==== 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 16-OCT-06 2E0Y . COMPND 2 MOLECULE: GAMMA-GLUTAMYLTRANSPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K12; . AUTHOR T.OKADA,K.WADA,K.FUKUYAMA . 1077 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36953.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 708 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 167 15.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 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 . 49 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 118 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 297 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 1.8 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 6 2 4 2 2 4 0 2 6 2 4 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 7 9 6 4 6 4 2 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 . 5 2 0 0 0 4 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 29 A A 0 0 71 0, 0.0 460,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 121.3 27.3 -5.6 -18.6 2 30 A P - 0 0 26 0, 0.0 461,-0.1 0, 0.0 460,-0.0 -0.163 360.0 -71.7 -75.6 172.5 28.6 -4.0 -21.8 3 31 A P - 0 0 119 0, 0.0 2,-0.1 0, 0.0 0, 0.0 -0.351 53.1-117.4 -67.0 147.1 26.5 -2.4 -24.5 4 32 A V - 0 0 27 -3,-0.1 2,-0.4 -2,-0.0 461,-0.1 -0.287 18.7-145.9 -79.9 166.8 24.5 -4.8 -26.7 5 33 A S - 0 0 28 459,-0.3 461,-0.2 454,-0.3 3,-0.1 -0.964 18.2-177.7-139.6 120.7 24.9 -5.3 -30.5 6 34 A Y - 0 0 44 -2,-0.4 460,-0.2 1,-0.2 -1,-0.1 0.533 67.6 -78.7 -91.2 -7.9 22.0 -6.1 -32.9 7 35 A G - 0 0 18 458,-0.1 2,-0.3 7,-0.1 -1,-0.2 0.069 40.5-146.6 117.1 134.1 24.5 -6.3 -35.8 8 36 A V > - 0 0 66 -3,-0.1 3,-2.0 1,-0.0 457,-0.1 -0.887 34.4-105.8-126.8 157.9 26.5 -4.0 -38.1 9 37 A E T 3 S+ 0 0 114 -2,-0.3 1042,-0.0 1,-0.3 -1,-0.0 0.771 114.3 62.7 -54.0 -29.9 27.6 -4.4 -41.7 10 38 A E T 3 S+ 0 0 66 1040,-0.1 1041,-2.2 3,-0.0 -1,-0.3 0.498 81.6 103.0 -77.2 -3.9 31.2 -5.1 -40.7 11 39 A D S < S- 0 0 3 -3,-2.0 3,-0.1 1039,-0.1 1039,-0.0 -0.289 73.0-131.6 -74.2 165.2 30.4 -8.3 -38.7 12 40 A V S S+ 0 0 11 1,-0.2 2,-0.5 1038,-0.0 -1,-0.1 0.876 94.1 45.9 -83.5 -41.8 31.1 -11.8 -40.2 13 41 A F S S- 0 0 30 1060,-0.1 455,-0.4 452,-0.0 454,-0.2 -0.893 74.7-159.7-108.1 131.1 27.6 -13.2 -39.4 14 42 A H - 0 0 46 -2,-0.5 -7,-0.1 1058,-0.5 -5,-0.0 -0.908 12.6-131.9-113.3 130.7 24.5 -11.1 -40.2 15 43 A P - 0 0 14 0, 0.0 2,-0.3 0, 0.0 513,-0.2 -0.378 30.8-104.1 -75.5 158.8 21.1 -11.6 -38.7 16 44 A V E -A 527 0A 59 511,-3.0 511,-2.5 -2,-0.0 2,-0.4 -0.661 43.0-145.0 -76.3 137.8 18.0 -11.8 -40.9 17 45 A R E +A 526 0A 91 -2,-0.3 2,-0.3 509,-0.2 509,-0.2 -0.901 25.6 165.5-114.1 140.2 16.2 -8.4 -40.5 18 46 A A E -A 525 0A 5 507,-1.9 507,-3.2 -2,-0.4 4,-0.1 -0.990 27.6-154.1-147.8 148.9 12.5 -7.7 -40.5 19 47 A K S S+ 0 0 168 -2,-0.3 3,-0.1 505,-0.2 -1,-0.1 0.720 89.3 20.5 -96.6 -25.2 10.4 -4.8 -39.5 20 48 A Q S S- 0 0 92 1,-0.3 2,-0.3 505,-0.1 351,-0.2 0.819 118.4 -4.0-109.0 -73.1 7.1 -6.5 -38.6 21 49 A G - 0 0 0 347,-0.1 520,-1.6 348,-0.1 -1,-0.3 -0.837 53.0-167.1-127.4 165.4 7.1 -10.2 -37.8 22 50 A X E -GH 367 540B 0 345,-2.7 345,-2.2 -2,-0.3 2,-0.4 -0.994 8.5-167.5-155.6 145.5 9.6 -13.1 -37.7 23 51 A V E -GH 366 539B 0 516,-2.9 516,-2.5 -2,-0.3 2,-0.4 -0.997 3.6-170.5-133.5 136.1 9.8 -16.9 -37.5 24 52 A A E +GH 365 538B 0 341,-2.5 341,-2.3 -2,-0.4 2,-0.3 -0.994 24.9 145.1-126.9 121.8 12.9 -19.0 -36.8 25 53 A S E - H 0 537B 0 512,-2.1 512,-2.4 -2,-0.4 339,-0.2 -0.952 59.3-105.2-150.3 171.1 12.6 -22.8 -37.2 26 54 A V S S+ 0 0 12 -2,-0.3 2,-0.4 337,-0.3 512,-0.1 0.555 102.0 58.9 -75.6 -7.9 14.5 -26.0 -38.3 27 55 A D > - 0 0 6 510,-0.2 4,-2.6 1,-0.1 509,-0.2 -0.970 66.9-148.7-134.5 125.0 12.5 -26.2 -41.5 28 56 A A H > S+ 0 0 31 507,-2.0 4,-2.3 -2,-0.4 5,-0.2 0.905 101.3 49.1 -50.2 -51.6 12.2 -23.7 -44.4 29 57 A T H > S+ 0 0 45 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.917 112.6 46.4 -57.6 -48.3 8.6 -24.8 -45.3 30 58 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.892 110.8 53.2 -62.8 -41.0 7.4 -24.6 -41.7 31 59 A T H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.939 108.7 49.6 -59.0 -46.0 9.0 -21.2 -41.2 32 60 A Q H X S+ 0 0 101 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.830 106.9 55.5 -63.4 -32.8 7.2 -19.9 -44.3 33 61 A V H X S+ 0 0 14 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.910 108.9 48.0 -65.5 -42.3 3.9 -21.3 -43.0 34 62 A G H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.909 110.8 50.3 -65.0 -42.0 4.4 -19.2 -39.8 35 63 A V H X S+ 0 0 10 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.901 109.2 51.5 -64.0 -39.5 5.3 -16.1 -41.7 36 64 A D H X S+ 0 0 83 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.897 107.9 52.8 -63.5 -39.6 2.1 -16.5 -43.9 37 65 A I H <>S+ 0 0 1 -4,-1.9 5,-2.5 1,-0.2 -1,-0.2 0.898 110.2 47.6 -62.6 -40.6 0.0 -16.8 -40.8 38 66 A L H ><5S+ 0 0 1 -4,-2.0 3,-1.8 1,-0.2 -2,-0.2 0.915 109.9 52.1 -67.5 -41.9 1.5 -13.6 -39.4 39 67 A K H 3<5S+ 0 0 125 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.829 103.7 59.2 -63.3 -30.6 0.9 -11.8 -42.7 40 68 A E T 3<5S- 0 0 130 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.407 130.8 -93.7 -78.8 3.7 -2.7 -12.9 -42.6 41 69 A G T < 5S+ 0 0 45 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.2 0.482 77.3 143.3 100.5 3.1 -3.1 -11.1 -39.3 42 70 A G < - 0 0 1 -5,-2.5 -1,-0.3 -6,-0.2 2,-0.1 -0.415 44.4-125.8 -76.9 155.0 -2.4 -13.9 -36.8 43 71 A N > - 0 0 22 -2,-0.1 4,-2.5 325,-0.1 5,-0.2 -0.286 37.5 -86.1 -89.4-179.5 -0.6 -13.2 -33.6 44 72 A A H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.879 128.7 49.2 -54.8 -42.5 2.6 -15.0 -32.3 45 73 A V H > S+ 0 0 6 88,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.922 109.5 51.7 -65.3 -43.4 0.6 -17.8 -30.7 46 74 A D H > S+ 0 0 0 87,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.954 114.0 43.5 -57.2 -50.4 -1.5 -18.4 -33.9 47 75 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.887 110.3 56.1 -62.7 -40.8 1.7 -18.6 -36.0 48 76 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.908 109.1 46.2 -59.2 -43.3 3.4 -20.8 -33.4 49 77 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.904 111.7 51.4 -67.5 -39.3 0.6 -23.4 -33.5 50 78 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.899 111.9 47.3 -63.5 -39.5 0.6 -23.3 -37.3 51 79 A V H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.897 109.5 54.4 -67.2 -40.0 4.3 -23.9 -37.3 52 80 A G H X S+ 0 0 0 -4,-2.3 4,-1.0 -5,-0.2 12,-0.3 0.887 112.2 42.6 -61.8 -41.1 3.9 -26.7 -34.8 53 81 A Y H < S+ 0 0 0 -4,-2.3 4,-0.5 2,-0.2 -1,-0.2 0.903 113.3 53.0 -72.6 -39.0 1.4 -28.5 -37.0 54 82 A A H >X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 3,-1.8 0.936 107.5 50.5 -60.6 -47.2 3.4 -27.8 -40.1 55 83 A L H 3X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.3 8,-0.3 0.801 99.0 66.6 -61.4 -28.4 6.6 -29.4 -38.6 56 84 A A H 3< S+ 0 0 8 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.696 114.2 31.6 -66.0 -16.5 4.5 -32.4 -37.6 57 85 A V H <4 S+ 0 0 0 -3,-1.8 -2,-0.2 -4,-0.5 -1,-0.2 0.810 128.3 35.3-104.4 -48.1 4.2 -33.0 -41.4 58 86 A T H < S+ 0 0 4 -4,-2.7 -3,-0.2 1,-0.2 -2,-0.2 0.599 124.0 39.8 -85.7 -13.7 7.5 -31.7 -42.8 59 87 A H >X + 0 0 19 -4,-2.4 4,-2.4 -5,-0.3 3,-1.9 -0.432 59.8 162.0-134.6 60.8 9.8 -32.7 -39.9 60 88 A P T 34 + 0 0 4 0, 0.0 324,-0.2 0, 0.0 -1,-0.1 0.648 67.0 79.4 -55.2 -15.0 8.7 -36.1 -38.7 61 89 A Q T 34 S- 0 0 7 322,-0.1 323,-2.6 323,-0.1 324,-0.4 0.884 128.6 -21.8 -59.8 -40.6 12.1 -36.5 -37.0 62 90 A A T <4 S+ 0 0 2 -3,-1.9 300,-0.2 -7,-0.2 319,-0.1 0.512 112.9 96.7-142.7 -35.2 10.8 -34.3 -34.1 63 91 A G < + 0 0 2 -4,-2.4 2,-0.3 -8,-0.3 -10,-0.1 -0.413 64.8 156.5 -58.3 147.0 7.9 -32.2 -35.3 64 92 A N - 0 0 6 -12,-0.3 -8,-0.2 1,-0.1 -7,-0.1 -0.992 63.1-157.2-167.9 171.7 4.9 -34.2 -34.1 65 93 A L S S+ 0 0 4 331,-0.3 58,-0.5 -2,-0.3 -1,-0.1 0.356 103.0 57.7-127.5 -20.7 1.3 -34.9 -33.0 66 94 A G S S+ 0 0 0 330,-0.3 332,-1.8 56,-0.1 2,-0.1 0.139 105.8 48.6-101.7 20.5 2.3 -38.1 -31.2 67 95 A G S S- 0 0 0 330,-0.2 54,-2.3 53,-0.1 55,-1.5 -0.194 74.0-123.4-128.3-140.2 4.9 -36.5 -28.8 68 96 A G E +I 379 0B 0 311,-2.4 311,-3.4 53,-0.2 2,-0.3 -0.968 24.4 156.5-164.9 176.7 5.1 -33.6 -26.5 69 97 A G E -IJ 378 85B 0 16,-1.1 16,-2.0 309,-0.3 2,-0.3 -0.965 33.2 -82.9 179.8-164.4 6.9 -30.4 -25.5 70 98 A F E -IJ 377 84B 0 307,-3.3 307,-2.4 -2,-0.3 2,-0.4 -0.927 23.6-160.8-130.3 154.8 7.0 -27.0 -23.8 71 99 A X E -IJ 376 83B 0 12,-1.9 12,-3.0 -2,-0.3 2,-0.5 -1.000 3.9-160.4-139.0 135.4 6.0 -23.5 -24.8 72 100 A L E -IJ 375 82B 0 303,-3.0 303,-2.3 -2,-0.4 2,-0.4 -0.964 15.2-171.0-114.0 128.8 7.0 -20.1 -23.3 73 101 A I E -IJ 374 81B 5 8,-2.8 8,-2.6 -2,-0.5 2,-0.5 -0.982 10.4-178.4-125.3 128.9 4.6 -17.2 -24.1 74 102 A R E -IJ 373 80B 20 299,-2.4 299,-2.4 -2,-0.4 6,-0.2 -0.947 17.7-146.6-129.4 114.1 5.2 -13.6 -23.4 75 103 A S > - 0 0 24 4,-2.6 3,-2.3 -2,-0.5 361,-0.1 -0.311 28.9-111.1 -71.8 157.3 2.5 -11.1 -24.3 76 104 A K T 3 S+ 0 0 134 1,-0.3 -1,-0.1 2,-0.1 360,-0.1 0.730 119.7 62.2 -60.1 -20.8 3.4 -7.6 -25.5 77 105 A N T 3 S- 0 0 126 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.442 122.8-103.9 -85.9 -1.5 1.9 -6.5 -22.1 78 106 A G S < S+ 0 0 26 -3,-2.3 2,-0.2 1,-0.3 -2,-0.1 0.132 72.3 142.1 103.0 -21.8 4.5 -8.4 -20.1 79 107 A N - 0 0 74 -5,-0.1 -4,-2.6 1,-0.0 2,-0.5 -0.390 30.8-169.2 -58.5 119.3 2.5 -11.4 -19.0 80 108 A T E +J 74 0B 20 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.960 12.9 162.2-118.0 127.4 4.9 -14.4 -19.2 81 109 A T E -J 73 0B 11 -8,-2.6 -8,-2.8 -2,-0.5 2,-0.4 -0.945 27.2-134.3-142.3 161.7 3.6 -17.9 -18.9 82 110 A A E -JK 72 247B 0 165,-2.1 165,-2.8 -2,-0.3 2,-0.6 -0.945 7.1-151.7-122.1 139.7 4.6 -21.5 -19.6 83 111 A I E -JK 71 246B 0 -12,-3.0 -12,-1.9 -2,-0.4 2,-0.8 -0.946 9.0-158.2-111.2 121.1 2.6 -24.3 -21.1 84 112 A D E +JK 70 245B 0 161,-3.7 161,-3.2 -2,-0.6 -14,-0.2 -0.869 27.9 154.3 -99.8 106.6 3.5 -27.8 -20.1 85 113 A F E +J 69 0B 0 -16,-2.0 -16,-1.1 -2,-0.8 36,-0.4 -0.196 21.8 146.1-125.4 43.0 2.4 -30.4 -22.6 86 114 A R - 0 0 0 -18,-0.3 -18,-0.1 1,-0.1 33,-0.1 -0.467 58.5 -92.9 -74.4 147.0 5.0 -33.1 -21.8 87 115 A E - 0 0 0 -2,-0.1 2,-0.4 31,-0.1 -1,-0.1 -0.246 35.6-136.0 -63.4 153.0 3.8 -36.7 -22.2 88 116 A X B -M 119 0C 25 31,-1.1 31,-3.1 332,-0.2 332,-0.2 -0.925 21.8-112.0-111.6 135.8 2.3 -38.5 -19.2 89 117 A A - 0 0 1 330,-2.9 329,-1.7 -2,-0.4 29,-0.1 -0.355 46.9 -94.8 -63.2 144.4 3.2 -42.1 -18.4 90 118 A P > - 0 0 2 0, 0.0 3,-1.8 0, 0.0 328,-0.5 -0.157 30.0-112.0 -58.3 157.4 0.2 -44.4 -18.9 91 119 A A T 3 S+ 0 0 43 1,-0.3 143,-0.1 326,-0.2 -2,-0.1 0.850 119.0 53.0 -59.5 -35.3 -1.9 -45.3 -15.9 92 120 A K T 3 S+ 0 0 86 141,-0.2 -1,-0.3 324,-0.1 2,-0.1 0.318 82.1 126.8 -84.4 8.8 -0.7 -48.9 -16.1 93 121 A A < - 0 0 5 -3,-1.8 2,-0.3 323,-0.1 -4,-0.0 -0.428 42.3-162.5 -68.9 140.0 2.9 -47.8 -16.0 94 122 A T > - 0 0 80 322,-0.2 3,-2.0 -2,-0.1 4,-0.2 -0.944 29.3-115.9-128.5 150.5 5.1 -49.4 -13.3 95 123 A R T 3 S+ 0 0 118 -2,-0.3 320,-0.4 1,-0.3 3,-0.2 0.770 115.4 34.0 -48.8 -38.2 8.5 -48.6 -11.8 96 124 A D T > S+ 0 0 97 1,-0.2 3,-1.8 2,-0.1 -1,-0.3 0.076 77.8 120.2-110.1 23.4 10.2 -51.7 -13.1 97 125 A X T < S+ 0 0 26 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.668 78.6 48.4 -62.1 -15.8 8.4 -52.1 -16.4 98 126 A F T 3 S+ 0 0 8 -3,-0.2 8,-3.3 308,-0.2 2,-0.4 0.210 86.2 106.4-110.6 15.6 11.7 -51.8 -18.3 99 127 A L B < -N 105 0D 32 -3,-1.8 -3,-0.0 6,-0.2 308,-0.0 -0.814 57.7-145.0 -99.6 133.5 13.8 -54.3 -16.3 100 128 A D - 0 0 62 4,-2.4 -1,-0.1 -2,-0.4 6,-0.1 0.323 44.3 -77.6 -70.3-151.7 14.6 -57.7 -17.8 101 129 A D S S+ 0 0 158 1,-0.2 -1,-0.0 2,-0.1 -2,-0.0 0.816 130.8 54.0 -83.9 -33.1 14.9 -60.9 -15.8 102 130 A Q S S- 0 0 156 2,-0.2 -1,-0.2 1,-0.0 -3,-0.0 0.658 119.7-108.9 -74.6 -15.7 18.3 -60.1 -14.3 103 131 A G S S+ 0 0 20 1,-0.3 -2,-0.1 -7,-0.1 -5,-0.1 0.535 77.5 129.4 98.7 8.6 16.9 -56.8 -13.1 104 132 A N - 0 0 95 1,-0.1 -4,-2.4 -5,-0.0 -1,-0.3 -0.793 67.1 -96.3-100.2 140.1 18.9 -54.6 -15.6 105 133 A P B -N 99 0D 54 0, 0.0 2,-0.9 0, 0.0 -6,-0.2 -0.204 28.0-142.5 -53.2 135.1 17.1 -52.0 -17.8 106 134 A D >> - 0 0 52 -8,-3.3 3,-1.8 1,-0.2 4,-1.2 -0.795 13.1-170.5-105.1 89.6 16.2 -53.1 -21.3 107 135 A S H 3> S+ 0 0 77 -2,-0.9 4,-0.8 1,-0.3 5,-0.3 0.849 83.2 64.3 -45.0 -44.0 16.9 -50.1 -23.5 108 136 A K H 3>>S+ 0 0 102 1,-0.2 4,-2.3 2,-0.2 5,-0.9 0.849 103.3 47.7 -51.0 -38.9 15.2 -51.9 -26.4 109 137 A K H <45S+ 0 0 53 -3,-1.8 4,-0.3 1,-0.2 6,-0.3 0.861 112.9 45.8 -73.7 -36.8 11.9 -51.8 -24.6 110 138 A S H <5S+ 0 0 7 -4,-1.2 292,-0.5 -3,-0.3 -1,-0.2 0.386 125.7 30.9 -87.9 4.6 12.0 -48.2 -23.5 111 139 A L H <5S+ 0 0 45 -4,-0.8 -2,-0.2 -3,-0.5 -3,-0.2 0.664 130.7 18.5-128.6 -37.5 13.0 -47.0 -27.0 112 140 A T T <5S+ 0 0 53 -4,-2.3 -3,-0.2 -5,-0.3 2,-0.1 0.574 101.3 82.6-118.1 -12.5 11.7 -49.3 -29.8 113 141 A S S > S+ 0 0 19 116,-0.4 3,-0.7 1,-0.3 119,-0.5 0.603 116.9 69.8 -68.2 -9.5 5.2 -50.1 -27.9 115 143 A L G 3 S+ 0 0 29 -6,-0.3 -1,-0.3 1,-0.2 -5,-0.1 0.585 81.4 74.1 -82.9 -10.9 5.9 -49.7 -24.2 116 144 A A G < S+ 0 0 0 -3,-1.7 285,-2.5 -7,-0.2 286,-0.4 0.539 76.9 100.6 -80.3 -6.3 8.2 -46.8 -24.8 117 145 A S < - 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0 0 16 -4,-1.0 2,-0.3 -5,-0.5 43,-0.2 0.038 8.1-121.4 80.7 169.2 2.8 -33.8 -50.3 153 181 A F E -O 194 0E 26 41,-1.3 41,-2.9 -4,-0.1 2,-0.3 -0.951 30.1 -87.5-146.4 163.0 6.2 -31.9 -50.3 154 182 A I E -O 193 0E 100 -2,-0.3 2,-0.4 39,-0.2 39,-0.2 -0.590 39.9-121.6 -79.0 129.9 9.7 -32.5 -51.7 155 183 A V - 0 0 1 37,-3.1 36,-2.8 -2,-0.3 37,-0.1 -0.555 34.8-162.3 -71.0 124.6 12.1 -34.4 -49.5 156 184 A N > - 0 0 37 -2,-0.4 4,-2.2 34,-0.2 5,-0.2 -0.238 36.1 -84.5 -96.6-170.7 15.2 -32.2 -48.9 157 185 A D H > S+ 0 0 27 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.906 123.6 52.1 -63.4 -43.7 18.7 -33.0 -47.7 158 186 A A H > S+ 0 0 15 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.949 114.7 39.6 -58.9 -54.7 17.8 -32.9 -44.0 159 187 A L H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.925 116.5 51.8 -63.3 -44.1 14.8 -35.3 -44.2 160 188 A A H X S+ 0 0 9 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.955 113.1 43.7 -56.7 -53.7 16.6 -37.6 -46.7 161 189 A D H X S+ 0 0 68 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.877 115.2 48.9 -61.1 -40.2 19.7 -37.9 -44.5 162 190 A D H X>S+ 0 0 40 -4,-2.4 5,-2.3 -5,-0.3 4,-1.6 0.881 109.7 50.9 -69.1 -38.7 17.7 -38.4 -41.3 163 191 A L H <>S+ 0 0 0 -4,-2.7 5,-1.1 3,-0.2 -2,-0.2 0.932 115.1 44.5 -61.9 -44.1 15.5 -41.1 -42.9 164 192 A K H <5S+ 0 0 113 -4,-2.1 4,-0.2 -5,-0.2 -2,-0.2 0.913 123.6 33.4 -66.1 -47.1 18.6 -42.9 -44.0 165 193 A T H <5S+ 0 0 81 -4,-2.6 4,-0.3 -5,-0.2 -3,-0.2 0.987 138.0 11.7 -75.6 -64.5 20.6 -42.5 -40.8 166 194 A Y T ><5S+ 0 0 79 -4,-1.6 3,-0.8 -5,-0.2 4,-0.4 0.815 123.2 59.7 -87.1 -34.4 18.0 -42.7 -38.0 167 195 A G G >>< S+ 0 0 0 -4,-1.8 3,-1.5 1,-0.2 7,-0.5 0.911 99.1 51.1 -55.1 -50.6 10.7 -47.2 -39.5 172 200 A P G 3 S+ 0 0 28 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.626 98.1 71.1 -66.2 -8.1 11.1 -50.2 -41.8 173 201 A N G < S+ 0 0 109 -3,-1.2 2,-0.4 1,-0.1 -2,-0.2 0.255 93.7 59.9 -91.2 12.5 10.4 -52.5 -38.9 174 202 A H S <> S- 0 0 40 -3,-1.5 4,-3.2 1,-0.1 5,-0.3 -0.953 76.4-142.4-142.7 117.6 6.7 -51.5 -38.8 175 203 A E H > S+ 0 0 182 -2,-0.4 4,-2.1 1,-0.2 5,-0.1 0.859 100.9 44.4 -46.9 -49.9 4.5 -52.1 -41.8 176 204 A N H > S+ 0 0 31 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.879 116.2 47.0 -68.7 -34.7 2.4 -48.9 -41.5 177 205 A S H >> S+ 0 0 0 -3,-0.3 4,-2.3 1,-0.2 3,-0.9 0.920 113.0 49.7 -69.5 -43.5 5.5 -46.8 -40.9 178 206 A K H 3X S+ 0 0 95 -4,-3.2 4,-2.1 -7,-0.5 -2,-0.2 0.876 102.6 60.9 -62.6 -39.2 7.4 -48.4 -43.8 179 207 A A H 3< S+ 0 0 84 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.738 113.8 37.3 -60.7 -23.4 4.4 -47.8 -46.2 180 208 A I H << S+ 0 0 28 -3,-0.9 -2,-0.2 -4,-0.6 15,-0.2 0.886 127.1 27.2 -95.1 -49.3 4.8 -44.1 -45.6 181 209 A F H < S+ 0 0 0 -4,-2.3 7,-1.9 -10,-0.1 2,-0.3 0.589 108.5 71.3 -95.3 -12.6 8.5 -43.3 -45.3 182 210 A W E < -P 187 0F 31 -4,-2.1 2,-0.3 -5,-0.3 -19,-0.0 -0.759 55.7-174.2-105.6 153.4 10.1 -46.1 -47.4 183 211 A K E > -P 186 0F 92 3,-3.5 3,-2.2 -2,-0.3 -4,-0.0 -0.974 67.4 -8.6-149.0 130.7 10.0 -46.5 -51.2 184 212 A E T 3 S- 0 0 172 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 0.888 129.3 -54.2 50.4 43.2 11.2 -49.3 -53.5 185 213 A G T 3 S+ 0 0 50 1,-0.2 -1,-0.3 -13,-0.0 -3,-0.0 0.479 125.2 84.8 73.8 3.0 12.9 -50.9 -50.5 186 214 A E E < S-P 183 0F 103 -3,-2.2 -3,-3.5 1,-0.0 -1,-0.2 -0.914 87.8 -91.6-133.0 158.8 14.9 -47.8 -49.5 187 215 A P E -P 182 0F 5 0, 0.0 -5,-0.2 0, 0.0 -23,-0.1 -0.341 61.6 -83.5 -65.4 155.1 14.2 -44.7 -47.4 188 216 A L - 0 0 9 -7,-1.9 2,-0.2 1,-0.1 -24,-0.2 -0.293 52.0-142.4 -56.6 144.0 12.8 -41.8 -49.5 189 217 A K > - 0 0 73 1,-0.1 3,-2.4 -3,-0.1 -34,-0.3 -0.690 30.0 -75.0-109.2 163.3 15.6 -39.8 -51.1 190 218 A K T 3 S+ 0 0 108 1,-0.3 -34,-0.2 -2,-0.2 -1,-0.1 -0.260 121.8 29.9 -53.5 138.3 16.1 -36.1 -51.8 191 219 A G T 3 S+ 0 0 46 -36,-2.8 -1,-0.3 1,-0.4 -35,-0.1 0.057 92.9 117.8 97.4 -27.5 13.8 -35.0 -54.6 192 220 A D < - 0 0 40 -3,-2.4 -37,-3.1 -37,-0.1 2,-0.5 -0.285 66.8-118.8 -68.8 160.3 11.2 -37.7 -53.8 193 221 A T E -O 154 0E 75 -39,-0.2 2,-0.7 -3,-0.1 -39,-0.2 -0.886 18.7-151.8-105.9 131.9 7.7 -36.5 -52.9 194 222 A L E +O 153 0E 2 -41,-2.9 -41,-1.3 -2,-0.5 2,-0.4 -0.907 15.5 179.7-107.4 112.1 6.3 -37.4 -49.5 195 223 A V - 0 0 71 -2,-0.7 2,-0.4 -43,-0.2 -45,-0.2 -0.927 9.1-169.2-109.1 133.8 2.5 -37.7 -49.3 196 224 A Q > + 0 0 5 -47,-2.6 4,-2.3 -2,-0.4 5,-0.2 -0.683 13.1 168.8-126.0 77.5 1.0 -38.6 -46.0 197 225 A A H > S+ 0 0 65 -2,-0.4 4,-1.8 1,-0.2 -1,-0.1 0.851 77.5 49.7 -57.5 -42.0 -2.7 -39.3 -46.7 198 226 A N H > S+ 0 0 50 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.904 111.7 48.1 -67.4 -40.6 -3.4 -40.8 -43.3 199 227 A L H > S+ 0 0 4 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.893 108.5 55.6 -65.8 -38.0 -1.8 -37.9 -41.4 200 228 A A H X S+ 0 0 5 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.902 106.6 51.1 -60.1 -40.2 -3.9 -35.6 -43.6 201 229 A K H X S+ 0 0 107 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.922 110.4 48.1 -63.0 -44.7 -7.0 -37.4 -42.5 202 230 A S H X S+ 0 0 4 -4,-2.0 4,-2.1 191,-0.4 -2,-0.2 0.937 113.3 47.9 -61.0 -46.4 -6.0 -37.0 -38.8 203 231 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.896 110.2 51.9 -61.5 -42.1 -5.3 -33.3 -39.4 204 232 A E H X S+ 0 0 87 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.889 111.2 47.5 -62.5 -40.1 -8.6 -32.8 -41.2 205 233 A X H X S+ 0 0 35 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.837 111.9 49.4 -71.1 -34.6 -10.5 -34.4 -38.4 206 234 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.926 110.9 49.8 -69.6 -43.9 -8.7 -32.3 -35.7 207 235 A A H < S+ 0 0 20 -4,-2.6 -68,-0.4 1,-0.2 -2,-0.2 0.863 118.4 41.3 -61.7 -34.3 -9.4 -29.1 -37.7 208 236 A E H < S+ 0 0 136 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.898 129.8 22.3 -81.7 -43.8 -13.0 -30.1 -37.9 209 237 A N H < S- 0 0 78 -4,-3.0 3,-0.5 1,-0.3 -3,-0.2 0.375 101.2-127.3-108.9 3.6 -13.7 -31.5 -34.4 210 238 A G >< - 0 0 16 -4,-2.3 3,-1.7 -5,-0.2 4,-0.4 -0.177 55.2 -38.4 80.1-176.3 -11.1 -29.9 -32.3 211 239 A P T >> S+ 0 0 34 0, 0.0 4,-1.9 0, 0.0 3,-1.0 0.704 123.8 75.6 -58.0 -23.9 -8.6 -31.6 -29.9 212 240 A D H 3>>S+ 0 0 83 -3,-0.5 4,-4.0 1,-0.3 5,-2.0 0.814 83.4 68.5 -59.9 -28.2 -11.1 -34.1 -28.7 213 241 A E H <45S+ 0 0 14 -3,-1.7 7,-1.2 3,-0.2 6,-0.7 0.913 107.3 38.2 -55.6 -41.4 -10.7 -35.9 -32.0 214 242 A F H <45S+ 0 0 0 -3,-1.0 -2,-0.2 -4,-0.4 -1,-0.2 0.888 127.4 33.6 -77.1 -41.2 -7.1 -36.8 -30.8 215 243 A Y H <5S+ 0 0 16 -4,-1.9 -2,-0.2 1,-0.1 -3,-0.2 0.690 139.6 9.6 -91.8 -19.7 -8.0 -37.5 -27.2 216 244 A K T <5S+ 0 0 128 -4,-4.0 -3,-0.2 -5,-0.2 -2,-0.1 0.472 116.6 62.5-135.3 -12.3 -11.5 -38.9 -27.4 217 245 A G S > S+ 0 0 54 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.904 131.8 49.6 -51.7 -52.0 -11.0 -41.6 -34.1 219 247 A I H > S+ 0 0 1 -6,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.915 109.6 53.1 -57.5 -42.5 -7.4 -40.9 -33.5 220 248 A A H > S+ 0 0 0 -7,-1.2 4,-2.4 1,-0.2 -1,-0.2 0.918 109.5 48.7 -57.3 -44.6 -7.7 -41.8 -29.9 221 249 A E H X S+ 0 0 78 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.906 110.1 52.1 -61.6 -43.1 -9.3 -45.1 -31.0 222 250 A Q H X S+ 0 0 39 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.843 110.6 46.8 -64.0 -36.1 -6.4 -45.7 -33.5 223 251 A I H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.919 113.2 49.1 -72.1 -43.3 -3.8 -45.1 -30.8 224 252 A A H X S+ 0 0 14 -4,-2.4 4,-3.5 -5,-0.2 5,-0.2 0.904 111.8 47.8 -62.1 -45.1 -5.5 -47.4 -28.3 225 253 A Q H X S+ 0 0 98 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.939 109.4 53.3 -62.5 -47.1 -5.9 -50.2 -30.9 226 254 A E H < S+ 0 0 23 -4,-1.7 4,-0.4 -5,-0.2 -1,-0.2 0.906 116.4 40.6 -53.4 -43.2 -2.3 -49.9 -31.9 227 255 A X H ><>S+ 0 0 1 -4,-2.0 5,-3.5 7,-0.2 3,-1.3 0.951 113.6 51.0 -70.8 -52.1 -1.3 -50.3 -28.3 228 256 A Q H 3<5S+ 0 0 145 -4,-3.5 3,-0.5 1,-0.3 -2,-0.2 0.833 113.4 46.4 -56.1 -35.8 -3.9 -53.0 -27.3 229 257 A K T 3<5S+ 0 0 131 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.532 119.1 39.2 -87.3 -6.4 -2.8 -55.2 -30.3 230 258 A N T < 5S- 0 0 86 -3,-1.3 -116,-0.4 -4,-0.4 -1,-0.2 0.089 118.9 -92.1-131.7 25.5 1.0 -54.8 -29.7 231 259 A G T 5S+ 0 0 52 -3,-0.5 -3,-0.2 -4,-0.3 2,-0.1 0.781 75.7 147.6 71.7 27.7 1.4 -54.9 -26.0 232 260 A G < - 0 0 15 -5,-3.5 -1,-0.2 -6,-0.2 -117,-0.2 -0.429 43.4-146.0 -89.2 170.0 1.2 -51.2 -25.4 233 261 A L + 0 0 43 -119,-0.5 2,-0.3 -116,-0.2 -141,-0.2 0.696 61.0 108.7-108.9 -26.8 -0.2 -49.4 -22.4 234 262 A I + 0 0 3 -117,-0.1 -6,-0.2 -144,-0.1 -7,-0.2 -0.372 48.3 179.9 -58.9 117.2 -1.8 -46.3 -23.6 235 263 A T > - 0 0 46 -2,-0.3 4,-2.0 -8,-0.1 5,-0.2 -0.575 45.1 -98.9-111.5 176.1 -5.6 -46.7 -23.3 236 264 A K H > S+ 0 0 92 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.765 123.9 55.8 -67.6 -24.5 -8.5 -44.5 -24.2 237 265 A E H > S+ 0 0 159 2,-0.2 4,-1.9 3,-0.2 -1,-0.2 0.893 104.9 51.6 -73.1 -40.3 -8.7 -43.5 -20.5 238 266 A D H > S+ 0 0 7 1,-0.2 4,-0.8 2,-0.2 -2,-0.2 0.955 114.2 44.0 -58.3 -50.1 -5.1 -42.4 -20.5 239 267 A L H >< S+ 0 0 0 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.871 114.0 49.2 -63.0 -40.4 -5.8 -40.2 -23.6 240 268 A A H 3< S+ 0 0 55 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.765 112.5 50.1 -71.8 -23.9 -9.1 -39.0 -22.1 241 269 A A H 3< S+ 0 0 57 -4,-1.9 -1,-0.2 -3,-0.2 -2,-0.2 0.560 84.2 114.7 -91.1 -9.3 -7.3 -38.1 -18.9 242 270 A Y << - 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0 0 0 165,-0.5 7,-0.5 -2,-0.3 8,-0.4 -0.417 45.8-147.4 -70.0 134.9 10.6 -23.5 -18.4 263 291 A P > - 0 0 6 0, 0.0 3,-2.2 0, 0.0 6,-0.1 -0.365 46.8 -29.5 -91.5 174.0 9.9 -24.7 -14.9 264 292 A P T 3 S+ 0 0 11 0, 0.0 51,-0.1 0, 0.0 3,-0.1 -0.290 119.8 55.3 -55.2 150.4 9.8 -28.3 -13.7 265 293 A P T 3 S+ 0 0 0 0, 0.0 158,-2.2 0, 0.0 2,-0.3 -0.974 113.1 69.3 -60.7 1.0 9.1 -30.9 -15.3 266 294 A S B < -q 423 0G 0 -3,-2.2 4,-0.3 156,-0.2 158,-0.2 -0.701 63.2-168.4 -87.4 144.9 11.8 -29.2 -17.2 267 295 A S S > S+ 0 0 0 156,-3.5 4,-1.7 -2,-0.3 5,-0.2 0.735 75.8 72.9 -99.1 -30.5 15.3 -29.2 -15.6 268 296 A G H > S+ 0 0 0 155,-0.7 4,-2.4 1,-0.2 5,-0.3 0.890 89.1 55.6 -50.4 -54.7 16.8 -26.6 -17.9 269 297 A G H > S+ 0 0 0 -7,-0.5 4,-2.0 156,-0.4 -1,-0.2 0.916 109.1 46.0 -47.2 -56.1 15.1 -23.5 -16.8 270 298 A I H > S+ 0 0 0 -8,-0.4 4,-2.5 -4,-0.3 -1,-0.2 0.899 116.3 45.0 -56.7 -45.2 16.1 -23.8 -13.1 271 299 A H H X S+ 0 0 2 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.756 107.4 56.6 -76.6 -22.4 19.7 -24.6 -14.0 272 300 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.931 113.1 43.0 -70.2 -42.9 20.1 -21.9 -16.6 273 301 A V H X S+ 0 0 2 -4,-2.0 4,-2.7 -5,-0.3 -2,-0.2 0.924 114.6 50.7 -66.0 -44.6 19.1 -19.4 -13.9 274 302 A Q H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.944 112.1 45.6 -58.5 -50.9 21.3 -21.1 -11.4 275 303 A I H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.911 112.1 51.5 -61.9 -42.1 24.4 -21.0 -13.6 276 304 A L H X S+ 0 0 3 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.932 107.1 54.5 -59.9 -43.0 23.7 -17.4 -14.6 277 305 A N H < S+ 0 0 5 -4,-2.7 4,-0.4 1,-0.2 -1,-0.2 0.887 111.5 45.3 -56.5 -39.9 23.5 -16.6 -10.9 278 306 A I H >< S+ 0 0 0 -4,-1.9 3,-1.6 1,-0.2 -2,-0.2 0.958 112.6 49.3 -68.0 -51.2 26.9 -18.2 -10.4 279 307 A L H >< S+ 0 0 0 -4,-3.0 3,-2.2 1,-0.3 5,-0.4 0.737 94.5 74.8 -60.8 -25.6 28.5 -16.5 -13.5 280 308 A E T 3< S+ 0 0 51 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.776 86.2 64.5 -60.2 -25.3 27.1 -13.1 -12.4 281 309 A N T < S+ 0 0 66 -3,-1.6 2,-0.3 -4,-0.4 -1,-0.3 0.523 98.7 67.6 -76.0 -4.7 29.9 -13.0 -9.7 282 310 A F S < S- 0 0 38 -3,-2.2 2,-1.4 -4,-0.1 3,-0.2 -0.841 85.9-123.0-117.1 154.2 32.5 -12.9 -12.5 283 311 A D >> + 0 0 65 -2,-0.3 3,-1.1 1,-0.2 4,-1.0 -0.584 39.2 170.0 -93.1 71.2 33.3 -10.2 -15.0 284 312 A X H 3> S+ 0 0 0 -2,-1.4 4,-2.6 -5,-0.4 3,-0.5 0.856 71.2 62.5 -50.0 -43.7 32.8 -12.5 -18.0 285 313 A K H 34 S+ 0 0 93 1,-0.2 -1,-0.3 -3,-0.2 4,-0.1 0.880 100.2 56.4 -50.3 -42.6 33.0 -9.6 -20.4 286 314 A K H <4 S+ 0 0 132 -3,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.877 109.6 42.5 -59.1 -44.4 36.6 -9.1 -19.2 287 315 A Y H < S- 0 0 54 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.926 102.1-155.6 -72.1 -45.0 37.7 -12.6 -20.1 288 316 A G >< - 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0 0 18 -4,-1.4 -90,-0.1 -5,-0.8 -4,-0.0 -0.189 58.0-150.8 -90.0-172.7 31.1 -22.5 -74.4 676 163 C T + 0 0 99 -92,-0.1 -1,-0.1 2,-0.1 -4,-0.0 0.484 68.2 79.4-132.4 -18.2 28.4 -24.2 -76.4 677 164 C X S S- 0 0 34 1,-0.1 2,-0.1 -93,-0.1 -2,-0.1 -0.632 80.2-109.6 -98.1 153.4 25.5 -21.7 -76.4 678 165 C P >> - 0 0 72 0, 0.0 4,-1.1 0, 0.0 3,-1.1 -0.456 33.9-111.2 -75.5 154.0 25.1 -18.6 -78.6 679 166 C L H 3> S+ 0 0 19 1,-0.2 4,-1.5 2,-0.2 3,-0.3 0.858 113.7 61.7 -53.5 -40.5 25.4 -15.2 -76.8 680 167 C N H 3> S+ 0 0 70 68,-0.4 4,-1.2 1,-0.2 -1,-0.2 0.843 103.0 51.9 -58.8 -32.0 21.8 -14.3 -77.2 681 168 C K H <4 S+ 0 0 115 -3,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.853 111.3 43.9 -73.5 -35.8 20.8 -17.4 -75.1 682 169 C V H < S+ 0 0 0 -4,-1.1 4,-0.3 -3,-0.3 -1,-0.2 0.665 115.3 49.8 -84.0 -14.0 23.1 -16.6 -72.1 683 170 C V H X S+ 0 0 0 -4,-1.5 4,-2.5 1,-0.1 3,-0.4 0.703 90.0 82.6 -92.2 -24.1 22.2 -12.9 -72.2 684 171 C Q H X S+ 0 0 73 -4,-1.2 4,-2.5 1,-0.2 5,-0.2 0.854 86.6 52.8 -50.7 -45.9 18.4 -13.5 -72.2 685 172 C P H > S+ 0 0 29 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.919 113.7 43.8 -59.5 -42.1 18.0 -14.1 -68.4 686 173 C A H > S+ 0 0 0 -3,-0.4 4,-2.2 -4,-0.3 5,-0.2 0.866 110.1 57.3 -68.7 -37.9 19.8 -10.8 -67.7 687 174 C F H X S+ 0 0 22 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.950 108.8 44.8 -57.7 -50.2 17.8 -9.1 -70.4 688 175 C K H X S+ 0 0 97 -4,-2.5 4,-3.0 1,-0.2 5,-0.4 0.871 110.8 53.9 -63.5 -37.4 14.5 -10.0 -68.8 689 176 C L H X S+ 0 0 30 -4,-1.8 4,-1.0 -5,-0.2 -1,-0.2 0.873 114.4 41.8 -65.1 -36.4 15.7 -9.0 -65.3 690 177 C A H < S+ 0 0 0 -4,-2.2 47,-2.5 2,-0.2 -2,-0.2 0.914 119.6 43.6 -76.1 -43.8 16.6 -5.6 -66.7 691 178 C R H < S+ 0 0 115 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.967 126.3 29.6 -66.4 -53.5 13.5 -5.2 -68.8 692 179 C D H < S- 0 0 95 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.638 105.5-138.1 -83.8 -14.8 11.0 -6.5 -66.2 693 180 C G < - 0 0 16 -4,-1.0 2,-0.3 -5,-0.4 43,-0.2 0.038 9.9-123.7 79.4 167.3 12.9 -5.4 -63.1 694 181 C F E -K 735 0P 23 41,-1.4 41,-3.1 -4,-0.1 2,-0.4 -0.951 28.7 -86.3-146.3 163.8 13.5 -7.2 -59.8 695 182 C I E -K 734 0P 116 -2,-0.3 2,-0.2 39,-0.2 39,-0.2 -0.601 40.7-121.2 -80.1 128.8 12.9 -6.6 -56.1 696 183 C V - 0 0 1 37,-2.9 36,-2.4 -2,-0.4 2,-0.1 -0.496 33.8-160.0 -67.2 128.3 15.6 -4.8 -54.2 697 184 C N > - 0 0 35 -2,-0.2 4,-2.4 34,-0.2 5,-0.2 -0.312 35.2 -86.3-100.0-173.9 16.9 -6.9 -51.4 698 185 C D H > S+ 0 0 34 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.904 123.9 51.8 -60.8 -44.2 18.8 -6.0 -48.2 699 186 C A H > S+ 0 0 17 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.940 115.4 38.7 -60.0 -51.7 22.3 -6.1 -49.9 700 187 C L H > S+ 0 0 3 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.923 116.6 51.0 -67.5 -44.3 21.4 -3.8 -52.8 701 188 C A H X S+ 0 0 11 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.945 113.9 44.8 -58.4 -48.4 19.3 -1.4 -50.6 702 189 C D H X S+ 0 0 80 -4,-2.6 4,-2.7 -5,-0.2 5,-0.3 0.902 114.9 47.6 -63.6 -42.9 22.1 -1.1 -48.1 703 190 C D H X>S+ 0 0 42 -4,-2.3 4,-2.3 -5,-0.2 5,-2.2 0.896 110.5 52.8 -65.8 -39.9 24.8 -0.6 -50.7 704 191 C L H <>S+ 0 0 0 -4,-3.0 5,-1.1 3,-0.2 -2,-0.2 0.930 115.0 40.9 -60.3 -45.8 22.7 1.9 -52.6 705 192 C K H <5S+ 0 0 135 -4,-2.2 4,-0.3 -5,-0.2 -2,-0.2 0.913 124.3 36.8 -69.5 -44.2 22.2 4.0 -49.4 706 193 C T H <5S+ 0 0 79 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.959 136.9 11.3 -76.2 -56.0 25.8 3.6 -48.1 707 194 C Y T ><5S+ 0 0 94 -4,-2.3 3,-1.0 -5,-0.3 4,-0.4 0.813 124.3 58.1 -94.8 -34.7 28.0 3.7 -51.2 708 195 C G G >>< S+ 0 0 0 -4,-1.9 3,-1.4 1,-0.3 7,-0.5 0.891 99.9 48.5 -53.4 -49.6 24.8 8.0 -58.1 713 200 C P G 3 S+ 0 0 23 0, 0.0 -1,-0.3 0, 0.0 -4,-0.1 0.679 97.5 73.7 -68.6 -12.2 22.6 11.0 -57.4 714 201 C N G < S+ 0 0 111 -3,-1.1 2,-0.4 1,-0.1 -2,-0.2 0.404 93.7 59.4 -80.1 3.6 25.4 13.3 -58.7 715 202 C H S <> S- 0 0 42 -3,-1.4 4,-3.3 1,-0.1 5,-0.3 -0.992 76.3-140.1-137.0 126.9 24.6 12.2 -62.3 716 203 C E H > S+ 0 0 146 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.905 103.1 43.4 -50.0 -54.0 21.2 12.7 -64.1 717 204 C N H > S+ 0 0 19 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.900 116.5 47.2 -63.5 -40.1 21.2 9.3 -65.8 718 205 C S H >> S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 3,-0.8 0.946 112.7 49.4 -66.2 -46.3 22.4 7.4 -62.8 719 206 C K H 3X S+ 0 0 95 -4,-3.3 4,-2.4 -7,-0.5 -2,-0.2 0.905 104.5 58.6 -58.3 -43.8 19.9 9.1 -60.5 720 207 C A H 3< S+ 0 0 70 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.778 115.9 36.3 -57.5 -28.3 17.0 8.4 -62.9 721 208 C I H << S+ 0 0 28 -4,-0.9 -2,-0.2 -3,-0.8 15,-0.2 0.907 129.2 25.7 -91.8 -50.4 17.8 4.7 -62.5 722 209 C F H < S+ 0 0 1 -4,-2.7 7,-1.9 -5,-0.1 2,-0.3 0.651 110.1 67.8 -94.1 -17.7 18.8 4.2 -58.9 723 210 C W E < -L 728 0Q 25 -4,-2.4 2,-0.3 -5,-0.4 -19,-0.0 -0.752 56.9-168.7-103.5 152.9 17.2 7.0 -57.0 724 211 C K E > S-L 727 0Q 107 3,-4.0 3,-0.6 -2,-0.3 -4,-0.1 -0.874 71.4 -16.6-145.7 107.6 13.4 7.4 -56.5 725 212 C E T 3 S- 0 0 184 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 0.921 128.6 -48.6 65.0 47.5 11.9 10.6 -55.1 726 213 C G T 3 S+ 0 0 58 1,-0.2 -1,-0.2 -7,-0.1 -3,-0.0 0.482 126.5 89.5 74.4 2.1 15.2 12.0 -53.8 727 214 C E E < S-L 724 0Q 109 -3,-0.6 -3,-4.0 3,-0.0 -1,-0.2 -0.946 82.6-103.4-132.0 151.6 16.0 8.7 -52.1 728 215 C P E -L 723 0Q 5 0, 0.0 -5,-0.2 0, 0.0 -23,-0.1 -0.379 53.6 -89.1 -68.6 150.6 17.8 5.5 -53.1 729 216 C L - 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