.3 -2,-0.2 0.860 106.4 55.6 -65.1 -32.3 81.3 46.7 -29.0 270 272 A A H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.971 112.0 38.0 -62.9 -57.6 83.6 48.6 -26.6 271 273 A A H X S+ 0 0 0 -4,-1.9 4,-3.6 21,-0.2 5,-0.3 0.911 116.6 53.6 -61.7 -42.8 86.1 45.8 -26.1 272 274 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.929 110.4 47.2 -56.8 -47.3 85.8 44.9 -29.8 273 275 A A H X S+ 0 0 7 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.942 116.3 43.2 -59.8 -50.9 86.5 48.5 -30.8 274 276 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.955 112.8 51.9 -61.0 -52.7 89.5 48.8 -28.5 275 277 A A H X S+ 0 0 0 -4,-3.6 4,-2.5 1,-0.2 -1,-0.2 0.892 111.5 48.2 -51.3 -45.1 90.9 45.3 -29.4 276 278 A I H X S+ 0 0 9 -4,-2.4 4,-1.3 -5,-0.3 -1,-0.2 0.918 108.1 53.1 -64.6 -45.1 90.7 46.2 -33.1 277 279 A K H >< S+ 0 0 90 -4,-2.3 3,-1.1 1,-0.2 4,-0.5 0.959 112.6 45.6 -53.6 -52.3 92.5 49.6 -32.6 278 280 A L H >< S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.3 -1,-0.2 0.918 109.7 54.6 -55.9 -46.6 95.3 47.8 -30.8 279 281 A A H 3< S+ 0 0 0 -4,-2.5 -251,-2.7 1,-0.3 -252,-2.1 0.686 103.7 57.6 -62.9 -18.5 95.4 45.1 -33.5 280 282 A Q T << S+ 0 0 82 -4,-1.3 -1,-0.3 -3,-1.1 -2,-0.2 0.555 77.3 108.0 -89.5 -9.2 95.8 47.9 -36.1 281 283 A R S X S- 0 0 81 -3,-1.7 3,-3.2 -4,-0.5 -254,-0.1 -0.606 72.6-135.8 -72.7 116.8 99.0 49.2 -34.5 282 284 A P G > S+ 0 0 106 0, 0.0 3,-1.9 0, 0.0 -1,-0.2 0.799 102.0 61.2 -39.5 -45.6 101.8 48.3 -36.9 283 285 A E G 3 S+ 0 0 140 1,-0.3 -2,-0.1 3,-0.0 -4,-0.1 0.671 99.6 59.9 -61.7 -14.5 104.1 47.1 -34.0 284 286 A N G X S+ 0 0 4 -3,-3.2 3,-2.1 -6,-0.2 -1,-0.3 0.197 70.5 141.2-100.4 17.5 101.4 44.6 -33.2 285 287 A A T < S+ 0 0 60 -3,-1.9 -257,-0.3 1,-0.3 3,-0.1 -0.368 74.8 16.7 -59.2 132.7 101.5 42.7 -36.5 286 288 A G T 3 S+ 0 0 48 -259,-2.7 -1,-0.3 1,-0.3 -258,-0.2 0.278 96.1 133.3 87.4 -11.0 101.1 39.0 -35.8 287 289 A K < - 0 0 62 -3,-2.1 -258,-3.8 -8,-0.1 2,-0.6 -0.464 51.4-135.7 -79.2 145.5 99.8 39.5 -32.3 288 290 A L E -bc 29 171A 5 -118,-0.5 -116,-3.0 -260,-0.2 -115,-2.0 -0.876 20.9-171.8-102.2 117.7 96.8 37.7 -30.8 289 291 A F E -bc 30 173A 0 -260,-3.5 -258,-3.0 -2,-0.6 2,-0.6 -0.927 8.7-157.6-110.6 133.5 94.4 39.8 -28.9 290 292 A V E -bc 31 174A 0 -117,-2.4 -115,-2.2 -2,-0.5 2,-0.4 -0.956 11.2-171.3-113.6 116.1 91.5 38.3 -26.9 291 293 A A E -bc 32 175A 0 -260,-2.2 -258,-2.5 -2,-0.6 2,-0.5 -0.873 20.7-125.6-106.3 139.0 88.7 40.7 -26.2 292 294 A I E -b 33 0A 3 -117,-1.8 -115,-0.3 -2,-0.4 -21,-0.2 -0.739 9.1-157.0 -91.1 127.6 85.9 39.7 -23.9 293 295 A F E -b 34 0A 0 -260,-2.2 -258,-1.3 -2,-0.5 -257,-0.7 -0.828 13.9-169.7-102.8 90.0 82.3 40.0 -25.1 294 296 A P + 0 0 20 0, 0.0 -251,-2.1 0, 0.0 2,-0.3 0.700 58.5 11.7 -49.8 -37.2 80.5 40.3 -21.6 295 297 A S B S-F 42 0B 1 -253,-0.2 -30,-2.1 -252,-0.1 2,-0.3 -0.982 71.9-104.4-151.3 162.2 76.9 39.8 -22.8 296 298 A F B > -J 264 0D 56 -255,-1.2 3,-1.1 -2,-0.3 -32,-0.3 -0.655 32.3-129.1 -85.6 139.3 74.5 38.9 -25.6 297 299 A G G > S+ 0 0 0 -34,-3.0 3,-1.1 -2,-0.3 -33,-0.2 0.559 93.1 79.9 -68.1 -10.1 72.8 41.8 -27.4 298 300 A E G > S+ 0 0 116 -35,-0.4 3,-0.9 1,-0.2 -1,-0.2 0.741 83.6 62.6 -71.6 -21.4 69.2 40.4 -27.1 299 301 A R G < S+ 0 0 51 -3,-1.1 -1,-0.2 1,-0.2 3,-0.2 0.617 101.1 55.8 -76.4 -10.5 68.9 41.6 -23.4 300 302 A Y G < + 0 0 8 -3,-1.1 6,-0.3 -4,-0.2 5,-0.3 -0.026 63.5 124.4-112.7 30.7 69.3 45.2 -24.6 301 303 A L S < S+ 0 0 85 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.802 78.9 46.5 -61.2 -30.3 66.5 45.4 -27.2 302 304 A S S S+ 0 0 44 -3,-0.2 -1,-0.2 3,-0.1 -2,-0.1 0.828 98.3 90.7 -80.8 -32.2 65.0 48.5 -25.5 303 305 A T S > S- 0 0 25 -3,-0.1 3,-1.7 1,-0.1 4,-0.1 0.098 97.5 -92.9 -60.0 173.3 68.3 50.3 -25.0 304 306 A V G > S+ 0 0 41 1,-0.3 3,-1.1 2,-0.2 4,-0.4 0.621 111.8 84.3 -63.1 -16.6 69.9 52.8 -27.3 305 307 A L G 3 S+ 0 0 6 -5,-0.3 -1,-0.3 1,-0.3 4,-0.2 0.779 104.4 28.6 -59.6 -25.9 71.9 50.0 -28.9 306 308 A F G <> S+ 0 0 26 -3,-1.7 4,-3.4 -6,-0.3 5,-0.3 0.191 81.8 117.1-120.3 15.4 68.8 49.3 -31.1 307 309 A D H <> S+ 0 0 82 -3,-1.1 4,-2.4 2,-0.2 5,-0.3 0.900 81.5 46.8 -49.5 -46.0 67.2 52.8 -31.4 308 310 A A H > S+ 0 0 36 -4,-0.4 4,-2.2 2,-0.2 3,-0.2 0.991 118.8 35.9 -60.1 -67.5 67.8 52.8 -35.1 309 311 A T H > S+ 0 0 70 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.835 117.3 58.0 -56.9 -33.4 66.6 49.4 -36.1 310 312 A R H X S+ 0 0 108 -4,-3.4 4,-1.9 2,-0.2 -1,-0.2 0.922 106.2 44.2 -65.1 -48.6 63.9 49.7 -33.4 311 313 A K H X S+ 0 0 144 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.909 114.1 53.4 -62.7 -39.3 62.3 52.9 -34.7 312 314 A E H X S+ 0 0 128 -4,-2.2 4,-0.8 -5,-0.3 -2,-0.2 0.890 107.3 51.1 -60.9 -40.5 62.5 51.3 -38.2 313 315 A A H < S+ 0 0 56 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.846 112.8 44.1 -67.5 -35.9 60.7 48.2 -36.9 314 316 A E H < S+ 0 0 127 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.836 110.6 55.3 -78.6 -32.6 57.8 50.2 -35.4 315 317 A A H < S+ 0 0 80 -4,-2.4 2,-0.3 -5,-0.2 -1,-0.2 0.633 87.3 100.2 -75.6 -14.0 57.5 52.4 -38.4 316 318 A M < - 0 0 137 -4,-0.8 2,-0.2 -3,-0.2 -4,-0.0 -0.597 54.4-163.9 -83.9 132.7 57.1 49.5 -40.8 317 319 A T - 0 0 133 -2,-0.3 2,-0.2 1,-0.1 -2,-0.0 -0.532 29.6 -86.3-102.1 171.6 53.6 48.5 -42.0 318 320 A F - 0 0 176 -2,-0.2 2,-0.4 1,-0.0 -1,-0.1 -0.545 30.5-134.0 -88.0 148.3 52.5 45.3 -43.7 319 321 A E 0 0 187 -2,-0.2 -1,-0.0 0, 0.0 0, 0.0 -0.818 360.0 360.0 -99.1 133.1 52.6 44.5 -47.5 320 322 A A 0 0 145 -2,-0.4 0, 0.0 0, 0.0 0, 0.0 -0.535 360.0 360.0 -97.7 360.0 49.6 43.0 -49.1 321 !* 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 0.0 322 900 B T 0 0 181 0, 0.0 2,-0.7 0, 0.0 -201,-0.1 0.000 360.0 360.0 360.0 98.9 72.9 64.5 -8.4 323 901 B E - 0 0 161 -202,-0.1 -106,-0.1 -106,-0.0 2,-0.1 -0.924 360.0-106.3 -99.4 117.3 76.2 62.6 -9.1 324 902 B W + 0 0 72 -2,-0.7 -203,-0.0 1,-0.2 -202,-0.0 -0.211 56.6 153.6 -48.0 113.1 75.5 60.2 -11.9 325 903 B S + 0 0 24 -2,-0.1 -202,-1.9 1,-0.0 2,-1.2 -0.042 28.9 121.6-131.3 27.3 75.4 56.7 -10.3 326 904 B D + 0 0 50 -204,-0.2 2,-0.2 -203,-0.1 -204,-0.1 -0.423 35.4 146.2 -93.3 61.4 73.2 55.1 -12.9 327 905 B Y - 0 0 14 -2,-1.2 2,-0.7 -101,-0.1 -254,-0.4 -0.645 44.7-136.9 -96.0 154.6 75.5 52.3 -14.0 328 906 B V 0 0 13 -104,-0.3 -253,-0.3 -2,-0.2 -105,-0.2 -0.796 360.0 360.0-115.7 88.9 74.3 48.8 -15.0 329 907 B I 0 0 1 -2,-0.7 -255,-0.8 -255,-0.2 -256,-0.2 -0.993 360.0 360.0-130.1 360.0 76.6 46.2 -13.5