==== 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 LIGASE 09-AUG-02 1MEZ . COMPND 2 MOLECULE: ADENYLOSUCCINATE SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR C.V.IANCU,T.BORZA,H.J.FROMM,R.B.HONZATKO . 430 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17772.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 299 69.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 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 0.5 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 . 36 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 115 26.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 1 1 1 2 1 1 0 1 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 3 3 2 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 PARALLEL BRIDGES PER LADDER . 3 1 2 0 1 0 0 1 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 2 1 0 0 0 0 0 1 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 28 A A 0 0 142 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -86.5 87.6 45.4 59.9 2 29 A T - 0 0 76 1,-0.2 2,-0.2 260,-0.0 214,-0.0 0.748 360.0-109.6 -53.7 -22.5 86.4 48.8 58.8 3 30 A G - 0 0 21 214,-0.1 214,-0.2 2,-0.0 -1,-0.2 -0.680 46.2 -33.5 123.0-177.1 83.4 46.8 57.6 4 31 A S - 0 0 21 212,-2.4 2,-0.5 -2,-0.2 218,-0.1 -0.333 52.7-128.9 -75.1 160.1 81.6 45.6 54.5 5 32 A R - 0 0 149 216,-0.2 218,-0.3 259,-0.1 259,-0.3 -0.961 21.4-133.6-115.0 127.7 81.6 47.6 51.3 6 33 A V E -a 264 0A 0 257,-3.2 259,-2.8 -2,-0.5 2,-0.4 -0.322 12.3-125.1 -76.6 159.9 78.3 48.2 49.6 7 34 A T E - b 0 224A 39 216,-2.6 218,-3.3 258,-0.2 2,-0.4 -0.905 25.6-155.4-105.7 132.9 77.6 47.8 45.9 8 35 A V E -ab 267 225A 0 258,-3.4 260,-3.5 -2,-0.4 2,-0.5 -0.919 11.7-163.4-117.1 138.2 76.1 50.8 44.1 9 36 A V E +ab 268 226A 0 216,-2.6 218,-2.3 -2,-0.4 2,-0.3 -0.972 22.3 177.5-117.1 115.7 74.1 51.0 40.9 10 37 A L E -a 269 0A 1 258,-3.2 260,-3.4 -2,-0.5 2,-0.4 -0.879 31.5-116.0-123.3 153.6 74.0 54.5 39.3 11 38 A G E -a 270 0A 1 -2,-0.3 220,-2.3 237,-0.3 260,-0.1 -0.692 20.1-165.8 -84.9 134.7 72.5 56.1 36.2 12 39 A A S S+ 0 0 0 258,-1.8 311,-0.2 -2,-0.4 -1,-0.1 0.483 72.0 22.8-100.5 -3.6 75.1 57.4 33.8 13 40 A Q S S- 0 0 2 257,-0.3 219,-1.7 216,-0.2 220,-0.3 0.239 122.2 -43.7-124.9-113.9 72.9 59.6 31.6 14 41 A W S S- 0 0 4 262,-0.5 264,-0.5 1,-0.5 216,-0.1 -0.196 91.9 -92.6-120.1 38.4 69.6 61.3 32.3 15 42 A G S S+ 0 0 2 214,-0.2 -1,-0.5 255,-0.1 261,-0.2 -0.081 96.5 82.9 83.8 176.8 67.9 58.3 33.9 16 43 A D + 0 0 37 213,-0.1 -1,-0.1 27,-0.1 214,-0.1 0.784 53.3 135.2 54.0 32.5 65.7 55.4 32.8 17 44 A E S S- 0 0 0 253,-0.1 318,-0.2 255,-0.1 256,-0.1 0.669 87.0 -83.9 -81.5 -18.3 68.8 53.5 31.8 18 45 A G S > S+ 0 0 24 252,-0.1 4,-2.3 254,-0.1 5,-0.2 0.615 76.1 149.2 119.4 28.9 67.5 50.4 33.5 19 46 A K H > S+ 0 0 5 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.884 73.7 54.8 -59.1 -41.9 68.5 50.8 37.1 20 47 A G H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.917 109.5 49.4 -58.8 -41.5 65.5 48.8 38.4 21 48 A K H > S+ 0 0 16 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.954 113.2 43.6 -61.7 -52.9 66.5 45.9 36.1 22 49 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.902 115.7 49.1 -61.5 -41.8 70.2 45.9 37.2 23 50 A V H X S+ 0 0 0 -4,-2.8 4,-1.8 -5,-0.2 -1,-0.2 0.898 109.1 52.2 -66.1 -40.3 69.3 46.3 40.9 24 51 A D H < S+ 0 0 6 -4,-2.5 4,-0.4 -5,-0.3 3,-0.2 0.938 110.3 49.3 -60.5 -44.6 66.7 43.5 40.7 25 52 A L H >< S+ 0 0 39 -4,-2.2 3,-0.7 1,-0.2 -1,-0.2 0.893 115.5 42.1 -60.9 -43.0 69.3 41.2 39.3 26 53 A L H 3< S+ 0 0 36 -4,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.663 104.4 66.4 -79.9 -17.2 71.9 42.0 41.9 27 54 A A T >< S+ 0 0 4 -4,-1.8 3,-1.0 -3,-0.2 -1,-0.2 0.479 71.2 95.1 -85.4 -1.6 69.4 41.9 44.8 28 55 A T T < S+ 0 0 62 -3,-0.7 -1,-0.2 -4,-0.4 -2,-0.1 0.913 103.5 20.3 -54.4 -47.9 68.7 38.2 44.5 29 56 A D T 3 S+ 0 0 86 -3,-0.5 2,-0.3 37,-0.0 -1,-0.3 0.086 98.8 127.5-110.1 23.2 71.3 37.4 47.2 30 57 A A < - 0 0 3 -3,-1.0 193,-0.2 1,-0.1 3,-0.2 -0.598 47.1-159.0 -83.4 139.1 71.4 40.8 48.8 31 58 A D S S+ 0 0 46 191,-2.1 37,-2.6 1,-0.3 2,-0.4 0.843 83.6 18.0 -82.9 -35.6 70.9 41.2 52.5 32 59 A I E -cd 68 223A 0 190,-2.0 192,-3.4 35,-0.2 2,-0.5 -0.997 61.4-169.4-140.2 133.0 69.9 44.8 52.2 33 60 A V E -cd 69 224A 0 35,-3.0 37,-2.5 -2,-0.4 2,-0.3 -0.987 23.3-174.9-121.4 121.8 68.8 46.9 49.3 34 61 A S E -cd 70 225A 0 190,-3.3 192,-3.7 -2,-0.5 2,-0.4 -0.819 26.7-145.8-125.5 164.0 68.6 50.6 49.9 35 62 A R E +cd 71 226A 1 35,-2.4 37,-3.2 -2,-0.3 40,-0.3 -0.981 16.3 177.9-122.9 128.3 67.6 53.9 48.4 36 63 A C + 0 0 5 190,-0.8 38,-0.3 -2,-0.4 2,-0.2 0.777 56.0 13.5-106.2 -32.5 69.7 57.0 49.2 37 64 A Q S S+ 0 0 15 37,-0.1 38,-0.2 2,-0.1 -1,-0.1 -0.825 91.6 34.5-138.0 178.8 68.4 60.1 47.3 38 65 A G - 0 0 0 36,-0.4 38,-1.7 -2,-0.2 2,-0.1 -0.095 65.1-119.6 69.2-173.3 65.4 61.4 45.3 39 66 A G > - 0 0 0 36,-0.2 3,-0.9 38,-0.1 38,-0.1 -0.289 56.6 -46.5-137.2-139.2 61.7 60.5 46.0 40 67 A N T 3 S+ 0 0 11 36,-0.2 17,-0.1 1,-0.2 37,-0.1 0.291 111.7 90.9 -88.8 12.3 58.9 58.9 44.0 41 68 A N T 3 S+ 0 0 15 15,-0.1 -1,-0.2 97,-0.1 265,-0.1 0.790 75.6 88.0 -70.4 -24.5 59.8 61.1 41.1 42 69 A A < - 0 0 4 -3,-0.9 2,-0.4 14,-0.4 186,-0.0 -0.384 65.2-164.1 -71.9 148.9 62.0 58.1 40.3 43 70 A G - 0 0 10 -2,-0.1 2,-0.5 14,-0.1 13,-0.2 -0.881 7.3-178.4-141.9 107.2 60.5 55.2 38.3 44 71 A H E -J 55 0B 5 11,-3.0 11,-3.1 -2,-0.4 2,-0.5 -0.924 13.1-151.6-113.7 122.3 62.2 51.8 38.3 45 72 A T E -J 54 0B 41 -2,-0.5 2,-0.4 9,-0.2 9,-0.2 -0.804 12.7-175.6 -96.2 124.2 60.8 49.0 36.2 46 73 A V E -J 53 0B 0 7,-2.4 7,-2.9 -2,-0.5 2,-0.4 -0.940 4.1-169.6-118.7 138.0 61.4 45.4 37.3 47 74 A V E +J 52 0B 17 374,-0.5 376,-2.1 -2,-0.4 2,-0.4 -0.960 16.6 155.7-132.6 116.3 60.4 42.3 35.3 48 75 A V E > S-J 51 0B 17 3,-2.1 3,-0.6 -2,-0.4 -2,-0.0 -0.927 70.5 -14.2-144.1 115.3 60.5 38.8 36.7 49 76 A D T 3 S- 0 0 124 -2,-0.4 2,-2.5 1,-0.3 -1,-0.1 0.968 123.1 -54.7 60.6 57.7 58.4 35.9 35.6 50 77 A G T 3 S+ 0 0 71 1,-0.2 -1,-0.3 -3,-0.1 372,-0.0 -0.256 113.6 113.2 76.5 -55.6 55.9 37.8 33.5 51 78 A K E < -J 48 0B 125 -2,-2.5 -3,-2.1 -3,-0.6 2,-0.4 -0.254 52.5-159.4 -53.4 127.7 55.0 40.1 36.4 52 79 A E E -J 47 0B 83 -5,-0.2 2,-0.3 -3,-0.1 -5,-0.2 -0.931 8.4-172.4-114.0 138.5 56.1 43.7 35.9 53 80 A Y E -J 46 0B 29 -7,-2.9 -7,-2.4 -2,-0.4 2,-0.4 -0.923 15.1-158.4-127.4 151.8 56.6 46.2 38.7 54 81 A D E -J 45 0B 22 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.922 17.4-166.7-131.9 105.4 57.3 49.9 38.7 55 82 A F E +J 44 0B 1 -11,-3.1 -11,-3.0 -2,-0.4 5,-0.1 -0.651 19.0 165.7 -92.9 151.1 58.8 51.1 42.0 56 83 A H S S+ 0 0 24 -2,-0.3 -14,-0.4 -13,-0.2 -1,-0.1 0.630 83.9 0.9-129.0 -48.0 59.1 54.8 42.9 57 84 A L S S+ 0 0 0 -17,-0.1 -2,-0.1 24,-0.1 25,-0.1 0.648 112.2 88.5-113.9 -36.7 60.0 55.0 46.6 58 85 A L S S- 0 0 0 24,-0.1 -24,-0.1 1,-0.1 43,-0.0 -0.436 89.8-111.6 -65.8 130.0 60.1 51.3 47.4 59 86 A P > - 0 0 0 0, 0.0 3,-2.5 0, 0.0 4,-0.1 -0.386 27.1-117.4 -60.9 143.9 63.6 49.9 46.8 60 87 A S G > S+ 0 0 0 1,-0.3 3,-0.5 2,-0.1 4,-0.1 0.596 113.1 66.5 -61.0 -8.6 63.5 47.6 43.8 61 88 A G G > + 0 0 2 1,-0.2 3,-1.2 2,-0.1 -1,-0.3 0.429 66.6 100.7 -91.0 1.5 64.6 44.8 46.1 62 89 A I G < S+ 0 0 0 -3,-2.5 -1,-0.2 1,-0.3 -2,-0.1 0.616 74.6 65.6 -60.4 -10.3 61.3 45.0 48.0 63 90 A I G < S+ 0 0 34 -3,-0.5 2,-0.6 -4,-0.1 -1,-0.3 0.873 80.5 84.2 -77.4 -41.9 60.4 42.0 45.9 64 91 A N < - 0 0 30 -3,-1.2 3,-0.5 1,-0.2 5,-0.1 -0.517 63.7-166.3 -64.9 110.2 63.0 39.8 47.6 65 92 A T S S+ 0 0 85 -2,-0.6 -1,-0.2 1,-0.2 -3,-0.1 0.608 87.0 56.2 -76.1 -10.3 61.2 38.6 50.7 66 93 A K S S+ 0 0 106 -38,-0.1 -1,-0.2 2,-0.0 2,-0.2 0.687 100.0 70.2 -91.8 -21.6 64.6 37.4 52.1 67 94 A A S S- 0 0 1 -3,-0.5 2,-0.5 -6,-0.3 -35,-0.2 -0.617 79.8-121.8 -99.1 157.1 66.2 40.8 51.8 68 95 A V E -c 32 0A 43 -37,-2.6 -35,-3.0 -2,-0.2 2,-0.4 -0.836 18.9-146.8-100.4 128.5 65.7 44.0 53.7 69 96 A S E -ce 33 101A 0 31,-3.2 33,-3.0 -2,-0.5 2,-0.4 -0.790 17.3-168.4 -95.5 135.7 64.7 47.2 51.9 70 97 A F E -ce 34 102A 0 -37,-2.5 -35,-2.4 -2,-0.4 2,-0.6 -0.980 16.8-157.6-130.8 134.6 65.9 50.5 53.4 71 98 A I E -ce 35 103A 0 31,-2.3 33,-2.8 -2,-0.4 36,-0.2 -0.938 27.4-145.0-109.8 111.3 65.0 54.1 52.6 72 99 A G > - 0 0 0 -37,-3.2 3,-1.8 -2,-0.6 185,-0.2 -0.162 25.1 -99.7 -76.5 169.1 67.8 56.4 53.7 73 100 A N T 3 S+ 0 0 27 1,-0.3 35,-0.6 183,-0.2 184,-0.2 0.628 116.2 65.4 -60.3 -17.9 67.9 60.0 55.1 74 101 A G T 3 S+ 0 0 0 182,-1.8 -36,-0.4 -38,-0.3 -1,-0.3 0.712 83.8 95.4 -79.4 -19.1 68.7 61.5 51.7 75 102 A V < - 0 0 0 -3,-1.8 33,-0.9 181,-0.3 2,-0.5 -0.367 67.6-143.6 -71.9 148.2 65.3 60.4 50.4 76 103 A V E -k 108 0C 1 -38,-1.7 2,-0.5 31,-0.2 -36,-0.2 -0.976 22.0-153.3-113.5 123.5 62.3 62.8 50.5 77 104 A I E -k 109 0C 0 31,-2.7 33,-3.1 -2,-0.5 2,-0.8 -0.877 20.0-163.6-111.3 126.9 59.0 61.0 51.2 78 105 A H > - 0 0 14 -2,-0.5 4,-2.1 31,-0.2 33,-0.1 -0.898 19.0-154.1-100.1 104.3 55.5 61.8 50.3 79 106 A L H > S+ 0 0 3 -2,-0.8 4,-1.7 31,-0.4 5,-0.3 0.873 87.8 50.6 -47.2 -51.7 53.5 59.6 52.7 80 107 A P H > S+ 0 0 36 0, 0.0 4,-2.6 0, 0.0 3,-0.4 0.965 112.3 47.1 -53.8 -54.8 50.3 59.2 50.6 81 108 A G H > S+ 0 0 7 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.846 104.6 63.8 -55.4 -36.3 52.2 58.2 47.5 82 109 A L H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.940 112.1 32.6 -55.5 -51.0 54.3 55.8 49.6 83 110 A F H X S+ 0 0 6 -4,-1.7 4,-3.0 -3,-0.4 5,-0.3 0.840 111.0 63.3 -77.6 -31.8 51.3 53.6 50.4 84 111 A E H X S+ 0 0 141 -4,-2.6 4,-1.3 -5,-0.3 -1,-0.2 0.916 110.6 43.4 -54.5 -40.1 49.5 54.3 47.1 85 112 A E H X S+ 0 0 10 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.926 112.3 49.4 -70.4 -50.3 52.5 52.5 45.7 86 113 A A H X S+ 0 0 0 -4,-1.9 4,-1.1 1,-0.2 -2,-0.2 0.880 112.1 49.2 -59.9 -39.9 52.7 49.6 48.2 87 114 A E H X S+ 0 0 83 -4,-3.0 4,-1.9 2,-0.2 -1,-0.2 0.856 107.1 54.7 -69.3 -35.2 49.0 48.9 47.8 88 115 A K H < S+ 0 0 86 -4,-1.3 4,-0.5 -5,-0.3 -1,-0.2 0.869 112.5 43.8 -65.6 -35.3 49.3 48.8 44.0 89 116 A N H <>S+ 0 0 1 -4,-1.7 5,-2.9 2,-0.2 -1,-0.2 0.672 104.4 63.7 -82.7 -18.7 52.1 46.2 44.3 90 117 A E H ><5S+ 0 0 77 -4,-1.1 3,-3.1 3,-0.2 -2,-0.2 0.957 99.9 53.4 -65.6 -48.9 50.2 44.3 46.9 91 118 A K T 3<5S+ 0 0 181 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.774 104.9 56.0 -55.5 -27.3 47.5 43.7 44.2 92 119 A K T 3 5S- 0 0 76 -4,-0.5 -1,-0.3 -5,-0.1 -2,-0.2 0.427 137.2 -85.0 -86.2 1.4 50.4 42.4 42.1 93 120 A G T < 5S+ 0 0 50 -3,-3.1 2,-0.3 1,-0.3 -3,-0.2 0.307 77.6 147.3 116.2 -9.7 51.2 39.9 44.9 94 121 A L < - 0 0 15 -5,-2.9 2,-0.4 -8,-0.1 -1,-0.3 -0.453 25.6-179.5 -64.3 120.3 53.5 41.9 47.2 95 122 A K - 0 0 115 -2,-0.3 4,-0.1 1,-0.2 -1,-0.0 -0.954 53.4 -0.3-128.0 144.0 52.8 40.5 50.8 96 123 A D S > S+ 0 0 94 -2,-0.4 3,-0.7 1,-0.1 4,-0.3 0.844 74.3 144.3 51.6 39.7 54.2 41.4 54.2 97 124 A W G > + 0 0 3 1,-0.2 3,-2.4 2,-0.2 4,-0.4 0.875 63.3 66.5 -73.4 -37.5 56.4 44.1 52.8 98 125 A E G 3 S+ 0 0 81 1,-0.3 -1,-0.2 2,-0.2 3,-0.1 0.597 94.8 64.7 -59.1 -6.3 55.9 46.3 55.8 99 126 A K G < S+ 0 0 168 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.726 112.0 29.1 -87.3 -27.0 57.8 43.5 57.5 100 127 A R S < S+ 0 0 21 -3,-2.4 -31,-3.2 -4,-0.3 2,-0.5 0.038 96.7 100.0-124.1 26.8 61.0 44.1 55.5 101 128 A L E -e 69 0A 3 -4,-0.4 2,-0.4 -33,-0.2 -31,-0.2 -0.961 48.1-172.2-116.0 120.8 60.9 47.8 54.9 102 129 A I E -e 70 0A 16 -33,-3.0 -31,-2.3 -2,-0.5 2,-0.5 -0.926 6.1-158.1-114.7 138.2 62.9 50.1 57.1 103 130 A I E -ef 71 205A 0 101,-1.4 103,-1.9 -2,-0.4 -31,-0.2 -0.964 20.5-122.6-122.8 119.0 62.7 53.9 57.0 104 131 A S E > - f 0 206A 0 -33,-2.8 3,-1.8 -2,-0.5 51,-0.3 -0.358 15.7-139.5 -58.0 123.9 65.4 56.2 58.2 105 132 A D T 3 S+ 0 0 35 101,-2.5 51,-2.3 1,-0.3 52,-0.2 0.486 99.6 60.1 -66.6 -0.2 64.0 58.5 60.9 106 133 A R T 3 S+ 0 0 88 49,-0.2 -1,-0.3 48,-0.1 2,-0.1 0.515 74.3 116.7-104.0 -7.0 66.0 61.4 59.3 107 134 A A < - 0 0 0 -3,-1.8 48,-2.2 -36,-0.2 -31,-0.2 -0.384 66.8-120.7 -63.0 134.5 64.4 61.3 55.9 108 135 A H E -kL 76 154C 17 -33,-0.9 -31,-2.7 -35,-0.6 2,-0.4 -0.277 22.7-118.2 -74.0 163.0 62.5 64.5 55.0 109 136 A L E -k 77 0C 2 44,-2.5 2,-0.7 -33,-0.2 44,-0.4 -0.887 8.0-145.2-110.3 132.8 58.8 64.7 54.2 110 137 A V - 0 0 5 -33,-3.1 -31,-0.4 -2,-0.4 2,-0.2 -0.834 26.7-152.9 -92.1 118.5 57.2 65.8 51.0 111 138 A F >> - 0 0 4 -2,-0.7 3,-2.2 28,-0.1 4,-1.3 -0.601 26.3-106.7 -95.1 156.3 53.9 67.5 51.9 112 139 A D H 3> S+ 0 0 52 1,-0.3 4,-1.2 -2,-0.2 3,-0.1 0.865 121.1 51.4 -43.8 -46.8 50.8 67.8 49.7 113 140 A F H 3> S+ 0 0 1 1,-0.2 4,-3.1 2,-0.2 -1,-0.3 0.705 100.5 64.4 -69.1 -18.0 51.4 71.5 49.1 114 141 A H H <> S+ 0 0 0 -3,-2.2 4,-2.6 2,-0.2 25,-0.2 0.963 105.1 43.3 -67.0 -50.8 55.0 70.7 48.0 115 142 A Q H X S+ 0 0 46 -4,-1.3 4,-1.6 23,-0.2 24,-0.3 0.796 115.5 52.9 -62.4 -28.2 53.7 68.8 45.0 116 143 A A H X S+ 0 0 34 -4,-1.2 4,-2.4 -5,-0.3 -2,-0.2 0.934 109.7 44.3 -72.4 -48.8 51.2 71.6 44.6 117 144 A V H X S+ 0 0 0 -4,-3.1 4,-3.1 1,-0.2 5,-0.2 0.862 108.8 60.8 -63.0 -35.1 53.9 74.4 44.6 118 145 A D H X S+ 0 0 2 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.949 108.4 42.1 -56.2 -51.0 55.9 72.1 42.3 119 146 A G H X S+ 0 0 12 -4,-1.6 4,-2.3 1,-0.2 3,-0.3 0.927 114.9 50.4 -62.2 -46.3 53.1 72.3 39.7 120 147 A L H X S+ 0 0 51 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.862 108.3 52.2 -60.3 -39.7 52.5 76.0 40.3 121 148 A Q H X S+ 0 0 47 -4,-3.1 4,-1.7 2,-0.2 -1,-0.2 0.796 110.3 49.9 -66.8 -29.7 56.2 76.8 39.8 122 149 A E H X S+ 0 0 2 -4,-1.3 4,-1.8 -3,-0.3 -2,-0.2 0.900 111.7 45.8 -75.7 -43.5 56.2 74.9 36.5 123 150 A V H X S+ 0 0 89 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.824 114.4 51.0 -68.0 -31.4 53.1 76.7 35.2 124 151 A Q H < S+ 0 0 92 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.878 110.3 46.5 -73.2 -40.9 54.7 80.0 36.3 125 152 A R H >X S+ 0 0 65 -4,-1.7 6,-0.9 1,-0.2 3,-0.6 0.830 117.3 45.3 -70.6 -31.9 58.0 79.4 34.6 126 153 A Q H >X S+ 0 0 86 -4,-1.8 4,-2.6 1,-0.2 3,-1.0 0.948 111.9 49.6 -74.5 -52.3 56.2 78.3 31.5 127 154 A A H 3< S+ 0 0 83 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.1 0.058 120.9 38.9 -77.2 29.1 53.7 81.2 31.5 128 155 A Q H <4 S+ 0 0 135 -3,-0.6 -1,-0.2 -2,-0.2 -2,-0.2 0.361 133.5 15.5-152.4 -8.8 56.7 83.5 32.0 129 156 A E H << S- 0 0 134 -3,-1.0 -3,-0.2 -4,-0.6 -2,-0.2 0.299 91.5-118.8-150.1 -1.0 59.5 82.2 29.8 130 157 A G S < S+ 0 0 59 -4,-2.6 2,-0.3 -5,-0.1 -4,-0.2 0.563 94.4 77.7 66.4 6.2 57.7 79.7 27.5 131 158 A K + 0 0 82 -6,-0.9 2,-0.2 -5,-0.1 -1,-0.1 -0.960 54.6 174.8-151.5 127.7 60.0 77.2 29.1 132 159 A N - 0 0 30 -2,-0.3 -10,-0.1 -3,-0.1 148,-0.1 -0.642 46.1 -93.6-120.4-179.7 59.9 75.3 32.4 133 160 A I - 0 0 34 -2,-0.2 147,-1.4 146,-0.1 -11,-0.0 0.832 47.2-122.0 -66.5 -37.7 62.1 72.5 34.0 134 161 A G - 0 0 16 145,-0.2 -1,-0.1 1,-0.1 108,-0.0 0.659 44.1-177.1 98.0 19.8 59.9 69.6 33.0 135 162 A T - 0 0 35 1,-0.1 -1,-0.1 -17,-0.1 109,-0.0 -0.018 37.5-126.1 -47.7 151.3 59.5 68.4 36.6 136 163 A T - 0 0 30 1,-0.0 -1,-0.1 143,-0.0 -17,-0.1 0.523 42.2-124.9 -78.9 -5.4 57.6 65.2 37.3 137 164 A K S S+ 0 0 99 -19,-0.1 -18,-0.2 1,-0.1 -19,-0.1 0.818 73.8 128.6 65.8 33.0 55.4 67.4 39.6 138 165 A K S S- 0 0 61 -20,-0.1 -23,-0.2 -19,-0.0 -98,-0.2 0.208 81.5-109.6-100.5 13.5 56.1 65.1 42.6 139 166 A G S > S+ 0 0 0 -24,-0.3 4,-2.0 -25,-0.2 5,-0.2 0.611 76.0 135.7 71.1 13.9 57.2 68.0 44.7 140 167 A I H > + 0 0 8 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.932 69.7 46.5 -59.1 -50.6 60.8 67.0 44.8 141 168 A G H > S+ 0 0 22 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.942 112.7 48.6 -59.3 -51.2 62.3 70.4 44.2 142 169 A P H > S+ 0 0 8 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.883 112.7 48.9 -58.0 -39.1 60.1 72.2 46.8 143 170 A T H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.898 111.8 46.7 -69.9 -41.0 60.9 69.6 49.5 144 171 A Y H X S+ 0 0 21 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.842 111.9 52.8 -69.4 -30.6 64.6 69.7 48.9 145 172 A S H X S+ 0 0 80 -4,-2.1 4,-1.5 -5,-0.2 -2,-0.2 0.874 109.1 48.3 -71.5 -36.5 64.5 73.5 49.0 146 173 A S H X>S+ 0 0 8 -4,-1.8 5,-1.9 -5,-0.2 6,-1.5 0.888 110.2 54.7 -68.9 -36.4 62.6 73.4 52.3 147 174 A K H ><5S+ 0 0 56 -4,-2.1 3,-1.6 2,-0.2 -2,-0.2 0.952 107.4 46.3 -60.6 -53.1 65.3 70.9 53.6 148 175 A A H 3<5S+ 0 0 82 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.856 112.0 53.3 -59.7 -32.8 68.2 73.2 52.8 149 176 A A H 3<5S- 0 0 51 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.600 109.1-129.4 -77.0 -10.6 66.3 76.0 54.3 150 177 A R T <<5S+ 0 0 219 -3,-1.6 -3,-0.2 -4,-0.5 -2,-0.1 0.613 83.8 107.1 69.4 15.7 65.9 73.9 57.5 151 178 A T < + 0 0 46 -5,-1.9 -4,-0.2 -6,-0.2 21,-0.1 0.651 54.5 99.2 -93.6 -19.5 62.1 74.6 57.4 152 179 A G - 0 0 11 -6,-1.5 2,-0.3 -9,-0.1 -42,-0.1 -0.058 68.3-128.4 -63.1 168.9 61.3 71.1 56.3 153 180 A L - 0 0 0 -44,-0.4 -44,-2.5 16,-0.0 2,-0.2 -0.882 18.4-148.5-122.2 154.3 60.1 68.3 58.6 154 181 A R B >> -L 108 0C 82 -2,-0.3 4,-1.7 -46,-0.3 3,-1.3 -0.723 31.9 -97.6-122.5 169.2 61.3 64.8 59.0 155 182 A I H >> S+ 0 0 1 -48,-2.2 4,-2.2 1,-0.3 3,-0.6 0.912 122.0 52.2 -45.7 -55.0 60.1 61.3 59.9 156 183 A C H 34 S+ 0 0 37 -51,-2.3 4,-0.4 1,-0.2 -1,-0.3 0.759 106.7 55.1 -56.9 -26.7 61.2 61.6 63.5 157 184 A D H X4 S+ 0 0 41 -3,-1.3 3,-0.5 -52,-0.2 8,-0.3 0.874 107.9 47.8 -73.7 -38.2 59.2 64.9 63.7 158 185 A L H << S+ 0 0 2 -4,-1.7 -2,-0.2 -3,-0.6 -1,-0.2 0.886 112.3 49.4 -68.4 -40.0 56.0 63.2 62.6 159 186 A L T 3< S+ 0 0 31 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.508 108.3 65.7 -78.2 -5.6 56.5 60.3 65.1 160 187 A S S < S- 0 0 81 -3,-0.5 2,-0.4 -4,-0.4 -3,-0.1 0.043 110.9 -19.1 -96.6-154.3 57.1 62.7 68.0 161 188 A D > - 0 0 91 1,-0.2 4,-2.3 2,-0.1 -1,-0.2 -0.353 59.7-158.9 -53.9 109.6 54.9 65.3 69.7 162 189 A F H > S+ 0 0 40 -2,-0.4 4,-3.1 1,-0.2 5,-0.2 0.859 88.9 56.7 -62.8 -38.1 52.2 65.7 67.1 163 190 A D H > S+ 0 0 125 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.912 108.8 48.1 -59.2 -42.3 51.0 69.1 68.5 164 191 A E H > S+ 0 0 101 2,-0.2 4,-1.3 1,-0.2 3,-0.5 0.961 112.0 48.8 -60.2 -54.2 54.6 70.3 68.0 165 192 A F H >X S+ 0 0 2 -4,-2.3 4,-3.1 -8,-0.3 3,-1.0 0.929 107.3 55.6 -49.8 -54.5 54.7 68.9 64.5 166 193 A S H 3X S+ 0 0 14 -4,-3.1 4,-2.3 1,-0.3 -1,-0.2 0.833 102.7 55.9 -50.4 -39.4 51.4 70.6 63.6 167 194 A A H 3X S+ 0 0 47 -4,-1.6 4,-1.3 -3,-0.5 -1,-0.3 0.860 112.9 41.6 -63.8 -36.0 52.7 74.0 64.7 168 195 A R H X S+ 0 0 8 -4,-1.6 4,-1.6 -3,-0.3 3,-0.5 0.930 108.3 53.5 -74.3 -46.2 54.5 78.6 50.8 177 204 A Q H 3< S+ 0 0 48 -4,-2.1 6,-0.2 1,-0.2 -2,-0.2 0.812 103.0 63.7 -57.6 -27.6 51.2 80.4 50.4 178 205 A S H 3< S+ 0 0 101 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.925 110.1 34.2 -61.9 -47.9 53.2 83.5 50.9 179 206 A M H << S+ 0 0 99 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.622 132.6 35.5 -82.1 -14.4 55.2 83.0 47.7 180 207 A F >< + 0 0 14 -4,-1.6 3,-1.9 -5,-0.1 -1,-0.3 -0.590 65.4 174.6-140.2 73.6 52.1 81.4 46.0 181 208 A P T 3 S+ 0 0 107 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.674 79.1 65.1 -53.5 -21.1 49.0 83.2 47.2 182 209 A T T 3 S+ 0 0 112 -3,-0.1 2,-0.5 2,-0.1 -5,-0.1 0.175 79.0 111.8 -89.9 17.3 46.9 81.2 44.8 183 210 A L < - 0 0 16 -3,-1.9 2,-0.6 -6,-0.2 -3,-0.1 -0.807 57.1-151.6 -95.9 129.2 47.8 78.0 46.7 184 211 A E + 0 0 181 -2,-0.5 2,-0.5 2,-0.0 -2,-0.1 -0.882 16.4 179.9-102.4 122.9 45.0 76.3 48.6 185 212 A I - 0 0 22 -2,-0.6 2,-2.0 -72,-0.0 3,-0.2 -0.942 23.7-152.6-130.4 114.2 46.0 74.3 51.6 186 213 A D > - 0 0 102 -2,-0.5 4,-2.9 1,-0.2 5,-0.4 -0.571 21.6-176.9 -81.2 78.8 43.6 72.4 53.9 187 214 A V H > S+ 0 0 28 -2,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.889 78.6 38.6 -42.6 -59.9 45.8 72.7 57.0 188 215 A E H > S+ 0 0 118 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.817 116.8 52.8 -66.6 -31.9 43.5 70.6 59.3 189 216 A G H >> S+ 0 0 16 2,-0.2 4,-1.2 -3,-0.2 3,-0.9 0.964 109.5 44.7 -69.0 -53.7 42.7 68.1 56.5 190 217 A Q H 3X S+ 0 0 19 -4,-2.9 4,-2.1 1,-0.3 -1,-0.2 0.841 110.4 58.0 -59.8 -33.2 46.2 67.2 55.4 191 218 A L H 3X S+ 0 0 6 -4,-1.6 4,-1.5 -5,-0.4 -1,-0.3 0.769 98.2 59.6 -68.4 -26.9 47.2 67.0 59.1 192 219 A K H X S+ 0 0 0 -4,-3.0 3,-2.3 -3,-0.1 4,-1.3 0.822 94.8 89.1 -87.1 -35.6 54.9 54.2 59.4 202 229 A R G >< S+ 0 0 98 -4,-2.7 3,-1.0 -5,-0.4 -2,-0.1 0.788 83.7 52.0 -29.3 -65.1 56.0 54.0 63.1 203 230 A P G 34 S+ 0 0 88 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.753 112.3 46.9 -51.3 -28.1 56.8 50.2 63.2 204 231 A M G <4 S+ 0 0 5 -3,-2.3 -101,-1.4 -4,-0.2 -2,-0.2 0.747 89.8 102.0 -87.3 -24.7 59.1 50.5 60.2 205 232 A V E << +f 103 0A 19 -4,-1.3 2,-0.3 -3,-1.0 -101,-0.2 -0.288 43.4 157.6 -63.6 143.0 61.0 53.6 61.3 206 233 A R E -f 104 0A 128 -103,-1.9 -101,-2.5 -2,-0.0 2,-0.8 -0.917 52.3 -80.8-153.1 172.9 64.5 53.1 62.7 207 234 A D > - 0 0 55 -2,-0.3 4,-2.5 -103,-0.2 -103,-0.1 -0.776 40.2-160.4 -84.6 113.8 67.7 55.2 63.2 208 235 A G H > S+ 0 0 1 -2,-0.8 4,-3.1 2,-0.2 5,-0.4 0.885 84.7 52.1 -63.5 -43.0 69.4 55.0 59.8 209 236 A V H > S+ 0 0 64 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.968 115.9 40.4 -58.5 -55.1 72.9 55.9 60.9 210 237 A Y H > S+ 0 0 140 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.912 116.0 54.1 -59.1 -44.3 72.9 53.2 63.6 211 238 A F H X S+ 0 0 36 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.964 113.9 37.1 -56.7 -60.2 71.1 50.8 61.2 212 239 A M H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 5,-0.2 0.935 117.9 52.3 -59.8 -47.0 73.6 51.1 58.3 213 240 A Y H X S+ 0 0 127 -4,-2.6 4,-1.0 -5,-0.4 -1,-0.2 0.920 109.4 48.7 -55.0 -47.7 76.6 51.3 60.6 214 241 A E H X S+ 0 0 94 -4,-3.0 4,-1.4 -5,-0.2 3,-0.3 0.878 112.8 48.9 -59.6 -40.1 75.5 48.1 62.5 215 242 A A H < S+ 0 0 7 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.854 110.3 49.8 -68.9 -38.0 75.0 46.3 59.2 216 243 A L H < S+ 0 0 3 -4,-2.5 -212,-2.4 1,-0.2 -1,-0.2 0.619 120.8 34.8 -77.7 -13.9 78.4 47.3 57.8 217 244 A H H < S+ 0 0 70 -4,-1.0 -2,-0.2 -3,-0.3 -1,-0.2 0.508 103.7 76.4-117.7 -9.3 80.3 46.2 60.9 218 245 A G S < S- 0 0 33 -4,-1.4 3,-0.1 1,-0.3 -214,-0.1 0.131 109.8 -29.5 -82.0-155.9 78.4 43.2 62.1 219 246 A P S S- 0 0 108 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.410 95.9 -79.9 -59.6 132.1 78.7 39.8 60.5 220 247 A P - 0 0 117 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 0.058 59.4-177.1 -35.7 130.8 79.5 40.5 56.8 221 248 A K - 0 0 85 -6,-0.2 2,-0.7 -3,-0.1 -216,-0.2 -0.896 30.2-120.2-131.2 159.8 76.5 41.4 54.7 222 249 A K - 0 0 109 -2,-0.3 -191,-2.1 -193,-0.1 -190,-2.0 -0.917 34.3-173.8-104.2 109.2 75.8 42.2 51.1 223 250 A V E - d 0 32A 3 -2,-0.7 -216,-2.6 -218,-0.3 2,-0.4 -0.911 4.9-163.8-108.5 131.5 74.4 45.7 50.9 224 251 A L E -bd 7 33A 4 -192,-3.4 -190,-3.3 -2,-0.5 2,-0.5 -0.932 5.0-153.4-116.4 137.0 73.1 47.1 47.6 225 252 A V E -bd 8 34A 0 -218,-3.3 -216,-2.6 -2,-0.4 2,-0.7 -0.941 5.1-153.0-117.1 118.8 72.4 50.8 46.9 226 253 A E E -bd 9 35A 1 -192,-3.7 -190,-0.8 -2,-0.5 -216,-0.1 -0.767 13.3-151.5 -90.7 111.6 69.9 51.8 44.3 227 254 A G - 0 0 1 -218,-2.3 2,-0.3 -2,-0.7 21,-0.1 -0.331 6.8-146.5 -77.1 165.3 70.6 55.1 42.7 228 255 A A - 0 0 6 20,-0.1 -217,-0.2 -217,-0.1 -190,-0.1 -0.908 61.5 -4.6-129.4 157.3 67.8 57.3 41.4 229 256 A N S S- 0 0 17 -2,-0.3 2,-0.3 -215,-0.1 -214,-0.2 -0.339 92.2-104.3 58.6-137.2 67.8 59.7 38.5 230 257 A A > - 0 0 0 -216,-0.1 3,-1.8 1,-0.1 4,-0.3 -0.991 26.6 -73.9-172.5 175.6 71.4 59.9 37.1 231 258 A A G > S+ 0 0 2 -220,-2.3 3,-2.0 -2,-0.3 18,-0.2 0.914 123.4 46.7 -49.4 -57.2 74.7 61.7 36.6 232 259 A L G 3 S+ 0 0 0 -219,-1.7 7,-2.2 1,-0.3 -1,-0.3 0.449 111.3 54.2 -71.5 4.5 73.5 64.4 34.2 233 260 A L G < S+ 0 0 28 -3,-1.8 11,-2.8 -220,-0.3 13,-0.3 0.307 81.1 127.8-112.3 1.9 70.4 65.0 36.4 234 261 A D <> - 0 0 0 -3,-2.0 4,-2.8 -4,-0.3 13,-0.2 -0.379 66.8-128.5 -64.3 133.2 72.6 65.7 39.5 235 262 A I T 4 S+ 0 0 46 11,-2.2 12,-0.1 1,-0.2 -1,-0.1 0.818 107.5 28.3 -52.7 -34.7 71.9 68.9 41.3 236 263 A D T 4 S+ 0 0 105 10,-0.1 -1,-0.2 3,-0.0 4,-0.2 0.902 134.9 25.8 -92.2 -48.6 75.6 69.8 41.2 237 264 A F T 4 S+ 0 0 79 -6,-0.1 -2,-0.2 2,-0.1 -6,-0.1 0.607 99.7 90.7 -96.1 -15.2 76.9 68.1 38.1 238 265 A G S < S- 0 0 8 -4,-2.8 2,-3.0 1,-0.1 -5,-0.2 0.072 101.7 -66.5 -72.4-173.0 74.0 67.7 35.8 239 266 A T S > S- 0 0 4 -7,-2.2 3,-2.0 3,-0.4 -1,-0.1 -0.365 79.3-126.2 -75.4 65.6 72.7 70.1 33.1 240 267 A Y T 3 S+ 0 0 141 -2,-3.0 126,-0.6 1,-0.3 -5,-0.0 -0.241 83.9 17.8 -54.0 140.5 71.8 72.7 35.7 241 268 A P T 3 S+ 0 0 59 0, 0.0 2,-1.7 0, 0.0 -1,-0.3 -0.954 119.3 65.8 -89.9 8.8 69.2 74.0 36.1 242 269 A F S < S+ 0 0 19 -3,-2.0 -3,-0.4 -4,-0.0 2,-0.2 -0.516 89.6 94.6 -88.8 69.0 67.5 71.3 34.0 243 270 A V S S- 0 0 16 -2,-1.7 2,-0.2 -5,-0.1 -9,-0.2 -0.763 81.1 -93.1-141.4-178.4 68.3 68.7 36.7 244 271 A T - 0 0 21 -11,-2.8 -6,-0.1 -2,-0.2 4,-0.1 -0.588 42.0-108.9 -97.9 168.2 66.6 67.0 39.7 245 272 A S S S+ 0 0 43 -2,-0.2 2,-0.3 -11,-0.1 -11,-0.1 0.028 88.2 64.8 -93.4 31.1 67.2 68.5 43.2 246 273 A S S S- 0 0 3 -13,-0.3 -11,-2.2 -209,-0.1 2,-1.0 -0.898 90.5 -93.5-140.6 167.9 69.4 65.8 44.7 247 274 A N + 0 0 44 -2,-0.3 -13,-0.1 -13,-0.2 9,-0.1 -0.772 38.2 173.7 -89.6 104.3 72.9 64.3 44.2 248 275 A C + 0 0 6 -2,-1.0 -237,-0.3 -18,-0.3 -17,-0.2 0.594 53.6 93.6 -83.1 -15.7 72.4 61.3 41.9 249 276 A T S > S- 0 0 5 -19,-0.2 3,-1.7 -18,-0.2 4,-0.4 -0.146 100.9 -85.6 -72.2 173.0 76.1 60.8 41.6 250 277 A V T >> S+ 0 0 30 1,-0.3 3,-1.5 2,-0.2 4,-0.8 0.774 124.0 64.5 -53.8 -31.6 78.1 58.5 43.9 251 278 A G H >> S+ 0 0 40 1,-0.3 4,-2.1 2,-0.2 3,-0.6 0.857 90.3 68.2 -62.1 -31.8 78.6 61.1 46.6 252 279 A G H <> S+ 0 0 0 -3,-1.7 4,-1.6 1,-0.2 -1,-0.3 0.745 91.0 62.1 -58.0 -25.4 74.8 61.0 47.1 253 280 A V H <> S+ 0 0 1 -3,-1.5 4,-1.0 -4,-0.4 6,-0.3 0.928 107.5 42.2 -66.9 -44.8 75.3 57.5 48.5 254 281 A C H S+ 0 0 33 -4,-0.8 4,-1.8 -3,-0.6 5,-0.7 0.940 119.7 41.1 -66.7 -50.7 77.5 58.8 51.4 255 282 A T H <5S+ 0 0 89 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.760 117.7 50.4 -70.5 -24.2 75.4 61.8 52.2 256 283 A G H <5S+ 0 0 0 -4,-1.6 -182,-1.8 -5,-0.3 -181,-0.3 0.589 124.2 23.4 -90.8 -13.4 72.1 59.9 51.8 257 284 A L H <5S- 0 0 0 -4,-1.0 -45,-0.2 -3,-0.5 -2,-0.2 0.430 100.4-119.1-127.5 -8.6 72.9 56.8 53.9 258 285 A G T <5 + 0 0 42 -4,-1.8 -3,-0.2 1,-0.2 -4,-0.1 0.867 64.7 137.0 71.7 36.9 75.5 58.2 56.3 259 286 A I < - 0 0 7 -5,-0.7 -1,-0.2 -6,-0.3 -2,-0.2 -0.947 52.8-118.1-118.8 140.5 78.3 55.8 55.3 260 287 A P > - 0 0 56 0, 0.0 3,-2.7 0, 0.0 4,-0.1 -0.399 31.2-105.1 -74.1 149.5 82.0 56.8 54.7 261 288 A P G > S+ 0 0 95 0, 0.0 3,-1.4 0, 0.0 -2,-0.0 0.688 115.2 66.3 -45.7 -27.8 83.7 56.4 51.3 262 289 A Q G 3 S+ 0 0 100 1,-0.3 -260,-0.0 -257,-0.0 -259,-0.0 0.673 94.0 59.4 -73.6 -14.4 85.7 53.3 52.5 263 290 A N G < S+ 0 0 2 -3,-2.7 -257,-3.2 -258,-0.1 2,-0.7 0.174 84.9 98.9 -96.0 17.4 82.4 51.3 52.8 264 291 A I E < +a 6 0A 22 -3,-1.4 -257,-0.1 -259,-0.3 3,-0.1 -0.915 47.6 166.5-106.8 110.6 81.7 51.9 49.1 265 292 A G E + 0 0 15 -259,-2.8 -258,-0.2 -2,-0.7 2,-0.2 0.629 53.3 9.5 -90.3-115.3 82.7 48.9 47.0 266 293 A D E - 0 0 68 -261,-0.2 -258,-3.4 64,-0.1 2,-0.5 -0.461 59.0-163.2 -71.4 137.4 81.7 48.4 43.4 267 294 A V E -a 8 0A 8 -260,-0.2 63,-2.5 61,-0.2 64,-0.8 -0.918 10.2-164.3-124.0 101.0 80.0 51.3 41.7 268 295 A Y E -ag 9 331A 11 -260,-3.5 -258,-3.2 -2,-0.5 2,-0.6 -0.715 7.7-148.3 -91.4 133.5 78.2 50.2 38.5 269 296 A G E -ag 10 332A 0 62,-1.9 64,-2.3 -2,-0.4 2,-0.7 -0.883 10.1-141.2-103.0 122.0 77.1 52.6 35.9 270 297 A V E -ag 11 333A 0 -260,-3.4 -258,-1.8 -2,-0.6 2,-0.5 -0.719 23.2-172.3 -82.6 116.5 73.9 51.8 34.0 271 298 A V E - g 0 334A 0 62,-3.0 64,-1.9 -2,-0.7 2,-0.2 -0.933 14.9-144.7-115.9 114.5 74.5 52.8 30.4 272 299 A K E - g 0 335A 0 -2,-0.5 64,-0.2 62,-0.2 -254,-0.1 -0.543 22.6-123.7 -75.5 141.8 71.6 52.7 27.8 273 300 A A S S+ 0 0 0 62,-3.0 42,-0.5 -2,-0.2 2,-0.3 0.619 99.2 21.3 -59.3 -16.3 72.8 51.7 24.3 274 301 A Y S S- 0 0 0 61,-0.2 2,-0.4 40,-0.2 40,-0.2 -0.885 96.1 -99.3-140.9 170.9 71.2 55.0 23.1 275 302 A T E -M 313 0D 0 38,-2.4 38,-2.5 -2,-0.3 2,-0.3 -0.819 33.0-179.1-105.5 138.2 70.3 58.2 25.0 276 303 A T E -M 312 0D 2 -2,-0.4 -262,-0.5 -261,-0.2 2,-0.3 -0.959 4.8-176.0-129.9 148.9 67.0 59.3 26.4 277 304 A R E -M 311 0D 5 34,-1.9 34,-2.4 -2,-0.3 2,-0.6 -0.965 7.9-163.3-145.2 123.5 65.9 62.4 28.2 278 305 A V + 0 0 34 -264,-0.5 2,-0.2 -2,-0.3 32,-0.1 -0.942 63.6 24.1-111.2 115.2 62.5 63.1 29.6 279 306 A G S S- 0 0 16 -2,-0.6 -145,-0.2 2,-0.1 2,-0.1 -0.745 99.5 -41.4 127.5-175.0 62.0 66.7 30.4 280 307 A I S S+ 0 0 61 -147,-1.4 2,-0.2 -2,-0.2 -2,-0.1 -0.472 78.6 78.8 -87.6 157.0 63.4 70.0 29.3 281 308 A G S S- 0 0 4 -2,-0.1 -2,-0.1 -4,-0.1 -41,-0.1 -0.543 76.7 -42.1 132.6 163.3 67.1 70.8 28.6 282 309 A A + 0 0 0 -2,-0.2 88,-0.1 -43,-0.1 -43,-0.1 -0.240 44.3 174.6 -59.3 147.0 70.0 70.5 26.2 283 310 A F > - 0 0 9 86,-0.2 3,-1.5 1,-0.1 -6,-0.1 -0.611 11.1-168.7-160.9 84.7 70.4 67.1 24.5 284 311 A P T 3 S+ 0 0 23 0, 0.0 90,-0.3 0, 0.0 -1,-0.1 0.818 86.6 39.2 -45.8 -50.1 73.3 67.1 21.9 285 312 A T T 3 S+ 0 0 0 29,-0.2 29,-1.3 28,-0.1 -10,-0.1 0.354 82.5 143.1 -90.0 7.6 72.6 63.7 20.2 286 313 A E B < -N 313 0D 48 -3,-1.5 2,-0.6 27,-0.2 27,-0.3 -0.134 40.1-149.2 -49.2 139.1 68.8 64.1 20.3 287 314 A Q - 0 0 32 25,-3.3 2,-1.5 2,-0.1 25,-0.3 -0.874 16.2-177.8-118.9 97.9 67.1 62.7 17.1 288 315 A I + 0 0 139 -2,-0.6 2,-0.3 4,-0.1 25,-0.1 -0.625 61.4 58.6 -91.7 76.6 63.9 64.5 16.2 289 316 A N S > S- 0 0 62 -2,-1.5 4,-2.7 1,-0.1 5,-0.2 -0.927 106.9 -47.7-172.4-165.8 63.1 62.2 13.2 290 317 A E H > S+ 0 0 161 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.928 132.2 47.0 -52.9 -51.6 62.4 58.8 11.9 291 318 A I H > S+ 0 0 52 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.844 111.2 52.5 -61.5 -34.8 65.4 57.3 13.8 292 319 A G H > S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.894 110.3 48.5 -67.4 -38.5 64.2 59.1 16.9 293 320 A D H X S+ 0 0 94 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.865 108.0 54.3 -68.5 -37.6 60.8 57.6 16.5 294 321 A L H X S+ 0 0 62 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.827 111.6 44.3 -67.1 -33.1 62.2 54.1 16.0 295 322 A L H X S+ 0 0 2 -4,-1.5 4,-2.0 2,-0.2 6,-0.2 0.928 114.3 48.6 -75.3 -47.3 64.1 54.3 19.2 296 323 A Q H <>S+ 0 0 29 -4,-2.1 5,-2.5 2,-0.2 -2,-0.2 0.898 120.1 40.0 -57.9 -41.5 61.2 55.8 21.2 297 324 A N H ><5S+ 0 0 106 -4,-2.4 3,-1.6 2,-0.2 -2,-0.2 0.962 117.6 42.6 -76.1 -56.0 59.0 53.1 19.8 298 325 A R H 3<5S+ 0 0 78 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.785 120.3 47.5 -64.0 -22.8 61.1 50.0 19.8 299 326 A G T 3<5S- 0 0 4 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.394 101.6-132.1 -98.3 4.4 62.3 51.1 23.3 300 327 A H T < 5 - 0 0 104 -3,-1.6 2,-1.7 1,-0.2 -3,-0.2 0.900 36.0-174.3 45.2 48.1 58.8 51.8 24.7 301 328 A E < + 0 0 0 -5,-2.5 9,-2.5 -6,-0.2 2,-0.3 -0.508 28.5 121.6 -81.4 80.0 60.3 55.1 25.9 302 329 A W B S-O 309 0E 131 -2,-1.7 7,-0.2 7,-0.2 6,-0.1 -0.991 71.0 -76.7-139.2 145.4 57.6 56.8 28.0 303 330 A G - 0 0 9 5,-3.4 6,-0.0 -2,-0.3 -2,-0.0 -0.037 25.3-159.5 -42.4 130.0 57.6 57.9 31.6 304 331 A V S S+ 0 0 38 -261,-0.2 -1,-0.2 2,-0.1 -260,-0.1 0.477 99.6 30.3 -88.9 -3.8 57.2 55.1 34.1 305 332 A T S S+ 0 0 40 -262,-0.1 -1,-0.1 3,-0.1 -263,-0.1 0.704 138.4 17.4-116.0 -50.4 56.0 57.9 36.5 306 333 A T S S- 0 0 57 -265,-0.1 -2,-0.1 2,-0.1 3,-0.1 0.777 88.5-127.4 -97.6 -33.8 54.3 60.5 34.3 307 334 A G + 0 0 47 1,-0.3 -3,-0.1 0, 0.0 3,-0.1 0.411 56.0 149.6 97.3 -1.0 53.6 58.7 31.1 308 335 A R - 0 0 76 -6,-0.1 -5,-3.4 1,-0.1 2,-0.4 -0.265 54.1-107.7 -64.5 150.5 55.4 61.4 29.0 309 336 A K B -O 302 0E 138 -7,-0.2 -7,-0.2 -3,-0.1 2,-0.2 -0.666 36.1-134.1 -80.7 131.3 57.1 60.5 25.8 310 337 A R - 0 0 18 -9,-2.5 2,-0.2 -2,-0.4 -32,-0.2 -0.574 13.7-117.4 -86.8 151.7 60.9 60.6 26.2 311 338 A R E -M 277 0D 53 -34,-2.4 -34,-1.9 -2,-0.2 2,-0.3 -0.615 34.2-151.9 -82.4 145.0 63.2 62.3 23.7 312 339 A C E +M 276 0D 5 -25,-0.3 -25,-3.3 -2,-0.2 2,-0.3 -0.917 21.7 156.8-125.6 151.5 65.6 59.8 22.1 313 340 A G E -MN 275 286D 0 -38,-2.5 -38,-2.4 -2,-0.3 -27,-0.2 -0.957 43.5 -72.8-158.9 172.2 69.1 60.1 20.6 314 341 A W - 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