==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 16-DEC-05 2DBW . COMPND 2 MOLECULE: GAMMA-GLUTAMYLTRANSPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K12; . AUTHOR T.OKADA,K.WADA,K.FUKUYAMA . 1097 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36304.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 725 66.1 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 . 166 15.1 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 . 10 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 0.9 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 . 51 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 122 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 300 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 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 3 1 0 8 4 2 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 7 3 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 65 0, 0.0 469,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 148.2 26.9 -6.1 -19.1 2 30 A P - 0 0 26 0, 0.0 470,-0.1 0, 0.0 469,-0.0 -0.211 360.0 -68.8 -80.6 174.6 28.2 -4.3 -22.2 3 31 A P - 0 0 117 0, 0.0 2,-0.2 0, 0.0 0, 0.0 -0.297 53.7-118.7 -64.7 150.8 26.0 -2.7 -24.9 4 32 A V - 0 0 28 -3,-0.1 2,-0.4 467,-0.0 470,-0.1 -0.485 17.9-145.2 -87.7 159.9 24.0 -5.0 -27.1 5 33 A S - 0 0 28 463,-0.3 470,-0.2 468,-0.3 3,-0.1 -0.984 16.5-174.9-130.7 122.4 24.3 -5.4 -30.9 6 34 A Y - 0 0 48 -2,-0.4 470,-0.1 1,-0.2 469,-0.1 0.479 66.1 -84.2 -90.0 -3.9 21.4 -6.1 -33.2 7 35 A G - 0 0 29 467,-0.1 2,-0.3 7,-0.1 -1,-0.2 0.146 43.0-148.6 109.4 136.0 23.9 -6.4 -36.1 8 36 A V > - 0 0 68 -3,-0.1 3,-1.5 -2,-0.0 466,-0.0 -0.816 35.6 -97.0-129.5 170.3 25.6 -4.0 -38.5 9 37 A E T 3 S+ 0 0 128 -2,-0.3 1058,-0.1 1,-0.3 5,-0.0 0.778 117.1 60.3 -57.7 -31.6 26.9 -4.1 -42.1 10 38 A E T 3 S+ 0 0 82 1056,-0.1 1057,-2.5 3,-0.0 -1,-0.3 0.619 82.8 107.8 -75.4 -13.3 30.5 -5.0 -41.0 11 39 A D < - 0 0 2 -3,-1.5 3,-0.1 1055,-0.1 1055,-0.0 -0.168 67.1-139.2 -64.7 158.8 29.5 -8.2 -39.3 12 40 A V S S+ 0 0 12 1,-0.2 2,-0.5 1078,-0.0 -1,-0.1 0.859 92.7 45.9 -83.6 -40.3 30.3 -11.6 -40.7 13 41 A F S S- 0 0 32 1076,-0.1 464,-0.4 461,-0.0 -1,-0.2 -0.919 75.7-160.9-110.1 126.7 27.0 -13.1 -39.8 14 42 A H - 0 0 47 -2,-0.5 -7,-0.1 1074,-0.4 -5,-0.0 -0.897 12.0-132.7-112.6 130.3 23.8 -11.2 -40.6 15 43 A P - 0 0 18 0, 0.0 2,-0.3 0, 0.0 522,-0.2 -0.365 28.8-107.0 -75.2 158.5 20.4 -11.7 -39.0 16 44 A V E -A 536 0A 60 520,-2.8 520,-2.6 -2,-0.0 2,-0.4 -0.676 41.8-145.3 -79.2 138.0 17.3 -11.9 -41.2 17 45 A R E +A 535 0A 94 -2,-0.3 2,-0.3 518,-0.2 532,-0.2 -0.864 25.6 164.6-114.3 147.7 15.3 -8.6 -40.7 18 46 A A E -A 534 0A 3 516,-1.8 516,-3.0 -2,-0.4 4,-0.1 -0.983 27.1-153.9-154.2 147.8 11.6 -7.9 -40.6 19 47 A K S S+ 0 0 106 -2,-0.3 3,-0.1 514,-0.2 -1,-0.1 0.710 89.4 23.4 -98.2 -22.6 9.4 -5.0 -39.4 20 48 A Q S S- 0 0 95 1,-0.4 2,-0.3 514,-0.1 351,-0.2 0.820 119.0 -6.3-107.5 -74.9 6.2 -6.9 -38.6 21 49 A G - 0 0 0 348,-0.1 529,-1.7 347,-0.1 -1,-0.4 -0.841 53.1-169.5-127.2 164.4 6.3 -10.6 -37.8 22 50 A X E -GH 367 549B 0 345,-2.5 345,-2.2 -2,-0.3 2,-0.4 -0.995 7.8-167.8-155.0 146.9 8.9 -13.4 -37.8 23 51 A V E -GH 366 548B 0 525,-2.6 525,-2.3 -2,-0.3 2,-0.5 -1.000 4.3-168.3-136.4 134.3 9.1 -17.1 -37.5 24 52 A A E +GH 365 547B 0 341,-2.6 341,-2.3 -2,-0.4 2,-0.3 -0.990 24.6 146.3-125.0 121.1 12.3 -19.2 -37.0 25 53 A S E - H 0 546B 0 521,-2.2 521,-2.2 -2,-0.5 339,-0.1 -0.933 58.5-106.4-147.8 172.0 12.1 -23.0 -37.4 26 54 A V S S+ 0 0 13 -2,-0.3 2,-0.4 519,-0.2 521,-0.1 0.556 101.8 59.0 -77.0 -8.2 14.1 -26.0 -38.5 27 55 A D > - 0 0 8 519,-0.2 4,-2.6 518,-0.1 518,-0.2 -0.972 67.5-148.4-132.8 125.3 12.0 -26.3 -41.7 28 56 A A H > S+ 0 0 31 516,-2.0 4,-2.3 -2,-0.4 5,-0.2 0.900 101.4 49.3 -52.9 -47.7 11.5 -23.9 -44.5 29 57 A T H > S+ 0 0 45 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.937 112.5 46.8 -59.7 -47.9 8.0 -25.1 -45.3 30 58 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.887 111.2 52.6 -61.9 -40.5 6.9 -24.9 -41.7 31 59 A T H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.913 109.4 48.9 -61.8 -42.5 8.4 -21.4 -41.3 32 60 A Q H X S+ 0 0 100 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.844 107.7 55.3 -67.7 -32.7 6.5 -20.2 -44.3 33 61 A V H X S+ 0 0 15 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.938 109.7 47.1 -63.6 -45.3 3.3 -21.7 -42.9 34 62 A G H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.922 111.4 49.8 -62.0 -45.6 3.8 -19.7 -39.8 35 63 A V H X S+ 0 0 9 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.894 109.3 52.5 -61.4 -39.7 4.6 -16.5 -41.7 36 64 A D H X S+ 0 0 81 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.879 106.9 52.5 -64.4 -37.4 1.4 -17.0 -43.8 37 65 A I H <>S+ 0 0 2 -4,-1.9 5,-2.6 2,-0.2 -1,-0.2 0.909 110.1 48.2 -64.3 -41.8 -0.7 -17.3 -40.6 38 66 A L H ><5S+ 0 0 2 -4,-2.0 3,-1.9 1,-0.2 -2,-0.2 0.933 109.8 52.1 -63.6 -44.7 0.7 -14.1 -39.3 39 67 A K H 3<5S+ 0 0 124 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.804 105.2 56.9 -61.2 -28.5 0.0 -12.4 -42.6 40 68 A E T 3<5S- 0 0 119 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.466 129.8 -94.9 -82.2 -1.7 -3.6 -13.6 -42.4 41 69 A G T < 5S+ 0 0 41 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.1 0.438 77.2 140.7 105.2 0.1 -4.0 -11.9 -39.0 42 70 A G < - 0 0 1 -5,-2.6 -1,-0.3 -6,-0.2 2,-0.1 -0.405 46.6-125.9 -74.0 153.9 -3.2 -14.7 -36.6 43 71 A N > - 0 0 23 325,-0.1 4,-2.5 -2,-0.1 5,-0.3 -0.238 37.9 -82.5 -88.9-175.0 -1.2 -13.8 -33.5 44 72 A A H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.880 130.6 48.8 -56.1 -41.4 2.0 -15.5 -32.3 45 73 A V H > S+ 0 0 6 88,-0.3 4,-2.4 2,-0.2 5,-0.2 0.915 109.9 51.3 -67.3 -41.5 0.1 -18.3 -30.6 46 74 A D H > S+ 0 0 0 87,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.958 115.0 42.9 -57.8 -50.8 -2.0 -19.0 -33.7 47 75 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.897 111.5 55.2 -62.4 -42.0 1.2 -19.1 -35.9 48 76 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 -5,-0.3 -1,-0.2 0.893 110.1 45.5 -59.4 -42.1 3.0 -21.2 -33.3 49 77 A V H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.905 112.4 51.1 -68.9 -40.2 0.3 -23.8 -33.3 50 78 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.907 111.1 48.3 -62.6 -41.5 0.1 -23.8 -37.1 51 79 A V H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.894 109.4 54.0 -65.6 -39.0 3.9 -24.3 -37.3 52 80 A G H X S+ 0 0 0 -4,-2.0 4,-1.0 -5,-0.2 12,-0.3 0.893 111.3 43.8 -62.8 -41.5 3.6 -27.1 -34.7 53 81 A Y H < S+ 0 0 0 -4,-2.2 4,-0.4 2,-0.2 -1,-0.2 0.887 113.0 52.3 -71.6 -36.9 1.1 -29.0 -36.8 54 82 A A H >X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 3,-1.7 0.923 107.5 50.9 -64.9 -43.8 3.0 -28.3 -40.0 55 83 A L H 3X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.3 8,-0.4 0.789 98.5 66.9 -64.3 -26.3 6.3 -29.7 -38.5 56 84 A A H 3< S+ 0 0 8 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.693 114.6 31.3 -66.0 -16.6 4.3 -32.8 -37.5 57 85 A V H <4 S+ 0 0 0 -3,-1.7 -2,-0.2 -4,-0.4 -1,-0.2 0.805 127.7 35.7-105.5 -48.4 4.0 -33.5 -41.2 58 86 A T H < S+ 0 0 3 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.584 124.1 39.1 -86.6 -12.7 7.2 -32.0 -42.8 59 87 A H >X + 0 0 18 -4,-2.1 4,-2.6 -5,-0.3 3,-2.0 -0.445 60.9 162.8-135.6 61.5 9.6 -32.9 -40.0 60 88 A P T 34 + 0 0 5 0, 0.0 324,-0.2 0, 0.0 -1,-0.1 0.651 67.6 77.8 -55.4 -15.4 8.6 -36.4 -38.7 61 89 A Q T 34 S- 0 0 5 322,-0.1 323,-2.6 323,-0.1 324,-0.4 0.882 128.8 -18.6 -61.3 -39.1 12.0 -36.6 -37.1 62 90 A A T <4 S+ 0 0 3 -3,-2.0 300,-0.2 -7,-0.2 319,-0.1 0.550 112.8 94.8-140.2 -35.9 10.9 -34.4 -34.3 63 91 A G < + 0 0 2 -4,-2.6 2,-0.3 -8,-0.4 3,-0.1 -0.431 65.3 157.7 -60.0 146.5 7.7 -32.4 -35.3 64 92 A N - 0 0 6 -12,-0.3 -8,-0.2 1,-0.1 -7,-0.1 -0.997 63.5-158.5-168.4 167.1 4.9 -34.6 -34.0 65 93 A L S S+ 0 0 3 -2,-0.3 58,-0.5 331,-0.3 57,-0.2 0.402 102.6 59.6-121.9 -19.8 1.4 -35.4 -32.8 66 94 A G S S+ 0 0 0 330,-0.3 332,-1.9 -3,-0.1 2,-0.1 0.183 104.6 45.9 -98.7 17.7 2.7 -38.5 -31.0 67 95 A G S S- 0 0 0 330,-0.2 54,-2.1 53,-0.1 55,-1.5 -0.202 74.2-123.6-128.5-139.7 5.2 -36.8 -28.6 68 96 A G E +I 379 0B 0 311,-2.3 311,-3.3 53,-0.2 2,-0.3 -0.956 25.2 153.3-163.9-179.7 5.2 -33.9 -26.3 69 97 A G E -IJ 378 85B 0 16,-1.5 16,-2.2 -2,-0.3 2,-0.3 -0.960 33.5 -80.9 177.3-159.4 6.9 -30.6 -25.3 70 98 A F E -IJ 377 84B 0 307,-2.8 307,-2.2 -2,-0.3 2,-0.4 -0.962 21.5-157.9-138.7 152.6 6.8 -27.2 -23.8 71 99 A X E -IJ 376 83B 0 12,-1.9 12,-2.9 -2,-0.3 2,-0.5 -0.999 3.0-159.6-135.7 133.1 5.7 -23.7 -24.8 72 100 A L E -IJ 375 82B 0 303,-2.8 303,-2.4 -2,-0.4 2,-0.4 -0.957 15.3-171.2-111.4 127.3 6.7 -20.4 -23.4 73 101 A I E +IJ 374 81B 5 8,-2.9 8,-2.9 -2,-0.5 2,-0.4 -0.978 10.5 179.8-123.5 131.3 4.3 -17.5 -24.1 74 102 A R E -IJ 373 80B 20 299,-2.5 299,-2.6 -2,-0.4 6,-0.2 -0.948 18.8-145.4-133.2 113.0 4.9 -13.8 -23.4 75 103 A S > - 0 0 26 4,-2.6 3,-2.4 -2,-0.4 370,-0.1 -0.282 29.5-109.0 -71.5 159.9 2.2 -11.3 -24.3 76 104 A K T 3 S+ 0 0 136 1,-0.3 -1,-0.1 2,-0.1 369,-0.1 0.784 121.4 60.6 -58.6 -25.7 2.9 -7.9 -25.5 77 105 A N T 3 S- 0 0 128 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.363 123.6-103.3 -86.0 5.4 1.7 -6.7 -22.1 78 106 A G S < S+ 0 0 25 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.211 70.7 145.3 96.8 -17.3 4.3 -8.7 -20.3 79 107 A N - 0 0 77 -5,-0.1 -4,-2.6 1,-0.0 2,-0.5 -0.410 29.7-168.5 -59.1 118.4 2.3 -11.7 -19.1 80 108 A T E +J 74 0B 20 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.950 13.0 161.9-117.4 127.3 4.6 -14.6 -19.3 81 109 A T E -J 73 0B 11 -8,-2.9 -8,-2.9 -2,-0.5 2,-0.4 -0.948 27.5-135.2-142.9 161.9 3.5 -18.2 -18.9 82 110 A A E -JK 72 247B 0 165,-1.9 165,-2.6 -2,-0.3 2,-0.6 -0.938 7.9-152.8-120.9 140.7 4.5 -21.8 -19.6 83 111 A I E -JK 71 246B 0 -12,-2.9 -12,-1.9 -2,-0.4 2,-0.8 -0.961 8.7-157.4-114.4 118.9 2.5 -24.7 -21.1 84 112 A D E +JK 70 245B 0 161,-3.1 161,-2.9 -2,-0.6 -14,-0.2 -0.856 27.1 156.6 -97.1 108.0 3.5 -28.2 -20.0 85 113 A F E +J 69 0B 0 -16,-2.2 -16,-1.5 -2,-0.8 36,-0.4 -0.291 23.8 147.2-125.1 47.9 2.4 -30.7 -22.6 86 114 A R - 0 0 0 -18,-0.3 -18,-0.1 35,-0.1 33,-0.1 -0.554 56.3 -95.8 -80.3 143.9 5.0 -33.4 -21.6 87 115 A E - 0 0 0 -2,-0.2 2,-0.4 31,-0.1 -1,-0.1 -0.236 33.1-136.2 -61.9 151.3 4.0 -37.0 -22.0 88 116 A X B -M 119 0C 25 31,-1.1 31,-3.0 341,-0.2 341,-0.2 -0.903 23.1-112.8-108.3 137.8 2.6 -38.8 -18.9 89 117 A A - 0 0 1 339,-2.8 338,-1.3 -2,-0.4 29,-0.1 -0.394 47.1 -91.0 -66.1 148.4 3.8 -42.3 -18.2 90 118 A P > - 0 0 2 0, 0.0 3,-2.0 0, 0.0 337,-0.5 -0.196 31.2-114.6 -58.4 154.0 1.0 -44.9 -18.6 91 119 A A T 3 S+ 0 0 47 1,-0.3 143,-0.1 335,-0.2 -2,-0.1 0.770 118.9 54.2 -61.4 -24.5 -1.0 -45.7 -15.4 92 120 A K T 3 S+ 0 0 109 141,-0.2 -1,-0.3 333,-0.1 2,-0.1 0.388 82.1 120.3 -91.1 2.9 0.4 -49.2 -15.7 93 121 A A < - 0 0 2 -3,-2.0 2,-0.3 332,-0.1 3,-0.0 -0.383 45.9-162.2 -67.6 145.8 4.0 -48.0 -15.7 94 122 A T > - 0 0 82 331,-0.2 3,-1.9 1,-0.1 4,-0.2 -0.947 29.8-110.5-132.4 153.7 6.3 -49.2 -12.9 95 123 A R T 3 S+ 0 0 165 -2,-0.3 329,-0.5 1,-0.3 3,-0.3 0.856 116.6 34.3 -45.9 -49.7 9.6 -48.1 -11.4 96 124 A D T > S+ 0 0 70 1,-0.2 3,-1.6 2,-0.1 -1,-0.3 0.072 78.8 120.6 -99.7 26.0 11.6 -51.2 -12.7 97 125 A X T < S+ 0 0 26 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.712 76.0 49.4 -62.6 -20.9 9.8 -51.7 -16.0 98 126 A F T 3 S+ 0 0 2 -3,-0.3 8,-3.0 308,-0.2 2,-0.3 0.359 87.4 104.4-101.6 7.4 13.0 -51.2 -18.0 99 127 A L B < -N 105 0D 27 -3,-1.6 2,-0.0 6,-0.3 -3,-0.0 -0.662 64.1-134.8 -89.5 142.2 15.2 -53.6 -16.1 100 128 A D > - 0 0 53 4,-2.6 3,-2.4 -2,-0.3 -1,-0.1 -0.213 43.2 -80.4 -82.8-177.7 16.1 -57.0 -17.5 101 129 A D T 3 S+ 0 0 166 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.725 133.1 53.4 -57.0 -22.3 16.0 -60.2 -15.5 102 130 A Q T 3 S- 0 0 163 2,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.460 120.8-106.9 -92.2 -2.7 19.4 -59.3 -14.0 103 131 A G S < S+ 0 0 19 -3,-2.4 -2,-0.1 1,-0.3 -5,-0.1 0.602 78.0 129.4 88.4 12.8 18.2 -55.9 -12.8 104 132 A N - 0 0 87 1,-0.1 -4,-2.6 303,-0.0 -1,-0.3 -0.843 66.5-100.7-104.4 136.2 20.1 -54.0 -15.5 105 133 A P B -N 99 0D 37 0, 0.0 2,-0.7 0, 0.0 -6,-0.3 -0.214 27.6-146.8 -53.4 139.1 18.4 -51.3 -17.6 106 134 A D >> - 0 0 50 -8,-3.0 4,-1.3 1,-0.1 3,-0.9 -0.914 7.3-165.8-111.3 101.2 17.5 -52.5 -21.1 107 135 A S H 3> S+ 0 0 70 -2,-0.7 4,-0.9 1,-0.2 5,-0.3 0.717 85.6 64.6 -60.7 -21.4 17.8 -49.5 -23.5 108 136 A K H 3>>S+ 0 0 116 2,-0.2 4,-2.4 1,-0.2 5,-1.3 0.897 101.9 48.7 -69.2 -38.5 15.9 -51.4 -26.2 109 137 A K H <45S+ 0 0 70 -3,-0.9 -2,-0.2 1,-0.2 4,-0.2 0.875 116.4 41.9 -68.2 -37.1 12.8 -51.4 -24.0 110 138 A S H <5S+ 0 0 4 -4,-1.3 292,-0.6 -12,-0.2 -1,-0.2 0.539 128.2 28.5 -88.9 -5.8 13.0 -47.7 -23.2 111 139 A L H <5S+ 0 0 27 -4,-0.9 -3,-0.2 -3,-0.3 -2,-0.2 0.705 131.8 16.8-123.2 -35.0 14.0 -46.6 -26.8 112 140 A T T <5S+ 0 0 41 -4,-2.4 -3,-0.2 -5,-0.3 2,-0.1 0.530 100.7 84.3-122.1 -6.8 12.6 -49.0 -29.4 113 141 A S S > S+ 0 0 18 116,-0.4 3,-0.7 1,-0.3 119,-0.5 0.627 119.1 67.2 -69.0 -11.3 6.2 -50.2 -27.5 115 143 A L G 3 S+ 0 0 40 1,-0.2 -1,-0.3 -6,-0.2 -6,-0.1 0.604 82.8 75.7 -82.1 -12.1 7.0 -49.7 -23.8 116 144 A A G < S+ 0 0 0 -3,-1.6 285,-2.2 -8,-0.2 286,-0.4 0.604 78.4 95.8 -75.4 -11.6 9.2 -46.7 -24.6 117 145 A S < - 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0 0 18 -4,-1.5 -90,-0.1 -5,-0.7 -4,-0.0 -0.262 57.9-152.3 -94.6-173.2 -4.9 -17.7 -29.7 135 163 A T + 0 0 100 -92,-0.1 -1,-0.1 -2,-0.1 -4,-0.0 0.489 67.3 79.0-133.9 -17.7 -7.6 -16.1 -31.9 136 164 A X S S- 0 0 27 1,-0.1 -2,-0.1 -93,-0.1 2,-0.1 -0.646 81.3-107.0 -98.8 153.5 -8.1 -18.6 -34.7 137 165 A P >> - 0 0 66 0, 0.0 4,-1.2 0, 0.0 3,-0.9 -0.403 33.5-112.4 -72.8 155.4 -10.2 -21.8 -34.6 138 166 A L H 3> S+ 0 0 18 1,-0.2 4,-1.7 2,-0.2 3,-0.3 0.888 114.3 59.6 -56.4 -42.8 -8.2 -25.1 -34.6 139 167 A N H 3> S+ 0 0 80 68,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.837 103.7 53.8 -57.0 -31.9 -9.4 -26.2 -38.1 140 168 A K H <4 S+ 0 0 86 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.884 111.7 41.3 -70.2 -42.0 -7.8 -23.0 -39.5 141 169 A V H < S+ 0 0 0 -4,-1.2 4,-0.4 -3,-0.3 -1,-0.2 0.653 116.4 50.7 -82.3 -14.3 -4.3 -23.5 -38.0 142 170 A V H X S+ 0 0 0 -4,-1.7 4,-2.5 -5,-0.2 3,-0.5 0.779 89.9 81.2 -89.7 -30.3 -4.4 -27.3 -38.8 143 171 A Q H X S+ 0 0 69 -4,-1.7 4,-2.4 -5,-0.3 5,-0.2 0.823 87.1 53.9 -45.6 -46.4 -5.4 -26.8 -42.5 144 172 A P H > S+ 0 0 33 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.951 113.0 43.3 -57.3 -47.4 -1.9 -26.0 -43.8 145 173 A A H > S+ 0 0 0 -3,-0.5 4,-2.1 -4,-0.4 -2,-0.2 0.891 110.3 57.7 -63.2 -40.9 -0.5 -29.2 -42.2 146 174 A F H X S+ 0 0 22 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.934 107.7 45.8 -55.4 -49.6 -3.5 -31.2 -43.5 147 175 A K H X>S+ 0 0 100 -4,-2.4 4,-3.1 1,-0.2 5,-0.5 0.874 110.1 53.9 -63.3 -38.5 -2.9 -30.2 -47.1 148 176 A L H X5S+ 0 0 28 -4,-1.8 4,-0.8 -5,-0.2 -1,-0.2 0.861 113.7 43.1 -64.4 -34.9 0.8 -31.0 -46.8 149 177 A A H <5S+ 0 0 0 -4,-2.1 47,-2.4 2,-0.2 -2,-0.2 0.925 120.2 41.3 -75.5 -46.0 -0.1 -34.5 -45.5 150 178 A R H <5S+ 0 0 116 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.946 128.4 27.8 -67.5 -51.4 -2.8 -35.0 -48.1 151 179 A D H <5S- 0 0 99 -4,-3.1 -3,-0.2 -5,-0.2 -1,-0.2 0.629 106.5-138.3 -88.0 -16.0 -1.1 -33.6 -51.2 152 180 A G << - 0 0 16 -4,-0.8 2,-0.3 -5,-0.5 43,-0.2 0.001 8.0-121.4 83.1 169.6 2.4 -34.3 -50.1 153 181 A F E -O 194 0E 25 41,-1.3 41,-2.7 -4,-0.1 2,-0.3 -0.959 31.6 -87.9-147.1 161.7 5.7 -32.3 -50.2 154 182 A I E -O 193 0E 101 -2,-0.3 2,-0.4 39,-0.2 39,-0.2 -0.577 40.1-120.8 -78.8 131.3 9.1 -32.8 -51.7 155 183 A V - 0 0 0 37,-3.4 36,-2.8 -2,-0.3 37,-0.2 -0.569 35.7-161.8 -71.1 123.2 11.7 -34.7 -49.6 156 184 A N > - 0 0 37 -2,-0.4 4,-2.3 34,-0.2 5,-0.2 -0.212 35.2 -85.4 -95.3-171.4 14.7 -32.3 -49.0 157 185 A D H > S+ 0 0 27 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.923 123.7 52.3 -62.9 -46.5 18.2 -33.0 -47.9 158 186 A A H > S+ 0 0 17 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.937 115.2 39.3 -56.5 -51.8 17.5 -32.9 -44.2 159 187 A L H > S+ 0 0 2 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.912 116.3 50.3 -68.2 -43.1 14.6 -35.4 -44.3 160 188 A A H X S+ 0 0 10 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.938 113.7 46.1 -60.2 -46.5 16.3 -37.7 -46.9 161 189 A D H X S+ 0 0 52 -4,-2.8 4,-3.0 -5,-0.2 5,-0.3 0.902 113.9 47.4 -63.7 -43.2 19.5 -37.8 -44.8 162 190 A D H X>S+ 0 0 37 -4,-2.2 5,-2.6 -5,-0.3 4,-2.0 0.880 109.5 53.5 -67.5 -37.4 17.7 -38.4 -41.5 163 191 A L H <>S+ 0 0 0 -4,-2.6 5,-0.9 3,-0.2 -1,-0.2 0.912 115.8 41.1 -61.8 -41.2 15.5 -41.1 -43.0 164 192 A K H <5S+ 0 0 123 -4,-1.9 4,-0.3 3,-0.2 -2,-0.2 0.936 124.0 35.4 -70.9 -50.7 18.7 -42.9 -44.2 165 193 A T H <5S+ 0 0 51 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.953 138.3 10.0 -72.6 -54.6 20.8 -42.3 -41.1 166 194 A Y T ><5S+ 0 0 90 -4,-2.0 3,-1.0 -5,-0.3 4,-0.4 0.799 123.8 59.2 -97.9 -35.2 18.4 -42.5 -38.2 167 195 A G G >>< S+ 0 0 0 -4,-2.4 3,-1.5 1,-0.2 7,-0.5 0.904 98.4 49.6 -58.4 -48.6 11.2 -47.3 -39.4 172 200 A P G 3 S+ 0 0 31 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.627 98.4 72.4 -69.7 -6.1 11.6 -50.4 -41.6 173 201 A N G < S+ 0 0 114 -3,-1.1 2,-0.4 1,-0.1 -2,-0.2 0.401 93.3 58.3 -87.5 3.2 11.1 -52.6 -38.6 174 202 A H S <> S- 0 0 39 -3,-1.5 4,-2.9 213,-0.1 5,-0.3 -0.986 76.9-140.8-135.5 122.9 7.4 -51.8 -38.4 175 203 A E H > S+ 0 0 180 -2,-0.4 4,-2.0 1,-0.2 5,-0.1 0.875 100.7 45.7 -48.5 -51.9 5.0 -52.5 -41.3 176 204 A N H > S+ 0 0 26 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.895 115.5 47.4 -64.2 -37.7 2.9 -49.3 -41.0 177 205 A S H >> S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 3,-1.0 0.929 111.5 50.2 -67.3 -45.2 5.9 -47.1 -40.6 178 206 A K H 3X S+ 0 0 95 -4,-2.9 4,-1.8 -7,-0.5 -1,-0.2 0.855 104.0 59.8 -61.8 -35.1 7.7 -48.7 -43.5 179 207 A A H 3< S+ 0 0 85 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.746 114.5 35.9 -65.9 -23.2 4.7 -48.3 -45.8 180 208 A I H << S+ 0 0 29 -3,-1.0 -2,-0.2 -4,-0.7 15,-0.2 0.885 128.1 27.6 -96.3 -47.9 4.9 -44.5 -45.2 181 209 A F H < S+ 0 0 0 -4,-2.5 7,-1.9 -10,-0.1 2,-0.3 0.594 108.7 69.9 -95.6 -13.0 8.6 -43.6 -45.1 182 210 A W E < -P 187 0F 28 -4,-1.8 2,-0.3 -5,-0.4 -19,-0.0 -0.754 56.5-173.8-105.3 154.4 10.2 -46.4 -47.2 183 211 A K E > -P 186 0F 92 3,-3.5 3,-1.8 -2,-0.3 -4,-0.0 -0.956 67.4 -8.0-150.9 127.8 9.9 -46.8 -51.0 184 212 A E T 3 S- 0 0 176 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 0.885 130.0 -53.6 54.1 40.6 11.1 -49.6 -53.3 185 213 A G T 3 S+ 0 0 50 1,-0.2 -1,-0.3 -7,-0.1 -3,-0.0 0.452 124.9 81.0 77.2 1.8 13.0 -51.1 -50.3 186 214 A E E < S-P 183 0F 101 -3,-1.8 -3,-3.5 1,-0.0 -1,-0.2 -0.892 88.8 -86.5-134.4 163.6 14.9 -47.9 -49.4 187 215 A P E -P 182 0F 3 0, 0.0 -5,-0.2 0, 0.0 -23,-0.1 -0.354 62.7 -83.9 -66.6 153.7 14.2 -44.8 -47.4 188 216 A L - 0 0 8 -7,-1.9 2,-0.2 1,-0.1 -24,-0.1 -0.304 52.7-140.6 -55.9 141.6 12.6 -42.0 -49.5 189 217 A K > - 0 0 105 1,-0.1 3,-2.3 -3,-0.1 -34,-0.3 -0.624 29.3 -75.0-105.3 164.4 15.3 -40.0 -51.3 190 218 A K T 3 S+ 0 0 111 1,-0.3 -34,-0.2 -2,-0.2 -1,-0.1 -0.307 121.2 28.5 -57.0 135.3 15.7 -36.3 -52.0 191 219 A G T 3 S+ 0 0 46 -36,-2.8 -1,-0.3 1,-0.4 -35,-0.1 0.123 92.9 120.3 99.0 -22.6 13.3 -35.2 -54.7 192 220 A D < - 0 0 40 -3,-2.3 -37,-3.4 -37,-0.2 2,-0.5 -0.343 65.6-119.6 -71.4 158.2 10.8 -37.9 -53.8 193 221 A T E -O 154 0E 74 -39,-0.2 2,-0.7 -3,-0.1 -39,-0.2 -0.886 19.2-152.6-103.8 128.3 7.3 -36.8 -52.8 194 222 A L E -O 153 0E 2 -41,-2.7 -41,-1.3 -2,-0.5 2,-0.4 -0.896 15.1-179.3-103.7 113.5 6.1 -37.8 -49.3 195 223 A V - 0 0 72 -2,-0.7 2,-0.4 -43,-0.2 -45,-0.2 -0.937 9.6-167.7-110.6 134.0 2.3 -38.2 -49.1 196 224 A Q > + 0 0 4 -47,-2.4 4,-2.0 -2,-0.4 5,-0.1 -0.711 13.6 169.0-125.4 80.4 0.9 -39.2 -45.7 197 225 A A H > S+ 0 0 66 -2,-0.4 4,-1.9 1,-0.2 -1,-0.1 0.859 77.9 49.1 -59.3 -42.7 -2.8 -40.1 -46.2 198 226 A N H > S+ 0 0 48 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.927 112.1 48.0 -66.5 -43.1 -3.4 -41.6 -42.8 199 227 A L H > S+ 0 0 4 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.854 108.8 56.2 -64.1 -33.5 -1.8 -38.6 -41.0 200 228 A A H X S+ 0 0 5 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.903 107.2 48.2 -64.8 -40.2 -4.0 -36.4 -43.2 201 229 A K H X S+ 0 0 109 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.918 111.2 50.6 -65.7 -42.4 -7.1 -38.2 -42.0 202 230 A S H X S+ 0 0 4 -4,-2.3 4,-1.6 191,-0.3 -2,-0.2 0.920 112.6 46.7 -60.3 -43.8 -5.9 -37.8 -38.4 203 231 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.906 111.1 51.4 -65.3 -42.8 -5.4 -34.1 -39.0 204 232 A E H X S+ 0 0 63 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.892 110.8 48.2 -61.9 -41.0 -8.8 -33.7 -40.7 205 233 A X H X S+ 0 0 40 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.813 111.6 49.9 -70.9 -30.0 -10.6 -35.4 -37.8 206 234 A I H X S+ 0 0 0 -4,-1.6 4,-2.4 -5,-0.2 -2,-0.2 0.910 111.0 49.4 -72.9 -42.0 -8.8 -33.3 -35.2 207 235 A A H < S+ 0 0 20 -4,-2.6 -68,-0.4 1,-0.2 -2,-0.2 0.900 118.8 39.8 -62.4 -39.7 -9.7 -30.1 -37.2 208 236 A E H < S+ 0 0 123 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.871 129.9 24.9 -79.4 -39.2 -13.3 -31.2 -37.3 209 237 A N H < S- 0 0 90 -4,-2.6 3,-0.4 1,-0.3 -3,-0.2 0.499 101.9-126.9-106.8 -5.1 -13.8 -32.7 -33.8 210 238 A G >< - 0 0 17 -4,-2.4 3,-2.0 -5,-0.2 4,-0.4 -0.269 54.3 -41.6 87.5-178.6 -11.2 -30.9 -31.8 211 239 A P T >> S+ 0 0 33 0, 0.0 4,-1.7 0, 0.0 3,-1.1 0.722 124.5 78.4 -58.4 -21.7 -8.4 -32.4 -29.5 212 240 A D H 3>>S+ 0 0 95 -3,-0.4 4,-2.8 1,-0.3 5,-1.8 0.776 82.1 66.5 -58.5 -26.2 -11.0 -35.0 -28.2 213 241 A E H <45S+ 0 0 12 -3,-2.0 7,-1.1 3,-0.2 6,-0.9 0.901 105.8 41.7 -61.6 -39.5 -10.4 -36.9 -31.5 214 242 A F H <45S+ 0 0 0 -3,-1.1 -2,-0.2 -4,-0.4 -1,-0.2 0.901 124.9 33.2 -74.1 -43.3 -6.9 -37.6 -30.3 215 243 A Y H <5S+ 0 0 16 -4,-1.7 -2,-0.2 4,-0.1 -3,-0.2 0.662 140.5 8.6 -91.4 -18.2 -7.6 -38.4 -26.7 216 244 A K T <5S+ 0 0 113 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.1 0.498 115.1 71.1-136.0 -16.1 -11.1 -40.0 -26.9 217 245 A G S > S+ 0 0 57 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.853 131.2 54.3 -58.6 -38.6 -10.6 -42.7 -33.4 219 247 A I H > S+ 0 0 1 -6,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.906 106.5 51.2 -63.9 -42.0 -7.0 -41.7 -33.0 220 248 A A H > S+ 0 0 0 -7,-1.1 4,-2.8 1,-0.2 -1,-0.2 0.911 109.9 51.3 -60.6 -41.1 -7.1 -42.7 -29.3 221 249 A E H X S+ 0 0 79 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.932 109.0 50.0 -59.9 -48.0 -8.5 -46.1 -30.5 222 250 A Q H X S+ 0 0 42 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.862 113.0 46.2 -61.4 -37.8 -5.7 -46.5 -33.0 223 251 A I H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.943 112.7 49.6 -70.1 -47.8 -3.0 -45.8 -30.4 224 252 A A H X S+ 0 0 14 -4,-2.8 4,-3.0 1,-0.2 -2,-0.2 0.905 112.9 46.9 -57.8 -45.0 -4.6 -48.1 -27.8 225 253 A Q H X S+ 0 0 99 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.895 108.1 55.2 -65.3 -40.8 -4.9 -50.9 -30.2 226 254 A E H X S+ 0 0 20 -4,-1.8 4,-0.7 -5,-0.2 -1,-0.2 0.891 114.9 41.4 -58.6 -38.9 -1.3 -50.4 -31.4 227 255 A X H ><>S+ 0 0 1 -4,-2.0 5,-3.7 7,-0.2 3,-0.7 0.937 113.1 50.7 -73.3 -50.8 -0.3 -50.8 -27.8 228 256 A Q H ><5S+ 0 0 144 -4,-3.0 3,-0.5 1,-0.2 -2,-0.2 0.834 112.7 47.1 -58.2 -36.2 -2.6 -53.7 -26.8 229 257 A K H 3<5S+ 0 0 118 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.681 119.4 38.5 -81.5 -17.9 -1.5 -55.8 -29.8 230 258 A N T <<5S- 0 0 83 -3,-0.7 -116,-0.4 -4,-0.7 -1,-0.2 0.012 118.9 -90.7-125.7 31.5 2.2 -55.2 -29.3 231 259 A G T < 5S+ 0 0 54 -3,-0.5 -3,-0.2 -4,-0.2 2,-0.1 0.752 77.4 145.1 70.4 24.6 2.9 -55.3 -25.5 232 260 A G < - 0 0 8 -5,-3.7 -1,-0.2 -6,-0.2 -117,-0.2 -0.442 43.9-146.7 -89.6 169.1 2.4 -51.5 -25.0 233 261 A L + 0 0 36 -119,-0.5 -141,-0.2 -116,-0.2 2,-0.2 0.708 58.8 109.8-109.1 -26.4 0.9 -49.9 -22.0 234 262 A I - 0 0 2 -117,-0.1 -6,-0.2 -144,-0.1 -7,-0.2 -0.346 48.2-177.0 -58.6 121.7 -1.0 -46.8 -23.2 235 263 A T > - 0 0 37 -2,-0.2 4,-2.1 -8,-0.1 5,-0.2 -0.603 44.2-100.3-113.1 174.8 -4.7 -47.4 -22.8 236 264 A K H > S+ 0 0 92 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.850 124.6 56.2 -62.6 -34.0 -7.9 -45.5 -23.7 237 265 A E H > S+ 0 0 155 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.902 105.0 50.6 -65.4 -41.4 -8.0 -44.5 -20.0 238 266 A D H > S+ 0 0 7 2,-0.2 4,-0.9 1,-0.2 -2,-0.2 0.930 112.8 46.4 -60.9 -46.4 -4.5 -43.0 -20.1 239 267 A L H >< S+ 0 0 0 -4,-2.1 3,-0.6 1,-0.2 -2,-0.2 0.909 112.3 49.6 -63.9 -42.0 -5.4 -41.0 -23.2 240 268 A A H 3< S+ 0 0 47 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.801 112.5 49.4 -67.5 -27.3 -8.7 -39.8 -21.6 241 269 A A H 3< S+ 0 0 60 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.591 84.7 112.8 -88.9 -11.5 -6.8 -38.8 -18.5 242 270 A Y << + 0 0 18 -4,-0.9 2,-0.3 -3,-0.6 -155,-0.1 -0.277 41.4 177.5 -63.1 147.8 -4.0 -36.8 -20.1 243 271 A K - 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0 0 14 -4,-1.1 2,-0.3 -5,-0.6 43,-0.2 -0.146 8.7-121.9 87.9 173.6 12.7 -5.1 -63.7 701 181 C F E -K 742 0P 25 41,-1.1 41,-2.9 -4,-0.1 2,-0.3 -0.970 30.1 -85.7-152.3 162.1 13.2 -6.9 -60.4 702 182 C I E -K 741 0P 101 -2,-0.3 2,-0.4 39,-0.2 39,-0.2 -0.582 40.8-122.2 -78.2 129.9 12.6 -6.4 -56.7 703 183 C V - 0 0 1 37,-2.9 36,-2.5 -2,-0.3 37,-0.1 -0.555 33.8-161.4 -71.0 123.4 15.3 -4.5 -54.8 704 184 C N > - 0 0 36 -2,-0.4 4,-2.3 34,-0.2 5,-0.2 -0.210 35.5 -85.4 -94.9-170.5 16.6 -6.7 -51.9 705 185 C D H > S+ 0 0 28 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.927 123.8 52.3 -63.2 -47.3 18.5 -5.8 -48.7 706 186 C A H > S+ 0 0 18 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.941 115.6 38.9 -55.6 -52.6 21.9 -6.0 -50.3 707 187 C L H > S+ 0 0 2 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.910 116.1 51.2 -67.4 -43.0 21.1 -3.6 -53.2 708 188 C A H X S+ 0 0 11 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.952 113.1 45.7 -59.2 -49.6 19.0 -1.3 -51.1 709 189 C D H X S+ 0 0 66 -4,-2.9 4,-2.8 -5,-0.2 5,-0.3 0.887 114.1 47.9 -62.2 -40.8 21.7 -1.0 -48.5 710 190 C D H X>S+ 0 0 40 -4,-2.2 5,-2.4 -5,-0.3 4,-2.3 0.901 108.9 54.0 -68.4 -39.2 24.5 -0.5 -51.1 711 191 C L H <>S+ 0 0 0 -4,-2.8 5,-1.1 3,-0.2 -2,-0.2 0.932 115.5 40.1 -59.4 -44.4 22.4 2.2 -52.9 712 192 C K H <5S+ 0 0 112 -4,-2.1 4,-0.4 3,-0.2 -2,-0.2 0.944 122.6 38.9 -70.0 -49.6 22.0 4.1 -49.7 713 193 C T H <5S+ 0 0 67 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.948 138.7 7.3 -68.5 -53.6 25.5 3.7 -48.4 714 194 C Y T ><5S+ 0 0 84 -4,-2.3 3,-1.0 -5,-0.3 4,-0.5 0.775 123.5 61.6-101.8 -33.5 27.6 3.9 -51.5 715 195 C G G >> S+ 0 0 16 -3,-1.5 4,-0.9 -4,-0.5 3,-0.5 0.637 115.1 68.3-138.3 -32.7 27.9 9.3 -56.7 719 199 C L T 3< S+ 0 0 0 -4,-2.5 3,-0.5 1,-0.2 7,-0.4 0.931 97.4 50.4 -64.6 -51.2 24.6 8.2 -58.3 720 200 C P T 34 S+ 0 0 26 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.662 102.4 66.9 -64.5 -12.1 22.3 11.2 -57.5 721 201 C N T <4 S+ 0 0 116 -3,-0.5 2,-0.4 1,-0.1 -2,-0.2 0.935 91.7 62.4 -72.3 -48.3 24.9 13.6 -58.9 722 202 C H S X S- 0 0 49 -4,-0.9 4,-2.6 -3,-0.5 5,-0.2 -0.693 80.2-139.4 -84.5 126.7 24.8 12.5 -62.5 723 203 C E H > S+ 0 0 155 -2,-0.4 4,-1.7 1,-0.2 -1,-0.1 0.861 100.1 46.6 -53.2 -46.4 21.4 13.1 -64.1 724 204 C N H > S+ 0 0 29 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.881 114.2 48.3 -68.1 -35.7 21.2 9.8 -66.1 725 205 C S H >> S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 3,-0.8 0.909 110.2 51.9 -68.9 -42.4 22.2 7.8 -63.1 726 206 C K H 3X S+ 0 0 78 -4,-2.6 4,-1.8 -7,-0.4 -1,-0.2 0.857 102.8 59.1 -62.5 -36.3 19.7 9.5 -60.8 727 207 C A H 3< S+ 0 0 83 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.771 115.3 36.0 -64.7 -25.4 16.9 8.8 -63.3 728 208 C I H << S+ 0 0 26 -3,-0.8 15,-0.2 -4,-0.7 -2,-0.2 0.887 128.0 27.2 -94.6 -47.7 17.6 5.1 -62.9 729 209 C F H < S+ 0 0 1 -4,-2.6 7,-2.0 -10,-0.1 2,-0.3 0.597 108.8 70.0 -96.2 -13.1 18.6 4.4 -59.3 730 210 C W E < -L 735 0Q 27 -4,-1.8 2,-0.3 -5,-0.4 -19,-0.0 -0.774 55.1-170.2-107.2 152.7 16.8 7.2 -57.4 731 211 C K E > S-L 734 0Q 101 3,-3.8 3,-1.4 -2,-0.3 -4,-0.1 -0.936 71.1 -14.4-145.4 117.4 13.1 7.7 -56.8 732 212 C E T 3 S- 0 0 172 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 0.894 128.3 -51.0 58.7 43.6 11.5 10.8 -55.4 733 213 C G T 3 S+ 0 0 44 1,-0.2 -1,-0.3 -7,-0.1 -3,-0.0 0.397 125.8 87.1 78.4 -3.8 14.8 12.2 -54.2 734 214 C E E < S-L 731 0Q 110 -3,-1.4 -3,-3.8 1,-0.0 -1,-0.2 -0.896 85.0 -97.7-127.1 156.0 15.8 9.0 -52.4 735 215 C P E -L 730 0Q 6 0, 0.0 -5,-0.2 0, 0.0 -23,-0.1 -0.360 56.7 -84.6 -68.6 152.9 17.5 5.8 -53.5 736 216 C L - 0 0 9 -7,-2.0 2,-0.2 1,-0.1 -24,-0.1 -0.281 52.8-143.1 -55.5 142.6 15.3 2.9 -54.3 737 217 C K > - 0 0 87 1,-0.1 3,-2.3 -3,-0.1 -34,-0.3 -0.641 29.4 -73.1-108.6 167.0 14.4 1.0 -51.2 738 218 C K T 3 S+ 0 0 98 1,-0.3 -34,-0.2 -2,-0.2 -1,-0.1 -0.334 122.7 28.6 -56.8 134.0 13.9 -2.7 -50.4 739 219 C G T 3 S+ 0 0 45 -36,-2.5 -1,-0.3 1,-0.4 -35,-0.1 0.007 94.8 115.6 101.8 -28.9 10.6 -3.8 -52.0 740 220 C D < - 0 0 49 -3,-2.3 -37,-2.9 -37,-0.1 2,-0.5 -0.216 68.5-116.0 -68.3 164.7 10.8 -1.3 -54.8 741 221 C T E -K 702 0P 76 -39,-0.2 2,-0.7 -3,-0.1 -39,-0.2 -0.910 18.7-150.9-107.7 130.0 11.2 -2.4 -58.4 742 222 C L E -K 701 0P 1 -41,-2.9 -41,-1.1 -2,-0.5 2,-0.4 -0.890 16.1-176.9-103.7 110.6 14.3 -1.5 -60.3 743 223 C V - 0 0 72 -2,-0.7 2,-0.3 -15,-0.2 -45,-0.2 -0.895 10.1-169.7-106.4 135.4 13.6 -1.2 -64.1 744 224 C Q > + 0 0 5 -47,-2.5 4,-2.3 -2,-0.4 5,-0.1 -0.660 15.5 164.9-127.0 76.0 16.6 -0.5 -66.4 745 225 C A H > S+ 0 0 65 -2,-0.3 4,-2.0 2,-0.2 -1,-0.1 0.882 77.1 49.0 -58.1 -45.6 15.1 0.3 -69.8 746 226 C N H > S+ 0 0 49 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.926 112.6 47.5 -63.9 -44.3 18.2 1.9 -71.3 747 227 C L H > S+ 0 0 4 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.888 108.5 56.8 -63.2 -37.6 20.4 -1.0 -70.1 748 228 C A H X S+ 0 0 5 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.919 106.4 48.9 -59.2 -44.2 17.7 -3.4 -71.6 749 229 C K H X S+ 0 0 87 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.917 111.2 50.1 -62.4 -42.7 18.1 -1.7 -75.0 750 230 C S H X S+ 0 0 2 -4,-2.1 4,-1.9 191,-0.3 -2,-0.2 0.919 112.1 47.0 -61.6 -44.8 21.9 -2.0 -74.8 751 231 C L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.903 110.6 53.0 -63.2 -42.3 21.6 -5.7 -73.9 752 232 C E H X S+ 0 0 74 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.903 110.2 47.0 -60.7 -42.8 19.2 -6.3 -76.7 753 233 C X H X S+ 0 0 36 -4,-2.3 4,-3.4 2,-0.2 5,-0.3 0.855 111.2 51.2 -69.7 -33.5 21.5 -4.7 -79.3 754 234 C I H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.914 110.9 49.3 -67.8 -40.7 24.4 -6.7 -78.0 755 235 C A H < S+ 0 0 21 -4,-2.6 -68,-0.4 1,-0.2 -2,-0.2 0.894 119.6 37.9 -64.0 -39.4 22.3 -9.8 -78.3 756 236 C E H < S+ 0 0 117 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.880 129.8 27.1 -81.0 -40.1 21.3 -8.9 -81.8 757 237 C N H < S- 0 0 90 -4,-3.4 3,-0.4 1,-0.3 -3,-0.2 0.508 102.1-128.9-102.9 -6.3 24.6 -7.4 -83.2 758 238 C G >< - 0 0 16 -4,-2.1 3,-2.2 -5,-0.3 4,-0.4 -0.266 55.0 -39.6 86.4-177.2 27.2 -9.2 -81.1 759 239 C P T >> S+ 0 0 37 0, 0.0 4,-1.8 0, 0.0 3,-0.9 0.729 125.3 78.1 -58.0 -21.2 30.0 -7.6 -79.0 760 240 C D H 3>>S+ 0 0 81 -3,-0.4 4,-2.9 1,-0.3 5,-2.0 0.784 81.6 68.0 -58.9 -26.5 30.6 -5.1 -81.9 761 241 C E H <45S+ 0 0 12 -3,-2.2 7,-1.2 3,-0.2 6,-0.7 0.931 106.5 38.7 -58.4 -43.9 27.5 -3.3 -80.5 762 242 C F H <45S+ 0 0 0 -3,-0.9 -2,-0.2 -4,-0.4 -1,-0.2 0.884 126.2 34.3 -74.0 -40.7 29.6 -2.4 -77.4 763 243 C Y H <5S+ 0 0 15 -4,-1.8 -2,-0.2 4,-0.1 -3,-0.2 0.646 138.4 9.8 -93.5 -14.9 32.9 -1.7 -79.1 764 244 C K T <5S+ 0 0 125 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.558 113.8 66.2-135.3 -23.2 31.9 -0.2 -82.4 765 245 C G S > S+ 0 0 65 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.883 131.9 53.4 -53.6 -45.0 25.7 2.8 -80.5 767 247 C I H > S+ 0 0 0 -6,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.930 107.8 51.9 -58.4 -44.7 27.0 1.8 -77.1 768 248 C A H > S+ 0 0 0 -7,-1.2 4,-2.5 1,-0.2 -1,-0.2 0.902 110.9 46.7 -58.9 -43.5 30.5 2.7 -78.2 769 249 C E H X S+ 0 0 100 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.879 109.4 54.8 -67.2 -36.8 29.5 6.1 -79.4 770 250 C Q H X S+ 0 0 33 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.869 110.6 46.0 -65.2 -34.6 27.5 6.7 -76.2 771 251 C I H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.944 113.9 47.1 -71.6 -47.9 30.6 6.0 -74.1 772 252 C A H X S+ 0 0 12 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.882 113.9 49.0 -61.0 -38.0 32.9 8.2 -76.3 773 253 C Q H X S+ 0 0 115 -4,-2.8 4,-2.9 2,-0.2 5,-0.3 0.929 108.0 52.2 -67.5 -46.3 30.3 11.0 -76.2 774 254 C E H X S+ 0 0 21 -4,-2.0 4,-1.3 -5,-0.2 -1,-0.2 0.899 114.3 45.8 -55.3 -41.8 29.9 10.8 -72.4 775 255 C X H <>S+ 0 0 1 -4,-2.2 5,-3.8 7,-0.2 -2,-0.2 0.929 112.7 47.5 -68.0 -48.5 33.7 11.1 -72.2 776 256 C Q H ><5S+ 0 0 173 -4,-2.8 3,-0.9 1,-0.2 -2,-0.2 0.912 111.7 50.5 -61.8 -42.6 34.1 13.9 -74.7 777 257 C K H 3<5S+ 0 0 172 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.827 119.9 35.8 -65.5 -31.3 31.3 16.0 -73.1 778 258 C N T 3<5S- 0 0 75 -4,-1.3 -116,-0.4 -5,-0.3 -1,-0.2 -0.023 118.3 -93.6-117.5 33.7 32.8 15.6 -69.6 779 259 C G T < 5S+ 0 0 54 -3,-0.9 -3,-0.2 1,-0.2 2,-0.2 0.806 75.5 143.5 65.6 31.2 36.6 15.6 -70.0 780 260 C G < - 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